USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 926 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 68 GLN : amide:sc= -1.23 X(o=-1.6,f=-1.7) USER MOD Set 1.2: A 88 LYS NZ :NH3+ -161:sc= -0.436 (180deg=-1.12) USER MOD Set 1.3: A 111 SER OG : rot 180:sc= 0.102 USER MOD Set 2.1: A 56 THR OG1 : rot 143:sc= -0.713 USER MOD Set 2.2: A 59 GLN : amide:sc= -0.168 K(o=-0.88,f=-0.16) USER MOD Single : A 3 ASN : amide:sc=-0.000257 X(o=-0.00026,f=-0.045) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0.00809 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 CYS SG : rot -176:sc= 0.215 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= 0.081 X(o=0.081,f=-0.36) USER MOD Single : A 26 LYS NZ :NH3+ 155:sc= -0.0178 (180deg=-0.249) USER MOD Single : A 27 SER OG : rot 57:sc= 0.00516 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 41 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -5.8! K(o=-5.8!,f=-4.7) USER MOD Single : A 45 SER OG : rot 96:sc= 0.98 USER MOD Single : A 46 THR OG1 : rot -98:sc= 0.872 USER MOD Single : A 65 CYS SG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= -0.868 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 74:sc= 0.143 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 98 MET CE :methyl 156:sc= -0.12 (180deg=-1.21) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.163 USER MOD Single : A 108 ASN : amide:sc= -0.137 K(o=-0.14,f=-1.5!) USER MOD Single : A 109 MET CE :methyl 150:sc= -0.62 (180deg=-1.55) USER MOD Single : A 110 TYR OH : rot 30:sc= -1.21 USER MOD Single : A 112 GLN : amide:sc= -0.103 X(o=-0.1,f=-0.35) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 7.733 0.288 2.164 1.00 13.00 N ATOM 2 CA GLY A 2 6.961 1.493 2.401 1.00 45.03 C ATOM 3 C GLY A 2 5.901 1.721 1.342 1.00 62.25 C ATOM 4 O GLY A 2 4.811 1.155 1.415 1.00 65.53 O ATOM 0 HA2 GLY A 2 6.485 1.429 3.379 1.00 45.03 H new ATOM 0 HA3 GLY A 2 7.632 2.351 2.429 1.00 45.03 H new ATOM 8 N ASN A 3 6.220 2.553 0.356 1.00 64.12 N ATOM 9 CA ASN A 3 5.285 2.857 -0.722 1.00 14.53 C ATOM 10 C ASN A 3 6.028 3.127 -2.026 1.00 44.43 C ATOM 11 O ASN A 3 7.256 3.041 -2.084 1.00 61.13 O ATOM 12 CB ASN A 3 4.422 4.065 -0.352 1.00 1.41 C ATOM 13 CG ASN A 3 2.963 3.865 -0.709 1.00 13.31 C ATOM 14 OD1 ASN A 3 2.306 2.956 -0.199 1.00 22.33 O ATOM 15 ND2 ASN A 3 2.447 4.714 -1.590 1.00 44.22 N ATOM 0 H ASN A 3 7.119 3.029 0.281 1.00 64.12 H new ATOM 0 HA ASN A 3 4.640 1.990 -0.866 1.00 14.53 H new ATOM 0 HB2 ASN A 3 4.508 4.256 0.718 1.00 1.41 H new ATOM 0 HB3 ASN A 3 4.801 4.949 -0.865 1.00 1.41 H new ATOM 0 HD21 ASN A 3 1.470 4.628 -1.869 1.00 44.22 H new ATOM 0 HD22 ASN A 3 3.028 5.452 -1.987 1.00 44.22 H new ATOM 22 N LEU A 4 5.276 3.456 -3.071 1.00 72.21 N ATOM 23 CA LEU A 4 5.863 3.740 -4.376 1.00 41.23 C ATOM 24 C LEU A 4 6.764 2.596 -4.830 1.00 61.13 C ATOM 25 O LEU A 4 7.794 2.818 -5.464 1.00 12.14 O ATOM 26 CB LEU A 4 6.662 5.044 -4.324 1.00 74.34 C ATOM 27 CG LEU A 4 6.533 5.958 -5.543 1.00 62.14 C ATOM 28 CD1 LEU A 4 7.467 7.152 -5.416 1.00 42.53 C ATOM 29 CD2 LEU A 4 6.821 5.187 -6.822 1.00 0.21 C ATOM 0 H LEU A 4 4.259 3.533 -3.040 1.00 72.21 H new ATOM 0 HA LEU A 4 5.052 3.846 -5.096 1.00 41.23 H new ATOM 0 HB2 LEU A 4 6.351 5.603 -3.441 1.00 74.34 H new ATOM 0 HB3 LEU A 4 7.715 4.797 -4.190 1.00 74.34 H new ATOM 0 HG LEU A 4 5.508 6.327 -5.589 1.00 62.14 H new ATOM 0 HD11 LEU A 4 7.362 7.791 -6.293 1.00 42.53 H new ATOM 0 HD12 LEU A 4 7.213 7.719 -4.521 1.00 42.53 H new ATOM 0 HD13 LEU A 4 8.497 6.802 -5.344 1.00 42.53 H new ATOM 0 HD21 LEU A 4 6.724 5.854 -7.679 1.00 0.21 H new ATOM 0 HD22 LEU A 4 7.835 4.788 -6.786 1.00 0.21 H new ATOM 0 HD23 LEU A 4 6.111 4.366 -6.920 1.00 0.21 H new ATOM 41 N LYS A 5 6.366 1.371 -4.502 1.00 41.24 N ATOM 42 CA LYS A 5 7.134 0.191 -4.878 1.00 54.30 C ATOM 43 C LYS A 5 7.438 0.193 -6.373 1.00 12.24 C ATOM 44 O LYS A 5 6.532 0.109 -7.201 1.00 52.52 O ATOM 45 CB LYS A 5 6.369 -1.081 -4.505 1.00 61.04 C ATOM 46 CG LYS A 5 6.148 -1.242 -3.011 1.00 42.34 C ATOM 47 CD LYS A 5 6.616 -2.601 -2.521 1.00 54.00 C ATOM 48 CE LYS A 5 8.130 -2.731 -2.597 1.00 44.33 C ATOM 49 NZ LYS A 5 8.670 -3.578 -1.497 1.00 20.43 N ATOM 0 H LYS A 5 5.515 1.170 -3.976 1.00 41.24 H new ATOM 0 HA LYS A 5 8.078 0.214 -4.333 1.00 54.30 H new ATOM 0 HB2 LYS A 5 5.402 -1.074 -5.008 1.00 61.04 H new ATOM 0 HB3 LYS A 5 6.916 -1.947 -4.878 1.00 61.04 H new ATOM 0 HG2 LYS A 5 6.684 -0.457 -2.477 1.00 42.34 H new ATOM 0 HG3 LYS A 5 5.089 -1.117 -2.783 1.00 42.34 H new ATOM 0 HD2 LYS A 5 6.288 -2.750 -1.492 1.00 54.00 H new ATOM 0 HD3 LYS A 5 6.152 -3.384 -3.120 1.00 54.00 H new ATOM 0 HE2 LYS A 5 8.410 -3.162 -3.558 1.00 44.33 H new ATOM 0 HE3 LYS A 5 8.582 -1.741 -2.548 1.00 44.33 H new ATOM 0 HZ1 LYS A 5 9.704 -3.642 -1.584 1.00 20.43 H new ATOM 0 HZ2 LYS A 5 8.425 -3.153 -0.580 1.00 20.43 H new ATOM 0 HZ3 LYS A 5 8.258 -4.531 -1.558 1.00 20.43 H new ATOM 63 N SER A 6 8.721 0.289 -6.710 1.00 65.32 N ATOM 64 CA SER A 6 9.144 0.305 -8.106 1.00 11.21 C ATOM 65 C SER A 6 8.733 -0.984 -8.813 1.00 63.01 C ATOM 66 O SER A 6 8.606 -1.019 -10.037 1.00 50.12 O ATOM 67 CB SER A 6 10.660 0.489 -8.199 1.00 45.54 C ATOM 68 OG SER A 6 11.333 -0.337 -7.263 1.00 64.23 O ATOM 0 H SER A 6 9.484 0.357 -6.037 1.00 65.32 H new ATOM 0 HA SER A 6 8.652 1.143 -8.600 1.00 11.21 H new ATOM 0 HB2 SER A 6 10.997 0.250 -9.208 1.00 45.54 H new ATOM 0 HB3 SER A 6 10.915 1.533 -8.016 1.00 45.54 H new ATOM 0 HG SER A 6 12.300 -0.202 -7.344 1.00 64.23 H new ATOM 74 N ARG A 7 8.527 -2.040 -8.032 1.00 45.22 N ATOM 75 CA ARG A 7 8.132 -3.330 -8.583 1.00 34.12 C ATOM 76 C ARG A 7 6.730 -3.260 -9.181 1.00 2.43 C ATOM 77 O ARG A 7 6.539 -3.515 -10.370 1.00 24.52 O ATOM 78 CB ARG A 7 8.181 -4.407 -7.498 1.00 11.11 C ATOM 79 CG ARG A 7 8.653 -5.761 -8.004 1.00 53.21 C ATOM 80 CD ARG A 7 10.164 -5.899 -7.899 1.00 34.41 C ATOM 81 NE ARG A 7 10.598 -7.285 -8.055 1.00 43.33 N ATOM 82 CZ ARG A 7 10.630 -7.918 -9.222 1.00 12.11 C ATOM 83 NH1 ARG A 7 10.256 -7.293 -10.330 1.00 2.11 N ATOM 84 NH2 ARG A 7 11.039 -9.179 -9.283 1.00 15.03 N ATOM 0 H ARG A 7 8.627 -2.027 -7.017 1.00 45.22 H new ATOM 0 HA ARG A 7 8.834 -3.589 -9.376 1.00 34.12 H new ATOM 0 HB2 ARG A 7 8.844 -4.076 -6.699 1.00 11.11 H new ATOM 0 HB3 ARG A 7 7.188 -4.517 -7.063 1.00 11.11 H new ATOM 0 HG2 ARG A 7 8.173 -6.553 -7.429 1.00 53.21 H new ATOM 0 HG3 ARG A 7 8.346 -5.890 -9.042 1.00 53.21 H new ATOM 0 HD2 ARG A 7 10.638 -5.282 -8.662 1.00 34.41 H new ATOM 0 HD3 ARG A 7 10.496 -5.521 -6.932 1.00 34.41 H new ATOM 0 HE ARG A 7 10.893 -7.795 -7.222 1.00 43.33 H new ATOM 0 HH11 ARG A 7 9.943 -6.323 -10.288 1.00 2.11 H new ATOM 0 HH12 ARG A 7 10.282 -7.782 -11.225 1.00 2.11 H new ATOM 0 HH21 ARG A 7 11.329 -9.663 -8.433 1.00 15.03 H new ATOM 0 HH22 ARG A 7 11.063 -9.664 -10.180 1.00 15.03 H new ATOM 98 N ASP A 8 5.754 -2.912 -8.350 1.00 10.40 N ATOM 99 CA ASP A 8 4.371 -2.808 -8.797 1.00 60.44 C ATOM 100 C ASP A 8 4.161 -1.545 -9.627 1.00 40.41 C ATOM 101 O ASP A 8 3.270 -1.487 -10.473 1.00 74.54 O ATOM 102 CB ASP A 8 3.423 -2.806 -7.596 1.00 20.42 C ATOM 103 CG ASP A 8 3.159 -4.202 -7.065 1.00 62.23 C ATOM 104 OD1 ASP A 8 2.081 -4.756 -7.363 1.00 71.22 O ATOM 105 OD2 ASP A 8 4.031 -4.739 -6.352 1.00 15.15 O ATOM 0 H ASP A 8 5.896 -2.697 -7.363 1.00 10.40 H new ATOM 0 HA ASP A 8 4.152 -3.673 -9.423 1.00 60.44 H new ATOM 0 HB2 ASP A 8 3.849 -2.193 -6.802 1.00 20.42 H new ATOM 0 HB3 ASP A 8 2.478 -2.345 -7.883 1.00 20.42 H new ATOM 110 N TRP A 9 4.988 -0.536 -9.377 1.00 23.25 N ATOM 111 CA TRP A 9 4.893 0.727 -10.102 1.00 72.25 C ATOM 112 C TRP A 9 5.280 0.546 -11.565 1.00 34.11 C ATOM 113 O TRP A 9 4.480 0.801 -12.465 1.00 34.25 O ATOM 114 CB TRP A 9 5.790 1.780 -9.451 1.00 73.03 C ATOM 115 CG TRP A 9 5.940 3.023 -10.273 1.00 64.21 C ATOM 116 CD1 TRP A 9 7.103 3.675 -10.571 1.00 12.23 C ATOM 117 CD2 TRP A 9 4.890 3.767 -10.903 1.00 33.33 C ATOM 118 NE1 TRP A 9 6.840 4.777 -11.348 1.00 31.21 N ATOM 119 CE2 TRP A 9 5.490 4.855 -11.566 1.00 1.11 C ATOM 120 CE3 TRP A 9 3.503 3.617 -10.973 1.00 31.34 C ATOM 121 CZ2 TRP A 9 4.749 5.787 -12.288 1.00 41.12 C ATOM 122 CZ3 TRP A 9 2.769 4.543 -11.689 1.00 62.41 C ATOM 123 CH2 TRP A 9 3.392 5.616 -12.339 1.00 23.24 C ATOM 0 H TRP A 9 5.731 -0.567 -8.679 1.00 23.25 H new ATOM 0 HA TRP A 9 3.858 1.065 -10.059 1.00 72.25 H new ATOM 0 HB2 TRP A 9 5.379 2.045 -8.477 1.00 73.03 H new ATOM 0 HB3 TRP A 9 6.775 1.349 -9.275 1.00 73.03 H new ATOM 0 HD1 TRP A 9 8.086 3.369 -10.244 1.00 12.23 H new ATOM 0 HE1 TRP A 9 7.537 5.431 -11.705 1.00 31.21 H new ATOM 0 HE3 TRP A 9 3.013 2.792 -10.477 1.00 31.34 H new ATOM 0 HZ2 TRP A 9 5.228 6.615 -12.790 1.00 41.12 H new ATOM 0 HZ3 TRP A 9 1.696 4.438 -11.749 1.00 62.41 H new ATOM 0 HH2 TRP A 9 2.790 6.322 -12.891 1.00 23.24 H new ATOM 134 N LYS A 10 6.512 0.104 -11.797 1.00 52.31 N ATOM 135 CA LYS A 10 7.005 -0.113 -13.151 1.00 20.05 C ATOM 136 C LYS A 10 6.209 -1.210 -13.851 1.00 12.12 C ATOM 137 O LYS A 10 5.876 -1.092 -15.029 1.00 20.31 O ATOM 138 CB LYS A 10 8.489 -0.484 -13.122 1.00 13.43 C ATOM 139 CG LYS A 10 9.057 -0.830 -14.488 1.00 2.44 C ATOM 140 CD LYS A 10 10.506 -1.277 -14.393 1.00 2.20 C ATOM 141 CE LYS A 10 11.425 -0.361 -15.187 1.00 5.24 C ATOM 142 NZ LYS A 10 11.772 0.872 -14.427 1.00 12.12 N ATOM 0 H LYS A 10 7.187 -0.111 -11.063 1.00 52.31 H new ATOM 0 HA LYS A 10 6.880 0.815 -13.709 1.00 20.05 H new ATOM 0 HB2 LYS A 10 9.055 0.348 -12.703 1.00 13.43 H new ATOM 0 HB3 LYS A 10 8.629 -1.334 -12.454 1.00 13.43 H new ATOM 0 HG2 LYS A 10 8.460 -1.622 -14.941 1.00 2.44 H new ATOM 0 HG3 LYS A 10 8.985 0.038 -15.143 1.00 2.44 H new ATOM 0 HD2 LYS A 10 10.816 -1.289 -13.348 1.00 2.20 H new ATOM 0 HD3 LYS A 10 10.598 -2.298 -14.765 1.00 2.20 H new ATOM 0 HE2 LYS A 10 12.338 -0.898 -15.445 1.00 5.24 H new ATOM 0 HE3 LYS A 10 10.942 -0.086 -16.124 1.00 5.24 H new ATOM 0 HZ1 LYS A 10 12.399 1.469 -15.002 1.00 12.12 H new ATOM 0 HZ2 LYS A 10 10.903 1.398 -14.203 1.00 12.12 H new ATOM 0 HZ3 LYS A 10 12.256 0.611 -13.544 1.00 12.12 H new ATOM 156 N MET A 11 5.908 -2.276 -13.117 1.00 2.31 N ATOM 157 CA MET A 11 5.150 -3.393 -13.667 1.00 60.45 C ATOM 158 C MET A 11 3.766 -2.939 -14.123 1.00 44.31 C ATOM 159 O MET A 11 3.337 -3.244 -15.235 1.00 42.51 O ATOM 160 CB MET A 11 5.016 -4.509 -12.629 1.00 4.13 C ATOM 161 CG MET A 11 4.408 -5.786 -13.184 1.00 43.14 C ATOM 162 SD MET A 11 4.086 -7.015 -11.904 1.00 71.51 S ATOM 163 CE MET A 11 2.327 -6.787 -11.652 1.00 14.30 C ATOM 0 H MET A 11 6.178 -2.390 -12.140 1.00 2.31 H new ATOM 0 HA MET A 11 5.692 -3.775 -14.532 1.00 60.45 H new ATOM 0 HB2 MET A 11 6.001 -4.733 -12.220 1.00 4.13 H new ATOM 0 HB3 MET A 11 4.401 -4.153 -11.802 1.00 4.13 H new ATOM 0 HG2 MET A 11 3.476 -5.547 -13.696 1.00 43.14 H new ATOM 0 HG3 MET A 11 5.081 -6.211 -13.929 1.00 43.14 H new ATOM 0 HE1 MET A 11 1.977 -7.479 -10.886 1.00 14.30 H new ATOM 0 HE2 MET A 11 2.135 -5.763 -11.331 1.00 14.30 H new ATOM 0 HE3 MET A 11 1.798 -6.980 -12.585 1.00 14.30 H new ATOM 173 N ALA A 12 3.073 -2.208 -13.255 1.00 32.30 N ATOM 174 CA ALA A 12 1.740 -1.711 -13.569 1.00 65.24 C ATOM 175 C ALA A 12 1.750 -0.880 -14.849 1.00 11.44 C ATOM 176 O ALA A 12 0.903 -1.059 -15.723 1.00 74.43 O ATOM 177 CB ALA A 12 1.196 -0.888 -12.409 1.00 32.45 C ATOM 0 H ALA A 12 3.413 -1.947 -12.329 1.00 32.30 H new ATOM 0 HA ALA A 12 1.088 -2.570 -13.729 1.00 65.24 H new ATOM 0 HB1 ALA A 12 0.199 -0.523 -12.658 1.00 32.45 H new ATOM 0 HB2 ALA A 12 1.142 -1.510 -11.515 1.00 32.45 H new ATOM 0 HB3 ALA A 12 1.856 -0.041 -12.223 1.00 32.45 H new ATOM 183 N ILE A 13 2.716 0.027 -14.952 1.00 71.15 N ATOM 184 CA ILE A 13 2.836 0.883 -16.125 1.00 41.13 C ATOM 185 C ILE A 13 2.933 0.056 -17.402 1.00 34.31 C ATOM 186 O ILE A 13 2.262 0.344 -18.394 1.00 34.14 O ATOM 187 CB ILE A 13 4.068 1.802 -16.027 1.00 23.23 C ATOM 188 CG1 ILE A 13 3.971 2.693 -14.786 1.00 73.41 C ATOM 189 CG2 ILE A 13 4.199 2.649 -17.284 1.00 71.21 C ATOM 190 CD1 ILE A 13 5.316 3.117 -14.241 1.00 40.15 C ATOM 0 H ILE A 13 3.426 0.188 -14.238 1.00 71.15 H new ATOM 0 HA ILE A 13 1.936 1.497 -16.161 1.00 41.13 H new ATOM 0 HB ILE A 13 4.959 1.181 -15.936 1.00 23.23 H new ATOM 0 HG12 ILE A 13 3.391 3.582 -15.032 1.00 73.41 H new ATOM 0 HG13 ILE A 13 3.424 2.160 -14.008 1.00 73.41 H new ATOM 0 HG21 ILE A 13 5.074 3.293 -17.199 1.00 71.21 H new ATOM 0 HG22 ILE A 13 4.310 1.998 -18.151 1.00 71.21 H new ATOM 0 HG23 ILE A 13 3.307 3.264 -17.403 1.00 71.21 H new ATOM 0 HD11 ILE A 13 5.171 3.746 -13.363 1.00 40.15 H new ATOM 0 HD12 ILE A 13 5.891 2.234 -13.964 1.00 40.15 H new ATOM 0 HD13 ILE A 13 5.857 3.678 -15.003 1.00 40.15 H new ATOM 202 N LYS A 14 3.771 -0.974 -17.371 1.00 72.30 N ATOM 203 CA LYS A 14 3.955 -1.847 -18.524 1.00 71.31 C ATOM 204 C LYS A 14 2.625 -2.447 -18.970 1.00 60.14 C ATOM 205 O LYS A 14 2.299 -2.444 -20.157 1.00 41.14 O ATOM 206 CB LYS A 14 4.944 -2.966 -18.191 1.00 13.53 C ATOM 207 CG LYS A 14 6.267 -2.848 -18.928 1.00 32.54 C ATOM 208 CD LYS A 14 7.434 -3.273 -18.053 1.00 74.34 C ATOM 209 CE LYS A 14 8.751 -3.206 -18.810 1.00 42.44 C ATOM 210 NZ LYS A 14 9.600 -4.403 -18.554 1.00 45.11 N ATOM 0 H LYS A 14 4.334 -1.225 -16.559 1.00 72.30 H new ATOM 0 HA LYS A 14 4.356 -1.247 -19.341 1.00 71.31 H new ATOM 0 HB2 LYS A 14 5.134 -2.964 -17.118 1.00 13.53 H new ATOM 0 HB3 LYS A 14 4.488 -3.926 -18.432 1.00 13.53 H new ATOM 0 HG2 LYS A 14 6.241 -3.466 -19.826 1.00 32.54 H new ATOM 0 HG3 LYS A 14 6.412 -1.818 -19.254 1.00 32.54 H new ATOM 0 HD2 LYS A 14 7.485 -2.630 -17.175 1.00 74.34 H new ATOM 0 HD3 LYS A 14 7.270 -4.289 -17.695 1.00 74.34 H new ATOM 0 HE2 LYS A 14 8.552 -3.124 -19.879 1.00 42.44 H new ATOM 0 HE3 LYS A 14 9.293 -2.307 -18.517 1.00 42.44 H new ATOM 0 HZ1 LYS A 14 10.489 -4.319 -19.088 1.00 45.11 H new ATOM 0 HZ2 LYS A 14 9.812 -4.468 -17.538 1.00 45.11 H new ATOM 0 HZ3 LYS A 14 9.093 -5.259 -18.857 1.00 45.11 H new ATOM 224 N ARG A 15 1.861 -2.959 -18.011 1.00 34.31 N ATOM 225 CA ARG A 15 0.566 -3.561 -18.305 1.00 20.41 C ATOM 226 C ARG A 15 -0.425 -2.508 -18.790 1.00 61.25 C ATOM 227 O ARG A 15 -1.155 -2.727 -19.758 1.00 10.13 O ATOM 228 CB ARG A 15 0.013 -4.266 -17.065 1.00 52.12 C ATOM 229 CG ARG A 15 0.101 -5.782 -17.135 1.00 64.53 C ATOM 230 CD ARG A 15 1.545 -6.256 -17.156 1.00 53.30 C ATOM 231 NE ARG A 15 1.659 -7.642 -17.602 1.00 33.14 N ATOM 232 CZ ARG A 15 2.801 -8.194 -18.000 1.00 63.54 C ATOM 233 NH1 ARG A 15 3.919 -7.481 -18.008 1.00 71.33 N ATOM 234 NH2 ARG A 15 2.824 -9.462 -18.391 1.00 21.55 N ATOM 0 H ARG A 15 2.116 -2.969 -17.024 1.00 34.31 H new ATOM 0 HA ARG A 15 0.707 -4.295 -19.098 1.00 20.41 H new ATOM 0 HB2 ARG A 15 0.558 -3.919 -16.187 1.00 52.12 H new ATOM 0 HB3 ARG A 15 -1.029 -3.977 -16.928 1.00 52.12 H new ATOM 0 HG2 ARG A 15 -0.413 -6.217 -16.278 1.00 64.53 H new ATOM 0 HG3 ARG A 15 -0.412 -6.136 -18.029 1.00 64.53 H new ATOM 0 HD2 ARG A 15 2.128 -5.614 -17.816 1.00 53.30 H new ATOM 0 HD3 ARG A 15 1.973 -6.160 -16.158 1.00 53.30 H new ATOM 0 HE ARG A 15 0.817 -8.218 -17.608 1.00 33.14 H new ATOM 0 HH11 ARG A 15 3.904 -6.506 -17.708 1.00 71.33 H new ATOM 0 HH12 ARG A 15 4.794 -7.907 -18.314 1.00 71.33 H new ATOM 0 HH21 ARG A 15 1.966 -10.013 -18.386 1.00 21.55 H new ATOM 0 HH22 ARG A 15 3.700 -9.886 -18.696 1.00 21.55 H new ATOM 248 N CYS A 16 -0.448 -1.367 -18.110 1.00 15.02 N ATOM 249 CA CYS A 16 -1.351 -0.280 -18.470 1.00 61.54 C ATOM 250 C CYS A 16 -1.018 0.268 -19.855 1.00 54.04 C ATOM 251 O CYS A 16 -1.873 0.846 -20.526 1.00 21.14 O ATOM 252 CB CYS A 16 -1.274 0.840 -17.433 1.00 72.12 C ATOM 253 SG CYS A 16 -1.845 0.361 -15.785 1.00 23.23 S ATOM 0 H CYS A 16 0.149 -1.171 -17.306 1.00 15.02 H new ATOM 0 HA CYS A 16 -2.366 -0.676 -18.491 1.00 61.54 H new ATOM 0 HB2 CYS A 16 -0.242 1.185 -17.362 1.00 72.12 H new ATOM 0 HB3 CYS A 16 -1.869 1.684 -17.781 1.00 72.12 H new ATOM 0 HG CYS A 16 -1.810 1.394 -14.996 1.00 23.23 H new ATOM 259 N SER A 17 0.229 0.083 -20.274 1.00 54.22 N ATOM 260 CA SER A 17 0.676 0.564 -21.576 1.00 13.33 C ATOM 261 C SER A 17 -0.210 0.018 -22.691 1.00 52.33 C ATOM 262 O SER A 17 -0.333 0.626 -23.754 1.00 74.21 O ATOM 263 CB SER A 17 2.131 0.156 -21.820 1.00 25.54 C ATOM 264 OG SER A 17 2.748 1.013 -22.766 1.00 10.52 O ATOM 0 H SER A 17 0.948 -0.396 -19.731 1.00 54.22 H new ATOM 0 HA SER A 17 0.604 1.652 -21.579 1.00 13.33 H new ATOM 0 HB2 SER A 17 2.683 0.188 -20.881 1.00 25.54 H new ATOM 0 HB3 SER A 17 2.169 -0.873 -22.178 1.00 25.54 H new ATOM 0 HG SER A 17 3.677 0.733 -22.904 1.00 10.52 H new ATOM 270 N ASN A 18 -0.827 -1.132 -22.439 1.00 22.03 N ATOM 271 CA ASN A 18 -1.703 -1.761 -23.422 1.00 51.54 C ATOM 272 C ASN A 18 -2.794 -0.795 -23.873 1.00 14.12 C ATOM 273 O ASN A 18 -3.301 -0.893 -24.991 1.00 12.10 O ATOM 274 CB ASN A 18 -2.335 -3.025 -22.836 1.00 30.21 C ATOM 275 CG ASN A 18 -1.480 -4.257 -23.063 1.00 24.12 C ATOM 276 OD1 ASN A 18 -1.549 -4.888 -24.118 1.00 71.22 O ATOM 277 ND2 ASN A 18 -0.670 -4.605 -22.071 1.00 10.45 N ATOM 0 H ASN A 18 -0.737 -1.647 -21.563 1.00 22.03 H new ATOM 0 HA ASN A 18 -1.101 -2.032 -24.289 1.00 51.54 H new ATOM 0 HB2 ASN A 18 -2.492 -2.887 -21.766 1.00 30.21 H new ATOM 0 HB3 ASN A 18 -3.316 -3.179 -23.285 1.00 30.21 H new ATOM 0 HD21 ASN A 18 -0.071 -5.425 -22.165 1.00 10.45 H new ATOM 0 HD22 ASN A 18 -0.646 -4.052 -21.214 1.00 10.45 H new ATOM 284 N VAL A 19 -3.152 0.138 -22.997 1.00 60.24 N ATOM 285 CA VAL A 19 -4.182 1.123 -23.306 1.00 13.33 C ATOM 286 C VAL A 19 -3.835 1.902 -24.570 1.00 73.24 C ATOM 287 O VAL A 19 -2.664 2.117 -24.877 1.00 45.44 O ATOM 288 CB VAL A 19 -4.379 2.114 -22.143 1.00 15.43 C ATOM 289 CG1 VAL A 19 -3.152 2.999 -21.983 1.00 75.13 C ATOM 290 CG2 VAL A 19 -5.628 2.953 -22.364 1.00 1.34 C ATOM 0 H VAL A 19 -2.744 0.233 -22.067 1.00 60.24 H new ATOM 0 HA VAL A 19 -5.109 0.572 -23.465 1.00 13.33 H new ATOM 0 HB VAL A 19 -4.510 1.546 -21.222 1.00 15.43 H new ATOM 0 HG11 VAL A 19 -3.309 3.693 -21.157 1.00 75.13 H new ATOM 0 HG12 VAL A 19 -2.280 2.378 -21.775 1.00 75.13 H new ATOM 0 HG13 VAL A 19 -2.986 3.561 -22.902 1.00 75.13 H new ATOM 0 HG21 VAL A 19 -5.752 3.647 -21.533 1.00 1.34 H new ATOM 0 HG22 VAL A 19 -5.530 3.513 -23.294 1.00 1.34 H new ATOM 0 HG23 VAL A 19 -6.499 2.300 -22.424 1.00 1.34 H new ATOM 300 N ALA A 20 -4.864 2.322 -25.299 1.00 34.41 N ATOM 301 CA ALA A 20 -4.669 3.079 -26.530 1.00 54.54 C ATOM 302 C ALA A 20 -4.962 4.559 -26.314 1.00 63.11 C ATOM 303 O ALA A 20 -5.844 4.922 -25.535 1.00 32.31 O ATOM 304 CB ALA A 20 -5.549 2.521 -27.638 1.00 15.00 C ATOM 0 H ALA A 20 -5.840 2.151 -25.059 1.00 34.41 H new ATOM 0 HA ALA A 20 -3.625 2.981 -26.827 1.00 54.54 H new ATOM 0 HB1 ALA A 20 -5.393 3.096 -28.551 1.00 15.00 H new ATOM 0 HB2 ALA A 20 -5.290 1.478 -27.818 1.00 15.00 H new ATOM 0 HB3 ALA A 20 -6.595 2.589 -27.341 1.00 15.00 H new ATOM 310 N VAL A 21 -4.217 5.413 -27.009 1.00 13.23 N ATOM 311 CA VAL A 21 -4.397 6.855 -26.894 1.00 51.22 C ATOM 312 C VAL A 21 -5.831 7.258 -27.219 1.00 53.11 C ATOM 313 O VAL A 21 -6.316 8.291 -26.761 1.00 54.23 O ATOM 314 CB VAL A 21 -3.438 7.617 -27.828 1.00 10.32 C ATOM 315 CG1 VAL A 21 -1.991 7.284 -27.495 1.00 41.43 C ATOM 316 CG2 VAL A 21 -3.745 7.297 -29.283 1.00 45.53 C ATOM 0 H VAL A 21 -3.483 5.131 -27.658 1.00 13.23 H new ATOM 0 HA VAL A 21 -4.173 7.120 -25.861 1.00 51.22 H new ATOM 0 HB VAL A 21 -3.584 8.686 -27.676 1.00 10.32 H new ATOM 0 HG11 VAL A 21 -1.328 7.832 -28.165 1.00 41.43 H new ATOM 0 HG12 VAL A 21 -1.780 7.568 -26.464 1.00 41.43 H new ATOM 0 HG13 VAL A 21 -1.827 6.213 -27.617 1.00 41.43 H new ATOM 0 HG21 VAL A 21 -3.058 7.844 -29.929 1.00 45.53 H new ATOM 0 HG22 VAL A 21 -3.628 6.227 -29.453 1.00 45.53 H new ATOM 0 HG23 VAL A 21 -4.769 7.591 -29.512 1.00 45.53 H new ATOM 326 N GLY A 22 -6.505 6.433 -28.014 1.00 71.31 N ATOM 327 CA GLY A 22 -7.879 6.719 -28.387 1.00 53.21 C ATOM 328 C GLY A 22 -8.269 6.076 -29.703 1.00 2.14 C ATOM 329 O GLY A 22 -7.504 5.296 -30.272 1.00 42.22 O ATOM 0 H GLY A 22 -6.125 5.572 -28.407 1.00 71.31 H new ATOM 0 HA2 GLY A 22 -8.547 6.365 -27.601 1.00 53.21 H new ATOM 0 HA3 GLY A 22 -8.015 7.798 -28.459 1.00 53.21 H new ATOM 333 N VAL A 23 -9.462 6.401 -30.188 1.00 31.43 N ATOM 334 CA VAL A 23 -9.952 5.848 -31.445 1.00 60.25 C ATOM 335 C VAL A 23 -9.426 6.641 -32.636 1.00 42.30 C ATOM 336 O VAL A 23 -9.292 6.111 -33.738 1.00 33.52 O ATOM 337 CB VAL A 23 -11.492 5.837 -31.490 1.00 24.33 C ATOM 338 CG1 VAL A 23 -12.056 5.049 -30.318 1.00 2.05 C ATOM 339 CG2 VAL A 23 -12.035 7.258 -31.499 1.00 74.05 C ATOM 0 H VAL A 23 -10.108 7.044 -29.730 1.00 31.43 H new ATOM 0 HA VAL A 23 -9.586 4.823 -31.504 1.00 60.25 H new ATOM 0 HB VAL A 23 -11.807 5.346 -32.411 1.00 24.33 H new ATOM 0 HG11 VAL A 23 -13.145 5.053 -30.367 1.00 2.05 H new ATOM 0 HG12 VAL A 23 -11.694 4.022 -30.363 1.00 2.05 H new ATOM 0 HG13 VAL A 23 -11.734 5.507 -29.383 1.00 2.05 H new ATOM 0 HG21 VAL A 23 -13.124 7.231 -31.531 1.00 74.05 H new ATOM 0 HG22 VAL A 23 -11.711 7.777 -30.597 1.00 74.05 H new ATOM 0 HG23 VAL A 23 -11.659 7.786 -32.376 1.00 74.05 H new ATOM 349 N GLY A 24 -9.128 7.916 -32.406 1.00 23.21 N ATOM 350 CA GLY A 24 -8.618 8.763 -33.470 1.00 15.01 C ATOM 351 C GLY A 24 -7.424 8.150 -34.176 1.00 44.24 C ATOM 352 O GLY A 24 -7.212 8.382 -35.365 1.00 65.41 O ATOM 0 H GLY A 24 -9.230 8.378 -31.502 1.00 23.21 H new ATOM 0 HA2 GLY A 24 -9.410 8.947 -34.196 1.00 15.01 H new ATOM 0 HA3 GLY A 24 -8.334 9.731 -33.056 1.00 15.01 H new ATOM 356 N GLY A 25 -6.641 7.368 -33.440 1.00 10.01 N ATOM 357 CA GLY A 25 -5.471 6.735 -34.020 1.00 31.24 C ATOM 358 C GLY A 25 -5.717 5.284 -34.384 1.00 72.32 C ATOM 359 O GLY A 25 -6.630 4.650 -33.856 1.00 74.01 O ATOM 0 H GLY A 25 -6.796 7.161 -32.453 1.00 10.01 H new ATOM 0 HA2 GLY A 25 -5.169 7.284 -34.912 1.00 31.24 H new ATOM 0 HA3 GLY A 25 -4.642 6.794 -33.314 1.00 31.24 H new ATOM 363 N LYS A 26 -4.902 4.757 -35.291 1.00 1.15 N ATOM 364 CA LYS A 26 -5.034 3.372 -35.727 1.00 61.41 C ATOM 365 C LYS A 26 -4.853 2.413 -34.555 1.00 34.41 C ATOM 366 O LYS A 26 -5.671 1.518 -34.340 1.00 20.42 O ATOM 367 CB LYS A 26 -4.009 3.059 -36.819 1.00 73.34 C ATOM 368 CG LYS A 26 -4.295 3.754 -38.139 1.00 42.20 C ATOM 369 CD LYS A 26 -5.335 3.002 -38.952 1.00 3.13 C ATOM 370 CE LYS A 26 -4.868 2.778 -40.383 1.00 74.15 C ATOM 371 NZ LYS A 26 -3.671 1.894 -40.444 1.00 50.24 N ATOM 0 H LYS A 26 -4.142 5.269 -35.739 1.00 1.15 H new ATOM 0 HA LYS A 26 -6.038 3.239 -36.131 1.00 61.41 H new ATOM 0 HB2 LYS A 26 -3.019 3.352 -36.471 1.00 73.34 H new ATOM 0 HB3 LYS A 26 -3.983 1.982 -36.983 1.00 73.34 H new ATOM 0 HG2 LYS A 26 -4.645 4.769 -37.949 1.00 42.20 H new ATOM 0 HG3 LYS A 26 -3.373 3.838 -38.714 1.00 42.20 H new ATOM 0 HD2 LYS A 26 -5.542 2.041 -38.481 1.00 3.13 H new ATOM 0 HD3 LYS A 26 -6.270 3.562 -38.957 1.00 3.13 H new ATOM 0 HE2 LYS A 26 -5.677 2.335 -40.964 1.00 74.15 H new ATOM 0 HE3 LYS A 26 -4.634 3.738 -40.843 1.00 74.15 H new ATOM 0 HZ1 LYS A 26 -3.631 1.427 -41.372 1.00 50.24 H new ATOM 0 HZ2 LYS A 26 -2.812 2.463 -40.306 1.00 50.24 H new ATOM 0 HZ3 LYS A 26 -3.733 1.174 -39.696 1.00 50.24 H new ATOM 385 N SER A 27 -3.777 2.606 -33.799 1.00 54.42 N ATOM 386 CA SER A 27 -3.487 1.756 -32.649 1.00 64.23 C ATOM 387 C SER A 27 -2.207 2.205 -31.951 1.00 22.14 C ATOM 388 O SER A 27 -1.175 1.538 -32.030 1.00 70.45 O ATOM 389 CB SER A 27 -3.358 0.296 -33.088 1.00 51.53 C ATOM 390 OG SER A 27 -2.585 0.186 -34.270 1.00 33.13 O ATOM 0 H SER A 27 -3.091 3.343 -33.962 1.00 54.42 H new ATOM 0 HA SER A 27 -4.314 1.844 -31.944 1.00 64.23 H new ATOM 0 HB2 SER A 27 -2.896 -0.287 -32.292 1.00 51.53 H new ATOM 0 HB3 SER A 27 -4.349 -0.125 -33.257 1.00 51.53 H new ATOM 0 HG SER A 27 -1.704 0.590 -34.124 1.00 33.13 H new ATOM 396 N LYS A 28 -2.281 3.342 -31.267 1.00 1.40 N ATOM 397 CA LYS A 28 -1.130 3.882 -30.552 1.00 71.40 C ATOM 398 C LYS A 28 -1.238 3.603 -29.057 1.00 61.34 C ATOM 399 O LYS A 28 -2.192 4.027 -28.404 1.00 72.05 O ATOM 400 CB LYS A 28 -1.015 5.389 -30.795 1.00 13.53 C ATOM 401 CG LYS A 28 -0.694 5.750 -32.235 1.00 11.32 C ATOM 402 CD LYS A 28 0.704 6.330 -32.366 1.00 24.01 C ATOM 403 CE LYS A 28 1.710 5.270 -32.786 1.00 31.14 C ATOM 404 NZ LYS A 28 3.053 5.855 -33.054 1.00 30.45 N ATOM 0 H LYS A 28 -3.126 3.908 -31.193 1.00 1.40 H new ATOM 0 HA LYS A 28 -0.234 3.390 -30.931 1.00 71.40 H new ATOM 0 HB2 LYS A 28 -1.952 5.867 -30.510 1.00 13.53 H new ATOM 0 HB3 LYS A 28 -0.239 5.795 -30.146 1.00 13.53 H new ATOM 0 HG2 LYS A 28 -0.781 4.862 -32.862 1.00 11.32 H new ATOM 0 HG3 LYS A 28 -1.424 6.472 -32.602 1.00 11.32 H new ATOM 0 HD2 LYS A 28 0.697 7.137 -33.099 1.00 24.01 H new ATOM 0 HD3 LYS A 28 1.009 6.766 -31.415 1.00 24.01 H new ATOM 0 HE2 LYS A 28 1.792 4.516 -32.003 1.00 31.14 H new ATOM 0 HE3 LYS A 28 1.350 4.762 -33.681 1.00 31.14 H new ATOM 0 HZ1 LYS A 28 3.710 5.100 -33.337 1.00 30.45 H new ATOM 0 HZ2 LYS A 28 2.980 6.556 -33.819 1.00 30.45 H new ATOM 0 HZ3 LYS A 28 3.408 6.318 -32.193 1.00 30.45 H new ATOM 418 N LYS A 29 -0.256 2.890 -28.519 1.00 24.04 N ATOM 419 CA LYS A 29 -0.238 2.558 -27.100 1.00 74.10 C ATOM 420 C LYS A 29 0.412 3.673 -26.288 1.00 73.35 C ATOM 421 O LYS A 29 1.337 4.336 -26.754 1.00 25.34 O ATOM 422 CB LYS A 29 0.512 1.243 -26.872 1.00 0.13 C ATOM 423 CG LYS A 29 1.909 1.228 -27.471 1.00 44.04 C ATOM 424 CD LYS A 29 1.985 0.320 -28.686 1.00 52.23 C ATOM 425 CE LYS A 29 3.410 -0.144 -28.945 1.00 33.54 C ATOM 426 NZ LYS A 29 3.554 -0.769 -30.290 1.00 44.11 N ATOM 0 H LYS A 29 0.540 2.530 -29.045 1.00 24.04 H new ATOM 0 HA LYS A 29 -1.269 2.444 -26.767 1.00 74.10 H new ATOM 0 HB2 LYS A 29 0.583 1.056 -25.801 1.00 0.13 H new ATOM 0 HB3 LYS A 29 -0.067 0.425 -27.301 1.00 0.13 H new ATOM 0 HG2 LYS A 29 2.195 2.241 -27.754 1.00 44.04 H new ATOM 0 HG3 LYS A 29 2.624 0.893 -26.720 1.00 44.04 H new ATOM 0 HD2 LYS A 29 1.341 -0.546 -28.535 1.00 52.23 H new ATOM 0 HD3 LYS A 29 1.608 0.849 -29.561 1.00 52.23 H new ATOM 0 HE2 LYS A 29 4.089 0.705 -28.864 1.00 33.54 H new ATOM 0 HE3 LYS A 29 3.704 -0.861 -28.178 1.00 33.54 H new ATOM 0 HZ1 LYS A 29 4.539 -1.072 -30.428 1.00 44.11 H new ATOM 0 HZ2 LYS A 29 2.925 -1.594 -30.358 1.00 44.11 H new ATOM 0 HZ3 LYS A 29 3.298 -0.077 -31.023 1.00 44.11 H new ATOM 440 N PHE A 30 -0.080 3.874 -25.069 1.00 4.23 N ATOM 441 CA PHE A 30 0.454 4.909 -24.191 1.00 23.42 C ATOM 442 C PHE A 30 1.943 4.694 -23.940 1.00 45.41 C ATOM 443 O PHE A 30 2.548 3.770 -24.479 1.00 3.12 O ATOM 444 CB PHE A 30 -0.303 4.919 -22.861 1.00 25.42 C ATOM 445 CG PHE A 30 -1.219 6.099 -22.702 1.00 71.02 C ATOM 446 CD1 PHE A 30 -0.907 7.121 -21.820 1.00 31.32 C ATOM 447 CD2 PHE A 30 -2.392 6.186 -23.434 1.00 60.54 C ATOM 448 CE1 PHE A 30 -1.747 8.208 -21.672 1.00 54.42 C ATOM 449 CE2 PHE A 30 -3.237 7.271 -23.289 1.00 14.15 C ATOM 450 CZ PHE A 30 -2.914 8.282 -22.406 1.00 61.53 C ATOM 0 H PHE A 30 -0.847 3.334 -24.668 1.00 4.23 H new ATOM 0 HA PHE A 30 0.322 5.872 -24.684 1.00 23.42 H new ATOM 0 HB2 PHE A 30 -0.887 4.002 -22.777 1.00 25.42 H new ATOM 0 HB3 PHE A 30 0.417 4.915 -22.042 1.00 25.42 H new ATOM 0 HD1 PHE A 30 0.003 7.067 -21.241 1.00 31.32 H new ATOM 0 HD2 PHE A 30 -2.649 5.398 -24.126 1.00 60.54 H new ATOM 0 HE1 PHE A 30 -1.491 8.999 -20.983 1.00 54.42 H new ATOM 0 HE2 PHE A 30 -4.148 7.327 -23.866 1.00 14.15 H new ATOM 0 HZ PHE A 30 -3.573 9.129 -22.290 1.00 61.53 H new ATOM 460 N GLY A 31 2.529 5.559 -23.115 1.00 2.03 N ATOM 461 CA GLY A 31 3.943 5.448 -22.807 1.00 61.40 C ATOM 462 C GLY A 31 4.251 5.804 -21.366 1.00 3.22 C ATOM 463 O GLY A 31 3.398 6.333 -20.655 1.00 23.31 O ATOM 0 H GLY A 31 2.050 6.333 -22.656 1.00 2.03 H new ATOM 0 HA2 GLY A 31 4.276 4.429 -23.006 1.00 61.40 H new ATOM 0 HA3 GLY A 31 4.509 6.104 -23.469 1.00 61.40 H new ATOM 467 N GLU A 32 5.474 5.513 -20.936 1.00 55.33 N ATOM 468 CA GLU A 32 5.891 5.803 -19.569 1.00 3.31 C ATOM 469 C GLU A 32 5.764 7.294 -19.267 1.00 12.51 C ATOM 470 O GLU A 32 5.267 7.684 -18.211 1.00 21.31 O ATOM 471 CB GLU A 32 7.334 5.348 -19.344 1.00 14.44 C ATOM 472 CG GLU A 32 8.316 5.915 -20.355 1.00 50.33 C ATOM 473 CD GLU A 32 9.702 5.314 -20.224 1.00 50.21 C ATOM 474 OE1 GLU A 32 10.651 6.070 -19.928 1.00 10.31 O ATOM 475 OE2 GLU A 32 9.838 4.087 -20.417 1.00 5.21 O ATOM 0 H GLU A 32 6.193 5.077 -21.513 1.00 55.33 H new ATOM 0 HA GLU A 32 5.235 5.255 -18.893 1.00 3.31 H new ATOM 0 HB2 GLU A 32 7.647 5.642 -18.342 1.00 14.44 H new ATOM 0 HB3 GLU A 32 7.373 4.259 -19.383 1.00 14.44 H new ATOM 0 HG2 GLU A 32 7.940 5.734 -21.362 1.00 50.33 H new ATOM 0 HG3 GLU A 32 8.379 6.996 -20.227 1.00 50.33 H new ATOM 482 N GLY A 33 6.219 8.122 -20.202 1.00 65.10 N ATOM 483 CA GLY A 33 6.148 9.560 -20.017 1.00 33.31 C ATOM 484 C GLY A 33 4.721 10.067 -19.954 1.00 61.20 C ATOM 485 O GLY A 33 4.432 11.044 -19.264 1.00 33.12 O ATOM 0 H GLY A 33 6.635 7.823 -21.084 1.00 65.10 H new ATOM 0 HA2 GLY A 33 6.667 9.831 -19.098 1.00 33.31 H new ATOM 0 HA3 GLY A 33 6.670 10.055 -20.836 1.00 33.31 H new ATOM 489 N ASN A 34 3.826 9.402 -20.678 1.00 21.11 N ATOM 490 CA ASN A 34 2.421 9.793 -20.703 1.00 14.33 C ATOM 491 C ASN A 34 1.752 9.501 -19.363 1.00 63.35 C ATOM 492 O ASN A 34 1.035 10.342 -18.821 1.00 52.42 O ATOM 493 CB ASN A 34 1.685 9.056 -21.824 1.00 23.32 C ATOM 494 CG ASN A 34 2.246 9.382 -23.195 1.00 71.34 C ATOM 495 OD1 ASN A 34 3.318 8.907 -23.568 1.00 20.13 O ATOM 496 ND2 ASN A 34 1.521 10.197 -23.953 1.00 55.42 N ATOM 0 H ASN A 34 4.049 8.591 -21.255 1.00 21.11 H new ATOM 0 HA ASN A 34 2.371 10.866 -20.889 1.00 14.33 H new ATOM 0 HB2 ASN A 34 1.751 7.981 -21.653 1.00 23.32 H new ATOM 0 HB3 ASN A 34 0.628 9.319 -21.795 1.00 23.32 H new ATOM 0 HD21 ASN A 34 1.848 10.452 -24.885 1.00 55.42 H new ATOM 0 HD22 ASN A 34 0.638 10.568 -23.603 1.00 55.42 H new ATOM 503 N PHE A 35 1.991 8.306 -18.836 1.00 55.22 N ATOM 504 CA PHE A 35 1.412 7.903 -17.560 1.00 31.10 C ATOM 505 C PHE A 35 1.961 8.755 -16.419 1.00 61.40 C ATOM 506 O PHE A 35 1.277 8.995 -15.424 1.00 22.13 O ATOM 507 CB PHE A 35 1.697 6.424 -17.290 1.00 62.03 C ATOM 508 CG PHE A 35 0.936 5.493 -18.189 1.00 12.14 C ATOM 509 CD1 PHE A 35 -0.411 5.697 -18.440 1.00 51.14 C ATOM 510 CD2 PHE A 35 1.568 4.413 -18.784 1.00 12.14 C ATOM 511 CE1 PHE A 35 -1.115 4.842 -19.268 1.00 11.31 C ATOM 512 CE2 PHE A 35 0.870 3.554 -19.612 1.00 61.20 C ATOM 513 CZ PHE A 35 -0.473 3.769 -19.854 1.00 71.22 C ATOM 0 H PHE A 35 2.582 7.599 -19.273 1.00 55.22 H new ATOM 0 HA PHE A 35 0.334 8.054 -17.616 1.00 31.10 H new ATOM 0 HB2 PHE A 35 2.765 6.240 -17.410 1.00 62.03 H new ATOM 0 HB3 PHE A 35 1.449 6.198 -16.253 1.00 62.03 H new ATOM 0 HD1 PHE A 35 -0.918 6.534 -17.983 1.00 51.14 H new ATOM 0 HD2 PHE A 35 2.618 4.240 -18.599 1.00 12.14 H new ATOM 0 HE1 PHE A 35 -2.165 5.013 -19.456 1.00 11.31 H new ATOM 0 HE2 PHE A 35 1.374 2.715 -20.069 1.00 61.20 H new ATOM 0 HZ PHE A 35 -1.020 3.099 -20.501 1.00 71.22 H new ATOM 523 N ARG A 36 3.201 9.210 -16.573 1.00 73.32 N ATOM 524 CA ARG A 36 3.843 10.034 -15.556 1.00 20.43 C ATOM 525 C ARG A 36 3.168 11.398 -15.455 1.00 24.34 C ATOM 526 O ARG A 36 2.646 11.767 -14.403 1.00 31.33 O ATOM 527 CB ARG A 36 5.329 10.210 -15.877 1.00 63.12 C ATOM 528 CG ARG A 36 6.254 9.622 -14.823 1.00 61.22 C ATOM 529 CD ARG A 36 7.716 9.822 -15.191 1.00 72.22 C ATOM 530 NE ARG A 36 8.089 11.234 -15.203 1.00 11.15 N ATOM 531 CZ ARG A 36 9.312 11.667 -15.484 1.00 3.34 C ATOM 532 NH1 ARG A 36 10.276 10.803 -15.776 1.00 73.12 N ATOM 533 NH2 ARG A 36 9.576 12.968 -15.474 1.00 34.23 N ATOM 0 H ARG A 36 3.780 9.022 -17.391 1.00 73.32 H new ATOM 0 HA ARG A 36 3.743 9.527 -14.596 1.00 20.43 H new ATOM 0 HB2 ARG A 36 5.542 9.741 -16.838 1.00 63.12 H new ATOM 0 HB3 ARG A 36 5.545 11.273 -15.986 1.00 63.12 H new ATOM 0 HG2 ARG A 36 6.053 10.090 -13.859 1.00 61.22 H new ATOM 0 HG3 ARG A 36 6.048 8.558 -14.710 1.00 61.22 H new ATOM 0 HD2 ARG A 36 8.345 9.287 -14.480 1.00 72.22 H new ATOM 0 HD3 ARG A 36 7.905 9.389 -16.173 1.00 72.22 H new ATOM 0 HE ARG A 36 7.371 11.925 -14.984 1.00 11.15 H new ATOM 0 HH11 ARG A 36 10.078 9.802 -15.785 1.00 73.12 H new ATOM 0 HH12 ARG A 36 11.214 11.140 -15.991 1.00 73.12 H new ATOM 0 HH21 ARG A 36 8.839 13.636 -15.250 1.00 34.23 H new ATOM 0 HH22 ARG A 36 10.516 13.299 -15.690 1.00 34.23 H new ATOM 547 N TRP A 37 3.183 12.142 -16.555 1.00 61.11 N ATOM 548 CA TRP A 37 2.573 13.467 -16.590 1.00 33.42 C ATOM 549 C TRP A 37 1.096 13.395 -16.217 1.00 71.32 C ATOM 550 O TRP A 37 0.546 14.333 -15.641 1.00 63.23 O ATOM 551 CB TRP A 37 2.730 14.087 -17.980 1.00 74.01 C ATOM 552 CG TRP A 37 1.916 15.330 -18.171 1.00 74.13 C ATOM 553 CD1 TRP A 37 2.357 16.619 -18.089 1.00 51.54 C ATOM 554 CD2 TRP A 37 0.518 15.400 -18.476 1.00 11.42 C ATOM 555 NE1 TRP A 37 1.317 17.488 -18.323 1.00 10.42 N ATOM 556 CE2 TRP A 37 0.180 16.765 -18.565 1.00 50.41 C ATOM 557 CE3 TRP A 37 -0.479 14.444 -18.685 1.00 3.52 C ATOM 558 CZ2 TRP A 37 -1.113 17.193 -18.851 1.00 71.42 C ATOM 559 CZ3 TRP A 37 -1.762 14.870 -18.970 1.00 44.13 C ATOM 560 CH2 TRP A 37 -2.070 16.236 -19.051 1.00 32.22 C ATOM 0 H TRP A 37 3.610 11.851 -17.434 1.00 61.11 H new ATOM 0 HA TRP A 37 3.084 14.095 -15.860 1.00 33.42 H new ATOM 0 HB2 TRP A 37 3.781 14.320 -18.149 1.00 74.01 H new ATOM 0 HB3 TRP A 37 2.441 13.353 -18.732 1.00 74.01 H new ATOM 0 HD1 TRP A 37 3.373 16.913 -17.872 1.00 51.54 H new ATOM 0 HE1 TRP A 37 1.382 18.506 -18.317 1.00 10.42 H new ATOM 0 HE3 TRP A 37 -0.251 13.390 -18.625 1.00 3.52 H new ATOM 0 HZ2 TRP A 37 -1.353 18.244 -18.913 1.00 71.42 H new ATOM 0 HZ3 TRP A 37 -2.540 14.139 -19.133 1.00 44.13 H new ATOM 0 HH2 TRP A 37 -3.082 16.538 -19.276 1.00 32.22 H new ATOM 571 N ALA A 38 0.460 12.276 -16.548 1.00 41.02 N ATOM 572 CA ALA A 38 -0.953 12.083 -16.245 1.00 14.21 C ATOM 573 C ALA A 38 -1.167 11.850 -14.753 1.00 14.32 C ATOM 574 O ALA A 38 -1.804 12.656 -14.075 1.00 53.25 O ATOM 575 CB ALA A 38 -1.511 10.917 -17.048 1.00 0.43 C ATOM 0 H ALA A 38 0.900 11.490 -17.026 1.00 41.02 H new ATOM 0 HA ALA A 38 -1.487 12.991 -16.525 1.00 14.21 H new ATOM 0 HB1 ALA A 38 -2.567 10.785 -16.812 1.00 0.43 H new ATOM 0 HB2 ALA A 38 -1.401 11.123 -18.113 1.00 0.43 H new ATOM 0 HB3 ALA A 38 -0.966 10.007 -16.796 1.00 0.43 H new ATOM 581 N ILE A 39 -0.631 10.743 -14.249 1.00 73.35 N ATOM 582 CA ILE A 39 -0.765 10.405 -12.837 1.00 31.32 C ATOM 583 C ILE A 39 -0.248 11.534 -11.950 1.00 73.51 C ATOM 584 O ILE A 39 -0.913 11.940 -10.997 1.00 42.51 O ATOM 585 CB ILE A 39 -0.004 9.110 -12.494 1.00 60.23 C ATOM 586 CG1 ILE A 39 -0.573 7.933 -13.289 1.00 63.44 C ATOM 587 CG2 ILE A 39 -0.079 8.832 -11.000 1.00 61.13 C ATOM 588 CD1 ILE A 39 0.212 6.653 -13.119 1.00 15.05 C ATOM 0 H ILE A 39 -0.100 10.066 -14.797 1.00 73.35 H new ATOM 0 HA ILE A 39 -1.828 10.254 -12.648 1.00 31.32 H new ATOM 0 HB ILE A 39 1.043 9.238 -12.768 1.00 60.23 H new ATOM 0 HG12 ILE A 39 -1.604 7.761 -12.980 1.00 63.44 H new ATOM 0 HG13 ILE A 39 -0.597 8.197 -14.346 1.00 63.44 H new ATOM 0 HG21 ILE A 39 0.463 7.914 -10.773 1.00 61.13 H new ATOM 0 HG22 ILE A 39 0.368 9.662 -10.453 1.00 61.13 H new ATOM 0 HG23 ILE A 39 -1.122 8.721 -10.703 1.00 61.13 H new ATOM 0 HD11 ILE A 39 -0.249 5.862 -13.711 1.00 15.05 H new ATOM 0 HD12 ILE A 39 1.237 6.808 -13.455 1.00 15.05 H new ATOM 0 HD13 ILE A 39 0.215 6.365 -12.068 1.00 15.05 H new ATOM 600 N ARG A 40 0.938 12.037 -12.273 1.00 2.13 N ATOM 601 CA ARG A 40 1.543 13.119 -11.507 1.00 42.04 C ATOM 602 C ARG A 40 0.625 14.338 -11.470 1.00 4.52 C ATOM 603 O ARG A 40 0.378 14.908 -10.408 1.00 62.31 O ATOM 604 CB ARG A 40 2.896 13.504 -12.108 1.00 62.34 C ATOM 605 CG ARG A 40 3.644 14.554 -11.302 1.00 73.41 C ATOM 606 CD ARG A 40 5.026 14.818 -11.878 1.00 33.44 C ATOM 607 NE ARG A 40 6.089 14.388 -10.972 1.00 71.33 N ATOM 608 CZ ARG A 40 7.382 14.489 -11.256 1.00 10.04 C ATOM 609 NH1 ARG A 40 7.772 15.002 -12.414 1.00 32.33 N ATOM 610 NH2 ARG A 40 8.289 14.076 -10.379 1.00 61.42 N ATOM 0 H ARG A 40 1.499 11.712 -13.060 1.00 2.13 H new ATOM 0 HA ARG A 40 1.694 12.768 -10.486 1.00 42.04 H new ATOM 0 HB2 ARG A 40 3.516 12.611 -12.189 1.00 62.34 H new ATOM 0 HB3 ARG A 40 2.741 13.877 -13.120 1.00 62.34 H new ATOM 0 HG2 ARG A 40 3.071 15.481 -11.289 1.00 73.41 H new ATOM 0 HG3 ARG A 40 3.737 14.222 -10.268 1.00 73.41 H new ATOM 0 HD2 ARG A 40 5.128 14.296 -12.830 1.00 33.44 H new ATOM 0 HD3 ARG A 40 5.135 15.883 -12.085 1.00 33.44 H new ATOM 0 HE ARG A 40 5.823 13.988 -10.072 1.00 71.33 H new ATOM 0 HH11 ARG A 40 7.078 15.321 -13.090 1.00 32.33 H new ATOM 0 HH12 ARG A 40 8.766 15.078 -12.629 1.00 32.33 H new ATOM 0 HH21 ARG A 40 7.993 13.681 -9.487 1.00 61.42 H new ATOM 0 HH22 ARG A 40 9.282 14.154 -10.598 1.00 61.42 H new ATOM 624 N MET A 41 0.125 14.731 -12.637 1.00 2.22 N ATOM 625 CA MET A 41 -0.765 15.882 -12.737 1.00 62.41 C ATOM 626 C MET A 41 -1.942 15.745 -11.776 1.00 12.42 C ATOM 627 O MET A 41 -2.334 16.709 -11.120 1.00 4.52 O ATOM 628 CB MET A 41 -1.279 16.032 -14.171 1.00 41.41 C ATOM 629 CG MET A 41 -2.335 17.114 -14.327 1.00 13.32 C ATOM 630 SD MET A 41 -1.955 18.270 -15.658 1.00 14.31 S ATOM 631 CE MET A 41 -0.741 19.317 -14.861 1.00 53.55 C ATOM 0 H MET A 41 0.321 14.270 -13.526 1.00 2.22 H new ATOM 0 HA MET A 41 -0.198 16.773 -12.465 1.00 62.41 H new ATOM 0 HB2 MET A 41 -0.439 16.258 -14.828 1.00 41.41 H new ATOM 0 HB3 MET A 41 -1.694 15.080 -14.501 1.00 41.41 H new ATOM 0 HG2 MET A 41 -3.301 16.648 -14.521 1.00 13.32 H new ATOM 0 HG3 MET A 41 -2.428 17.663 -13.390 1.00 13.32 H new ATOM 0 HE1 MET A 41 -0.408 20.085 -15.559 1.00 53.55 H new ATOM 0 HE2 MET A 41 -1.187 19.791 -13.987 1.00 53.55 H new ATOM 0 HE3 MET A 41 0.112 18.714 -14.551 1.00 53.55 H new ATOM 641 N ALA A 42 -2.499 14.541 -11.697 1.00 23.40 N ATOM 642 CA ALA A 42 -3.628 14.278 -10.814 1.00 64.33 C ATOM 643 C ALA A 42 -3.193 14.271 -9.353 1.00 43.15 C ATOM 644 O ALA A 42 -3.997 14.518 -8.455 1.00 24.32 O ATOM 645 CB ALA A 42 -4.285 12.955 -11.177 1.00 11.13 C ATOM 0 H ALA A 42 -2.186 13.732 -12.234 1.00 23.40 H new ATOM 0 HA ALA A 42 -4.354 15.080 -10.946 1.00 64.33 H new ATOM 0 HB1 ALA A 42 -5.127 12.771 -10.509 1.00 11.13 H new ATOM 0 HB2 ALA A 42 -4.641 12.996 -12.207 1.00 11.13 H new ATOM 0 HB3 ALA A 42 -3.559 12.148 -11.076 1.00 11.13 H new ATOM 651 N ASN A 43 -1.915 13.988 -9.122 1.00 60.20 N ATOM 652 CA ASN A 43 -1.374 13.948 -7.769 1.00 54.20 C ATOM 653 C ASN A 43 -1.063 15.354 -7.266 1.00 4.24 C ATOM 654 O ASN A 43 -1.637 15.814 -6.279 1.00 10.41 O ATOM 655 CB ASN A 43 -0.108 13.088 -7.728 1.00 63.44 C ATOM 656 CG ASN A 43 -0.343 11.690 -8.268 1.00 4.22 C ATOM 657 OD1 ASN A 43 -1.484 11.266 -8.449 1.00 14.32 O ATOM 658 ND2 ASN A 43 0.741 10.968 -8.529 1.00 53.30 N ATOM 0 H ASN A 43 -1.235 13.783 -9.854 1.00 60.20 H new ATOM 0 HA ASN A 43 -2.127 13.506 -7.117 1.00 54.20 H new ATOM 0 HB2 ASN A 43 0.676 13.572 -8.309 1.00 63.44 H new ATOM 0 HB3 ASN A 43 0.251 13.023 -6.701 1.00 63.44 H new ATOM 0 HD21 ASN A 43 0.647 10.021 -8.895 1.00 53.30 H new ATOM 0 HD22 ASN A 43 1.668 11.361 -8.363 1.00 53.30 H new ATOM 665 N VAL A 44 -0.149 16.034 -7.953 1.00 52.01 N ATOM 666 CA VAL A 44 0.239 17.388 -7.578 1.00 44.15 C ATOM 667 C VAL A 44 -0.978 18.301 -7.483 1.00 63.20 C ATOM 668 O VAL A 44 -1.101 19.096 -6.551 1.00 22.12 O ATOM 669 CB VAL A 44 1.238 17.986 -8.585 1.00 32.22 C ATOM 670 CG1 VAL A 44 1.718 19.351 -8.117 1.00 52.22 C ATOM 671 CG2 VAL A 44 2.413 17.041 -8.794 1.00 52.42 C ATOM 0 H VAL A 44 0.336 15.668 -8.772 1.00 52.01 H new ATOM 0 HA VAL A 44 0.717 17.321 -6.601 1.00 44.15 H new ATOM 0 HB VAL A 44 0.730 18.115 -9.541 1.00 32.22 H new ATOM 0 HG11 VAL A 44 2.423 19.757 -8.842 1.00 52.22 H new ATOM 0 HG12 VAL A 44 0.866 20.024 -8.024 1.00 52.22 H new ATOM 0 HG13 VAL A 44 2.210 19.252 -7.149 1.00 52.22 H new ATOM 0 HG21 VAL A 44 3.110 17.479 -9.509 1.00 52.42 H new ATOM 0 HG22 VAL A 44 2.922 16.878 -7.844 1.00 52.42 H new ATOM 0 HG23 VAL A 44 2.050 16.088 -9.179 1.00 52.42 H new ATOM 681 N SER A 45 -1.878 18.183 -8.456 1.00 12.23 N ATOM 682 CA SER A 45 -3.084 19.000 -8.485 1.00 72.33 C ATOM 683 C SER A 45 -3.843 18.897 -7.165 1.00 34.23 C ATOM 684 O SER A 45 -4.411 19.876 -6.683 1.00 61.55 O ATOM 685 CB SER A 45 -3.989 18.570 -9.642 1.00 54.14 C ATOM 686 OG SER A 45 -3.531 19.103 -10.872 1.00 15.02 O ATOM 0 H SER A 45 -1.793 17.529 -9.234 1.00 12.23 H new ATOM 0 HA SER A 45 -2.786 20.038 -8.632 1.00 72.33 H new ATOM 0 HB2 SER A 45 -4.017 17.482 -9.701 1.00 54.14 H new ATOM 0 HB3 SER A 45 -5.009 18.905 -9.454 1.00 54.14 H new ATOM 0 HG SER A 45 -2.977 18.438 -11.331 1.00 15.02 H new ATOM 692 N THR A 46 -3.847 17.700 -6.585 1.00 12.51 N ATOM 693 CA THR A 46 -4.535 17.466 -5.322 1.00 71.14 C ATOM 694 C THR A 46 -3.639 17.805 -4.136 1.00 74.33 C ATOM 695 O THR A 46 -4.124 18.079 -3.039 1.00 44.42 O ATOM 696 CB THR A 46 -5.000 16.002 -5.198 1.00 13.13 C ATOM 697 OG1 THR A 46 -4.121 15.145 -5.936 1.00 24.32 O ATOM 698 CG2 THR A 46 -6.422 15.841 -5.709 1.00 74.32 C ATOM 0 H THR A 46 -3.381 16.878 -6.970 1.00 12.51 H new ATOM 0 HA THR A 46 -5.408 18.119 -5.312 1.00 71.14 H new ATOM 0 HB THR A 46 -4.977 15.724 -4.144 1.00 13.13 H new ATOM 0 HG1 THR A 46 -4.516 14.946 -6.810 1.00 24.32 H new ATOM 0 HG21 THR A 46 -6.728 14.799 -5.611 1.00 74.32 H new ATOM 0 HG22 THR A 46 -7.092 16.472 -5.125 1.00 74.32 H new ATOM 0 HG23 THR A 46 -6.467 16.136 -6.757 1.00 74.32 H new ATOM 706 N GLY A 47 -2.330 17.785 -4.364 1.00 33.40 N ATOM 707 CA GLY A 47 -1.387 18.092 -3.305 1.00 10.31 C ATOM 708 C GLY A 47 -0.952 16.859 -2.538 1.00 30.41 C ATOM 709 O GLY A 47 -0.517 16.954 -1.391 1.00 4.41 O ATOM 0 H GLY A 47 -1.905 17.561 -5.264 1.00 33.40 H new ATOM 0 HA2 GLY A 47 -0.510 18.577 -3.734 1.00 10.31 H new ATOM 0 HA3 GLY A 47 -1.840 18.804 -2.615 1.00 10.31 H new ATOM 713 N ARG A 48 -1.073 15.697 -3.174 1.00 54.35 N ATOM 714 CA ARG A 48 -0.693 14.439 -2.542 1.00 2.35 C ATOM 715 C ARG A 48 0.743 14.065 -2.899 1.00 11.04 C ATOM 716 O ARG A 48 1.025 12.922 -3.258 1.00 4.45 O ATOM 717 CB ARG A 48 -1.644 13.320 -2.971 1.00 42.11 C ATOM 718 CG ARG A 48 -1.835 12.244 -1.915 1.00 0.44 C ATOM 719 CD ARG A 48 -3.201 11.589 -2.028 1.00 74.14 C ATOM 720 NE ARG A 48 -3.560 10.857 -0.814 1.00 24.42 N ATOM 721 CZ ARG A 48 -4.746 10.291 -0.622 1.00 12.50 C ATOM 722 NH1 ARG A 48 -5.682 10.371 -1.556 1.00 62.53 N ATOM 723 NH2 ARG A 48 -4.996 9.643 0.509 1.00 35.31 N ATOM 0 H ARG A 48 -1.430 15.601 -4.124 1.00 54.35 H new ATOM 0 HA ARG A 48 -0.760 14.569 -1.462 1.00 2.35 H new ATOM 0 HB2 ARG A 48 -2.614 13.753 -3.216 1.00 42.11 H new ATOM 0 HB3 ARG A 48 -1.262 12.859 -3.882 1.00 42.11 H new ATOM 0 HG2 ARG A 48 -1.058 11.487 -2.020 1.00 0.44 H new ATOM 0 HG3 ARG A 48 -1.721 12.682 -0.923 1.00 0.44 H new ATOM 0 HD2 ARG A 48 -3.954 12.352 -2.227 1.00 74.14 H new ATOM 0 HD3 ARG A 48 -3.207 10.906 -2.878 1.00 74.14 H new ATOM 0 HE ARG A 48 -2.862 10.777 -0.075 1.00 24.42 H new ATOM 0 HH11 ARG A 48 -5.493 10.869 -2.426 1.00 62.53 H new ATOM 0 HH12 ARG A 48 -6.592 9.935 -1.405 1.00 62.53 H new ATOM 0 HH21 ARG A 48 -4.277 9.580 1.230 1.00 35.31 H new ATOM 0 HH22 ARG A 48 -5.907 9.208 0.657 1.00 35.31 H new ATOM 737 N GLU A 49 1.646 15.037 -2.798 1.00 53.02 N ATOM 738 CA GLU A 49 3.052 14.809 -3.111 1.00 71.45 C ATOM 739 C GLU A 49 3.227 14.431 -4.580 1.00 55.24 C ATOM 740 O GLU A 49 2.291 13.998 -5.252 1.00 53.55 O ATOM 741 CB GLU A 49 3.624 13.707 -2.217 1.00 22.23 C ATOM 742 CG GLU A 49 4.516 14.229 -1.103 1.00 71.30 C ATOM 743 CD GLU A 49 3.833 14.206 0.250 1.00 24.23 C ATOM 744 OE1 GLU A 49 4.112 13.279 1.039 1.00 62.43 O ATOM 745 OE2 GLU A 49 3.020 15.115 0.520 1.00 54.23 O ATOM 0 H GLU A 49 1.429 15.989 -2.502 1.00 53.02 H new ATOM 0 HA GLU A 49 3.595 15.736 -2.925 1.00 71.45 H new ATOM 0 HB2 GLU A 49 2.801 13.143 -1.778 1.00 22.23 H new ATOM 0 HB3 GLU A 49 4.195 13.011 -2.832 1.00 22.23 H new ATOM 0 HG2 GLU A 49 5.424 13.628 -1.058 1.00 71.30 H new ATOM 0 HG3 GLU A 49 4.821 15.250 -1.335 1.00 71.30 H new ATOM 752 N PRO A 50 4.455 14.598 -5.090 1.00 10.43 N ATOM 753 CA PRO A 50 4.784 14.281 -6.483 1.00 44.44 C ATOM 754 C PRO A 50 4.770 12.781 -6.755 1.00 51.32 C ATOM 755 O PRO A 50 4.165 12.322 -7.723 1.00 53.43 O ATOM 756 CB PRO A 50 6.199 14.841 -6.649 1.00 21.42 C ATOM 757 CG PRO A 50 6.772 14.841 -5.275 1.00 52.23 C ATOM 758 CD PRO A 50 5.619 15.111 -4.346 1.00 35.02 C ATOM 0 HA PRO A 50 4.059 14.703 -7.179 1.00 44.44 H new ATOM 0 HB2 PRO A 50 6.792 14.224 -7.325 1.00 21.42 H new ATOM 0 HB3 PRO A 50 6.180 15.846 -7.069 1.00 21.42 H new ATOM 0 HG2 PRO A 50 7.241 13.884 -5.047 1.00 52.23 H new ATOM 0 HG3 PRO A 50 7.543 15.605 -5.173 1.00 52.23 H new ATOM 0 HD2 PRO A 50 5.743 14.599 -3.392 1.00 35.02 H new ATOM 0 HD3 PRO A 50 5.520 16.174 -4.127 1.00 35.02 H new ATOM 766 N GLY A 51 5.439 12.021 -5.893 1.00 42.04 N ATOM 767 CA GLY A 51 5.489 10.580 -6.058 1.00 53.53 C ATOM 768 C GLY A 51 4.296 9.883 -5.437 1.00 72.22 C ATOM 769 O GLY A 51 4.423 9.215 -4.411 1.00 74.12 O ATOM 0 H GLY A 51 5.947 12.378 -5.084 1.00 42.04 H new ATOM 0 HA2 GLY A 51 5.533 10.341 -7.120 1.00 53.53 H new ATOM 0 HA3 GLY A 51 6.405 10.197 -5.607 1.00 53.53 H new ATOM 773 N ASP A 52 3.131 10.040 -6.058 1.00 1.23 N ATOM 774 CA ASP A 52 1.909 9.421 -5.560 1.00 12.31 C ATOM 775 C ASP A 52 1.513 8.227 -6.424 1.00 41.12 C ATOM 776 O ASP A 52 0.871 8.387 -7.461 1.00 30.53 O ATOM 777 CB ASP A 52 0.771 10.442 -5.527 1.00 5.33 C ATOM 778 CG ASP A 52 0.044 10.457 -4.197 1.00 34.11 C ATOM 779 OD1 ASP A 52 0.717 10.344 -3.151 1.00 43.01 O ATOM 780 OD2 ASP A 52 -1.199 10.580 -4.202 1.00 25.31 O ATOM 0 H ASP A 52 3.008 10.591 -6.907 1.00 1.23 H new ATOM 0 HA ASP A 52 2.098 9.067 -4.547 1.00 12.31 H new ATOM 0 HB2 ASP A 52 1.172 11.435 -5.730 1.00 5.33 H new ATOM 0 HB3 ASP A 52 0.061 10.216 -6.323 1.00 5.33 H new ATOM 785 N ILE A 53 1.901 7.033 -5.988 1.00 63.11 N ATOM 786 CA ILE A 53 1.586 5.814 -6.721 1.00 13.04 C ATOM 787 C ILE A 53 0.713 4.882 -5.889 1.00 61.44 C ATOM 788 O ILE A 53 1.176 3.884 -5.337 1.00 23.13 O ATOM 789 CB ILE A 53 2.865 5.063 -7.141 1.00 52.33 C ATOM 790 CG1 ILE A 53 3.782 5.985 -7.948 1.00 33.11 C ATOM 791 CG2 ILE A 53 2.510 3.822 -7.945 1.00 13.42 C ATOM 792 CD1 ILE A 53 3.133 6.539 -9.196 1.00 33.30 C ATOM 0 H ILE A 53 2.434 6.884 -5.131 1.00 63.11 H new ATOM 0 HA ILE A 53 1.041 6.116 -7.615 1.00 13.04 H new ATOM 0 HB ILE A 53 3.397 4.749 -6.243 1.00 52.33 H new ATOM 0 HG12 ILE A 53 4.100 6.813 -7.315 1.00 33.11 H new ATOM 0 HG13 ILE A 53 4.681 5.436 -8.229 1.00 33.11 H new ATOM 0 HG21 ILE A 53 3.423 3.302 -8.234 1.00 13.42 H new ATOM 0 HG22 ILE A 53 1.892 3.160 -7.338 1.00 13.42 H new ATOM 0 HG23 ILE A 53 1.959 4.113 -8.839 1.00 13.42 H new ATOM 0 HD11 ILE A 53 3.840 7.184 -9.718 1.00 33.30 H new ATOM 0 HD12 ILE A 53 2.840 5.717 -9.849 1.00 33.30 H new ATOM 0 HD13 ILE A 53 2.250 7.116 -8.921 1.00 33.30 H new ATOM 804 N PRO A 54 -0.584 5.211 -5.797 1.00 44.35 N ATOM 805 CA PRO A 54 -1.551 4.416 -5.035 1.00 31.51 C ATOM 806 C PRO A 54 -1.840 3.071 -5.692 1.00 62.30 C ATOM 807 O PRO A 54 -2.136 3.004 -6.885 1.00 12.15 O ATOM 808 CB PRO A 54 -2.807 5.291 -5.033 1.00 33.41 C ATOM 809 CG PRO A 54 -2.678 6.141 -6.250 1.00 41.25 C ATOM 810 CD PRO A 54 -1.206 6.388 -6.428 1.00 21.41 C ATOM 0 HA PRO A 54 -1.183 4.173 -4.038 1.00 31.51 H new ATOM 0 HB2 PRO A 54 -3.712 4.685 -5.068 1.00 33.41 H new ATOM 0 HB3 PRO A 54 -2.865 5.899 -4.130 1.00 33.41 H new ATOM 0 HG2 PRO A 54 -3.098 5.640 -7.122 1.00 41.25 H new ATOM 0 HG3 PRO A 54 -3.219 7.079 -6.130 1.00 41.25 H new ATOM 0 HD2 PRO A 54 -0.937 6.469 -7.481 1.00 21.41 H new ATOM 0 HD3 PRO A 54 -0.893 7.315 -5.947 1.00 21.41 H new ATOM 818 N GLU A 55 -1.753 2.002 -4.907 1.00 10.41 N ATOM 819 CA GLU A 55 -2.004 0.659 -5.414 1.00 73.30 C ATOM 820 C GLU A 55 -3.328 0.116 -4.884 1.00 74.24 C ATOM 821 O GLU A 55 -3.426 -1.050 -4.502 1.00 74.43 O ATOM 822 CB GLU A 55 -0.862 -0.281 -5.023 1.00 52.53 C ATOM 823 CG GLU A 55 -0.750 -0.512 -3.524 1.00 34.51 C ATOM 824 CD GLU A 55 0.609 -1.044 -3.116 1.00 13.11 C ATOM 825 OE1 GLU A 55 0.728 -2.271 -2.911 1.00 1.21 O ATOM 826 OE2 GLU A 55 1.553 -0.236 -3.001 1.00 54.30 O ATOM 0 H GLU A 55 -1.510 2.040 -3.917 1.00 10.41 H new ATOM 0 HA GLU A 55 -2.062 0.715 -6.501 1.00 73.30 H new ATOM 0 HB2 GLU A 55 -1.006 -1.240 -5.520 1.00 52.53 H new ATOM 0 HB3 GLU A 55 0.078 0.131 -5.390 1.00 52.53 H new ATOM 0 HG2 GLU A 55 -0.941 0.425 -3.001 1.00 34.51 H new ATOM 0 HG3 GLU A 55 -1.521 -1.216 -3.210 1.00 34.51 H new ATOM 833 N THR A 56 -4.345 0.971 -4.864 1.00 61.55 N ATOM 834 CA THR A 56 -5.664 0.580 -4.380 1.00 22.32 C ATOM 835 C THR A 56 -6.768 1.286 -5.158 1.00 22.34 C ATOM 836 O THR A 56 -6.743 2.507 -5.321 1.00 63.43 O ATOM 837 CB THR A 56 -5.827 0.894 -2.881 1.00 52.32 C ATOM 838 OG1 THR A 56 -5.979 2.304 -2.689 1.00 62.11 O ATOM 839 CG2 THR A 56 -4.627 0.396 -2.089 1.00 34.40 C ATOM 0 H THR A 56 -4.281 1.940 -5.177 1.00 61.55 H new ATOM 0 HA THR A 56 -5.749 -0.496 -4.531 1.00 22.32 H new ATOM 0 HB THR A 56 -6.718 0.380 -2.521 1.00 52.32 H new ATOM 0 HG1 THR A 56 -6.620 2.469 -1.967 1.00 62.11 H new ATOM 0 HG21 THR A 56 -4.766 0.629 -1.033 1.00 34.40 H new ATOM 0 HG22 THR A 56 -4.532 -0.683 -2.213 1.00 34.40 H new ATOM 0 HG23 THR A 56 -3.723 0.884 -2.453 1.00 34.40 H new ATOM 847 N LEU A 57 -7.735 0.512 -5.638 1.00 61.32 N ATOM 848 CA LEU A 57 -8.849 1.064 -6.399 1.00 64.55 C ATOM 849 C LEU A 57 -9.514 2.210 -5.641 1.00 14.04 C ATOM 850 O LEU A 57 -10.061 3.132 -6.245 1.00 40.43 O ATOM 851 CB LEU A 57 -9.878 -0.028 -6.700 1.00 64.23 C ATOM 852 CG LEU A 57 -10.603 0.085 -8.043 1.00 13.45 C ATOM 853 CD1 LEU A 57 -9.729 -0.449 -9.166 1.00 32.42 C ATOM 854 CD2 LEU A 57 -11.929 -0.660 -7.996 1.00 42.03 C ATOM 0 H LEU A 57 -7.770 -0.500 -5.513 1.00 61.32 H new ATOM 0 HA LEU A 57 -8.456 1.454 -7.338 1.00 64.55 H new ATOM 0 HB2 LEU A 57 -9.375 -0.994 -6.661 1.00 64.23 H new ATOM 0 HB3 LEU A 57 -10.624 -0.025 -5.905 1.00 64.23 H new ATOM 0 HG LEU A 57 -10.807 1.138 -8.238 1.00 13.45 H new ATOM 0 HD11 LEU A 57 -10.260 -0.361 -10.114 1.00 32.42 H new ATOM 0 HD12 LEU A 57 -8.805 0.127 -9.213 1.00 32.42 H new ATOM 0 HD13 LEU A 57 -9.494 -1.497 -8.978 1.00 32.42 H new ATOM 0 HD21 LEU A 57 -12.432 -0.569 -8.959 1.00 42.03 H new ATOM 0 HD22 LEU A 57 -11.747 -1.713 -7.779 1.00 42.03 H new ATOM 0 HD23 LEU A 57 -12.559 -0.232 -7.216 1.00 42.03 H new ATOM 866 N ASP A 58 -9.461 2.143 -4.315 1.00 4.23 N ATOM 867 CA ASP A 58 -10.053 3.176 -3.473 1.00 22.51 C ATOM 868 C ASP A 58 -9.269 4.481 -3.580 1.00 34.32 C ATOM 869 O ASP A 58 -9.849 5.550 -3.765 1.00 34.31 O ATOM 870 CB ASP A 58 -10.101 2.712 -2.018 1.00 13.32 C ATOM 871 CG ASP A 58 -10.786 1.369 -1.859 1.00 20.42 C ATOM 872 OD1 ASP A 58 -10.297 0.542 -1.060 1.00 45.22 O ATOM 873 OD2 ASP A 58 -11.811 1.143 -2.535 1.00 61.41 O ATOM 0 H ASP A 58 -9.014 1.384 -3.800 1.00 4.23 H new ATOM 0 HA ASP A 58 -11.070 3.356 -3.822 1.00 22.51 H new ATOM 0 HB2 ASP A 58 -9.086 2.647 -1.627 1.00 13.32 H new ATOM 0 HB3 ASP A 58 -10.626 3.457 -1.420 1.00 13.32 H new ATOM 878 N GLN A 59 -7.949 4.383 -3.460 1.00 31.45 N ATOM 879 CA GLN A 59 -7.087 5.555 -3.541 1.00 44.22 C ATOM 880 C GLN A 59 -7.254 6.263 -4.881 1.00 15.02 C ATOM 881 O GLN A 59 -7.348 7.490 -4.940 1.00 74.11 O ATOM 882 CB GLN A 59 -5.624 5.153 -3.342 1.00 42.52 C ATOM 883 CG GLN A 59 -5.233 4.984 -1.882 1.00 71.42 C ATOM 884 CD GLN A 59 -3.815 4.477 -1.713 1.00 3.22 C ATOM 885 OE1 GLN A 59 -3.030 5.037 -0.946 1.00 13.11 O ATOM 886 NE2 GLN A 59 -3.476 3.413 -2.431 1.00 14.13 N ATOM 0 H GLN A 59 -7.454 3.505 -3.306 1.00 31.45 H new ATOM 0 HA GLN A 59 -7.379 6.244 -2.748 1.00 44.22 H new ATOM 0 HB2 GLN A 59 -5.438 4.218 -3.870 1.00 42.52 H new ATOM 0 HB3 GLN A 59 -4.983 5.909 -3.796 1.00 42.52 H new ATOM 0 HG2 GLN A 59 -5.337 5.940 -1.369 1.00 71.42 H new ATOM 0 HG3 GLN A 59 -5.923 4.289 -1.403 1.00 71.42 H new ATOM 0 HE21 GLN A 59 -4.158 2.980 -3.054 1.00 14.13 H new ATOM 0 HE22 GLN A 59 -2.534 3.029 -2.359 1.00 14.13 H new ATOM 895 N LEU A 60 -7.289 5.483 -5.956 1.00 31.05 N ATOM 896 CA LEU A 60 -7.445 6.035 -7.297 1.00 3.23 C ATOM 897 C LEU A 60 -8.858 6.570 -7.505 1.00 3.14 C ATOM 898 O LEU A 60 -9.043 7.709 -7.936 1.00 73.24 O ATOM 899 CB LEU A 60 -7.131 4.969 -8.348 1.00 22.23 C ATOM 900 CG LEU A 60 -5.739 4.340 -8.273 1.00 41.31 C ATOM 901 CD1 LEU A 60 -5.831 2.826 -8.371 1.00 33.14 C ATOM 902 CD2 LEU A 60 -4.844 4.894 -9.372 1.00 45.54 C ATOM 0 H LEU A 60 -7.211 4.466 -5.925 1.00 31.05 H new ATOM 0 HA LEU A 60 -6.744 6.862 -7.406 1.00 3.23 H new ATOM 0 HB2 LEU A 60 -7.872 4.174 -8.262 1.00 22.23 H new ATOM 0 HB3 LEU A 60 -7.254 5.414 -9.335 1.00 22.23 H new ATOM 0 HG LEU A 60 -5.298 4.595 -7.309 1.00 41.31 H new ATOM 0 HD11 LEU A 60 -4.831 2.396 -8.316 1.00 33.14 H new ATOM 0 HD12 LEU A 60 -6.436 2.444 -7.548 1.00 33.14 H new ATOM 0 HD13 LEU A 60 -6.293 2.550 -9.319 1.00 33.14 H new ATOM 0 HD21 LEU A 60 -3.857 4.435 -9.304 1.00 45.54 H new ATOM 0 HD22 LEU A 60 -5.281 4.670 -10.345 1.00 45.54 H new ATOM 0 HD23 LEU A 60 -4.751 5.974 -9.256 1.00 45.54 H new ATOM 914 N ARG A 61 -9.850 5.743 -7.194 1.00 3.02 N ATOM 915 CA ARG A 61 -11.246 6.135 -7.346 1.00 75.42 C ATOM 916 C ARG A 61 -11.515 7.470 -6.658 1.00 75.20 C ATOM 917 O ARG A 61 -12.339 8.262 -7.116 1.00 25.45 O ATOM 918 CB ARG A 61 -12.165 5.057 -6.768 1.00 35.43 C ATOM 919 CG ARG A 61 -13.622 5.481 -6.683 1.00 73.44 C ATOM 920 CD ARG A 61 -14.072 5.642 -5.239 1.00 40.12 C ATOM 921 NE ARG A 61 -14.072 4.371 -4.520 1.00 21.12 N ATOM 922 CZ ARG A 61 -14.689 4.183 -3.359 1.00 5.50 C ATOM 923 NH1 ARG A 61 -15.352 5.180 -2.789 1.00 74.04 N ATOM 924 NH2 ARG A 61 -14.642 2.997 -2.765 1.00 44.03 N ATOM 0 H ARG A 61 -9.713 4.798 -6.835 1.00 3.02 H new ATOM 0 HA ARG A 61 -11.452 6.247 -8.410 1.00 75.42 H new ATOM 0 HB2 ARG A 61 -12.092 4.160 -7.384 1.00 35.43 H new ATOM 0 HB3 ARG A 61 -11.815 4.789 -5.771 1.00 35.43 H new ATOM 0 HG2 ARG A 61 -13.760 6.422 -7.215 1.00 73.44 H new ATOM 0 HG3 ARG A 61 -14.248 4.739 -7.180 1.00 73.44 H new ATOM 0 HD2 ARG A 61 -13.413 6.346 -4.731 1.00 40.12 H new ATOM 0 HD3 ARG A 61 -15.074 6.071 -5.217 1.00 40.12 H new ATOM 0 HE ARG A 61 -13.570 3.584 -4.932 1.00 21.12 H new ATOM 0 HH11 ARG A 61 -15.389 6.093 -3.242 1.00 74.04 H new ATOM 0 HH12 ARG A 61 -15.825 5.034 -1.897 1.00 74.04 H new ATOM 0 HH21 ARG A 61 -14.132 2.229 -3.200 1.00 44.03 H new ATOM 0 HH22 ARG A 61 -15.116 2.854 -1.873 1.00 44.03 H new ATOM 938 N LEU A 62 -10.816 7.712 -5.555 1.00 10.54 N ATOM 939 CA LEU A 62 -10.978 8.951 -4.803 1.00 73.12 C ATOM 940 C LEU A 62 -10.263 10.106 -5.495 1.00 23.21 C ATOM 941 O LEU A 62 -10.816 11.197 -5.636 1.00 44.11 O ATOM 942 CB LEU A 62 -10.441 8.782 -3.381 1.00 3.33 C ATOM 943 CG LEU A 62 -11.303 9.368 -2.262 1.00 44.15 C ATOM 944 CD1 LEU A 62 -11.635 10.824 -2.553 1.00 53.43 C ATOM 945 CD2 LEU A 62 -12.575 8.553 -2.087 1.00 63.23 C ATOM 0 H LEU A 62 -10.131 7.066 -5.161 1.00 10.54 H new ATOM 0 HA LEU A 62 -12.042 9.182 -4.758 1.00 73.12 H new ATOM 0 HB2 LEU A 62 -10.307 7.717 -3.189 1.00 3.33 H new ATOM 0 HB3 LEU A 62 -9.454 9.242 -3.330 1.00 3.33 H new ATOM 0 HG LEU A 62 -10.737 9.324 -1.331 1.00 44.15 H new ATOM 0 HD11 LEU A 62 -12.249 11.225 -1.747 1.00 53.43 H new ATOM 0 HD12 LEU A 62 -10.712 11.400 -2.628 1.00 53.43 H new ATOM 0 HD13 LEU A 62 -12.182 10.892 -3.493 1.00 53.43 H new ATOM 0 HD21 LEU A 62 -13.176 8.984 -1.287 1.00 63.23 H new ATOM 0 HD22 LEU A 62 -13.145 8.565 -3.016 1.00 63.23 H new ATOM 0 HD23 LEU A 62 -12.316 7.525 -1.833 1.00 63.23 H new ATOM 957 N VAL A 63 -9.031 9.859 -5.927 1.00 34.13 N ATOM 958 CA VAL A 63 -8.241 10.877 -6.608 1.00 65.34 C ATOM 959 C VAL A 63 -8.859 11.245 -7.953 1.00 34.43 C ATOM 960 O VAL A 63 -8.634 12.337 -8.474 1.00 5.24 O ATOM 961 CB VAL A 63 -6.791 10.407 -6.833 1.00 60.35 C ATOM 962 CG1 VAL A 63 -5.994 11.469 -7.573 1.00 31.02 C ATOM 963 CG2 VAL A 63 -6.133 10.061 -5.506 1.00 0.35 C ATOM 0 H VAL A 63 -8.558 8.962 -5.817 1.00 34.13 H new ATOM 0 HA VAL A 63 -8.234 11.755 -5.962 1.00 65.34 H new ATOM 0 HB VAL A 63 -6.809 9.508 -7.449 1.00 60.35 H new ATOM 0 HG11 VAL A 63 -4.973 11.119 -7.723 1.00 31.02 H new ATOM 0 HG12 VAL A 63 -6.457 11.663 -8.541 1.00 31.02 H new ATOM 0 HG13 VAL A 63 -5.980 12.388 -6.987 1.00 31.02 H new ATOM 0 HG21 VAL A 63 -5.109 9.731 -5.683 1.00 0.35 H new ATOM 0 HG22 VAL A 63 -6.125 10.942 -4.864 1.00 0.35 H new ATOM 0 HG23 VAL A 63 -6.693 9.262 -5.020 1.00 0.35 H new ATOM 973 N ILE A 64 -9.639 10.324 -8.510 1.00 41.12 N ATOM 974 CA ILE A 64 -10.290 10.551 -9.794 1.00 34.41 C ATOM 975 C ILE A 64 -11.547 11.399 -9.630 1.00 25.14 C ATOM 976 O ILE A 64 -11.636 12.504 -10.167 1.00 31.20 O ATOM 977 CB ILE A 64 -10.667 9.223 -10.477 1.00 64.30 C ATOM 978 CG1 ILE A 64 -9.414 8.382 -10.733 1.00 43.25 C ATOM 979 CG2 ILE A 64 -11.409 9.489 -11.779 1.00 20.04 C ATOM 980 CD1 ILE A 64 -9.658 6.892 -10.647 1.00 43.14 C ATOM 0 H ILE A 64 -9.835 9.414 -8.092 1.00 41.12 H new ATOM 0 HA ILE A 64 -9.574 11.082 -10.421 1.00 34.41 H new ATOM 0 HB ILE A 64 -11.327 8.664 -9.813 1.00 64.30 H new ATOM 0 HG12 ILE A 64 -9.022 8.621 -11.721 1.00 43.25 H new ATOM 0 HG13 ILE A 64 -8.647 8.659 -10.010 1.00 43.25 H new ATOM 0 HG21 ILE A 64 -11.669 8.541 -12.250 1.00 20.04 H new ATOM 0 HG22 ILE A 64 -12.319 10.052 -11.571 1.00 20.04 H new ATOM 0 HG23 ILE A 64 -10.772 10.065 -12.450 1.00 20.04 H new ATOM 0 HD11 ILE A 64 -8.727 6.359 -10.839 1.00 43.14 H new ATOM 0 HD12 ILE A 64 -10.021 6.640 -9.651 1.00 43.14 H new ATOM 0 HD13 ILE A 64 -10.402 6.602 -11.389 1.00 43.14 H new ATOM 992 N CYS A 65 -12.513 10.877 -8.884 1.00 51.54 N ATOM 993 CA CYS A 65 -13.765 11.587 -8.647 1.00 64.42 C ATOM 994 C CYS A 65 -13.504 12.964 -8.045 1.00 65.42 C ATOM 995 O CYS A 65 -14.269 13.904 -8.265 1.00 50.33 O ATOM 996 CB CYS A 65 -14.669 10.775 -7.719 1.00 63.13 C ATOM 997 SG CYS A 65 -16.425 11.188 -7.852 1.00 14.21 S ATOM 0 H CYS A 65 -12.454 9.964 -8.432 1.00 51.54 H new ATOM 0 HA CYS A 65 -14.266 11.719 -9.606 1.00 64.42 H new ATOM 0 HB2 CYS A 65 -14.538 9.715 -7.938 1.00 63.13 H new ATOM 0 HB3 CYS A 65 -14.347 10.930 -6.689 1.00 63.13 H new ATOM 0 HG CYS A 65 -17.108 10.448 -7.030 1.00 14.21 H new ATOM 1003 N ASP A 66 -12.421 13.076 -7.284 1.00 10.11 N ATOM 1004 CA ASP A 66 -12.058 14.337 -6.649 1.00 64.41 C ATOM 1005 C ASP A 66 -11.414 15.286 -7.655 1.00 4.44 C ATOM 1006 O ASP A 66 -11.963 16.345 -7.968 1.00 14.54 O ATOM 1007 CB ASP A 66 -11.105 14.090 -5.480 1.00 54.44 C ATOM 1008 CG ASP A 66 -11.798 13.450 -4.294 1.00 55.24 C ATOM 1009 OD1 ASP A 66 -11.349 13.676 -3.150 1.00 70.42 O ATOM 1010 OD2 ASP A 66 -12.791 12.722 -4.508 1.00 65.05 O ATOM 0 H ASP A 66 -11.778 12.307 -7.092 1.00 10.11 H new ATOM 0 HA ASP A 66 -12.970 14.800 -6.271 1.00 64.41 H new ATOM 0 HB2 ASP A 66 -10.289 13.448 -5.810 1.00 54.44 H new ATOM 0 HB3 ASP A 66 -10.661 15.036 -5.171 1.00 54.44 H new ATOM 1015 N LEU A 67 -10.246 14.903 -8.158 1.00 35.41 N ATOM 1016 CA LEU A 67 -9.525 15.718 -9.129 1.00 44.43 C ATOM 1017 C LEU A 67 -10.429 16.103 -10.295 1.00 64.21 C ATOM 1018 O LEU A 67 -10.366 17.225 -10.797 1.00 65.23 O ATOM 1019 CB LEU A 67 -8.297 14.967 -9.646 1.00 61.43 C ATOM 1020 CG LEU A 67 -7.491 15.669 -10.739 1.00 10.20 C ATOM 1021 CD1 LEU A 67 -6.365 16.488 -10.128 1.00 23.42 C ATOM 1022 CD2 LEU A 67 -6.939 14.655 -11.730 1.00 74.34 C ATOM 0 H LEU A 67 -9.777 14.032 -7.909 1.00 35.41 H new ATOM 0 HA LEU A 67 -9.200 16.630 -8.629 1.00 44.43 H new ATOM 0 HB2 LEU A 67 -7.634 14.771 -8.803 1.00 61.43 H new ATOM 0 HB3 LEU A 67 -8.622 13.999 -10.027 1.00 61.43 H new ATOM 0 HG LEU A 67 -8.155 16.346 -11.276 1.00 10.20 H new ATOM 0 HD11 LEU A 67 -5.802 16.981 -10.921 1.00 23.42 H new ATOM 0 HD12 LEU A 67 -6.784 17.240 -9.459 1.00 23.42 H new ATOM 0 HD13 LEU A 67 -5.701 15.831 -9.566 1.00 23.42 H new ATOM 0 HD21 LEU A 67 -6.368 15.173 -12.501 1.00 74.34 H new ATOM 0 HD22 LEU A 67 -6.289 13.952 -11.208 1.00 74.34 H new ATOM 0 HD23 LEU A 67 -7.763 14.112 -12.192 1.00 74.34 H new ATOM 1034 N GLN A 68 -11.269 15.166 -10.720 1.00 50.10 N ATOM 1035 CA GLN A 68 -12.188 15.407 -11.827 1.00 4.42 C ATOM 1036 C GLN A 68 -13.241 16.441 -11.444 1.00 23.30 C ATOM 1037 O GLN A 68 -13.354 17.490 -12.078 1.00 15.22 O ATOM 1038 CB GLN A 68 -12.865 14.103 -12.250 1.00 3.24 C ATOM 1039 CG GLN A 68 -13.848 14.272 -13.397 1.00 52.13 C ATOM 1040 CD GLN A 68 -13.990 13.016 -14.234 1.00 70.21 C ATOM 1041 OE1 GLN A 68 -14.232 11.930 -13.707 1.00 12.43 O ATOM 1042 NE2 GLN A 68 -13.843 13.159 -15.545 1.00 23.41 N ATOM 0 H GLN A 68 -11.333 14.232 -10.315 1.00 50.10 H new ATOM 0 HA GLN A 68 -11.612 15.796 -12.666 1.00 4.42 H new ATOM 0 HB2 GLN A 68 -12.099 13.384 -12.542 1.00 3.24 H new ATOM 0 HB3 GLN A 68 -13.389 13.681 -11.393 1.00 3.24 H new ATOM 0 HG2 GLN A 68 -14.823 14.549 -12.997 1.00 52.13 H new ATOM 0 HG3 GLN A 68 -13.519 15.093 -14.034 1.00 52.13 H new ATOM 0 HE21 GLN A 68 -13.643 14.079 -15.938 1.00 23.41 H new ATOM 0 HE22 GLN A 68 -13.930 12.349 -16.159 1.00 23.41 H new ATOM 1051 N GLU A 69 -14.011 16.137 -10.404 1.00 73.31 N ATOM 1052 CA GLU A 69 -15.056 17.040 -9.938 1.00 52.14 C ATOM 1053 C GLU A 69 -14.475 18.403 -9.574 1.00 70.35 C ATOM 1054 O GLU A 69 -15.186 19.409 -9.562 1.00 64.13 O ATOM 1055 CB GLU A 69 -15.778 16.440 -8.729 1.00 3.41 C ATOM 1056 CG GLU A 69 -17.044 17.186 -8.343 1.00 65.33 C ATOM 1057 CD GLU A 69 -18.301 16.495 -8.836 1.00 3.32 C ATOM 1058 OE1 GLU A 69 -18.524 15.329 -8.452 1.00 74.14 O ATOM 1059 OE2 GLU A 69 -19.060 17.121 -9.606 1.00 10.44 O ATOM 0 H GLU A 69 -13.931 15.273 -9.869 1.00 73.31 H new ATOM 0 HA GLU A 69 -15.772 17.175 -10.749 1.00 52.14 H new ATOM 0 HB2 GLU A 69 -16.030 15.402 -8.946 1.00 3.41 H new ATOM 0 HB3 GLU A 69 -15.098 16.432 -7.878 1.00 3.41 H new ATOM 0 HG2 GLU A 69 -17.088 17.282 -7.258 1.00 65.33 H new ATOM 0 HG3 GLU A 69 -17.005 18.196 -8.751 1.00 65.33 H new ATOM 1066 N ARG A 70 -13.181 18.428 -9.276 1.00 2.11 N ATOM 1067 CA ARG A 70 -12.504 19.666 -8.910 1.00 64.14 C ATOM 1068 C ARG A 70 -12.328 20.570 -10.127 1.00 53.12 C ATOM 1069 O ARG A 70 -12.913 21.651 -10.199 1.00 2.53 O ATOM 1070 CB ARG A 70 -11.142 19.362 -8.285 1.00 23.22 C ATOM 1071 CG ARG A 70 -11.125 19.486 -6.771 1.00 32.12 C ATOM 1072 CD ARG A 70 -9.717 19.337 -6.216 1.00 13.00 C ATOM 1073 NE ARG A 70 -9.679 19.514 -4.766 1.00 13.44 N ATOM 1074 CZ ARG A 70 -10.069 18.583 -3.903 1.00 53.43 C ATOM 1075 NH1 ARG A 70 -10.523 17.417 -4.339 1.00 53.13 N ATOM 1076 NH2 ARG A 70 -10.004 18.818 -2.598 1.00 52.20 N ATOM 0 H ARG A 70 -12.579 17.604 -9.281 1.00 2.11 H new ATOM 0 HA ARG A 70 -13.123 20.187 -8.179 1.00 64.14 H new ATOM 0 HB2 ARG A 70 -10.842 18.351 -8.562 1.00 23.22 H new ATOM 0 HB3 ARG A 70 -10.400 20.041 -8.705 1.00 23.22 H new ATOM 0 HG2 ARG A 70 -11.532 20.454 -6.480 1.00 32.12 H new ATOM 0 HG3 ARG A 70 -11.772 18.724 -6.335 1.00 32.12 H new ATOM 0 HD2 ARG A 70 -9.329 18.351 -6.471 1.00 13.00 H new ATOM 0 HD3 ARG A 70 -9.062 20.069 -6.688 1.00 13.00 H new ATOM 0 HE ARG A 70 -9.334 20.400 -4.397 1.00 13.44 H new ATOM 0 HH11 ARG A 70 -10.574 17.232 -5.341 1.00 53.13 H new ATOM 0 HH12 ARG A 70 -10.822 16.705 -3.673 1.00 53.13 H new ATOM 0 HH21 ARG A 70 -9.654 19.714 -2.258 1.00 52.20 H new ATOM 0 HH22 ARG A 70 -10.304 18.103 -1.935 1.00 52.20 H new ATOM 1090 N ARG A 71 -11.520 20.119 -11.080 1.00 1.34 N ATOM 1091 CA ARG A 71 -11.265 20.888 -12.293 1.00 40.14 C ATOM 1092 C ARG A 71 -12.546 21.067 -13.102 1.00 31.02 C ATOM 1093 O ARG A 71 -12.797 22.135 -13.657 1.00 65.12 O ATOM 1094 CB ARG A 71 -10.202 20.196 -13.147 1.00 14.24 C ATOM 1095 CG ARG A 71 -9.054 21.107 -13.549 1.00 43.33 C ATOM 1096 CD ARG A 71 -9.444 22.019 -14.701 1.00 23.43 C ATOM 1097 NE ARG A 71 -9.542 23.416 -14.287 1.00 12.32 N ATOM 1098 CZ ARG A 71 -10.178 24.347 -14.988 1.00 5.44 C ATOM 1099 NH1 ARG A 71 -10.768 24.033 -16.132 1.00 74.42 N ATOM 1100 NH2 ARG A 71 -10.223 25.597 -14.544 1.00 62.23 N ATOM 0 H ARG A 71 -11.030 19.225 -11.036 1.00 1.34 H new ATOM 0 HA ARG A 71 -10.901 21.872 -11.999 1.00 40.14 H new ATOM 0 HB2 ARG A 71 -9.803 19.345 -12.595 1.00 14.24 H new ATOM 0 HB3 ARG A 71 -10.673 19.800 -14.047 1.00 14.24 H new ATOM 0 HG2 ARG A 71 -8.750 21.710 -12.693 1.00 43.33 H new ATOM 0 HG3 ARG A 71 -8.193 20.504 -13.836 1.00 43.33 H new ATOM 0 HD2 ARG A 71 -8.708 21.929 -15.499 1.00 23.43 H new ATOM 0 HD3 ARG A 71 -10.400 21.695 -15.111 1.00 23.43 H new ATOM 0 HE ARG A 71 -9.097 23.692 -13.411 1.00 12.32 H new ATOM 0 HH11 ARG A 71 -10.734 23.074 -16.477 1.00 74.42 H new ATOM 0 HH12 ARG A 71 -11.256 24.751 -16.668 1.00 74.42 H new ATOM 0 HH21 ARG A 71 -9.769 25.842 -13.664 1.00 62.23 H new ATOM 0 HH22 ARG A 71 -10.712 26.312 -15.083 1.00 62.23 H new ATOM 1114 N GLU A 72 -13.353 20.011 -13.164 1.00 25.12 N ATOM 1115 CA GLU A 72 -14.607 20.052 -13.907 1.00 41.15 C ATOM 1116 C GLU A 72 -15.521 21.150 -13.370 1.00 61.44 C ATOM 1117 O GLU A 72 -16.019 21.986 -14.126 1.00 13.34 O ATOM 1118 CB GLU A 72 -15.317 18.698 -13.829 1.00 44.51 C ATOM 1119 CG GLU A 72 -16.673 18.681 -14.513 1.00 25.23 C ATOM 1120 CD GLU A 72 -17.824 18.776 -13.532 1.00 3.32 C ATOM 1121 OE1 GLU A 72 -18.495 19.830 -13.506 1.00 53.04 O ATOM 1122 OE2 GLU A 72 -18.054 17.799 -12.790 1.00 2.12 O ATOM 0 H GLU A 72 -13.161 19.119 -12.709 1.00 25.12 H new ATOM 0 HA GLU A 72 -14.376 20.273 -14.949 1.00 41.15 H new ATOM 0 HB2 GLU A 72 -14.681 17.937 -14.282 1.00 44.51 H new ATOM 0 HB3 GLU A 72 -15.444 18.424 -12.782 1.00 44.51 H new ATOM 0 HG2 GLU A 72 -16.731 19.512 -15.216 1.00 25.23 H new ATOM 0 HG3 GLU A 72 -16.771 17.764 -15.094 1.00 25.23 H new ATOM 1129 N LYS A 73 -15.740 21.141 -12.060 1.00 52.44 N ATOM 1130 CA LYS A 73 -16.594 22.135 -11.419 1.00 2.11 C ATOM 1131 C LYS A 73 -16.060 23.544 -11.656 1.00 51.32 C ATOM 1132 O LYS A 73 -16.829 24.493 -11.808 1.00 61.44 O ATOM 1133 CB LYS A 73 -16.693 21.860 -9.917 1.00 65.21 C ATOM 1134 CG LYS A 73 -17.696 22.748 -9.201 1.00 64.34 C ATOM 1135 CD LYS A 73 -18.327 22.034 -8.018 1.00 70.04 C ATOM 1136 CE LYS A 73 -17.483 22.182 -6.762 1.00 1.44 C ATOM 1137 NZ LYS A 73 -17.101 20.861 -6.191 1.00 40.14 N ATOM 0 H LYS A 73 -15.338 20.456 -11.420 1.00 52.44 H new ATOM 0 HA LYS A 73 -17.588 22.063 -11.861 1.00 2.11 H new ATOM 0 HB2 LYS A 73 -16.970 20.817 -9.765 1.00 65.21 H new ATOM 0 HB3 LYS A 73 -15.711 21.998 -9.465 1.00 65.21 H new ATOM 0 HG2 LYS A 73 -17.200 23.655 -8.857 1.00 64.34 H new ATOM 0 HG3 LYS A 73 -18.475 23.056 -9.899 1.00 64.34 H new ATOM 0 HD2 LYS A 73 -19.323 22.438 -7.838 1.00 70.04 H new ATOM 0 HD3 LYS A 73 -18.449 20.977 -8.253 1.00 70.04 H new ATOM 0 HE2 LYS A 73 -16.583 22.751 -6.994 1.00 1.44 H new ATOM 0 HE3 LYS A 73 -18.037 22.753 -6.017 1.00 1.44 H new ATOM 0 HZ1 LYS A 73 -16.527 21.005 -5.336 1.00 40.14 H new ATOM 0 HZ2 LYS A 73 -17.959 20.328 -5.945 1.00 40.14 H new ATOM 0 HZ3 LYS A 73 -16.550 20.326 -6.892 1.00 40.14 H new ATOM 1151 N PHE A 74 -14.737 23.674 -11.685 1.00 72.32 N ATOM 1152 CA PHE A 74 -14.101 24.967 -11.903 1.00 0.55 C ATOM 1153 C PHE A 74 -14.149 25.356 -13.378 1.00 51.41 C ATOM 1154 O PHE A 74 -14.053 26.532 -13.724 1.00 1.05 O ATOM 1155 CB PHE A 74 -12.649 24.933 -11.420 1.00 32.40 C ATOM 1156 CG PHE A 74 -12.409 25.750 -10.184 1.00 54.43 C ATOM 1157 CD1 PHE A 74 -12.236 25.135 -8.954 1.00 4.32 C ATOM 1158 CD2 PHE A 74 -12.358 27.133 -10.250 1.00 43.41 C ATOM 1159 CE1 PHE A 74 -12.014 25.884 -7.814 1.00 52.33 C ATOM 1160 CE2 PHE A 74 -12.135 27.887 -9.113 1.00 74.33 C ATOM 1161 CZ PHE A 74 -11.965 27.262 -7.893 1.00 51.21 C ATOM 0 H PHE A 74 -14.085 22.899 -11.560 1.00 72.32 H new ATOM 0 HA PHE A 74 -14.650 25.715 -11.330 1.00 0.55 H new ATOM 0 HB2 PHE A 74 -12.364 23.899 -11.224 1.00 32.40 H new ATOM 0 HB3 PHE A 74 -12.001 25.296 -12.217 1.00 32.40 H new ATOM 0 HD1 PHE A 74 -12.275 24.058 -8.886 1.00 4.32 H new ATOM 0 HD2 PHE A 74 -12.494 27.628 -11.200 1.00 43.41 H new ATOM 0 HE1 PHE A 74 -11.879 25.392 -6.862 1.00 52.33 H new ATOM 0 HE2 PHE A 74 -12.094 28.964 -9.179 1.00 74.33 H new ATOM 0 HZ PHE A 74 -11.794 27.849 -7.003 1.00 51.21 H new ATOM 1171 N GLY A 75 -14.300 24.356 -14.242 1.00 24.33 N ATOM 1172 CA GLY A 75 -14.358 24.613 -15.670 1.00 42.32 C ATOM 1173 C GLY A 75 -14.003 23.391 -16.492 1.00 22.33 C ATOM 1174 O GLY A 75 -13.953 22.276 -15.973 1.00 52.43 O ATOM 0 H GLY A 75 -14.383 23.374 -13.979 1.00 24.33 H new ATOM 0 HA2 GLY A 75 -15.361 24.947 -15.936 1.00 42.32 H new ATOM 0 HA3 GLY A 75 -13.675 25.425 -15.918 1.00 42.32 H new ATOM 1178 N SER A 76 -13.757 23.599 -17.782 1.00 21.12 N ATOM 1179 CA SER A 76 -13.410 22.505 -18.681 1.00 72.30 C ATOM 1180 C SER A 76 -12.035 22.728 -19.303 1.00 30.15 C ATOM 1181 O SER A 76 -11.715 23.828 -19.751 1.00 65.05 O ATOM 1182 CB SER A 76 -14.464 22.366 -19.781 1.00 63.34 C ATOM 1183 OG SER A 76 -15.330 21.274 -19.524 1.00 34.13 O ATOM 0 H SER A 76 -13.792 24.516 -18.228 1.00 21.12 H new ATOM 0 HA SER A 76 -13.381 21.584 -18.098 1.00 72.30 H new ATOM 0 HB2 SER A 76 -15.045 23.286 -19.851 1.00 63.34 H new ATOM 0 HB3 SER A 76 -13.973 22.226 -20.744 1.00 63.34 H new ATOM 0 HG SER A 76 -15.995 21.208 -20.241 1.00 34.13 H new ATOM 1189 N SER A 77 -11.225 21.674 -19.327 1.00 34.51 N ATOM 1190 CA SER A 77 -9.883 21.753 -19.891 1.00 65.01 C ATOM 1191 C SER A 77 -9.409 20.383 -20.363 1.00 33.14 C ATOM 1192 O SER A 77 -9.618 19.374 -19.689 1.00 34.11 O ATOM 1193 CB SER A 77 -8.905 22.315 -18.857 1.00 60.31 C ATOM 1194 OG SER A 77 -8.220 21.273 -18.185 1.00 45.21 O ATOM 0 H SER A 77 -11.475 20.755 -18.962 1.00 34.51 H new ATOM 0 HA SER A 77 -9.917 22.422 -20.751 1.00 65.01 H new ATOM 0 HB2 SER A 77 -8.186 22.969 -19.350 1.00 60.31 H new ATOM 0 HB3 SER A 77 -9.446 22.925 -18.133 1.00 60.31 H new ATOM 0 HG SER A 77 -7.600 21.658 -17.531 1.00 45.21 H new ATOM 1200 N LYS A 78 -8.770 20.352 -21.528 1.00 1.33 N ATOM 1201 CA LYS A 78 -8.263 19.107 -22.092 1.00 74.54 C ATOM 1202 C LYS A 78 -7.121 18.552 -21.248 1.00 1.32 C ATOM 1203 O LYS A 78 -6.818 17.360 -21.305 1.00 43.42 O ATOM 1204 CB LYS A 78 -7.789 19.329 -23.529 1.00 64.12 C ATOM 1205 CG LYS A 78 -6.634 20.309 -23.644 1.00 53.44 C ATOM 1206 CD LYS A 78 -5.335 19.601 -23.990 1.00 32.34 C ATOM 1207 CE LYS A 78 -5.153 19.474 -25.495 1.00 75.14 C ATOM 1208 NZ LYS A 78 -5.243 18.058 -25.947 1.00 22.21 N ATOM 0 H LYS A 78 -8.591 21.177 -22.101 1.00 1.33 H new ATOM 0 HA LYS A 78 -9.076 18.381 -22.093 1.00 74.54 H new ATOM 0 HB2 LYS A 78 -7.487 18.372 -23.955 1.00 64.12 H new ATOM 0 HB3 LYS A 78 -8.625 19.694 -24.126 1.00 64.12 H new ATOM 0 HG2 LYS A 78 -6.860 21.051 -24.410 1.00 53.44 H new ATOM 0 HG3 LYS A 78 -6.517 20.847 -22.703 1.00 53.44 H new ATOM 0 HD2 LYS A 78 -4.495 20.152 -23.566 1.00 32.34 H new ATOM 0 HD3 LYS A 78 -5.328 18.610 -23.537 1.00 32.34 H new ATOM 0 HE2 LYS A 78 -5.913 20.067 -26.004 1.00 75.14 H new ATOM 0 HE3 LYS A 78 -4.185 19.885 -25.780 1.00 75.14 H new ATOM 0 HZ1 LYS A 78 -5.114 18.014 -26.978 1.00 22.21 H new ATOM 0 HZ2 LYS A 78 -4.502 17.497 -25.481 1.00 22.21 H new ATOM 0 HZ3 LYS A 78 -6.176 17.673 -25.698 1.00 22.21 H new ATOM 1222 N GLU A 79 -6.491 19.423 -20.467 1.00 0.33 N ATOM 1223 CA GLU A 79 -5.381 19.019 -19.611 1.00 73.43 C ATOM 1224 C GLU A 79 -5.852 18.044 -18.535 1.00 60.25 C ATOM 1225 O GLU A 79 -5.367 16.915 -18.450 1.00 50.21 O ATOM 1226 CB GLU A 79 -4.738 20.244 -18.959 1.00 74.02 C ATOM 1227 CG GLU A 79 -3.703 20.927 -19.835 1.00 0.02 C ATOM 1228 CD GLU A 79 -2.470 21.349 -19.061 1.00 2.42 C ATOM 1229 OE1 GLU A 79 -1.447 20.636 -19.141 1.00 55.34 O ATOM 1230 OE2 GLU A 79 -2.525 22.391 -18.376 1.00 61.53 O ATOM 0 H GLU A 79 -6.730 20.413 -20.409 1.00 0.33 H new ATOM 0 HA GLU A 79 -4.640 18.517 -20.233 1.00 73.43 H new ATOM 0 HB2 GLU A 79 -5.518 20.962 -18.706 1.00 74.02 H new ATOM 0 HB3 GLU A 79 -4.267 19.942 -18.023 1.00 74.02 H new ATOM 0 HG2 GLU A 79 -3.409 20.251 -20.638 1.00 0.02 H new ATOM 0 HG3 GLU A 79 -4.151 21.803 -20.304 1.00 0.02 H new ATOM 1237 N ILE A 80 -6.799 18.489 -17.716 1.00 10.44 N ATOM 1238 CA ILE A 80 -7.335 17.656 -16.646 1.00 71.03 C ATOM 1239 C ILE A 80 -8.139 16.489 -17.208 1.00 33.22 C ATOM 1240 O ILE A 80 -8.188 15.412 -16.613 1.00 4.14 O ATOM 1241 CB ILE A 80 -8.231 18.471 -15.694 1.00 12.12 C ATOM 1242 CG1 ILE A 80 -8.570 17.649 -14.448 1.00 5.44 C ATOM 1243 CG2 ILE A 80 -9.502 18.909 -16.407 1.00 22.54 C ATOM 1244 CD1 ILE A 80 -7.681 17.956 -13.263 1.00 31.32 C ATOM 0 H ILE A 80 -7.211 19.421 -17.773 1.00 10.44 H new ATOM 0 HA ILE A 80 -6.482 17.271 -16.088 1.00 71.03 H new ATOM 0 HB ILE A 80 -7.687 19.362 -15.382 1.00 12.12 H new ATOM 0 HG12 ILE A 80 -9.608 17.834 -14.171 1.00 5.44 H new ATOM 0 HG13 ILE A 80 -8.489 16.589 -14.688 1.00 5.44 H new ATOM 0 HG21 ILE A 80 -10.124 19.484 -15.721 1.00 22.54 H new ATOM 0 HG22 ILE A 80 -9.242 19.527 -17.266 1.00 22.54 H new ATOM 0 HG23 ILE A 80 -10.051 18.030 -16.745 1.00 22.54 H new ATOM 0 HD11 ILE A 80 -7.978 17.338 -12.416 1.00 31.32 H new ATOM 0 HD12 ILE A 80 -6.644 17.744 -13.522 1.00 31.32 H new ATOM 0 HD13 ILE A 80 -7.780 19.008 -12.997 1.00 31.32 H new ATOM 1256 N ASP A 81 -8.767 16.710 -18.358 1.00 14.12 N ATOM 1257 CA ASP A 81 -9.567 15.674 -19.003 1.00 5.34 C ATOM 1258 C ASP A 81 -8.724 14.437 -19.291 1.00 55.31 C ATOM 1259 O ASP A 81 -9.131 13.314 -18.994 1.00 54.22 O ATOM 1260 CB ASP A 81 -10.175 16.206 -20.302 1.00 51.54 C ATOM 1261 CG ASP A 81 -11.137 15.221 -20.936 1.00 41.23 C ATOM 1262 OD1 ASP A 81 -11.351 15.306 -22.163 1.00 30.53 O ATOM 1263 OD2 ASP A 81 -11.677 14.365 -20.205 1.00 53.54 O ATOM 0 H ASP A 81 -8.738 17.596 -18.862 1.00 14.12 H new ATOM 0 HA ASP A 81 -10.371 15.393 -18.322 1.00 5.34 H new ATOM 0 HB2 ASP A 81 -10.698 17.141 -20.099 1.00 51.54 H new ATOM 0 HB3 ASP A 81 -9.376 16.434 -21.007 1.00 51.54 H new ATOM 1268 N MET A 82 -7.547 14.649 -19.870 1.00 4.41 N ATOM 1269 CA MET A 82 -6.646 13.550 -20.197 1.00 20.40 C ATOM 1270 C MET A 82 -6.070 12.924 -18.932 1.00 54.05 C ATOM 1271 O MET A 82 -6.045 11.702 -18.788 1.00 30.51 O ATOM 1272 CB MET A 82 -5.513 14.042 -21.098 1.00 20.35 C ATOM 1273 CG MET A 82 -5.911 14.176 -22.559 1.00 30.52 C ATOM 1274 SD MET A 82 -5.404 12.758 -23.550 1.00 32.42 S ATOM 1275 CE MET A 82 -6.354 13.031 -25.044 1.00 73.14 C ATOM 0 H MET A 82 -7.195 15.572 -20.123 1.00 4.41 H new ATOM 0 HA MET A 82 -7.219 12.790 -20.728 1.00 20.40 H new ATOM 0 HB2 MET A 82 -5.165 15.009 -20.735 1.00 20.35 H new ATOM 0 HB3 MET A 82 -4.673 13.352 -21.021 1.00 20.35 H new ATOM 0 HG2 MET A 82 -6.992 14.294 -22.628 1.00 30.52 H new ATOM 0 HG3 MET A 82 -5.465 15.081 -22.972 1.00 30.52 H new ATOM 0 HE1 MET A 82 -6.148 12.233 -25.757 1.00 73.14 H new ATOM 0 HE2 MET A 82 -7.417 13.036 -24.803 1.00 73.14 H new ATOM 0 HE3 MET A 82 -6.076 13.990 -25.482 1.00 73.14 H new ATOM 1285 N ALA A 83 -5.609 13.769 -18.015 1.00 30.11 N ATOM 1286 CA ALA A 83 -5.035 13.297 -16.761 1.00 5.33 C ATOM 1287 C ALA A 83 -5.985 12.342 -16.048 1.00 42.54 C ATOM 1288 O ALA A 83 -5.564 11.311 -15.521 1.00 65.21 O ATOM 1289 CB ALA A 83 -4.693 14.477 -15.862 1.00 34.21 C ATOM 0 H ALA A 83 -5.622 14.784 -18.117 1.00 30.11 H new ATOM 0 HA ALA A 83 -4.120 12.751 -16.990 1.00 5.33 H new ATOM 0 HB1 ALA A 83 -4.265 14.111 -14.929 1.00 34.21 H new ATOM 0 HB2 ALA A 83 -3.971 15.120 -16.365 1.00 34.21 H new ATOM 0 HB3 ALA A 83 -5.598 15.046 -15.648 1.00 34.21 H new ATOM 1295 N ILE A 84 -7.267 12.692 -16.032 1.00 13.33 N ATOM 1296 CA ILE A 84 -8.276 11.864 -15.383 1.00 50.54 C ATOM 1297 C ILE A 84 -8.446 10.534 -16.108 1.00 42.15 C ATOM 1298 O ILE A 84 -8.393 9.469 -15.494 1.00 14.42 O ATOM 1299 CB ILE A 84 -9.637 12.581 -15.322 1.00 71.13 C ATOM 1300 CG1 ILE A 84 -9.523 13.874 -14.510 1.00 34.22 C ATOM 1301 CG2 ILE A 84 -10.693 11.665 -14.721 1.00 13.32 C ATOM 1302 CD1 ILE A 84 -10.528 14.930 -14.912 1.00 5.44 C ATOM 0 H ILE A 84 -7.631 13.543 -16.461 1.00 13.33 H new ATOM 0 HA ILE A 84 -7.926 11.678 -14.367 1.00 50.54 H new ATOM 0 HB ILE A 84 -9.940 12.837 -16.337 1.00 71.13 H new ATOM 0 HG12 ILE A 84 -9.654 13.643 -13.453 1.00 34.22 H new ATOM 0 HG13 ILE A 84 -8.517 14.278 -14.625 1.00 34.22 H new ATOM 0 HG21 ILE A 84 -11.649 12.187 -14.685 1.00 13.32 H new ATOM 0 HG22 ILE A 84 -10.791 10.770 -15.336 1.00 13.32 H new ATOM 0 HG23 ILE A 84 -10.396 11.381 -13.711 1.00 13.32 H new ATOM 0 HD11 ILE A 84 -10.389 15.818 -14.295 1.00 5.44 H new ATOM 0 HD12 ILE A 84 -10.383 15.190 -15.961 1.00 5.44 H new ATOM 0 HD13 ILE A 84 -11.538 14.544 -14.770 1.00 5.44 H new ATOM 1314 N VAL A 85 -8.649 10.604 -17.420 1.00 54.13 N ATOM 1315 CA VAL A 85 -8.825 9.404 -18.230 1.00 25.23 C ATOM 1316 C VAL A 85 -7.698 8.406 -17.987 1.00 54.24 C ATOM 1317 O VAL A 85 -7.892 7.195 -18.097 1.00 2.53 O ATOM 1318 CB VAL A 85 -8.877 9.745 -19.732 1.00 72.51 C ATOM 1319 CG1 VAL A 85 -9.018 8.478 -20.562 1.00 61.35 C ATOM 1320 CG2 VAL A 85 -10.016 10.710 -20.019 1.00 62.25 C ATOM 0 H VAL A 85 -8.696 11.478 -17.944 1.00 54.13 H new ATOM 0 HA VAL A 85 -9.773 8.957 -17.932 1.00 25.23 H new ATOM 0 HB VAL A 85 -7.941 10.230 -20.010 1.00 72.51 H new ATOM 0 HG11 VAL A 85 -9.053 8.738 -21.620 1.00 61.35 H new ATOM 0 HG12 VAL A 85 -8.165 7.825 -20.377 1.00 61.35 H new ATOM 0 HG13 VAL A 85 -9.937 7.962 -20.285 1.00 61.35 H new ATOM 0 HG21 VAL A 85 -10.038 10.940 -21.084 1.00 62.25 H new ATOM 0 HG22 VAL A 85 -10.962 10.254 -19.727 1.00 62.25 H new ATOM 0 HG23 VAL A 85 -9.866 11.629 -19.452 1.00 62.25 H new ATOM 1330 N THR A 86 -6.520 8.923 -17.651 1.00 74.12 N ATOM 1331 CA THR A 86 -5.362 8.077 -17.391 1.00 4.15 C ATOM 1332 C THR A 86 -5.476 7.390 -16.036 1.00 72.24 C ATOM 1333 O THR A 86 -5.375 6.166 -15.938 1.00 52.23 O ATOM 1334 CB THR A 86 -4.053 8.889 -17.434 1.00 11.43 C ATOM 1335 OG1 THR A 86 -3.852 9.425 -18.746 1.00 43.13 O ATOM 1336 CG2 THR A 86 -2.865 8.021 -17.047 1.00 73.30 C ATOM 0 H THR A 86 -6.343 9.923 -17.553 1.00 74.12 H new ATOM 0 HA THR A 86 -5.339 7.322 -18.177 1.00 4.15 H new ATOM 0 HB THR A 86 -4.134 9.706 -16.717 1.00 11.43 H new ATOM 0 HG1 THR A 86 -4.473 10.169 -18.894 1.00 43.13 H new ATOM 0 HG21 THR A 86 -1.952 8.616 -17.085 1.00 73.30 H new ATOM 0 HG22 THR A 86 -3.008 7.639 -16.036 1.00 73.30 H new ATOM 0 HG23 THR A 86 -2.783 7.186 -17.743 1.00 73.30 H new ATOM 1344 N LEU A 87 -5.688 8.183 -14.992 1.00 50.44 N ATOM 1345 CA LEU A 87 -5.817 7.650 -13.639 1.00 2.02 C ATOM 1346 C LEU A 87 -6.900 6.579 -13.578 1.00 73.41 C ATOM 1347 O LEU A 87 -6.845 5.670 -12.749 1.00 11.31 O ATOM 1348 CB LEU A 87 -6.141 8.775 -12.655 1.00 3.34 C ATOM 1349 CG LEU A 87 -5.099 9.033 -11.565 1.00 72.22 C ATOM 1350 CD1 LEU A 87 -5.595 10.094 -10.595 1.00 42.45 C ATOM 1351 CD2 LEU A 87 -4.771 7.743 -10.826 1.00 50.25 C ATOM 0 H LEU A 87 -5.774 9.197 -15.055 1.00 50.44 H new ATOM 0 HA LEU A 87 -4.866 7.196 -13.361 1.00 2.02 H new ATOM 0 HB2 LEU A 87 -6.282 9.696 -13.220 1.00 3.34 H new ATOM 0 HB3 LEU A 87 -7.092 8.547 -12.174 1.00 3.34 H new ATOM 0 HG LEU A 87 -4.188 9.399 -12.038 1.00 72.22 H new ATOM 0 HD11 LEU A 87 -4.841 10.265 -9.826 1.00 42.45 H new ATOM 0 HD12 LEU A 87 -5.780 11.023 -11.135 1.00 42.45 H new ATOM 0 HD13 LEU A 87 -6.520 9.756 -10.128 1.00 42.45 H new ATOM 0 HD21 LEU A 87 -4.028 7.945 -10.054 1.00 50.25 H new ATOM 0 HD22 LEU A 87 -5.676 7.348 -10.364 1.00 50.25 H new ATOM 0 HD23 LEU A 87 -4.374 7.012 -11.530 1.00 50.25 H new ATOM 1363 N LYS A 88 -7.886 6.689 -14.462 1.00 10.32 N ATOM 1364 CA LYS A 88 -8.982 5.728 -14.512 1.00 24.25 C ATOM 1365 C LYS A 88 -8.543 4.437 -15.195 1.00 43.43 C ATOM 1366 O LYS A 88 -8.439 3.390 -14.556 1.00 34.54 O ATOM 1367 CB LYS A 88 -10.180 6.328 -15.253 1.00 33.05 C ATOM 1368 CG LYS A 88 -11.113 7.123 -14.357 1.00 53.12 C ATOM 1369 CD LYS A 88 -12.403 7.483 -15.075 1.00 24.42 C ATOM 1370 CE LYS A 88 -13.396 8.150 -14.137 1.00 74.10 C ATOM 1371 NZ LYS A 88 -14.734 8.312 -14.769 1.00 32.21 N ATOM 0 H LYS A 88 -7.949 7.435 -15.155 1.00 10.32 H new ATOM 0 HA LYS A 88 -9.275 5.495 -13.488 1.00 24.25 H new ATOM 0 HB2 LYS A 88 -9.816 6.976 -16.050 1.00 33.05 H new ATOM 0 HB3 LYS A 88 -10.743 5.524 -15.727 1.00 33.05 H new ATOM 0 HG2 LYS A 88 -11.343 6.543 -13.463 1.00 53.12 H new ATOM 0 HG3 LYS A 88 -10.613 8.033 -14.026 1.00 53.12 H new ATOM 0 HD2 LYS A 88 -12.183 8.151 -15.908 1.00 24.42 H new ATOM 0 HD3 LYS A 88 -12.849 6.583 -15.498 1.00 24.42 H new ATOM 0 HE2 LYS A 88 -13.493 7.555 -13.229 1.00 74.10 H new ATOM 0 HE3 LYS A 88 -13.014 9.127 -13.839 1.00 74.10 H new ATOM 0 HZ1 LYS A 88 -15.277 9.034 -14.253 1.00 32.21 H new ATOM 0 HZ2 LYS A 88 -14.617 8.609 -15.759 1.00 32.21 H new ATOM 0 HZ3 LYS A 88 -15.245 7.407 -14.737 1.00 32.21 H new ATOM 1385 N VAL A 89 -8.284 4.519 -16.496 1.00 42.34 N ATOM 1386 CA VAL A 89 -7.853 3.358 -17.265 1.00 54.24 C ATOM 1387 C VAL A 89 -6.667 2.667 -16.600 1.00 61.14 C ATOM 1388 O VAL A 89 -6.570 1.440 -16.600 1.00 24.11 O ATOM 1389 CB VAL A 89 -7.465 3.749 -18.703 1.00 14.12 C ATOM 1390 CG1 VAL A 89 -6.352 4.785 -18.692 1.00 44.11 C ATOM 1391 CG2 VAL A 89 -7.050 2.518 -19.496 1.00 22.20 C ATOM 0 H VAL A 89 -8.365 5.378 -17.040 1.00 42.34 H new ATOM 0 HA VAL A 89 -8.698 2.670 -17.299 1.00 54.24 H new ATOM 0 HB VAL A 89 -8.335 4.190 -19.189 1.00 14.12 H new ATOM 0 HG11 VAL A 89 -6.091 5.049 -19.717 1.00 44.11 H new ATOM 0 HG12 VAL A 89 -6.689 5.676 -18.162 1.00 44.11 H new ATOM 0 HG13 VAL A 89 -5.477 4.373 -18.189 1.00 44.11 H new ATOM 0 HG21 VAL A 89 -6.779 2.813 -20.510 1.00 22.20 H new ATOM 0 HG22 VAL A 89 -6.194 2.046 -19.014 1.00 22.20 H new ATOM 0 HG23 VAL A 89 -7.880 1.812 -19.533 1.00 22.20 H new ATOM 1401 N PHE A 90 -5.768 3.464 -16.032 1.00 52.03 N ATOM 1402 CA PHE A 90 -4.587 2.930 -15.363 1.00 72.13 C ATOM 1403 C PHE A 90 -4.972 2.213 -14.072 1.00 31.12 C ATOM 1404 O PHE A 90 -4.495 1.113 -13.795 1.00 75.42 O ATOM 1405 CB PHE A 90 -3.596 4.055 -15.058 1.00 22.54 C ATOM 1406 CG PHE A 90 -2.218 3.563 -14.718 1.00 72.12 C ATOM 1407 CD1 PHE A 90 -1.962 2.973 -13.491 1.00 41.42 C ATOM 1408 CD2 PHE A 90 -1.178 3.691 -15.625 1.00 71.13 C ATOM 1409 CE1 PHE A 90 -0.696 2.519 -13.174 1.00 2.25 C ATOM 1410 CE2 PHE A 90 0.090 3.237 -15.315 1.00 43.53 C ATOM 1411 CZ PHE A 90 0.332 2.653 -14.087 1.00 53.10 C ATOM 0 H PHE A 90 -5.835 4.482 -16.022 1.00 52.03 H new ATOM 0 HA PHE A 90 -4.115 2.210 -16.032 1.00 72.13 H new ATOM 0 HB2 PHE A 90 -3.534 4.718 -15.921 1.00 22.54 H new ATOM 0 HB3 PHE A 90 -3.977 4.649 -14.227 1.00 22.54 H new ATOM 0 HD1 PHE A 90 -2.762 2.867 -12.773 1.00 41.42 H new ATOM 0 HD2 PHE A 90 -1.361 4.151 -16.585 1.00 71.13 H new ATOM 0 HE1 PHE A 90 -0.511 2.060 -12.214 1.00 2.25 H new ATOM 0 HE2 PHE A 90 0.891 3.339 -16.032 1.00 43.53 H new ATOM 0 HZ PHE A 90 1.323 2.302 -13.841 1.00 53.10 H new ATOM 1421 N ALA A 91 -5.836 2.846 -13.286 1.00 55.54 N ATOM 1422 CA ALA A 91 -6.287 2.268 -12.025 1.00 4.43 C ATOM 1423 C ALA A 91 -6.846 0.865 -12.232 1.00 65.41 C ATOM 1424 O ALA A 91 -6.570 -0.046 -11.452 1.00 40.54 O ATOM 1425 CB ALA A 91 -7.331 3.165 -11.377 1.00 75.02 C ATOM 0 H ALA A 91 -6.238 3.759 -13.499 1.00 55.54 H new ATOM 0 HA ALA A 91 -5.426 2.192 -11.360 1.00 4.43 H new ATOM 0 HB1 ALA A 91 -7.659 2.721 -10.437 1.00 75.02 H new ATOM 0 HB2 ALA A 91 -6.898 4.146 -11.184 1.00 75.02 H new ATOM 0 HB3 ALA A 91 -8.185 3.271 -12.046 1.00 75.02 H new ATOM 1431 N VAL A 92 -7.635 0.698 -13.290 1.00 3.31 N ATOM 1432 CA VAL A 92 -8.233 -0.595 -13.600 1.00 41.00 C ATOM 1433 C VAL A 92 -7.239 -1.503 -14.314 1.00 74.01 C ATOM 1434 O VAL A 92 -7.206 -2.711 -14.078 1.00 33.10 O ATOM 1435 CB VAL A 92 -9.488 -0.436 -14.478 1.00 72.24 C ATOM 1436 CG1 VAL A 92 -9.137 0.240 -15.795 1.00 75.30 C ATOM 1437 CG2 VAL A 92 -10.144 -1.787 -14.720 1.00 22.05 C ATOM 0 H VAL A 92 -7.874 1.442 -13.946 1.00 3.31 H new ATOM 0 HA VAL A 92 -8.517 -1.048 -12.650 1.00 41.00 H new ATOM 0 HB VAL A 92 -10.201 0.198 -13.951 1.00 72.24 H new ATOM 0 HG11 VAL A 92 -10.036 0.344 -16.402 1.00 75.30 H new ATOM 0 HG12 VAL A 92 -8.717 1.226 -15.597 1.00 75.30 H new ATOM 0 HG13 VAL A 92 -8.406 -0.365 -16.331 1.00 75.30 H new ATOM 0 HG21 VAL A 92 -11.029 -1.655 -15.342 1.00 22.05 H new ATOM 0 HG22 VAL A 92 -9.440 -2.448 -15.226 1.00 22.05 H new ATOM 0 HG23 VAL A 92 -10.433 -2.227 -13.766 1.00 22.05 H new ATOM 1447 N ALA A 93 -6.429 -0.915 -15.188 1.00 71.34 N ATOM 1448 CA ALA A 93 -5.432 -1.671 -15.935 1.00 53.33 C ATOM 1449 C ALA A 93 -4.363 -2.237 -15.006 1.00 3.01 C ATOM 1450 O ALA A 93 -3.592 -3.113 -15.393 1.00 15.14 O ATOM 1451 CB ALA A 93 -4.795 -0.793 -17.003 1.00 12.02 C ATOM 0 H ALA A 93 -6.444 0.083 -15.396 1.00 71.34 H new ATOM 0 HA ALA A 93 -5.935 -2.508 -16.420 1.00 53.33 H new ATOM 0 HB1 ALA A 93 -4.052 -1.370 -17.553 1.00 12.02 H new ATOM 0 HB2 ALA A 93 -5.564 -0.441 -17.691 1.00 12.02 H new ATOM 0 HB3 ALA A 93 -4.312 0.062 -16.530 1.00 12.02 H new ATOM 1457 N GLY A 94 -4.322 -1.727 -13.778 1.00 74.44 N ATOM 1458 CA GLY A 94 -3.343 -2.194 -12.814 1.00 54.13 C ATOM 1459 C GLY A 94 -3.967 -3.024 -11.710 1.00 54.52 C ATOM 1460 O GLY A 94 -3.732 -4.230 -11.621 1.00 63.12 O ATOM 0 H GLY A 94 -4.949 -0.999 -13.434 1.00 74.44 H new ATOM 0 HA2 GLY A 94 -2.587 -2.788 -13.327 1.00 54.13 H new ATOM 0 HA3 GLY A 94 -2.832 -1.337 -12.375 1.00 54.13 H new ATOM 1464 N LEU A 95 -4.763 -2.379 -10.864 1.00 31.10 N ATOM 1465 CA LEU A 95 -5.422 -3.065 -9.758 1.00 33.14 C ATOM 1466 C LEU A 95 -6.284 -4.215 -10.268 1.00 33.22 C ATOM 1467 O LEU A 95 -6.431 -5.240 -9.599 1.00 43.41 O ATOM 1468 CB LEU A 95 -6.282 -2.082 -8.962 1.00 13.34 C ATOM 1469 CG LEU A 95 -5.532 -1.167 -7.993 1.00 1.22 C ATOM 1470 CD1 LEU A 95 -4.727 -1.988 -6.998 1.00 51.51 C ATOM 1471 CD2 LEU A 95 -4.624 -0.212 -8.756 1.00 71.44 C ATOM 0 H LEU A 95 -4.968 -1.381 -10.923 1.00 31.10 H new ATOM 0 HA LEU A 95 -4.651 -3.474 -9.105 1.00 33.14 H new ATOM 0 HB2 LEU A 95 -6.833 -1.459 -9.667 1.00 13.34 H new ATOM 0 HB3 LEU A 95 -7.020 -2.651 -8.396 1.00 13.34 H new ATOM 0 HG LEU A 95 -6.264 -0.578 -7.440 1.00 1.22 H new ATOM 0 HD11 LEU A 95 -4.200 -1.320 -6.317 1.00 51.51 H new ATOM 0 HD12 LEU A 95 -5.399 -2.631 -6.429 1.00 51.51 H new ATOM 0 HD13 LEU A 95 -4.004 -2.603 -7.534 1.00 51.51 H new ATOM 0 HD21 LEU A 95 -4.098 0.432 -8.051 1.00 71.44 H new ATOM 0 HD22 LEU A 95 -3.899 -0.784 -9.335 1.00 71.44 H new ATOM 0 HD23 LEU A 95 -5.224 0.401 -9.429 1.00 71.44 H new ATOM 1483 N LEU A 96 -6.852 -4.041 -11.456 1.00 53.10 N ATOM 1484 CA LEU A 96 -7.698 -5.065 -12.057 1.00 75.51 C ATOM 1485 C LEU A 96 -6.962 -5.791 -13.179 1.00 62.43 C ATOM 1486 O LEU A 96 -7.464 -6.767 -13.734 1.00 70.44 O ATOM 1487 CB LEU A 96 -8.986 -4.439 -12.597 1.00 23.21 C ATOM 1488 CG LEU A 96 -10.290 -4.948 -11.983 1.00 53.10 C ATOM 1489 CD1 LEU A 96 -10.500 -6.417 -12.316 1.00 12.25 C ATOM 1490 CD2 LEU A 96 -10.286 -4.737 -10.475 1.00 75.41 C ATOM 0 H LEU A 96 -6.742 -3.200 -12.022 1.00 53.10 H new ATOM 0 HA LEU A 96 -7.951 -5.791 -11.284 1.00 75.51 H new ATOM 0 HB2 LEU A 96 -8.933 -3.361 -12.445 1.00 23.21 H new ATOM 0 HB3 LEU A 96 -9.025 -4.608 -13.673 1.00 23.21 H new ATOM 0 HG LEU A 96 -11.116 -4.379 -12.409 1.00 53.10 H new ATOM 0 HD11 LEU A 96 -11.433 -6.761 -11.870 1.00 12.25 H new ATOM 0 HD12 LEU A 96 -10.547 -6.542 -13.398 1.00 12.25 H new ATOM 0 HD13 LEU A 96 -9.671 -7.002 -11.919 1.00 12.25 H new ATOM 0 HD21 LEU A 96 -11.222 -5.105 -10.054 1.00 75.41 H new ATOM 0 HD22 LEU A 96 -9.451 -5.281 -10.034 1.00 75.41 H new ATOM 0 HD23 LEU A 96 -10.183 -3.674 -10.257 1.00 75.41 H new ATOM 1502 N ASN A 97 -5.769 -5.307 -13.506 1.00 24.11 N ATOM 1503 CA ASN A 97 -4.963 -5.911 -14.561 1.00 3.12 C ATOM 1504 C ASN A 97 -5.774 -6.070 -15.842 1.00 23.33 C ATOM 1505 O ASN A 97 -5.540 -6.988 -16.628 1.00 11.52 O ATOM 1506 CB ASN A 97 -4.430 -7.271 -14.110 1.00 54.12 C ATOM 1507 CG ASN A 97 -3.359 -7.148 -13.043 1.00 73.12 C ATOM 1508 OD1 ASN A 97 -3.661 -7.010 -11.857 1.00 64.21 O ATOM 1509 ND2 ASN A 97 -2.100 -7.198 -13.461 1.00 12.54 N ATOM 0 H ASN A 97 -5.339 -4.499 -13.056 1.00 24.11 H new ATOM 0 HA ASN A 97 -4.122 -5.248 -14.764 1.00 3.12 H new ATOM 0 HB2 ASN A 97 -5.254 -7.872 -13.726 1.00 54.12 H new ATOM 0 HB3 ASN A 97 -4.022 -7.802 -14.970 1.00 54.12 H new ATOM 0 HD21 ASN A 97 -1.336 -7.121 -12.789 1.00 12.54 H new ATOM 0 HD22 ASN A 97 -1.896 -7.313 -14.454 1.00 12.54 H new ATOM 1516 N MET A 98 -6.730 -5.168 -16.048 1.00 52.30 N ATOM 1517 CA MET A 98 -7.575 -5.208 -17.235 1.00 62.34 C ATOM 1518 C MET A 98 -6.827 -4.676 -18.454 1.00 12.24 C ATOM 1519 O MET A 98 -6.324 -3.551 -18.446 1.00 35.11 O ATOM 1520 CB MET A 98 -8.848 -4.390 -17.008 1.00 31.22 C ATOM 1521 CG MET A 98 -10.108 -5.077 -17.508 1.00 31.41 C ATOM 1522 SD MET A 98 -11.536 -4.763 -16.452 1.00 12.13 S ATOM 1523 CE MET A 98 -11.864 -6.410 -15.828 1.00 53.13 C ATOM 0 H MET A 98 -6.938 -4.401 -15.408 1.00 52.30 H new ATOM 0 HA MET A 98 -7.846 -6.247 -17.422 1.00 62.34 H new ATOM 0 HB2 MET A 98 -8.954 -4.186 -15.943 1.00 31.22 H new ATOM 0 HB3 MET A 98 -8.746 -3.427 -17.509 1.00 31.22 H new ATOM 0 HG2 MET A 98 -10.327 -4.735 -18.520 1.00 31.41 H new ATOM 0 HG3 MET A 98 -9.933 -6.151 -17.566 1.00 31.41 H new ATOM 0 HE1 MET A 98 -12.399 -6.340 -14.881 1.00 53.13 H new ATOM 0 HE2 MET A 98 -12.471 -6.958 -16.549 1.00 53.13 H new ATOM 0 HE3 MET A 98 -10.921 -6.935 -15.674 1.00 53.13 H new ATOM 1533 N THR A 99 -6.754 -5.493 -19.501 1.00 52.05 N ATOM 1534 CA THR A 99 -6.066 -5.106 -20.725 1.00 22.14 C ATOM 1535 C THR A 99 -6.993 -4.335 -21.657 1.00 45.22 C ATOM 1536 O THR A 99 -7.187 -4.717 -22.812 1.00 42.24 O ATOM 1537 CB THR A 99 -5.512 -6.335 -21.471 1.00 62.31 C ATOM 1538 OG1 THR A 99 -4.951 -7.263 -20.537 1.00 74.25 O ATOM 1539 CG2 THR A 99 -4.452 -5.923 -22.482 1.00 41.24 C ATOM 0 H THR A 99 -7.163 -6.427 -19.525 1.00 52.05 H new ATOM 0 HA THR A 99 -5.236 -4.464 -20.431 1.00 22.14 H new ATOM 0 HB THR A 99 -6.336 -6.809 -22.005 1.00 62.31 H new ATOM 0 HG1 THR A 99 -4.603 -8.042 -21.019 1.00 74.25 H new ATOM 0 HG21 THR A 99 -4.076 -6.808 -22.996 1.00 41.24 H new ATOM 0 HG22 THR A 99 -4.889 -5.239 -23.209 1.00 41.24 H new ATOM 0 HG23 THR A 99 -3.630 -5.427 -21.966 1.00 41.24 H new ATOM 1547 N VAL A 100 -7.564 -3.248 -21.150 1.00 51.35 N ATOM 1548 CA VAL A 100 -8.472 -2.421 -21.938 1.00 3.53 C ATOM 1549 C VAL A 100 -7.844 -2.038 -23.274 1.00 54.22 C ATOM 1550 O VAL A 100 -6.622 -1.975 -23.403 1.00 15.20 O ATOM 1551 CB VAL A 100 -8.863 -1.139 -21.181 1.00 71.13 C ATOM 1552 CG1 VAL A 100 -7.665 -0.213 -21.042 1.00 44.52 C ATOM 1553 CG2 VAL A 100 -10.013 -0.434 -21.886 1.00 30.22 C ATOM 0 H VAL A 100 -7.414 -2.918 -20.196 1.00 51.35 H new ATOM 0 HA VAL A 100 -9.368 -3.015 -22.117 1.00 3.53 H new ATOM 0 HB VAL A 100 -9.195 -1.416 -20.180 1.00 71.13 H new ATOM 0 HG11 VAL A 100 -7.962 0.688 -20.504 1.00 44.52 H new ATOM 0 HG12 VAL A 100 -6.874 -0.721 -20.490 1.00 44.52 H new ATOM 0 HG13 VAL A 100 -7.299 0.060 -22.032 1.00 44.52 H new ATOM 0 HG21 VAL A 100 -10.277 0.470 -21.337 1.00 30.22 H new ATOM 0 HG22 VAL A 100 -9.711 -0.169 -22.899 1.00 30.22 H new ATOM 0 HG23 VAL A 100 -10.876 -1.098 -21.927 1.00 30.22 H new ATOM 1563 N SER A 101 -8.691 -1.782 -24.266 1.00 3.03 N ATOM 1564 CA SER A 101 -8.220 -1.408 -25.594 1.00 23.24 C ATOM 1565 C SER A 101 -7.893 0.082 -25.656 1.00 32.35 C ATOM 1566 O SER A 101 -6.776 0.472 -25.996 1.00 22.15 O ATOM 1567 CB SER A 101 -9.272 -1.755 -26.649 1.00 53.12 C ATOM 1568 OG SER A 101 -9.713 -3.094 -26.507 1.00 21.53 O ATOM 0 H SER A 101 -9.706 -1.827 -24.175 1.00 3.03 H new ATOM 0 HA SER A 101 -7.310 -1.971 -25.800 1.00 23.24 H new ATOM 0 HB2 SER A 101 -10.121 -1.077 -26.557 1.00 53.12 H new ATOM 0 HB3 SER A 101 -8.854 -1.610 -27.645 1.00 53.12 H new ATOM 0 HG SER A 101 -10.386 -3.291 -27.191 1.00 21.53 H new ATOM 1574 N THR A 102 -8.878 0.910 -25.324 1.00 60.44 N ATOM 1575 CA THR A 102 -8.698 2.357 -25.341 1.00 21.54 C ATOM 1576 C THR A 102 -8.972 2.962 -23.969 1.00 13.05 C ATOM 1577 O THR A 102 -9.856 2.506 -23.245 1.00 65.11 O ATOM 1578 CB THR A 102 -9.622 3.025 -26.378 1.00 10.20 C ATOM 1579 OG1 THR A 102 -10.970 3.039 -25.895 1.00 50.22 O ATOM 1580 CG2 THR A 102 -9.563 2.290 -27.709 1.00 1.40 C ATOM 0 H THR A 102 -9.809 0.604 -25.040 1.00 60.44 H new ATOM 0 HA THR A 102 -7.660 2.543 -25.616 1.00 21.54 H new ATOM 0 HB THR A 102 -9.280 4.049 -26.531 1.00 10.20 H new ATOM 0 HG1 THR A 102 -11.551 3.466 -26.559 1.00 50.22 H new ATOM 0 HG21 THR A 102 -10.223 2.780 -28.425 1.00 1.40 H new ATOM 0 HG22 THR A 102 -8.541 2.306 -28.088 1.00 1.40 H new ATOM 0 HG23 THR A 102 -9.882 1.257 -27.569 1.00 1.40 H new ATOM 1588 N ALA A 103 -8.207 3.990 -23.618 1.00 60.12 N ATOM 1589 CA ALA A 103 -8.369 4.660 -22.334 1.00 74.22 C ATOM 1590 C ALA A 103 -9.821 5.061 -22.103 1.00 72.25 C ATOM 1591 O ALA A 103 -10.311 5.035 -20.974 1.00 65.21 O ATOM 1592 CB ALA A 103 -7.463 5.879 -22.256 1.00 41.43 C ATOM 0 H ALA A 103 -7.468 4.377 -24.205 1.00 60.12 H new ATOM 0 HA ALA A 103 -8.084 3.960 -21.549 1.00 74.22 H new ATOM 0 HB1 ALA A 103 -7.595 6.369 -21.291 1.00 41.43 H new ATOM 0 HB2 ALA A 103 -6.424 5.568 -22.366 1.00 41.43 H new ATOM 0 HB3 ALA A 103 -7.720 6.575 -23.055 1.00 41.43 H new ATOM 1598 N ALA A 104 -10.506 5.434 -23.180 1.00 22.25 N ATOM 1599 CA ALA A 104 -11.903 5.841 -23.095 1.00 11.23 C ATOM 1600 C ALA A 104 -12.779 4.693 -22.607 1.00 73.33 C ATOM 1601 O ALA A 104 -13.578 4.858 -21.686 1.00 72.45 O ATOM 1602 CB ALA A 104 -12.390 6.341 -24.447 1.00 40.20 C ATOM 0 H ALA A 104 -10.115 5.463 -24.122 1.00 22.25 H new ATOM 0 HA ALA A 104 -11.976 6.653 -22.372 1.00 11.23 H new ATOM 0 HB1 ALA A 104 -13.435 6.642 -24.369 1.00 40.20 H new ATOM 0 HB2 ALA A 104 -11.789 7.196 -24.757 1.00 40.20 H new ATOM 0 HB3 ALA A 104 -12.296 5.544 -25.185 1.00 40.20 H new ATOM 1608 N ALA A 105 -12.625 3.530 -23.230 1.00 34.52 N ATOM 1609 CA ALA A 105 -13.402 2.353 -22.859 1.00 54.13 C ATOM 1610 C ALA A 105 -13.217 2.018 -21.382 1.00 4.10 C ATOM 1611 O ALA A 105 -14.181 1.716 -20.679 1.00 44.20 O ATOM 1612 CB ALA A 105 -13.010 1.166 -23.724 1.00 21.33 C ATOM 0 H ALA A 105 -11.968 3.377 -23.995 1.00 34.52 H new ATOM 0 HA ALA A 105 -14.456 2.576 -23.026 1.00 54.13 H new ATOM 0 HB1 ALA A 105 -13.598 0.295 -23.435 1.00 21.33 H new ATOM 0 HB2 ALA A 105 -13.199 1.401 -24.771 1.00 21.33 H new ATOM 0 HB3 ALA A 105 -11.951 0.950 -23.587 1.00 21.33 H new ATOM 1618 N ALA A 106 -11.972 2.071 -20.920 1.00 43.14 N ATOM 1619 CA ALA A 106 -11.661 1.775 -19.527 1.00 71.13 C ATOM 1620 C ALA A 106 -12.331 2.775 -18.590 1.00 14.42 C ATOM 1621 O ALA A 106 -12.841 2.403 -17.533 1.00 34.42 O ATOM 1622 CB ALA A 106 -10.155 1.774 -19.311 1.00 73.42 C ATOM 0 H ALA A 106 -11.162 2.316 -21.490 1.00 43.14 H new ATOM 0 HA ALA A 106 -12.051 0.784 -19.297 1.00 71.13 H new ATOM 0 HB1 ALA A 106 -9.937 1.552 -18.266 1.00 73.42 H new ATOM 0 HB2 ALA A 106 -9.697 1.016 -19.946 1.00 73.42 H new ATOM 0 HB3 ALA A 106 -9.750 2.754 -19.565 1.00 73.42 H new ATOM 1628 N GLU A 107 -12.324 4.045 -18.984 1.00 34.23 N ATOM 1629 CA GLU A 107 -12.931 5.097 -18.177 1.00 11.44 C ATOM 1630 C GLU A 107 -14.442 4.911 -18.087 1.00 40.33 C ATOM 1631 O GLU A 107 -15.032 5.048 -17.015 1.00 74.41 O ATOM 1632 CB GLU A 107 -12.609 6.471 -18.767 1.00 21.40 C ATOM 1633 CG GLU A 107 -13.382 7.608 -18.120 1.00 54.45 C ATOM 1634 CD GLU A 107 -14.414 8.215 -19.048 1.00 72.44 C ATOM 1635 OE1 GLU A 107 -14.350 9.439 -19.288 1.00 72.50 O ATOM 1636 OE2 GLU A 107 -15.288 7.468 -19.535 1.00 32.42 O ATOM 0 H GLU A 107 -11.905 4.370 -19.856 1.00 34.23 H new ATOM 0 HA GLU A 107 -12.515 5.034 -17.171 1.00 11.44 H new ATOM 0 HB2 GLU A 107 -11.541 6.662 -18.660 1.00 21.40 H new ATOM 0 HB3 GLU A 107 -12.825 6.458 -19.835 1.00 21.40 H new ATOM 0 HG2 GLU A 107 -13.878 7.240 -17.222 1.00 54.45 H new ATOM 0 HG3 GLU A 107 -12.684 8.383 -17.803 1.00 54.45 H new ATOM 1643 N ASN A 108 -15.063 4.598 -19.219 1.00 12.04 N ATOM 1644 CA ASN A 108 -16.506 4.394 -19.269 1.00 54.13 C ATOM 1645 C ASN A 108 -16.937 3.308 -18.287 1.00 52.40 C ATOM 1646 O ASN A 108 -17.894 3.484 -17.534 1.00 34.14 O ATOM 1647 CB ASN A 108 -16.940 4.016 -20.686 1.00 60.41 C ATOM 1648 CG ASN A 108 -18.353 4.469 -20.999 1.00 51.32 C ATOM 1649 OD1 ASN A 108 -18.823 5.480 -20.477 1.00 24.04 O ATOM 1650 ND2 ASN A 108 -19.040 3.719 -21.853 1.00 21.10 N ATOM 0 H ASN A 108 -14.589 4.480 -20.115 1.00 12.04 H new ATOM 0 HA ASN A 108 -16.989 5.329 -18.985 1.00 54.13 H new ATOM 0 HB2 ASN A 108 -16.251 4.461 -21.405 1.00 60.41 H new ATOM 0 HB3 ASN A 108 -16.873 2.935 -20.807 1.00 60.41 H new ATOM 0 HD21 ASN A 108 -19.997 3.973 -22.100 1.00 21.10 H new ATOM 0 HD22 ASN A 108 -18.611 2.889 -22.262 1.00 21.10 H new ATOM 1657 N MET A 109 -16.221 2.188 -18.302 1.00 75.35 N ATOM 1658 CA MET A 109 -16.529 1.075 -17.411 1.00 12.14 C ATOM 1659 C MET A 109 -16.179 1.422 -15.967 1.00 33.54 C ATOM 1660 O MET A 109 -16.792 0.910 -15.030 1.00 50.41 O ATOM 1661 CB MET A 109 -15.767 -0.179 -17.845 1.00 31.41 C ATOM 1662 CG MET A 109 -16.536 -1.469 -17.611 1.00 71.21 C ATOM 1663 SD MET A 109 -15.502 -2.780 -16.931 1.00 32.53 S ATOM 1664 CE MET A 109 -15.002 -2.045 -15.376 1.00 33.51 C ATOM 0 H MET A 109 -15.425 2.027 -18.920 1.00 75.35 H new ATOM 0 HA MET A 109 -17.600 0.880 -17.470 1.00 12.14 H new ATOM 0 HB2 MET A 109 -15.524 -0.098 -18.904 1.00 31.41 H new ATOM 0 HB3 MET A 109 -14.822 -0.226 -17.304 1.00 31.41 H new ATOM 0 HG2 MET A 109 -17.365 -1.275 -16.930 1.00 71.21 H new ATOM 0 HG3 MET A 109 -16.969 -1.805 -18.553 1.00 71.21 H new ATOM 0 HE1 MET A 109 -14.840 -2.830 -14.638 1.00 33.51 H new ATOM 0 HE2 MET A 109 -14.078 -1.485 -15.519 1.00 33.51 H new ATOM 0 HE3 MET A 109 -15.784 -1.372 -15.024 1.00 33.51 H new ATOM 1674 N TYR A 110 -15.191 2.293 -15.795 1.00 34.40 N ATOM 1675 CA TYR A 110 -14.758 2.705 -14.465 1.00 75.11 C ATOM 1676 C TYR A 110 -15.880 3.430 -13.728 1.00 43.25 C ATOM 1677 O TYR A 110 -16.152 3.152 -12.560 1.00 5.43 O ATOM 1678 CB TYR A 110 -13.529 3.610 -14.564 1.00 55.14 C ATOM 1679 CG TYR A 110 -12.819 3.813 -13.245 1.00 55.31 C ATOM 1680 CD1 TYR A 110 -11.867 2.904 -12.798 1.00 75.34 C ATOM 1681 CD2 TYR A 110 -13.100 4.913 -12.443 1.00 72.41 C ATOM 1682 CE1 TYR A 110 -11.217 3.085 -11.593 1.00 34.21 C ATOM 1683 CE2 TYR A 110 -12.453 5.102 -11.237 1.00 23.31 C ATOM 1684 CZ TYR A 110 -11.513 4.185 -10.817 1.00 43.30 C ATOM 1685 OH TYR A 110 -10.868 4.370 -9.615 1.00 10.04 O ATOM 0 H TYR A 110 -14.675 2.727 -16.560 1.00 34.40 H new ATOM 0 HA TYR A 110 -14.497 1.809 -13.901 1.00 75.11 H new ATOM 0 HB2 TYR A 110 -12.829 3.181 -15.281 1.00 55.14 H new ATOM 0 HB3 TYR A 110 -13.833 4.580 -14.956 1.00 55.14 H new ATOM 0 HD1 TYR A 110 -11.632 2.041 -13.404 1.00 75.34 H new ATOM 0 HD2 TYR A 110 -13.837 5.632 -12.768 1.00 72.41 H new ATOM 0 HE1 TYR A 110 -10.481 2.368 -11.260 1.00 34.21 H new ATOM 0 HE2 TYR A 110 -12.682 5.963 -10.627 1.00 23.31 H new ATOM 0 HH TYR A 110 -9.971 3.979 -9.662 1.00 10.04 H new ATOM 1695 N SER A 111 -16.528 4.362 -14.420 1.00 73.20 N ATOM 1696 CA SER A 111 -17.619 5.130 -13.832 1.00 72.34 C ATOM 1697 C SER A 111 -18.888 4.288 -13.739 1.00 63.04 C ATOM 1698 O SER A 111 -19.594 4.320 -12.730 1.00 23.42 O ATOM 1699 CB SER A 111 -17.888 6.389 -14.659 1.00 61.02 C ATOM 1700 OG SER A 111 -17.365 6.260 -15.970 1.00 53.14 O ATOM 0 H SER A 111 -16.316 4.603 -15.388 1.00 73.20 H new ATOM 0 HA SER A 111 -17.323 5.422 -12.824 1.00 72.34 H new ATOM 0 HB2 SER A 111 -18.961 6.573 -14.709 1.00 61.02 H new ATOM 0 HB3 SER A 111 -17.439 7.253 -14.168 1.00 61.02 H new ATOM 0 HG SER A 111 -17.551 7.077 -16.478 1.00 53.14 H new ATOM 1706 N GLN A 112 -19.171 3.537 -14.798 1.00 53.12 N ATOM 1707 CA GLN A 112 -20.356 2.687 -14.835 1.00 30.52 C ATOM 1708 C GLN A 112 -20.283 1.603 -13.764 1.00 21.25 C ATOM 1709 O GLN A 112 -21.298 1.223 -13.182 1.00 62.53 O ATOM 1710 CB GLN A 112 -20.506 2.047 -16.217 1.00 11.34 C ATOM 1711 CG GLN A 112 -21.673 1.078 -16.315 1.00 73.23 C ATOM 1712 CD GLN A 112 -22.966 1.666 -15.784 1.00 22.31 C ATOM 1713 OE1 GLN A 112 -23.278 2.832 -16.029 1.00 1.15 O ATOM 1714 NE2 GLN A 112 -23.727 0.861 -15.053 1.00 33.22 N ATOM 0 H GLN A 112 -18.597 3.499 -15.641 1.00 53.12 H new ATOM 0 HA GLN A 112 -21.227 3.311 -14.634 1.00 30.52 H new ATOM 0 HB2 GLN A 112 -20.634 2.834 -16.961 1.00 11.34 H new ATOM 0 HB3 GLN A 112 -19.585 1.520 -16.466 1.00 11.34 H new ATOM 0 HG2 GLN A 112 -21.812 0.786 -17.356 1.00 73.23 H new ATOM 0 HG3 GLN A 112 -21.435 0.171 -15.759 1.00 73.23 H new ATOM 0 HE21 GLN A 112 -23.430 -0.098 -14.875 1.00 33.22 H new ATOM 0 HE22 GLN A 112 -24.609 1.202 -14.670 1.00 33.22 H new ATOM 1723 N MET A 113 -19.076 1.110 -13.511 1.00 15.04 N ATOM 1724 CA MET A 113 -18.871 0.070 -12.509 1.00 54.03 C ATOM 1725 C MET A 113 -19.243 0.574 -11.118 1.00 21.23 C ATOM 1726 O MET A 113 -19.539 -0.213 -10.220 1.00 70.40 O ATOM 1727 CB MET A 113 -17.416 -0.401 -12.521 1.00 1.33 C ATOM 1728 CG MET A 113 -17.088 -1.391 -11.415 1.00 3.45 C ATOM 1729 SD MET A 113 -15.777 -2.541 -11.878 1.00 43.13 S ATOM 1730 CE MET A 113 -15.554 -3.435 -10.344 1.00 53.41 C ATOM 0 H MET A 113 -18.225 1.413 -13.985 1.00 15.04 H new ATOM 0 HA MET A 113 -19.519 -0.771 -12.757 1.00 54.03 H new ATOM 0 HB2 MET A 113 -17.200 -0.861 -13.485 1.00 1.33 H new ATOM 0 HB3 MET A 113 -16.761 0.466 -12.427 1.00 1.33 H new ATOM 0 HG2 MET A 113 -16.788 -0.845 -10.521 1.00 3.45 H new ATOM 0 HG3 MET A 113 -17.986 -1.954 -11.158 1.00 3.45 H new ATOM 0 HE1 MET A 113 -14.773 -4.185 -10.470 1.00 53.41 H new ATOM 0 HE2 MET A 113 -15.265 -2.739 -9.556 1.00 53.41 H new ATOM 0 HE3 MET A 113 -16.488 -3.926 -10.070 1.00 53.41 H new ATOM 1740 N GLY A 114 -19.224 1.892 -10.947 1.00 41.34 N ATOM 1741 CA GLY A 114 -19.560 2.479 -9.662 1.00 75.25 C ATOM 1742 C GLY A 114 -18.363 3.112 -8.982 1.00 63.02 C ATOM 1743 O GLY A 114 -18.374 3.336 -7.771 1.00 42.22 O ATOM 0 H GLY A 114 -18.982 2.564 -11.675 1.00 41.34 H new ATOM 0 HA2 GLY A 114 -20.335 3.233 -9.802 1.00 75.25 H new ATOM 0 HA3 GLY A 114 -19.978 1.709 -9.013 1.00 75.25 H new ATOM 1747 N LEU A 115 -17.326 3.400 -9.761 1.00 33.31 N ATOM 1748 CA LEU A 115 -16.114 4.010 -9.226 1.00 5.04 C ATOM 1749 C LEU A 115 -16.085 5.507 -9.514 1.00 43.34 C ATOM 1750 O LEU A 115 -15.323 6.254 -8.900 1.00 32.12 O ATOM 1751 CB LEU A 115 -14.876 3.341 -9.826 1.00 4.54 C ATOM 1752 CG LEU A 115 -14.909 1.814 -9.902 1.00 13.54 C ATOM 1753 CD1 LEU A 115 -13.576 1.275 -10.399 1.00 43.41 C ATOM 1754 CD2 LEU A 115 -15.252 1.220 -8.543 1.00 62.42 C ATOM 0 H LEU A 115 -17.300 3.221 -10.765 1.00 33.31 H new ATOM 0 HA LEU A 115 -16.111 3.866 -8.146 1.00 5.04 H new ATOM 0 HB2 LEU A 115 -14.728 3.732 -10.833 1.00 4.54 H new ATOM 0 HB3 LEU A 115 -14.007 3.637 -9.238 1.00 4.54 H new ATOM 0 HG LEU A 115 -15.683 1.521 -10.611 1.00 13.54 H new ATOM 0 HD11 LEU A 115 -13.618 0.187 -10.447 1.00 43.41 H new ATOM 0 HD12 LEU A 115 -13.370 1.674 -11.392 1.00 43.41 H new ATOM 0 HD13 LEU A 115 -12.783 1.578 -9.715 1.00 43.41 H new ATOM 0 HD21 LEU A 115 -15.271 0.133 -8.616 1.00 62.42 H new ATOM 0 HD22 LEU A 115 -14.500 1.522 -7.814 1.00 62.42 H new ATOM 0 HD23 LEU A 115 -16.231 1.580 -8.225 1.00 62.42 H new ATOM 1766 N ASP A 116 -16.923 5.941 -10.450 1.00 40.54 N ATOM 1767 CA ASP A 116 -16.997 7.351 -10.816 1.00 15.02 C ATOM 1768 C ASP A 116 -18.272 7.642 -11.602 1.00 14.03 C ATOM 1769 O ASP A 116 -19.152 6.788 -11.717 1.00 31.45 O ATOM 1770 CB ASP A 116 -15.773 7.750 -11.642 1.00 12.43 C ATOM 1771 CG ASP A 116 -15.136 9.034 -11.148 1.00 13.41 C ATOM 1772 OD1 ASP A 116 -15.510 10.114 -11.651 1.00 54.25 O ATOM 1773 OD2 ASP A 116 -14.262 8.959 -10.259 1.00 74.13 O ATOM 0 H ASP A 116 -17.560 5.337 -10.969 1.00 40.54 H new ATOM 0 HA ASP A 116 -17.014 7.939 -9.898 1.00 15.02 H new ATOM 0 HB2 ASP A 116 -15.037 6.946 -11.608 1.00 12.43 H new ATOM 0 HB3 ASP A 116 -16.066 7.871 -12.685 1.00 12.43 H new ATOM 1778 N THR A 117 -18.366 8.854 -12.139 1.00 64.11 N ATOM 1779 CA THR A 117 -19.535 9.259 -12.911 1.00 2.53 C ATOM 1780 C THR A 117 -19.149 9.621 -14.341 1.00 64.14 C ATOM 1781 O THR A 117 -17.981 9.879 -14.633 1.00 20.52 O ATOM 1782 CB THR A 117 -20.247 10.461 -12.264 1.00 11.52 C ATOM 1783 OG1 THR A 117 -19.285 11.333 -11.659 1.00 40.00 O ATOM 1784 CG2 THR A 117 -21.247 9.997 -11.216 1.00 41.34 C ATOM 0 H THR A 117 -17.647 9.572 -12.054 1.00 64.11 H new ATOM 0 HA THR A 117 -20.216 8.408 -12.925 1.00 2.53 H new ATOM 0 HB THR A 117 -20.785 10.999 -13.044 1.00 11.52 H new ATOM 0 HG1 THR A 117 -19.746 12.096 -11.251 1.00 40.00 H new ATOM 0 HG21 THR A 117 -21.738 10.863 -10.773 1.00 41.34 H new ATOM 0 HG22 THR A 117 -21.995 9.357 -11.685 1.00 41.34 H new ATOM 0 HG23 THR A 117 -20.726 9.438 -10.439 1.00 41.34 H new ATOM 1792 N ARG A 118 -20.138 9.639 -15.228 1.00 64.41 N ATOM 1793 CA ARG A 118 -19.902 9.969 -16.629 1.00 61.12 C ATOM 1794 C ARG A 118 -19.450 11.419 -16.777 1.00 3.00 C ATOM 1795 O ARG A 118 -18.358 11.708 -17.268 1.00 55.40 O ATOM 1796 CB ARG A 118 -21.171 9.733 -17.451 1.00 22.22 C ATOM 1797 CG ARG A 118 -21.042 8.601 -18.457 1.00 12.10 C ATOM 1798 CD ARG A 118 -22.369 8.312 -19.143 1.00 20.12 C ATOM 1799 NE ARG A 118 -22.848 9.459 -19.910 1.00 32.52 N ATOM 1800 CZ ARG A 118 -24.061 9.528 -20.447 1.00 43.04 C ATOM 1801 NH1 ARG A 118 -24.913 8.523 -20.299 1.00 61.33 N ATOM 1802 NH2 ARG A 118 -24.425 10.605 -21.131 1.00 41.10 N ATOM 0 H ARG A 118 -21.110 9.429 -15.002 1.00 64.41 H new ATOM 0 HA ARG A 118 -19.110 9.319 -17.001 1.00 61.12 H new ATOM 0 HB2 ARG A 118 -21.997 9.514 -16.774 1.00 22.22 H new ATOM 0 HB3 ARG A 118 -21.427 10.651 -17.980 1.00 22.22 H new ATOM 0 HG2 ARG A 118 -20.293 8.861 -19.205 1.00 12.10 H new ATOM 0 HG3 ARG A 118 -20.689 7.702 -17.952 1.00 12.10 H new ATOM 0 HD2 ARG A 118 -22.256 7.454 -19.806 1.00 20.12 H new ATOM 0 HD3 ARG A 118 -23.113 8.040 -18.394 1.00 20.12 H new ATOM 0 HE ARG A 118 -22.217 10.250 -20.040 1.00 32.52 H new ATOM 0 HH11 ARG A 118 -24.638 7.694 -19.772 1.00 61.33 H new ATOM 0 HH12 ARG A 118 -25.844 8.578 -20.712 1.00 61.33 H new ATOM 0 HH21 ARG A 118 -23.773 11.381 -21.245 1.00 41.10 H new ATOM 0 HH22 ARG A 118 -25.357 10.657 -21.543 1.00 41.10 H new ATOM 1816 N PRO A 119 -20.309 12.355 -16.344 1.00 12.32 N ATOM 1817 CA PRO A 119 -20.019 13.789 -16.418 1.00 51.33 C ATOM 1818 C PRO A 119 -18.919 14.210 -15.447 1.00 72.44 C ATOM 1819 O PRO A 119 -18.994 13.929 -14.251 1.00 42.43 O ATOM 1820 CB PRO A 119 -21.349 14.440 -16.031 1.00 73.12 C ATOM 1821 CG PRO A 119 -22.043 13.419 -15.197 1.00 11.40 C ATOM 1822 CD PRO A 119 -21.628 12.083 -15.748 1.00 54.21 C ATOM 0 HA PRO A 119 -19.656 14.080 -17.404 1.00 51.33 H new ATOM 0 HB2 PRO A 119 -21.190 15.364 -15.475 1.00 73.12 H new ATOM 0 HB3 PRO A 119 -21.936 14.696 -16.913 1.00 73.12 H new ATOM 0 HG2 PRO A 119 -21.760 13.514 -14.149 1.00 11.40 H new ATOM 0 HG3 PRO A 119 -23.125 13.543 -15.248 1.00 11.40 H new ATOM 0 HD2 PRO A 119 -21.567 11.327 -14.965 1.00 54.21 H new ATOM 0 HD3 PRO A 119 -22.337 11.717 -16.491 1.00 54.21 H new TER 1830 PRO A 119