USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 972 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 57 GLN : amide:sc= -0.0868 K(o=-0.19,f=-0.74) USER MOD Set 1.2: A 93 THR OG1 : rot 120:sc= -0.0995 USER MOD Set 2.1: A 34 LYS NZ :NH3+ -150:sc= 1.05 (180deg=0.0579) USER MOD Set 2.2: A 77 TYR OH : rot -0:sc= 1.31 USER MOD Set 3.1: A 39 SER OG : rot 180:sc= 0.655 USER MOD Set 3.2: A 68 GLN : amide:sc= 0.485 X(o=1.1,f=1.1) USER MOD Set 4.1: A 25 ASN : amide:sc= 0.401 X(o=0.87,f=1.2) USER MOD Set 4.2: A 31 SER OG : rot -85:sc= 0.467 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 169:sc= -0.0368 (180deg=-0.219) USER MOD Single : A 4 LYS NZ :NH3+ -152:sc= 0.675 (180deg=-0.111) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 100:sc= -0.0771 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 109:sc= 0.946 USER MOD Single : A 12 SER OG : rot -149:sc= 1.25 USER MOD Single : A 14 SER OG : rot 80:sc= 0.526 USER MOD Single : A 17 THR OG1 : rot -130:sc= 0.0591 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -142:sc= -3.13 (180deg=-5.2!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl -170:sc= -0.003 (180deg=-0.154) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 151:sc= 1.2 (180deg=0.625) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.0759 USER MOD Single : A 51 SER OG : rot 180:sc= 0.00835 USER MOD Single : A 59 GLN : amide:sc= -0.774 K(o=-0.77,f=-1.9) USER MOD Single : A 61 ASN : amide:sc= 0.49 K(o=0.49,f=-0.86) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.452 X(o=-0.45,f=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0.141 X(o=0.14,f=0) USER MOD Single : A 76 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 84 SER OG : rot 180:sc= -0.215 USER MOD Single : A 88 SER OG : rot 170:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot -169:sc= 0.219 USER MOD Single : A 101 GLN : amide:sc= -0.0388 K(o=-0.039,f=-0.88) USER MOD Single : A 102 MET CE :methyl 159:sc= -0.109 (180deg=-0.965) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 TYR OH : rot 120:sc= 0.416 USER MOD Single : A 111 SER OG : rot 180:sc= -0.0781 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0992 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -0.743 X(o=-0.74,f=-0.61) USER MOD Single : A 120 HIS : no HD1:sc= -0.22 X(o=-0.22,f=0.036) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HE2:sc= -0.976 K(o=-0.98,f=-5.1!) USER MOD Single : A 128 ASN : amide:sc= 0.581 K(o=0.58,f=0) USER MOD Single : A 135 ASN :FLIP amide:sc= 0 F(o=-0.76,f=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -137:sc= 1.28 (180deg=0.492) USER MOD Single : A 150 SER OG : rot -170:sc=-0.00556 USER MOD Single : A 151 LYS NZ :NH3+ -160:sc= -0.0344 (180deg=-0.302) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.525 -26.741 -12.106 1.00 1.10 N ATOM 2 CA GLY A 1 -2.121 -25.346 -12.305 1.00 3.01 C ATOM 3 C GLY A 1 -1.965 -24.629 -10.982 1.00 13.00 C ATOM 4 O GLY A 1 -2.954 -24.432 -10.270 1.00 25.13 O ATOM 0 H1 GLY A 1 -2.625 -27.209 -13.030 1.00 1.10 H new ATOM 0 H2 GLY A 1 -1.803 -27.235 -11.544 1.00 1.10 H new ATOM 0 H3 GLY A 1 -3.435 -26.771 -11.603 1.00 1.10 H new ATOM 0 HA2 GLY A 1 -1.180 -25.312 -12.854 1.00 3.01 H new ATOM 0 HA3 GLY A 1 -2.864 -24.833 -12.915 1.00 3.01 H new ATOM 8 N MET A 2 -0.751 -24.188 -10.660 1.00 55.15 N ATOM 9 CA MET A 2 -0.448 -23.343 -9.515 1.00 13.53 C ATOM 10 C MET A 2 0.523 -22.268 -9.995 1.00 2.30 C ATOM 11 O MET A 2 1.532 -22.574 -10.632 1.00 13.54 O ATOM 12 CB MET A 2 0.049 -24.167 -8.311 1.00 2.22 C ATOM 13 CG MET A 2 1.056 -25.304 -8.574 1.00 25.12 C ATOM 14 SD MET A 2 2.765 -24.891 -9.030 1.00 4.11 S ATOM 15 CE MET A 2 3.281 -23.869 -7.626 1.00 2.40 C ATOM 0 H MET A 2 0.076 -24.419 -11.211 1.00 55.15 H new ATOM 0 HA MET A 2 -1.343 -22.853 -9.133 1.00 13.53 H new ATOM 0 HB2 MET A 2 0.504 -23.477 -7.600 1.00 2.22 H new ATOM 0 HB3 MET A 2 -0.823 -24.601 -7.821 1.00 2.22 H new ATOM 0 HG2 MET A 2 1.097 -25.920 -7.676 1.00 25.12 H new ATOM 0 HG3 MET A 2 0.646 -25.927 -9.369 1.00 25.12 H new ATOM 0 HE1 MET A 2 4.358 -23.707 -7.670 1.00 2.40 H new ATOM 0 HE2 MET A 2 2.768 -22.908 -7.667 1.00 2.40 H new ATOM 0 HE3 MET A 2 3.028 -24.376 -6.695 1.00 2.40 H new ATOM 23 N ALA A 3 0.176 -21.001 -9.783 1.00 60.14 N ATOM 24 CA ALA A 3 0.967 -19.864 -10.225 1.00 34.53 C ATOM 25 C ALA A 3 0.583 -18.660 -9.388 1.00 15.03 C ATOM 26 O ALA A 3 -0.444 -18.020 -9.639 1.00 20.32 O ATOM 27 CB ALA A 3 0.753 -19.557 -11.709 1.00 34.51 C ATOM 0 H ALA A 3 -0.677 -20.735 -9.291 1.00 60.14 H new ATOM 0 HA ALA A 3 2.023 -20.104 -10.097 1.00 34.53 H new ATOM 0 HB1 ALA A 3 1.363 -18.701 -11.995 1.00 34.51 H new ATOM 0 HB2 ALA A 3 1.041 -20.423 -12.305 1.00 34.51 H new ATOM 0 HB3 ALA A 3 -0.298 -19.328 -11.885 1.00 34.51 H new ATOM 33 N LYS A 4 1.397 -18.333 -8.393 1.00 11.05 N ATOM 34 CA LYS A 4 1.302 -17.023 -7.765 1.00 72.32 C ATOM 35 C LYS A 4 2.018 -16.014 -8.661 1.00 33.14 C ATOM 36 O LYS A 4 3.113 -16.304 -9.140 1.00 54.42 O ATOM 37 CB LYS A 4 1.755 -17.051 -6.305 1.00 13.40 C ATOM 38 CG LYS A 4 3.202 -17.469 -6.036 1.00 21.50 C ATOM 39 CD LYS A 4 3.650 -16.841 -4.717 1.00 73.13 C ATOM 40 CE LYS A 4 3.013 -17.481 -3.467 1.00 33.44 C ATOM 41 NZ LYS A 4 3.438 -16.826 -2.207 1.00 63.54 N ATOM 0 H LYS A 4 2.118 -18.944 -8.009 1.00 11.05 H new ATOM 0 HA LYS A 4 0.264 -16.701 -7.686 1.00 72.32 H new ATOM 0 HB2 LYS A 4 1.606 -16.056 -5.885 1.00 13.40 H new ATOM 0 HB3 LYS A 4 1.099 -17.729 -5.759 1.00 13.40 H new ATOM 0 HG2 LYS A 4 3.279 -18.555 -5.984 1.00 21.50 H new ATOM 0 HG3 LYS A 4 3.849 -17.142 -6.850 1.00 21.50 H new ATOM 0 HD2 LYS A 4 4.734 -16.919 -4.640 1.00 73.13 H new ATOM 0 HD3 LYS A 4 3.407 -15.778 -4.732 1.00 73.13 H new ATOM 0 HE2 LYS A 4 1.927 -17.428 -3.550 1.00 33.44 H new ATOM 0 HE3 LYS A 4 3.279 -18.537 -3.430 1.00 33.44 H new ATOM 0 HZ1 LYS A 4 3.400 -17.514 -1.428 1.00 63.54 H new ATOM 0 HZ2 LYS A 4 4.411 -16.473 -2.310 1.00 63.54 H new ATOM 0 HZ3 LYS A 4 2.801 -16.031 -1.997 1.00 63.54 H new ATOM 51 N LYS A 5 1.391 -14.867 -8.921 1.00 34.43 N ATOM 52 CA LYS A 5 2.004 -13.712 -9.581 1.00 44.41 C ATOM 53 C LYS A 5 2.072 -12.608 -8.561 1.00 74.31 C ATOM 54 O LYS A 5 1.331 -12.644 -7.577 1.00 43.34 O ATOM 55 CB LYS A 5 1.210 -13.134 -10.769 1.00 23.13 C ATOM 56 CG LYS A 5 0.586 -14.105 -11.753 1.00 14.11 C ATOM 57 CD LYS A 5 -0.764 -14.612 -11.256 1.00 53.51 C ATOM 58 CE LYS A 5 -1.108 -15.988 -11.833 1.00 33.41 C ATOM 59 NZ LYS A 5 -1.254 -15.963 -13.304 1.00 21.40 N ATOM 0 H LYS A 5 0.414 -14.710 -8.672 1.00 34.43 H new ATOM 0 HA LYS A 5 2.963 -14.058 -9.967 1.00 44.41 H new ATOM 0 HB2 LYS A 5 0.412 -12.511 -10.365 1.00 23.13 H new ATOM 0 HB3 LYS A 5 1.877 -12.477 -11.327 1.00 23.13 H new ATOM 0 HG2 LYS A 5 0.459 -13.615 -12.719 1.00 14.11 H new ATOM 0 HG3 LYS A 5 1.258 -14.949 -11.909 1.00 14.11 H new ATOM 0 HD2 LYS A 5 -0.752 -14.668 -10.168 1.00 53.51 H new ATOM 0 HD3 LYS A 5 -1.542 -13.899 -11.530 1.00 53.51 H new ATOM 0 HE2 LYS A 5 -0.328 -16.698 -11.560 1.00 33.41 H new ATOM 0 HE3 LYS A 5 -2.035 -16.345 -11.385 1.00 33.41 H new ATOM 0 HZ1 LYS A 5 -1.487 -16.917 -13.646 1.00 21.40 H new ATOM 0 HZ2 LYS A 5 -2.016 -15.306 -13.566 1.00 21.40 H new ATOM 0 HZ3 LYS A 5 -0.362 -15.648 -13.736 1.00 21.40 H new ATOM 69 N THR A 6 2.822 -11.572 -8.888 1.00 52.23 N ATOM 70 CA THR A 6 3.001 -10.424 -8.020 1.00 14.04 C ATOM 71 C THR A 6 2.846 -9.117 -8.798 1.00 40.31 C ATOM 72 O THR A 6 3.207 -9.031 -9.972 1.00 31.31 O ATOM 73 CB THR A 6 4.353 -10.545 -7.299 1.00 64.32 C ATOM 74 OG1 THR A 6 4.457 -11.801 -6.662 1.00 33.20 O ATOM 75 CG2 THR A 6 4.573 -9.419 -6.275 1.00 51.21 C ATOM 0 H THR A 6 3.328 -11.504 -9.771 1.00 52.23 H new ATOM 0 HA THR A 6 2.221 -10.406 -7.259 1.00 14.04 H new ATOM 0 HB THR A 6 5.130 -10.453 -8.058 1.00 64.32 H new ATOM 0 HG1 THR A 6 4.996 -12.405 -7.215 1.00 33.20 H new ATOM 0 HG21 THR A 6 5.542 -9.550 -5.793 1.00 51.21 H new ATOM 0 HG22 THR A 6 4.548 -8.455 -6.783 1.00 51.21 H new ATOM 0 HG23 THR A 6 3.786 -9.453 -5.522 1.00 51.21 H new ATOM 83 N LEU A 7 2.383 -8.063 -8.127 1.00 3.11 N ATOM 84 CA LEU A 7 2.435 -6.691 -8.618 1.00 21.42 C ATOM 85 C LEU A 7 3.074 -5.840 -7.528 1.00 11.01 C ATOM 86 O LEU A 7 2.819 -6.061 -6.344 1.00 44.31 O ATOM 87 CB LEU A 7 1.007 -6.229 -8.955 1.00 15.12 C ATOM 88 CG LEU A 7 0.919 -4.881 -9.701 1.00 43.22 C ATOM 89 CD1 LEU A 7 1.465 -4.973 -11.130 1.00 74.32 C ATOM 90 CD2 LEU A 7 -0.547 -4.451 -9.779 1.00 3.02 C ATOM 0 H LEU A 7 1.952 -8.144 -7.206 1.00 3.11 H new ATOM 0 HA LEU A 7 3.029 -6.602 -9.527 1.00 21.42 H new ATOM 0 HB2 LEU A 7 0.527 -6.996 -9.563 1.00 15.12 H new ATOM 0 HB3 LEU A 7 0.437 -6.153 -8.029 1.00 15.12 H new ATOM 0 HG LEU A 7 1.521 -4.160 -9.148 1.00 43.22 H new ATOM 0 HD11 LEU A 7 1.382 -4.000 -11.615 1.00 74.32 H new ATOM 0 HD12 LEU A 7 2.512 -5.276 -11.101 1.00 74.32 H new ATOM 0 HD13 LEU A 7 0.890 -5.709 -11.692 1.00 74.32 H new ATOM 0 HD21 LEU A 7 -0.619 -3.499 -10.305 1.00 3.02 H new ATOM 0 HD22 LEU A 7 -1.120 -5.207 -10.316 1.00 3.02 H new ATOM 0 HD23 LEU A 7 -0.948 -4.340 -8.771 1.00 3.02 H new ATOM 101 N ILE A 8 3.916 -4.880 -7.905 1.00 71.54 N ATOM 102 CA ILE A 8 4.495 -3.897 -6.997 1.00 42.24 C ATOM 103 C ILE A 8 4.070 -2.540 -7.555 1.00 23.13 C ATOM 104 O ILE A 8 4.660 -2.049 -8.525 1.00 72.54 O ATOM 105 CB ILE A 8 6.029 -4.067 -6.874 1.00 24.14 C ATOM 106 CG1 ILE A 8 6.495 -5.499 -6.493 1.00 0.15 C ATOM 107 CG2 ILE A 8 6.638 -3.047 -5.895 1.00 1.34 C ATOM 108 CD1 ILE A 8 7.296 -6.203 -7.599 1.00 73.13 C ATOM 0 H ILE A 8 4.220 -4.763 -8.872 1.00 71.54 H new ATOM 0 HA ILE A 8 4.140 -4.015 -5.973 1.00 42.24 H new ATOM 0 HB ILE A 8 6.400 -3.879 -7.882 1.00 24.14 H new ATOM 0 HG12 ILE A 8 7.106 -5.445 -5.592 1.00 0.15 H new ATOM 0 HG13 ILE A 8 5.621 -6.103 -6.249 1.00 0.15 H new ATOM 0 HG21 ILE A 8 7.716 -3.198 -5.836 1.00 1.34 H new ATOM 0 HG22 ILE A 8 6.432 -2.036 -6.248 1.00 1.34 H new ATOM 0 HG23 ILE A 8 6.198 -3.183 -4.907 1.00 1.34 H new ATOM 0 HD11 ILE A 8 7.587 -7.197 -7.261 1.00 73.13 H new ATOM 0 HD12 ILE A 8 6.681 -6.290 -8.495 1.00 73.13 H new ATOM 0 HD13 ILE A 8 8.189 -5.622 -7.828 1.00 73.13 H new ATOM 119 N LEU A 9 3.010 -1.960 -6.987 1.00 61.31 N ATOM 120 CA LEU A 9 2.583 -0.610 -7.333 1.00 74.24 C ATOM 121 C LEU A 9 3.333 0.377 -6.449 1.00 3.00 C ATOM 122 O LEU A 9 3.342 0.245 -5.220 1.00 42.21 O ATOM 123 CB LEU A 9 1.068 -0.417 -7.109 1.00 65.34 C ATOM 124 CG LEU A 9 0.118 -0.979 -8.182 1.00 14.13 C ATOM 125 CD1 LEU A 9 -1.327 -0.677 -7.770 1.00 33.10 C ATOM 126 CD2 LEU A 9 0.332 -0.360 -9.569 1.00 40.01 C ATOM 0 H LEU A 9 2.430 -2.412 -6.280 1.00 61.31 H new ATOM 0 HA LEU A 9 2.798 -0.442 -8.388 1.00 74.24 H new ATOM 0 HB2 LEU A 9 0.807 -0.875 -6.155 1.00 65.34 H new ATOM 0 HB3 LEU A 9 0.875 0.651 -7.014 1.00 65.34 H new ATOM 0 HG LEU A 9 0.324 -2.047 -8.250 1.00 14.13 H new ATOM 0 HD11 LEU A 9 -2.010 -1.071 -8.523 1.00 33.10 H new ATOM 0 HD12 LEU A 9 -1.537 -1.146 -6.809 1.00 33.10 H new ATOM 0 HD13 LEU A 9 -1.463 0.401 -7.685 1.00 33.10 H new ATOM 0 HD21 LEU A 9 -0.370 -0.801 -10.277 1.00 40.01 H new ATOM 0 HD22 LEU A 9 0.166 0.716 -9.517 1.00 40.01 H new ATOM 0 HD23 LEU A 9 1.352 -0.554 -9.901 1.00 40.01 H new ATOM 137 N TYR A 10 3.846 1.459 -7.030 1.00 42.42 N ATOM 138 CA TYR A 10 4.460 2.559 -6.293 1.00 53.35 C ATOM 139 C TYR A 10 3.948 3.886 -6.862 1.00 41.53 C ATOM 140 O TYR A 10 3.785 4.016 -8.073 1.00 71.33 O ATOM 141 CB TYR A 10 5.987 2.423 -6.363 1.00 53.13 C ATOM 142 CG TYR A 10 6.550 2.261 -7.762 1.00 13.24 C ATOM 143 CD1 TYR A 10 6.732 3.382 -8.591 1.00 21.52 C ATOM 144 CD2 TYR A 10 6.885 0.984 -8.242 1.00 41.01 C ATOM 145 CE1 TYR A 10 7.316 3.245 -9.860 1.00 34.40 C ATOM 146 CE2 TYR A 10 7.444 0.839 -9.524 1.00 21.14 C ATOM 147 CZ TYR A 10 7.666 1.966 -10.341 1.00 43.01 C ATOM 148 OH TYR A 10 8.234 1.809 -11.569 1.00 13.31 O ATOM 0 H TYR A 10 3.846 1.598 -8.041 1.00 42.42 H new ATOM 0 HA TYR A 10 4.185 2.532 -5.239 1.00 53.35 H new ATOM 0 HB2 TYR A 10 6.437 3.304 -5.906 1.00 53.13 H new ATOM 0 HB3 TYR A 10 6.289 1.564 -5.764 1.00 53.13 H new ATOM 0 HD1 TYR A 10 6.420 4.357 -8.248 1.00 21.52 H new ATOM 0 HD2 TYR A 10 6.713 0.114 -7.626 1.00 41.01 H new ATOM 0 HE1 TYR A 10 7.497 4.119 -10.468 1.00 34.40 H new ATOM 0 HE2 TYR A 10 7.706 -0.144 -9.886 1.00 21.14 H new ATOM 0 HH TYR A 10 8.407 0.858 -11.730 1.00 13.31 H new ATOM 157 N TYR A 11 3.678 4.874 -6.008 1.00 22.42 N ATOM 158 CA TYR A 11 3.217 6.204 -6.391 1.00 64.22 C ATOM 159 C TYR A 11 4.449 7.064 -6.676 1.00 31.20 C ATOM 160 O TYR A 11 4.825 7.936 -5.884 1.00 34.41 O ATOM 161 CB TYR A 11 2.348 6.795 -5.269 1.00 22.32 C ATOM 162 CG TYR A 11 0.912 6.352 -5.153 1.00 22.34 C ATOM 163 CD1 TYR A 11 0.615 5.048 -4.721 1.00 72.12 C ATOM 164 CD2 TYR A 11 -0.121 7.292 -5.321 1.00 21.10 C ATOM 165 CE1 TYR A 11 -0.715 4.661 -4.494 1.00 43.31 C ATOM 166 CE2 TYR A 11 -1.456 6.920 -5.093 1.00 32.40 C ATOM 167 CZ TYR A 11 -1.747 5.606 -4.670 1.00 61.33 C ATOM 168 OH TYR A 11 -3.014 5.259 -4.361 1.00 4.10 O ATOM 0 H TYR A 11 3.778 4.764 -4.999 1.00 22.42 H new ATOM 0 HA TYR A 11 2.598 6.165 -7.287 1.00 64.22 H new ATOM 0 HB2 TYR A 11 2.839 6.575 -4.321 1.00 22.32 H new ATOM 0 HB3 TYR A 11 2.351 7.879 -5.386 1.00 22.32 H new ATOM 0 HD1 TYR A 11 1.415 4.340 -4.563 1.00 72.12 H new ATOM 0 HD2 TYR A 11 0.113 8.301 -5.626 1.00 21.10 H new ATOM 0 HE1 TYR A 11 -0.945 3.651 -4.188 1.00 43.31 H new ATOM 0 HE2 TYR A 11 -2.253 7.634 -5.240 1.00 32.40 H new ATOM 0 HH TYR A 11 -3.293 5.730 -3.548 1.00 4.10 H new ATOM 177 N SER A 12 5.127 6.802 -7.790 1.00 52.33 N ATOM 178 CA SER A 12 6.278 7.561 -8.251 1.00 64.55 C ATOM 179 C SER A 12 6.464 7.283 -9.740 1.00 73.33 C ATOM 180 O SER A 12 5.925 6.301 -10.245 1.00 64.24 O ATOM 181 CB SER A 12 7.521 7.117 -7.464 1.00 55.43 C ATOM 182 OG SER A 12 8.627 7.974 -7.684 1.00 42.53 O ATOM 0 H SER A 12 4.881 6.033 -8.413 1.00 52.33 H new ATOM 0 HA SER A 12 6.129 8.629 -8.093 1.00 64.55 H new ATOM 0 HB2 SER A 12 7.287 7.095 -6.400 1.00 55.43 H new ATOM 0 HB3 SER A 12 7.788 6.100 -7.753 1.00 55.43 H new ATOM 0 HG SER A 12 9.458 7.460 -7.615 1.00 42.53 H new ATOM 187 N TRP A 13 7.263 8.117 -10.406 1.00 74.11 N ATOM 188 CA TRP A 13 7.760 7.878 -11.750 1.00 1.43 C ATOM 189 C TRP A 13 9.082 7.103 -11.629 1.00 61.21 C ATOM 190 O TRP A 13 9.070 5.877 -11.513 1.00 1.25 O ATOM 191 CB TRP A 13 7.877 9.260 -12.417 1.00 34.21 C ATOM 192 CG TRP A 13 8.164 9.312 -13.883 1.00 22.51 C ATOM 193 CD1 TRP A 13 9.366 9.558 -14.449 1.00 62.31 C ATOM 194 CD2 TRP A 13 7.216 9.207 -14.984 1.00 40.21 C ATOM 195 NE1 TRP A 13 9.220 9.646 -15.821 1.00 61.45 N ATOM 196 CE2 TRP A 13 7.910 9.454 -16.205 1.00 42.22 C ATOM 197 CE3 TRP A 13 5.828 8.967 -15.068 1.00 41.32 C ATOM 198 CZ2 TRP A 13 7.249 9.489 -17.443 1.00 4.52 C ATOM 199 CZ3 TRP A 13 5.159 8.972 -16.306 1.00 52.43 C ATOM 200 CH2 TRP A 13 5.866 9.238 -17.492 1.00 33.55 C ATOM 0 H TRP A 13 7.588 8.999 -10.010 1.00 74.11 H new ATOM 0 HA TRP A 13 7.109 7.266 -12.375 1.00 1.43 H new ATOM 0 HB2 TRP A 13 6.944 9.795 -12.241 1.00 34.21 H new ATOM 0 HB3 TRP A 13 8.664 9.813 -11.903 1.00 34.21 H new ATOM 0 HD1 TRP A 13 10.297 9.669 -13.913 1.00 62.31 H new ATOM 0 HE1 TRP A 13 9.986 9.830 -16.469 1.00 61.45 H new ATOM 0 HE3 TRP A 13 5.268 8.776 -14.164 1.00 41.32 H new ATOM 0 HZ2 TRP A 13 7.797 9.706 -18.348 1.00 4.52 H new ATOM 0 HZ3 TRP A 13 4.099 8.771 -16.345 1.00 52.43 H new ATOM 0 HH2 TRP A 13 5.348 9.250 -18.439 1.00 33.55 H new ATOM 210 N SER A 14 10.218 7.788 -11.465 1.00 60.41 N ATOM 211 CA SER A 14 11.563 7.213 -11.383 1.00 5.40 C ATOM 212 C SER A 14 12.324 7.707 -10.139 1.00 22.10 C ATOM 213 O SER A 14 13.549 7.546 -10.036 1.00 53.03 O ATOM 214 CB SER A 14 12.342 7.545 -12.663 1.00 72.52 C ATOM 215 OG SER A 14 11.660 7.187 -13.855 1.00 40.12 O ATOM 0 H SER A 14 10.225 8.805 -11.382 1.00 60.41 H new ATOM 0 HA SER A 14 11.466 6.132 -11.288 1.00 5.40 H new ATOM 0 HB2 SER A 14 12.553 8.614 -12.683 1.00 72.52 H new ATOM 0 HB3 SER A 14 13.303 7.031 -12.636 1.00 72.52 H new ATOM 0 HG SER A 14 10.989 7.870 -14.066 1.00 40.12 H new ATOM 220 N GLY A 15 11.613 8.303 -9.181 1.00 12.20 N ATOM 221 CA GLY A 15 12.162 8.853 -7.955 1.00 14.04 C ATOM 222 C GLY A 15 11.705 8.072 -6.730 1.00 74.44 C ATOM 223 O GLY A 15 10.992 7.074 -6.851 1.00 21.10 O ATOM 0 H GLY A 15 10.601 8.417 -9.247 1.00 12.20 H new ATOM 0 HA2 GLY A 15 13.251 8.842 -8.007 1.00 14.04 H new ATOM 0 HA3 GLY A 15 11.858 9.895 -7.856 1.00 14.04 H new ATOM 227 N GLU A 16 12.073 8.570 -5.551 1.00 43.24 N ATOM 228 CA GLU A 16 11.643 8.178 -4.212 1.00 32.52 C ATOM 229 C GLU A 16 11.675 6.657 -3.977 1.00 23.22 C ATOM 230 O GLU A 16 12.680 6.161 -3.461 1.00 45.44 O ATOM 231 CB GLU A 16 10.329 8.908 -3.846 1.00 15.40 C ATOM 232 CG GLU A 16 10.408 9.756 -2.561 1.00 33.44 C ATOM 233 CD GLU A 16 11.265 11.030 -2.687 1.00 2.10 C ATOM 234 OE1 GLU A 16 12.462 10.909 -3.041 1.00 14.15 O ATOM 235 OE2 GLU A 16 10.794 12.142 -2.358 1.00 5.01 O ATOM 0 H GLU A 16 12.747 9.334 -5.507 1.00 43.24 H new ATOM 0 HA GLU A 16 12.379 8.519 -3.484 1.00 32.52 H new ATOM 0 HB2 GLU A 16 10.043 9.554 -4.676 1.00 15.40 H new ATOM 0 HB3 GLU A 16 9.537 8.168 -3.730 1.00 15.40 H new ATOM 0 HG2 GLU A 16 9.398 10.041 -2.266 1.00 33.44 H new ATOM 0 HG3 GLU A 16 10.812 9.139 -1.758 1.00 33.44 H new ATOM 240 N THR A 17 10.645 5.889 -4.332 1.00 14.15 N ATOM 241 CA THR A 17 10.658 4.428 -4.244 1.00 73.24 C ATOM 242 C THR A 17 11.639 3.766 -5.215 1.00 54.45 C ATOM 243 O THR A 17 12.092 2.675 -4.914 1.00 42.22 O ATOM 244 CB THR A 17 9.248 3.854 -4.484 1.00 11.41 C ATOM 245 OG1 THR A 17 8.505 4.714 -5.339 1.00 72.32 O ATOM 246 CG2 THR A 17 8.488 3.656 -3.168 1.00 3.13 C ATOM 0 H THR A 17 9.769 6.267 -4.693 1.00 14.15 H new ATOM 0 HA THR A 17 10.994 4.198 -3.233 1.00 73.24 H new ATOM 0 HB THR A 17 9.367 2.880 -4.959 1.00 11.41 H new ATOM 0 HG1 THR A 17 7.629 4.896 -4.939 1.00 72.32 H new ATOM 0 HG21 THR A 17 7.498 3.250 -3.377 1.00 3.13 H new ATOM 0 HG22 THR A 17 9.038 2.963 -2.531 1.00 3.13 H new ATOM 0 HG23 THR A 17 8.387 4.614 -2.659 1.00 3.13 H new ATOM 254 N LYS A 18 11.992 4.377 -6.350 1.00 51.53 N ATOM 255 CA LYS A 18 12.456 3.683 -7.560 1.00 25.11 C ATOM 256 C LYS A 18 13.487 2.570 -7.340 1.00 54.33 C ATOM 257 O LYS A 18 13.279 1.456 -7.825 1.00 45.11 O ATOM 258 CB LYS A 18 12.860 4.748 -8.593 1.00 43.12 C ATOM 259 CG LYS A 18 13.477 4.219 -9.899 1.00 14.42 C ATOM 260 CD LYS A 18 14.957 3.814 -9.800 1.00 14.44 C ATOM 261 CE LYS A 18 15.603 4.024 -11.166 1.00 54.21 C ATOM 262 NZ LYS A 18 16.920 3.381 -11.299 1.00 75.23 N ATOM 0 H LYS A 18 11.963 5.391 -6.458 1.00 51.53 H new ATOM 0 HA LYS A 18 11.627 3.096 -7.955 1.00 25.11 H new ATOM 0 HB2 LYS A 18 11.977 5.336 -8.843 1.00 43.12 H new ATOM 0 HB3 LYS A 18 13.574 5.427 -8.126 1.00 43.12 H new ATOM 0 HG2 LYS A 18 12.901 3.356 -10.232 1.00 14.42 H new ATOM 0 HG3 LYS A 18 13.376 4.985 -10.668 1.00 14.42 H new ATOM 0 HD2 LYS A 18 15.465 4.413 -9.044 1.00 14.44 H new ATOM 0 HD3 LYS A 18 15.046 2.772 -9.494 1.00 14.44 H new ATOM 0 HE2 LYS A 18 14.938 3.635 -11.937 1.00 54.21 H new ATOM 0 HE3 LYS A 18 15.710 5.093 -11.348 1.00 54.21 H new ATOM 0 HZ1 LYS A 18 17.301 3.563 -12.249 1.00 75.23 H new ATOM 0 HZ2 LYS A 18 17.569 3.769 -10.585 1.00 75.23 H new ATOM 0 HZ3 LYS A 18 16.822 2.356 -11.156 1.00 75.23 H new ATOM 272 N LYS A 19 14.601 2.839 -6.652 1.00 35.10 N ATOM 273 CA LYS A 19 15.618 1.805 -6.407 1.00 34.12 C ATOM 274 C LYS A 19 14.999 0.592 -5.697 1.00 25.15 C ATOM 275 O LYS A 19 15.274 -0.553 -6.053 1.00 5.22 O ATOM 276 CB LYS A 19 16.817 2.383 -5.628 1.00 31.30 C ATOM 277 CG LYS A 19 16.451 2.976 -4.252 1.00 4.11 C ATOM 278 CD LYS A 19 17.641 3.327 -3.357 1.00 12.21 C ATOM 279 CE LYS A 19 18.465 4.513 -3.861 1.00 71.35 C ATOM 280 NZ LYS A 19 18.887 5.389 -2.747 1.00 1.50 N ATOM 0 H LYS A 19 14.823 3.753 -6.257 1.00 35.10 H new ATOM 0 HA LYS A 19 15.999 1.459 -7.368 1.00 34.12 H new ATOM 0 HB2 LYS A 19 17.557 1.596 -5.486 1.00 31.30 H new ATOM 0 HB3 LYS A 19 17.288 3.159 -6.232 1.00 31.30 H new ATOM 0 HG2 LYS A 19 15.857 3.876 -4.409 1.00 4.11 H new ATOM 0 HG3 LYS A 19 15.817 2.263 -3.724 1.00 4.11 H new ATOM 0 HD2 LYS A 19 17.276 3.550 -2.354 1.00 12.21 H new ATOM 0 HD3 LYS A 19 18.290 2.455 -3.273 1.00 12.21 H new ATOM 0 HE2 LYS A 19 19.344 4.148 -4.392 1.00 71.35 H new ATOM 0 HE3 LYS A 19 17.877 5.089 -4.576 1.00 71.35 H new ATOM 0 HZ1 LYS A 19 19.444 6.183 -3.122 1.00 1.50 H new ATOM 0 HZ2 LYS A 19 18.047 5.756 -2.256 1.00 1.50 H new ATOM 0 HZ3 LYS A 19 19.468 4.844 -2.078 1.00 1.50 H new ATOM 290 N MET A 20 14.108 0.880 -4.756 1.00 52.43 N ATOM 291 CA MET A 20 13.363 0.029 -3.849 1.00 63.35 C ATOM 292 C MET A 20 12.035 -0.410 -4.496 1.00 12.22 C ATOM 293 O MET A 20 11.017 -0.562 -3.834 1.00 62.33 O ATOM 294 CB MET A 20 13.152 0.844 -2.545 1.00 43.05 C ATOM 295 CG MET A 20 13.321 0.105 -1.218 1.00 33.43 C ATOM 296 SD MET A 20 12.527 -1.501 -1.100 1.00 60.24 S ATOM 297 CE MET A 20 13.948 -2.503 -1.564 1.00 73.44 C ATOM 0 H MET A 20 13.861 1.856 -4.594 1.00 52.43 H new ATOM 0 HA MET A 20 13.901 -0.891 -3.621 1.00 63.35 H new ATOM 0 HB2 MET A 20 13.849 1.682 -2.555 1.00 43.05 H new ATOM 0 HB3 MET A 20 12.147 1.265 -2.570 1.00 43.05 H new ATOM 0 HG2 MET A 20 14.387 -0.025 -1.031 1.00 33.43 H new ATOM 0 HG3 MET A 20 12.933 0.739 -0.421 1.00 33.43 H new ATOM 0 HE1 MET A 20 13.618 -3.337 -2.184 1.00 73.44 H new ATOM 0 HE2 MET A 20 14.657 -1.892 -2.123 1.00 73.44 H new ATOM 0 HE3 MET A 20 14.431 -2.888 -0.666 1.00 73.44 H new ATOM 305 N ALA A 21 12.014 -0.553 -5.820 1.00 1.43 N ATOM 306 CA ALA A 21 10.918 -1.128 -6.587 1.00 11.10 C ATOM 307 C ALA A 21 11.553 -2.120 -7.557 1.00 2.44 C ATOM 308 O ALA A 21 11.214 -3.302 -7.573 1.00 52.45 O ATOM 309 CB ALA A 21 10.136 -0.027 -7.312 1.00 4.14 C ATOM 0 H ALA A 21 12.793 -0.258 -6.409 1.00 1.43 H new ATOM 0 HA ALA A 21 10.195 -1.636 -5.948 1.00 11.10 H new ATOM 0 HB1 ALA A 21 9.320 -0.474 -7.880 1.00 4.14 H new ATOM 0 HB2 ALA A 21 9.729 0.671 -6.581 1.00 4.14 H new ATOM 0 HB3 ALA A 21 10.802 0.506 -7.991 1.00 4.14 H new ATOM 315 N GLU A 22 12.546 -1.639 -8.313 1.00 13.03 N ATOM 316 CA GLU A 22 13.336 -2.408 -9.268 1.00 3.10 C ATOM 317 C GLU A 22 14.057 -3.567 -8.569 1.00 0.12 C ATOM 318 O GLU A 22 14.227 -4.625 -9.169 1.00 52.15 O ATOM 319 CB GLU A 22 14.347 -1.458 -9.931 1.00 62.34 C ATOM 320 CG GLU A 22 13.690 -0.401 -10.839 1.00 43.31 C ATOM 321 CD GLU A 22 13.543 -0.863 -12.297 1.00 54.33 C ATOM 322 OE1 GLU A 22 13.113 -2.010 -12.537 1.00 20.20 O ATOM 323 OE2 GLU A 22 13.917 -0.098 -13.220 1.00 42.31 O ATOM 0 H GLU A 22 12.830 -0.660 -8.271 1.00 13.03 H new ATOM 0 HA GLU A 22 12.683 -2.842 -10.025 1.00 3.10 H new ATOM 0 HB2 GLU A 22 14.922 -0.953 -9.155 1.00 62.34 H new ATOM 0 HB3 GLU A 22 15.053 -2.044 -10.520 1.00 62.34 H new ATOM 0 HG2 GLU A 22 12.706 -0.152 -10.443 1.00 43.31 H new ATOM 0 HG3 GLU A 22 14.285 0.512 -10.812 1.00 43.31 H new ATOM 328 N LYS A 23 14.449 -3.385 -7.298 1.00 72.33 N ATOM 329 CA LYS A 23 15.011 -4.468 -6.482 1.00 3.43 C ATOM 330 C LYS A 23 14.035 -5.626 -6.399 1.00 15.04 C ATOM 331 O LYS A 23 14.306 -6.697 -6.930 1.00 11.01 O ATOM 332 CB LYS A 23 15.416 -4.014 -5.063 1.00 4.14 C ATOM 333 CG LYS A 23 16.879 -4.318 -4.772 1.00 62.44 C ATOM 334 CD LYS A 23 17.723 -3.111 -5.109 1.00 33.43 C ATOM 335 CE LYS A 23 17.717 -2.788 -6.601 1.00 1.04 C ATOM 336 NZ LYS A 23 18.371 -1.503 -6.869 1.00 11.43 N ATOM 0 H LYS A 23 14.385 -2.490 -6.812 1.00 72.33 H new ATOM 0 HA LYS A 23 15.925 -4.789 -6.982 1.00 3.43 H new ATOM 0 HB2 LYS A 23 15.239 -2.944 -4.959 1.00 4.14 H new ATOM 0 HB3 LYS A 23 14.787 -4.514 -4.327 1.00 4.14 H new ATOM 0 HG2 LYS A 23 17.005 -4.581 -3.722 1.00 62.44 H new ATOM 0 HG3 LYS A 23 17.206 -5.178 -5.357 1.00 62.44 H new ATOM 0 HD2 LYS A 23 17.355 -2.249 -4.553 1.00 33.43 H new ATOM 0 HD3 LYS A 23 18.748 -3.287 -4.783 1.00 33.43 H new ATOM 0 HE2 LYS A 23 18.227 -3.580 -7.149 1.00 1.04 H new ATOM 0 HE3 LYS A 23 16.690 -2.759 -6.965 1.00 1.04 H new ATOM 0 HZ1 LYS A 23 18.352 -1.310 -7.891 1.00 11.43 H new ATOM 0 HZ2 LYS A 23 17.868 -0.746 -6.364 1.00 11.43 H new ATOM 0 HZ3 LYS A 23 19.358 -1.541 -6.542 1.00 11.43 H new ATOM 346 N ILE A 24 12.881 -5.362 -5.792 1.00 23.33 N ATOM 347 CA ILE A 24 11.913 -6.367 -5.395 1.00 12.33 C ATOM 348 C ILE A 24 11.437 -7.143 -6.635 1.00 11.01 C ATOM 349 O ILE A 24 11.210 -8.349 -6.562 1.00 55.35 O ATOM 350 CB ILE A 24 10.779 -5.649 -4.634 1.00 33.14 C ATOM 351 CG1 ILE A 24 11.342 -5.058 -3.311 1.00 71.24 C ATOM 352 CG2 ILE A 24 9.631 -6.611 -4.301 1.00 0.41 C ATOM 353 CD1 ILE A 24 10.408 -4.104 -2.558 1.00 23.32 C ATOM 0 H ILE A 24 12.590 -4.413 -5.558 1.00 23.33 H new ATOM 0 HA ILE A 24 12.343 -7.112 -4.726 1.00 12.33 H new ATOM 0 HB ILE A 24 10.391 -4.856 -5.274 1.00 33.14 H new ATOM 0 HG12 ILE A 24 11.600 -5.883 -2.647 1.00 71.24 H new ATOM 0 HG13 ILE A 24 12.268 -4.528 -3.536 1.00 71.24 H new ATOM 0 HG21 ILE A 24 8.849 -6.073 -3.765 1.00 0.41 H new ATOM 0 HG22 ILE A 24 9.221 -7.022 -5.224 1.00 0.41 H new ATOM 0 HG23 ILE A 24 10.006 -7.423 -3.677 1.00 0.41 H new ATOM 0 HD11 ILE A 24 10.901 -3.752 -1.652 1.00 23.32 H new ATOM 0 HD12 ILE A 24 10.168 -3.252 -3.194 1.00 23.32 H new ATOM 0 HD13 ILE A 24 9.490 -4.628 -2.292 1.00 23.32 H new ATOM 364 N ASN A 25 11.323 -6.484 -7.795 1.00 74.22 N ATOM 365 CA ASN A 25 10.989 -7.155 -9.051 1.00 40.04 C ATOM 366 C ASN A 25 11.983 -8.292 -9.359 1.00 63.31 C ATOM 367 O ASN A 25 11.603 -9.392 -9.752 1.00 53.04 O ATOM 368 CB ASN A 25 10.983 -6.134 -10.195 1.00 13.32 C ATOM 369 CG ASN A 25 10.665 -6.753 -11.546 1.00 41.34 C ATOM 370 OD1 ASN A 25 11.282 -6.392 -12.544 1.00 41.15 O ATOM 371 ND2 ASN A 25 9.691 -7.642 -11.635 1.00 11.12 N ATOM 0 H ASN A 25 11.459 -5.477 -7.886 1.00 74.22 H new ATOM 0 HA ASN A 25 9.997 -7.596 -8.952 1.00 40.04 H new ATOM 0 HB2 ASN A 25 10.250 -5.357 -9.977 1.00 13.32 H new ATOM 0 HB3 ASN A 25 11.957 -5.648 -10.245 1.00 13.32 H new ATOM 0 HD21 ASN A 25 9.443 -8.038 -12.542 1.00 11.12 H new ATOM 0 HD22 ASN A 25 9.187 -7.932 -10.797 1.00 11.12 H new ATOM 377 N SER A 26 13.268 -8.030 -9.144 1.00 33.22 N ATOM 378 CA SER A 26 14.378 -8.959 -9.324 1.00 15.11 C ATOM 379 C SER A 26 14.447 -10.055 -8.243 1.00 74.53 C ATOM 380 O SER A 26 15.358 -10.890 -8.292 1.00 72.43 O ATOM 381 CB SER A 26 15.674 -8.136 -9.325 1.00 1.40 C ATOM 382 OG SER A 26 16.591 -8.620 -10.287 1.00 62.11 O ATOM 0 H SER A 26 13.580 -7.114 -8.822 1.00 33.22 H new ATOM 0 HA SER A 26 14.232 -9.487 -10.266 1.00 15.11 H new ATOM 0 HB2 SER A 26 15.443 -7.091 -9.533 1.00 1.40 H new ATOM 0 HB3 SER A 26 16.130 -8.171 -8.336 1.00 1.40 H new ATOM 0 HG SER A 26 17.406 -8.076 -10.265 1.00 62.11 H new ATOM 387 N GLU A 27 13.537 -10.060 -7.265 1.00 14.44 N ATOM 388 CA GLU A 27 13.575 -10.914 -6.086 1.00 63.44 C ATOM 389 C GLU A 27 12.324 -11.792 -5.956 1.00 64.51 C ATOM 390 O GLU A 27 12.326 -12.691 -5.107 1.00 52.32 O ATOM 391 CB GLU A 27 13.731 -10.048 -4.827 1.00 33.52 C ATOM 392 CG GLU A 27 15.055 -9.279 -4.748 1.00 62.31 C ATOM 393 CD GLU A 27 15.081 -8.405 -3.489 1.00 64.35 C ATOM 394 OE1 GLU A 27 15.349 -8.987 -2.407 1.00 44.33 O ATOM 395 OE2 GLU A 27 14.824 -7.184 -3.599 1.00 41.03 O ATOM 0 H GLU A 27 12.724 -9.444 -7.278 1.00 14.44 H new ATOM 0 HA GLU A 27 14.430 -11.581 -6.196 1.00 63.44 H new ATOM 0 HB2 GLU A 27 12.908 -9.335 -4.787 1.00 33.52 H new ATOM 0 HB3 GLU A 27 13.643 -10.687 -3.948 1.00 33.52 H new ATOM 0 HG2 GLU A 27 15.891 -9.979 -4.732 1.00 62.31 H new ATOM 0 HG3 GLU A 27 15.177 -8.657 -5.635 1.00 62.31 H new ATOM 400 N ILE A 28 11.276 -11.570 -6.762 1.00 3.25 N ATOM 401 CA ILE A 28 9.978 -12.232 -6.620 1.00 3.30 C ATOM 402 C ILE A 28 9.598 -12.924 -7.924 1.00 44.22 C ATOM 403 O ILE A 28 9.789 -12.379 -9.020 1.00 65.32 O ATOM 404 CB ILE A 28 8.885 -11.234 -6.177 1.00 32.14 C ATOM 405 CG1 ILE A 28 9.227 -10.622 -4.798 1.00 42.41 C ATOM 406 CG2 ILE A 28 7.520 -11.939 -6.119 1.00 51.02 C ATOM 407 CD1 ILE A 28 8.148 -9.688 -4.238 1.00 13.44 C ATOM 0 H ILE A 28 11.310 -10.914 -7.543 1.00 3.25 H new ATOM 0 HA ILE A 28 10.060 -12.988 -5.839 1.00 3.30 H new ATOM 0 HB ILE A 28 8.839 -10.427 -6.908 1.00 32.14 H new ATOM 0 HG12 ILE A 28 9.396 -11.430 -4.087 1.00 42.41 H new ATOM 0 HG13 ILE A 28 10.163 -10.069 -4.881 1.00 42.41 H new ATOM 0 HG21 ILE A 28 6.756 -11.227 -5.806 1.00 51.02 H new ATOM 0 HG22 ILE A 28 7.270 -12.329 -7.106 1.00 51.02 H new ATOM 0 HG23 ILE A 28 7.565 -12.761 -5.404 1.00 51.02 H new ATOM 0 HD11 ILE A 28 8.467 -9.303 -3.270 1.00 13.44 H new ATOM 0 HD12 ILE A 28 7.993 -8.857 -4.926 1.00 13.44 H new ATOM 0 HD13 ILE A 28 7.215 -10.239 -4.120 1.00 13.44 H new ATOM 418 N LYS A 29 8.989 -14.106 -7.788 1.00 23.10 N ATOM 419 CA LYS A 29 8.451 -14.862 -8.904 1.00 21.31 C ATOM 420 C LYS A 29 7.306 -14.104 -9.553 1.00 13.00 C ATOM 421 O LYS A 29 6.375 -13.673 -8.867 1.00 12.10 O ATOM 422 CB LYS A 29 7.969 -16.258 -8.459 1.00 31.51 C ATOM 423 CG LYS A 29 8.620 -17.328 -9.343 1.00 31.30 C ATOM 424 CD LYS A 29 10.047 -17.597 -8.850 1.00 32.14 C ATOM 425 CE LYS A 29 10.971 -18.101 -9.949 1.00 11.23 C ATOM 426 NZ LYS A 29 12.366 -18.167 -9.482 1.00 14.45 N ATOM 0 H LYS A 29 8.858 -14.563 -6.886 1.00 23.10 H new ATOM 0 HA LYS A 29 9.253 -14.994 -9.630 1.00 21.31 H new ATOM 0 HB2 LYS A 29 8.227 -16.428 -7.414 1.00 31.51 H new ATOM 0 HB3 LYS A 29 6.883 -16.321 -8.533 1.00 31.51 H new ATOM 0 HG2 LYS A 29 8.034 -18.246 -9.313 1.00 31.30 H new ATOM 0 HG3 LYS A 29 8.639 -16.996 -10.381 1.00 31.30 H new ATOM 0 HD2 LYS A 29 10.459 -16.680 -8.429 1.00 32.14 H new ATOM 0 HD3 LYS A 29 10.015 -18.331 -8.045 1.00 32.14 H new ATOM 0 HE2 LYS A 29 10.647 -19.089 -10.276 1.00 11.23 H new ATOM 0 HE3 LYS A 29 10.905 -17.441 -10.814 1.00 11.23 H new ATOM 0 HZ1 LYS A 29 12.974 -18.514 -10.252 1.00 14.45 H new ATOM 0 HZ2 LYS A 29 12.681 -17.219 -9.193 1.00 14.45 H new ATOM 0 HZ3 LYS A 29 12.430 -18.815 -8.671 1.00 14.45 H new ATOM 436 N ASP A 30 7.385 -14.008 -10.877 1.00 54.13 N ATOM 437 CA ASP A 30 6.363 -13.446 -11.749 1.00 3.14 C ATOM 438 C ASP A 30 5.839 -12.108 -11.231 1.00 13.00 C ATOM 439 O ASP A 30 4.631 -11.860 -11.177 1.00 11.12 O ATOM 440 CB ASP A 30 5.268 -14.489 -12.014 1.00 22.33 C ATOM 441 CG ASP A 30 4.478 -14.151 -13.279 1.00 45.03 C ATOM 442 OD1 ASP A 30 5.087 -13.626 -14.238 1.00 53.12 O ATOM 443 OD2 ASP A 30 3.327 -14.623 -13.403 1.00 12.21 O ATOM 0 H ASP A 30 8.202 -14.335 -11.393 1.00 54.13 H new ATOM 0 HA ASP A 30 6.810 -13.207 -12.714 1.00 3.14 H new ATOM 0 HB2 ASP A 30 5.719 -15.476 -12.116 1.00 22.33 H new ATOM 0 HB3 ASP A 30 4.591 -14.535 -11.161 1.00 22.33 H new ATOM 447 N SER A 31 6.759 -11.258 -10.759 1.00 12.11 N ATOM 448 CA SER A 31 6.411 -9.910 -10.376 1.00 72.43 C ATOM 449 C SER A 31 6.353 -8.988 -11.588 1.00 63.24 C ATOM 450 O SER A 31 7.124 -9.129 -12.540 1.00 0.55 O ATOM 451 CB SER A 31 7.366 -9.398 -9.303 1.00 25.25 C ATOM 452 OG SER A 31 8.722 -9.508 -9.671 1.00 55.21 O ATOM 0 H SER A 31 7.745 -11.492 -10.638 1.00 12.11 H new ATOM 0 HA SER A 31 5.410 -9.919 -9.945 1.00 72.43 H new ATOM 0 HB2 SER A 31 7.137 -8.354 -9.090 1.00 25.25 H new ATOM 0 HB3 SER A 31 7.200 -9.955 -8.381 1.00 25.25 H new ATOM 0 HG SER A 31 9.050 -10.404 -9.447 1.00 55.21 H new ATOM 457 N GLU A 32 5.486 -7.986 -11.497 1.00 41.03 N ATOM 458 CA GLU A 32 5.356 -6.896 -12.445 1.00 1.34 C ATOM 459 C GLU A 32 5.345 -5.576 -11.690 1.00 24.12 C ATOM 460 O GLU A 32 5.018 -5.516 -10.502 1.00 23.44 O ATOM 461 CB GLU A 32 4.057 -7.058 -13.246 1.00 51.24 C ATOM 462 CG GLU A 32 4.203 -7.992 -14.454 1.00 13.14 C ATOM 463 CD GLU A 32 2.858 -8.294 -15.116 1.00 45.52 C ATOM 464 OE1 GLU A 32 1.938 -7.444 -15.044 1.00 0.44 O ATOM 465 OE2 GLU A 32 2.703 -9.357 -15.760 1.00 42.05 O ATOM 0 H GLU A 32 4.826 -7.912 -10.723 1.00 41.03 H new ATOM 0 HA GLU A 32 6.198 -6.908 -13.137 1.00 1.34 H new ATOM 0 HB2 GLU A 32 3.278 -7.445 -12.588 1.00 51.24 H new ATOM 0 HB3 GLU A 32 3.726 -6.078 -13.591 1.00 51.24 H new ATOM 0 HG2 GLU A 32 4.872 -7.537 -15.185 1.00 13.14 H new ATOM 0 HG3 GLU A 32 4.667 -8.925 -14.136 1.00 13.14 H new ATOM 470 N LEU A 33 5.702 -4.519 -12.410 1.00 12.01 N ATOM 471 CA LEU A 33 6.120 -3.234 -11.866 1.00 5.42 C ATOM 472 C LEU A 33 5.364 -2.114 -12.579 1.00 14.24 C ATOM 473 O LEU A 33 5.451 -2.009 -13.809 1.00 32.54 O ATOM 474 CB LEU A 33 7.654 -3.119 -12.049 1.00 64.41 C ATOM 475 CG LEU A 33 8.375 -2.984 -10.722 1.00 64.12 C ATOM 476 CD1 LEU A 33 8.151 -4.276 -9.970 1.00 45.04 C ATOM 477 CD2 LEU A 33 9.862 -2.684 -10.937 1.00 14.44 C ATOM 0 H LEU A 33 5.708 -4.535 -13.430 1.00 12.01 H new ATOM 0 HA LEU A 33 5.889 -3.151 -10.804 1.00 5.42 H new ATOM 0 HB2 LEU A 33 8.024 -3.999 -12.575 1.00 64.41 H new ATOM 0 HB3 LEU A 33 7.881 -2.256 -12.675 1.00 64.41 H new ATOM 0 HG LEU A 33 7.987 -2.147 -10.142 1.00 64.12 H new ATOM 0 HD11 LEU A 33 8.653 -4.226 -9.004 1.00 45.04 H new ATOM 0 HD12 LEU A 33 7.083 -4.427 -9.816 1.00 45.04 H new ATOM 0 HD13 LEU A 33 8.555 -5.108 -10.547 1.00 45.04 H new ATOM 0 HD21 LEU A 33 10.358 -2.592 -9.971 1.00 14.44 H new ATOM 0 HD22 LEU A 33 10.319 -3.496 -11.503 1.00 14.44 H new ATOM 0 HD23 LEU A 33 9.969 -1.751 -11.490 1.00 14.44 H new ATOM 488 N LYS A 34 4.582 -1.317 -11.843 1.00 60.35 N ATOM 489 CA LYS A 34 3.627 -0.357 -12.404 1.00 43.32 C ATOM 490 C LYS A 34 3.701 0.969 -11.636 1.00 14.04 C ATOM 491 O LYS A 34 3.902 0.978 -10.418 1.00 41.54 O ATOM 492 CB LYS A 34 2.210 -0.960 -12.338 1.00 2.52 C ATOM 493 CG LYS A 34 1.643 -1.571 -13.624 1.00 43.02 C ATOM 494 CD LYS A 34 2.311 -2.853 -14.139 1.00 11.21 C ATOM 495 CE LYS A 34 1.241 -3.634 -14.917 1.00 44.11 C ATOM 496 NZ LYS A 34 1.773 -4.827 -15.599 1.00 74.44 N ATOM 0 H LYS A 34 4.596 -1.322 -10.823 1.00 60.35 H new ATOM 0 HA LYS A 34 3.874 -0.152 -13.446 1.00 43.32 H new ATOM 0 HB2 LYS A 34 2.208 -1.732 -11.569 1.00 2.52 H new ATOM 0 HB3 LYS A 34 1.526 -0.178 -12.007 1.00 2.52 H new ATOM 0 HG2 LYS A 34 0.586 -1.781 -13.462 1.00 43.02 H new ATOM 0 HG3 LYS A 34 1.701 -0.819 -14.411 1.00 43.02 H new ATOM 0 HD2 LYS A 34 3.159 -2.615 -14.782 1.00 11.21 H new ATOM 0 HD3 LYS A 34 2.696 -3.447 -13.310 1.00 11.21 H new ATOM 0 HE2 LYS A 34 0.451 -3.938 -14.230 1.00 44.11 H new ATOM 0 HE3 LYS A 34 0.785 -2.975 -15.655 1.00 44.11 H new ATOM 0 HZ1 LYS A 34 1.216 -5.013 -16.458 1.00 74.44 H new ATOM 0 HZ2 LYS A 34 2.767 -4.664 -15.859 1.00 74.44 H new ATOM 0 HZ3 LYS A 34 1.712 -5.647 -14.962 1.00 74.44 H new ATOM 506 N GLU A 35 3.513 2.083 -12.346 1.00 41.55 N ATOM 507 CA GLU A 35 3.665 3.453 -11.848 1.00 43.31 C ATOM 508 C GLU A 35 2.281 4.023 -11.526 1.00 15.43 C ATOM 509 O GLU A 35 1.437 4.192 -12.413 1.00 52.24 O ATOM 510 CB GLU A 35 4.378 4.317 -12.909 1.00 71.53 C ATOM 511 CG GLU A 35 5.893 4.072 -12.899 1.00 63.34 C ATOM 512 CD GLU A 35 6.587 4.416 -14.214 1.00 51.23 C ATOM 513 OE1 GLU A 35 6.590 3.523 -15.094 1.00 60.52 O ATOM 514 OE2 GLU A 35 7.148 5.523 -14.355 1.00 43.43 O ATOM 0 H GLU A 35 3.238 2.054 -13.328 1.00 41.55 H new ATOM 0 HA GLU A 35 4.270 3.456 -10.941 1.00 43.31 H new ATOM 0 HB2 GLU A 35 3.977 4.089 -13.897 1.00 71.53 H new ATOM 0 HB3 GLU A 35 4.176 5.371 -12.719 1.00 71.53 H new ATOM 0 HG2 GLU A 35 6.341 4.662 -12.099 1.00 63.34 H new ATOM 0 HG3 GLU A 35 6.079 3.024 -12.665 1.00 63.34 H new ATOM 519 N VAL A 36 2.017 4.306 -10.254 1.00 11.30 N ATOM 520 CA VAL A 36 0.802 4.985 -9.813 1.00 74.24 C ATOM 521 C VAL A 36 1.066 6.504 -9.872 1.00 32.23 C ATOM 522 O VAL A 36 2.197 6.956 -9.661 1.00 40.31 O ATOM 523 CB VAL A 36 0.404 4.498 -8.408 1.00 2.41 C ATOM 524 CG1 VAL A 36 -0.866 5.185 -7.917 1.00 43.25 C ATOM 525 CG2 VAL A 36 0.147 2.991 -8.396 1.00 21.23 C ATOM 0 H VAL A 36 2.649 4.067 -9.490 1.00 11.30 H new ATOM 0 HA VAL A 36 -0.043 4.755 -10.462 1.00 74.24 H new ATOM 0 HB VAL A 36 1.239 4.744 -7.752 1.00 2.41 H new ATOM 0 HG11 VAL A 36 -1.117 4.817 -6.922 1.00 43.25 H new ATOM 0 HG12 VAL A 36 -0.704 6.262 -7.875 1.00 43.25 H new ATOM 0 HG13 VAL A 36 -1.685 4.967 -8.602 1.00 43.25 H new ATOM 0 HG21 VAL A 36 -0.132 2.677 -7.390 1.00 21.23 H new ATOM 0 HG22 VAL A 36 -0.662 2.754 -9.087 1.00 21.23 H new ATOM 0 HG23 VAL A 36 1.051 2.465 -8.702 1.00 21.23 H new ATOM 535 N LYS A 37 0.025 7.299 -10.122 1.00 64.13 N ATOM 536 CA LYS A 37 0.016 8.761 -10.178 1.00 14.31 C ATOM 537 C LYS A 37 -1.152 9.258 -9.315 1.00 1.24 C ATOM 538 O LYS A 37 -1.899 8.446 -8.760 1.00 72.44 O ATOM 539 CB LYS A 37 -0.116 9.219 -11.647 1.00 25.31 C ATOM 540 CG LYS A 37 1.167 9.029 -12.482 1.00 2.41 C ATOM 541 CD LYS A 37 0.944 9.367 -13.967 1.00 43.51 C ATOM 542 CE LYS A 37 0.697 10.865 -14.205 1.00 35.45 C ATOM 543 NZ LYS A 37 0.164 11.157 -15.555 1.00 11.15 N ATOM 0 H LYS A 37 -0.900 6.910 -10.304 1.00 64.13 H new ATOM 0 HA LYS A 37 0.945 9.180 -9.790 1.00 14.31 H new ATOM 0 HB2 LYS A 37 -0.929 8.665 -12.118 1.00 25.31 H new ATOM 0 HB3 LYS A 37 -0.396 10.272 -11.665 1.00 25.31 H new ATOM 0 HG2 LYS A 37 1.958 9.663 -12.081 1.00 2.41 H new ATOM 0 HG3 LYS A 37 1.509 7.998 -12.392 1.00 2.41 H new ATOM 0 HD2 LYS A 37 1.815 9.051 -14.542 1.00 43.51 H new ATOM 0 HD3 LYS A 37 0.092 8.799 -14.340 1.00 43.51 H new ATOM 0 HE2 LYS A 37 -0.003 11.235 -13.456 1.00 35.45 H new ATOM 0 HE3 LYS A 37 1.631 11.408 -14.064 1.00 35.45 H new ATOM 0 HZ1 LYS A 37 0.018 12.182 -15.656 1.00 11.15 H new ATOM 0 HZ2 LYS A 37 0.841 10.831 -16.274 1.00 11.15 H new ATOM 0 HZ3 LYS A 37 -0.742 10.664 -15.685 1.00 11.15 H new ATOM 553 N VAL A 38 -1.338 10.572 -9.187 1.00 14.02 N ATOM 554 CA VAL A 38 -2.479 11.153 -8.477 1.00 54.04 C ATOM 555 C VAL A 38 -3.363 11.899 -9.479 1.00 2.03 C ATOM 556 O VAL A 38 -2.851 12.515 -10.415 1.00 63.14 O ATOM 557 CB VAL A 38 -2.030 11.999 -7.261 1.00 63.43 C ATOM 558 CG1 VAL A 38 -1.499 11.079 -6.149 1.00 20.11 C ATOM 559 CG2 VAL A 38 -0.965 13.058 -7.572 1.00 14.54 C ATOM 0 H VAL A 38 -0.699 11.267 -9.574 1.00 14.02 H new ATOM 0 HA VAL A 38 -3.089 10.363 -8.038 1.00 54.04 H new ATOM 0 HB VAL A 38 -2.922 12.540 -6.945 1.00 63.43 H new ATOM 0 HG11 VAL A 38 -1.185 11.682 -5.297 1.00 20.11 H new ATOM 0 HG12 VAL A 38 -2.287 10.393 -5.838 1.00 20.11 H new ATOM 0 HG13 VAL A 38 -0.648 10.509 -6.523 1.00 20.11 H new ATOM 0 HG21 VAL A 38 -0.714 13.600 -6.660 1.00 14.54 H new ATOM 0 HG22 VAL A 38 -0.071 12.571 -7.963 1.00 14.54 H new ATOM 0 HG23 VAL A 38 -1.352 13.756 -8.314 1.00 14.54 H new ATOM 569 N SER A 39 -4.686 11.846 -9.294 1.00 42.45 N ATOM 570 CA SER A 39 -5.630 12.668 -10.042 1.00 12.21 C ATOM 571 C SER A 39 -5.358 14.151 -9.763 1.00 33.30 C ATOM 572 O SER A 39 -4.625 14.515 -8.837 1.00 72.44 O ATOM 573 CB SER A 39 -7.061 12.304 -9.608 1.00 33.33 C ATOM 574 OG SER A 39 -7.920 11.970 -10.679 1.00 44.53 O ATOM 0 H SER A 39 -5.130 11.227 -8.616 1.00 42.45 H new ATOM 0 HA SER A 39 -5.515 12.485 -11.110 1.00 12.21 H new ATOM 0 HB2 SER A 39 -7.017 11.463 -8.916 1.00 33.33 H new ATOM 0 HB3 SER A 39 -7.489 13.145 -9.062 1.00 33.33 H new ATOM 0 HG SER A 39 -8.808 11.749 -10.329 1.00 44.53 H new ATOM 579 N GLU A 40 -5.974 15.019 -10.548 1.00 2.00 N ATOM 580 CA GLU A 40 -6.089 16.449 -10.343 1.00 40.32 C ATOM 581 C GLU A 40 -7.526 16.835 -10.714 1.00 12.40 C ATOM 582 O GLU A 40 -8.205 16.099 -11.433 1.00 44.45 O ATOM 583 CB GLU A 40 -4.992 17.181 -11.145 1.00 4.02 C ATOM 584 CG GLU A 40 -4.888 16.837 -12.648 1.00 52.44 C ATOM 585 CD GLU A 40 -3.452 16.824 -13.204 1.00 65.44 C ATOM 586 OE1 GLU A 40 -2.641 17.730 -12.904 1.00 13.41 O ATOM 587 OE2 GLU A 40 -3.121 15.907 -13.999 1.00 52.15 O ATOM 0 H GLU A 40 -6.439 14.719 -11.405 1.00 2.00 H new ATOM 0 HA GLU A 40 -5.921 16.748 -9.308 1.00 40.32 H new ATOM 0 HB2 GLU A 40 -5.160 18.254 -11.052 1.00 4.02 H new ATOM 0 HB3 GLU A 40 -4.030 16.968 -10.679 1.00 4.02 H new ATOM 0 HG2 GLU A 40 -5.337 15.858 -12.815 1.00 52.44 H new ATOM 0 HG3 GLU A 40 -5.476 17.559 -13.214 1.00 52.44 H new ATOM 592 N GLY A 41 -8.018 17.953 -10.184 1.00 52.14 N ATOM 593 CA GLY A 41 -9.318 18.516 -10.538 1.00 41.05 C ATOM 594 C GLY A 41 -9.174 19.647 -11.550 1.00 22.23 C ATOM 595 O GLY A 41 -10.114 19.941 -12.285 1.00 54.14 O ATOM 0 H GLY A 41 -7.516 18.501 -9.486 1.00 52.14 H new ATOM 0 HA2 GLY A 41 -9.955 17.734 -10.951 1.00 41.05 H new ATOM 0 HA3 GLY A 41 -9.812 18.889 -9.641 1.00 41.05 H new ATOM 599 N THR A 42 -7.995 20.267 -11.593 1.00 2.23 N ATOM 600 CA THR A 42 -7.551 21.255 -12.557 1.00 12.30 C ATOM 601 C THR A 42 -6.024 21.336 -12.419 1.00 43.34 C ATOM 602 O THR A 42 -5.463 20.832 -11.434 1.00 55.34 O ATOM 603 CB THR A 42 -8.250 22.598 -12.261 1.00 21.52 C ATOM 604 OG1 THR A 42 -8.075 23.499 -13.329 1.00 2.25 O ATOM 605 CG2 THR A 42 -7.772 23.291 -10.976 1.00 0.35 C ATOM 0 H THR A 42 -7.275 20.071 -10.898 1.00 2.23 H new ATOM 0 HA THR A 42 -7.806 20.993 -13.584 1.00 12.30 H new ATOM 0 HB THR A 42 -9.300 22.338 -12.127 1.00 21.52 H new ATOM 0 HG1 THR A 42 -8.527 24.343 -13.122 1.00 2.25 H new ATOM 0 HG21 THR A 42 -8.314 24.227 -10.844 1.00 0.35 H new ATOM 0 HG22 THR A 42 -7.958 22.641 -10.121 1.00 0.35 H new ATOM 0 HG23 THR A 42 -6.704 23.498 -11.050 1.00 0.35 H new ATOM 613 N PHE A 43 -5.354 22.006 -13.352 1.00 61.12 N ATOM 614 CA PHE A 43 -3.980 22.480 -13.243 1.00 20.23 C ATOM 615 C PHE A 43 -3.763 23.553 -14.310 1.00 52.23 C ATOM 616 O PHE A 43 -4.643 23.767 -15.152 1.00 5.32 O ATOM 617 CB PHE A 43 -2.986 21.321 -13.431 1.00 5.05 C ATOM 618 CG PHE A 43 -3.055 20.629 -14.781 1.00 72.42 C ATOM 619 CD1 PHE A 43 -3.983 19.598 -14.996 1.00 0.21 C ATOM 620 CD2 PHE A 43 -2.205 21.020 -15.830 1.00 43.31 C ATOM 621 CE1 PHE A 43 -4.056 18.957 -16.244 1.00 15.02 C ATOM 622 CE2 PHE A 43 -2.275 20.388 -17.081 1.00 24.20 C ATOM 623 CZ PHE A 43 -3.200 19.353 -17.287 1.00 54.14 C ATOM 0 H PHE A 43 -5.777 22.244 -14.249 1.00 61.12 H new ATOM 0 HA PHE A 43 -3.809 22.898 -12.251 1.00 20.23 H new ATOM 0 HB2 PHE A 43 -1.975 21.702 -13.286 1.00 5.05 H new ATOM 0 HB3 PHE A 43 -3.162 20.581 -12.651 1.00 5.05 H new ATOM 0 HD1 PHE A 43 -4.645 19.296 -14.198 1.00 0.21 H new ATOM 0 HD2 PHE A 43 -1.491 21.815 -15.672 1.00 43.31 H new ATOM 0 HE1 PHE A 43 -4.769 18.161 -16.402 1.00 15.02 H new ATOM 0 HE2 PHE A 43 -1.620 20.697 -17.882 1.00 24.20 H new ATOM 0 HZ PHE A 43 -3.254 18.861 -18.247 1.00 54.14 H new ATOM 632 N ASP A 44 -2.581 24.173 -14.328 1.00 11.10 N ATOM 633 CA ASP A 44 -2.051 24.760 -15.559 1.00 2.20 C ATOM 634 C ASP A 44 -0.538 24.554 -15.649 1.00 12.25 C ATOM 635 O ASP A 44 -0.091 23.719 -16.437 1.00 11.04 O ATOM 636 CB ASP A 44 -2.464 26.226 -15.715 1.00 1.34 C ATOM 637 CG ASP A 44 -1.960 26.808 -17.038 1.00 54.31 C ATOM 638 OD1 ASP A 44 -1.996 26.119 -18.083 1.00 34.24 O ATOM 639 OD2 ASP A 44 -1.523 27.979 -17.011 1.00 0.24 O ATOM 0 H ASP A 44 -1.978 24.281 -13.512 1.00 11.10 H new ATOM 0 HA ASP A 44 -2.495 24.236 -16.405 1.00 2.20 H new ATOM 0 HB2 ASP A 44 -3.550 26.307 -15.670 1.00 1.34 H new ATOM 0 HB3 ASP A 44 -2.066 26.809 -14.884 1.00 1.34 H new ATOM 643 N ALA A 45 0.266 25.221 -14.815 1.00 33.44 N ATOM 644 CA ALA A 45 1.727 25.117 -14.848 1.00 21.41 C ATOM 645 C ALA A 45 2.264 25.081 -13.416 1.00 41.34 C ATOM 646 O ALA A 45 2.911 26.032 -12.970 1.00 72.42 O ATOM 647 CB ALA A 45 2.301 26.281 -15.663 1.00 13.50 C ATOM 0 H ALA A 45 -0.082 25.852 -14.093 1.00 33.44 H new ATOM 0 HA ALA A 45 2.038 24.193 -15.336 1.00 21.41 H new ATOM 0 HB1 ALA A 45 3.388 26.206 -15.689 1.00 13.50 H new ATOM 0 HB2 ALA A 45 1.910 26.241 -16.680 1.00 13.50 H new ATOM 0 HB3 ALA A 45 2.014 27.225 -15.201 1.00 13.50 H new ATOM 653 N ASP A 46 1.955 24.007 -12.684 1.00 64.23 N ATOM 654 CA ASP A 46 1.944 24.029 -11.216 1.00 20.45 C ATOM 655 C ASP A 46 3.016 23.133 -10.585 1.00 4.04 C ATOM 656 O ASP A 46 3.532 23.470 -9.522 1.00 74.11 O ATOM 657 CB ASP A 46 0.549 23.632 -10.694 1.00 11.44 C ATOM 658 CG ASP A 46 -0.593 24.537 -11.174 1.00 11.24 C ATOM 659 OD1 ASP A 46 -0.431 25.779 -11.238 1.00 23.22 O ATOM 660 OD2 ASP A 46 -1.680 24.000 -11.488 1.00 15.12 O ATOM 0 H ASP A 46 1.707 23.103 -13.087 1.00 64.23 H new ATOM 0 HA ASP A 46 2.180 25.051 -10.918 1.00 20.45 H new ATOM 0 HB2 ASP A 46 0.338 22.608 -11.002 1.00 11.44 H new ATOM 0 HB3 ASP A 46 0.568 23.639 -9.604 1.00 11.44 H new ATOM 664 N MET A 47 3.353 22.007 -11.225 1.00 13.44 N ATOM 665 CA MET A 47 4.211 20.927 -10.723 1.00 52.33 C ATOM 666 C MET A 47 3.901 20.521 -9.272 1.00 13.34 C ATOM 667 O MET A 47 4.664 20.813 -8.349 1.00 65.25 O ATOM 668 CB MET A 47 5.701 21.151 -11.028 1.00 22.51 C ATOM 669 CG MET A 47 6.463 19.819 -10.871 1.00 15.01 C ATOM 670 SD MET A 47 8.211 19.781 -11.364 1.00 35.23 S ATOM 671 CE MET A 47 8.084 20.165 -13.132 1.00 32.45 C ATOM 0 H MET A 47 3.012 21.814 -12.167 1.00 13.44 H new ATOM 0 HA MET A 47 3.948 20.041 -11.301 1.00 52.33 H new ATOM 0 HB2 MET A 47 5.822 21.535 -12.041 1.00 22.51 H new ATOM 0 HB3 MET A 47 6.113 21.900 -10.352 1.00 22.51 H new ATOM 0 HG2 MET A 47 6.403 19.520 -9.824 1.00 15.01 H new ATOM 0 HG3 MET A 47 5.935 19.061 -11.449 1.00 15.01 H new ATOM 0 HE1 MET A 47 9.051 20.004 -13.610 1.00 32.45 H new ATOM 0 HE2 MET A 47 7.339 19.516 -13.593 1.00 32.45 H new ATOM 0 HE3 MET A 47 7.786 21.206 -13.258 1.00 32.45 H new ATOM 679 N TYR A 48 2.809 19.764 -9.120 1.00 42.42 N ATOM 680 CA TYR A 48 2.293 19.117 -7.910 1.00 20.10 C ATOM 681 C TYR A 48 1.813 20.110 -6.850 1.00 51.23 C ATOM 682 O TYR A 48 2.476 21.096 -6.539 1.00 32.10 O ATOM 683 CB TYR A 48 3.322 18.155 -7.298 1.00 31.32 C ATOM 684 CG TYR A 48 3.845 17.082 -8.231 1.00 15.04 C ATOM 685 CD1 TYR A 48 2.969 16.096 -8.719 1.00 34.53 C ATOM 686 CD2 TYR A 48 5.206 17.059 -8.598 1.00 31.13 C ATOM 687 CE1 TYR A 48 3.450 15.098 -9.579 1.00 40.03 C ATOM 688 CE2 TYR A 48 5.692 16.055 -9.458 1.00 14.14 C ATOM 689 CZ TYR A 48 4.805 15.073 -9.954 1.00 52.12 C ATOM 690 OH TYR A 48 5.225 14.072 -10.770 1.00 40.34 O ATOM 0 H TYR A 48 2.206 19.571 -9.920 1.00 42.42 H new ATOM 0 HA TYR A 48 1.423 18.547 -8.237 1.00 20.10 H new ATOM 0 HB2 TYR A 48 4.167 18.739 -6.933 1.00 31.32 H new ATOM 0 HB3 TYR A 48 2.871 17.671 -6.432 1.00 31.32 H new ATOM 0 HD1 TYR A 48 1.928 16.107 -8.432 1.00 34.53 H new ATOM 0 HD2 TYR A 48 5.878 17.814 -8.218 1.00 31.13 H new ATOM 0 HE1 TYR A 48 2.775 14.344 -9.956 1.00 40.03 H new ATOM 0 HE2 TYR A 48 6.735 16.036 -9.736 1.00 14.14 H new ATOM 0 HH TYR A 48 6.183 14.177 -10.950 1.00 40.34 H new ATOM 699 N LYS A 49 0.669 19.817 -6.226 1.00 62.24 N ATOM 700 CA LYS A 49 0.048 20.682 -5.217 1.00 33.33 C ATOM 701 C LYS A 49 -0.493 19.844 -4.057 1.00 61.31 C ATOM 702 O LYS A 49 -1.611 20.052 -3.574 1.00 51.13 O ATOM 703 CB LYS A 49 -0.959 21.658 -5.867 1.00 72.22 C ATOM 704 CG LYS A 49 -1.893 21.067 -6.937 1.00 62.41 C ATOM 705 CD LYS A 49 -1.386 21.302 -8.374 1.00 63.11 C ATOM 706 CE LYS A 49 -2.203 20.562 -9.445 1.00 74.13 C ATOM 707 NZ LYS A 49 -3.648 20.851 -9.359 1.00 72.23 N ATOM 0 H LYS A 49 0.141 18.963 -6.409 1.00 62.24 H new ATOM 0 HA LYS A 49 0.797 21.333 -4.766 1.00 33.33 H new ATOM 0 HB2 LYS A 49 -1.574 22.090 -5.078 1.00 72.22 H new ATOM 0 HB3 LYS A 49 -0.398 22.477 -6.318 1.00 72.22 H new ATOM 0 HG2 LYS A 49 -2.001 19.996 -6.766 1.00 62.41 H new ATOM 0 HG3 LYS A 49 -2.884 21.508 -6.830 1.00 62.41 H new ATOM 0 HD2 LYS A 49 -1.407 22.371 -8.587 1.00 63.11 H new ATOM 0 HD3 LYS A 49 -0.345 20.984 -8.439 1.00 63.11 H new ATOM 0 HE2 LYS A 49 -1.838 20.843 -10.433 1.00 74.13 H new ATOM 0 HE3 LYS A 49 -2.044 19.489 -9.340 1.00 74.13 H new ATOM 0 HZ1 LYS A 49 -4.075 20.769 -10.304 1.00 72.23 H new ATOM 0 HZ2 LYS A 49 -4.100 20.172 -8.714 1.00 72.23 H new ATOM 0 HZ3 LYS A 49 -3.788 21.816 -8.999 1.00 72.23 H new ATOM 717 N THR A 50 0.285 18.837 -3.654 1.00 14.30 N ATOM 718 CA THR A 50 -0.079 17.822 -2.669 1.00 44.41 C ATOM 719 C THR A 50 1.196 17.304 -1.984 1.00 25.52 C ATOM 720 O THR A 50 1.289 17.204 -0.765 1.00 72.53 O ATOM 721 CB THR A 50 -0.826 16.685 -3.409 1.00 1.44 C ATOM 722 OG1 THR A 50 -1.892 17.182 -4.198 1.00 32.43 O ATOM 723 CG2 THR A 50 -1.373 15.593 -2.487 1.00 60.35 C ATOM 0 H THR A 50 1.227 18.703 -4.023 1.00 14.30 H new ATOM 0 HA THR A 50 -0.730 18.233 -1.897 1.00 44.41 H new ATOM 0 HB THR A 50 -0.064 16.234 -4.044 1.00 1.44 H new ATOM 0 HG1 THR A 50 -2.339 16.437 -4.651 1.00 32.43 H new ATOM 0 HG21 THR A 50 -1.882 14.835 -3.083 1.00 60.35 H new ATOM 0 HG22 THR A 50 -0.550 15.133 -1.940 1.00 60.35 H new ATOM 0 HG23 THR A 50 -2.077 16.032 -1.781 1.00 60.35 H new ATOM 731 N SER A 51 2.207 16.946 -2.772 1.00 12.20 N ATOM 732 CA SER A 51 3.238 15.988 -2.406 1.00 3.25 C ATOM 733 C SER A 51 4.279 16.487 -1.389 1.00 13.41 C ATOM 734 O SER A 51 5.254 15.776 -1.137 1.00 43.23 O ATOM 735 CB SER A 51 3.945 15.606 -3.711 1.00 71.32 C ATOM 736 OG SER A 51 3.023 15.417 -4.777 1.00 12.33 O ATOM 0 H SER A 51 2.332 17.328 -3.710 1.00 12.20 H new ATOM 0 HA SER A 51 2.750 15.153 -1.903 1.00 3.25 H new ATOM 0 HB2 SER A 51 4.657 16.386 -3.980 1.00 71.32 H new ATOM 0 HB3 SER A 51 4.518 14.691 -3.559 1.00 71.32 H new ATOM 0 HG SER A 51 3.511 15.176 -5.592 1.00 12.33 H new ATOM 741 N ASP A 52 4.143 17.702 -0.850 1.00 0.44 N ATOM 742 CA ASP A 52 5.273 18.464 -0.317 1.00 35.14 C ATOM 743 C ASP A 52 5.233 18.721 1.193 1.00 11.11 C ATOM 744 O ASP A 52 6.307 18.829 1.792 1.00 24.14 O ATOM 745 CB ASP A 52 5.450 19.775 -1.096 1.00 75.51 C ATOM 746 CG ASP A 52 4.277 20.743 -0.952 1.00 60.23 C ATOM 747 OD1 ASP A 52 4.048 21.283 0.153 1.00 11.00 O ATOM 748 OD2 ASP A 52 3.612 21.022 -1.971 1.00 1.32 O ATOM 0 H ASP A 52 3.247 18.183 -0.771 1.00 0.44 H new ATOM 0 HA ASP A 52 6.144 17.825 -0.462 1.00 35.14 H new ATOM 0 HB2 ASP A 52 6.360 20.269 -0.755 1.00 75.51 H new ATOM 0 HB3 ASP A 52 5.590 19.543 -2.152 1.00 75.51 H new ATOM 752 N ILE A 53 4.072 18.769 1.854 1.00 24.41 N ATOM 753 CA ILE A 53 4.000 19.161 3.267 1.00 4.15 C ATOM 754 C ILE A 53 3.758 17.934 4.146 1.00 3.20 C ATOM 755 O ILE A 53 3.264 16.913 3.665 1.00 2.04 O ATOM 756 CB ILE A 53 3.009 20.329 3.463 1.00 14.30 C ATOM 757 CG1 ILE A 53 3.171 20.940 4.874 1.00 52.42 C ATOM 758 CG2 ILE A 53 1.552 19.921 3.186 1.00 24.14 C ATOM 759 CD1 ILE A 53 2.596 22.351 4.987 1.00 11.12 C ATOM 0 H ILE A 53 3.170 18.542 1.435 1.00 24.41 H new ATOM 0 HA ILE A 53 4.958 19.561 3.599 1.00 4.15 H new ATOM 0 HB ILE A 53 3.254 21.093 2.725 1.00 14.30 H new ATOM 0 HG12 ILE A 53 2.679 20.294 5.601 1.00 52.42 H new ATOM 0 HG13 ILE A 53 4.229 20.964 5.134 1.00 52.42 H new ATOM 0 HG21 ILE A 53 0.898 20.780 3.339 1.00 24.14 H new ATOM 0 HG22 ILE A 53 1.461 19.574 2.157 1.00 24.14 H new ATOM 0 HG23 ILE A 53 1.263 19.120 3.866 1.00 24.14 H new ATOM 0 HD11 ILE A 53 2.741 22.723 6.001 1.00 11.12 H new ATOM 0 HD12 ILE A 53 3.105 23.009 4.283 1.00 11.12 H new ATOM 0 HD13 ILE A 53 1.531 22.329 4.758 1.00 11.12 H new ATOM 770 N ALA A 54 4.159 18.011 5.417 1.00 34.21 N ATOM 771 CA ALA A 54 4.005 16.927 6.371 1.00 41.14 C ATOM 772 C ALA A 54 2.552 16.838 6.849 1.00 22.44 C ATOM 773 O ALA A 54 1.981 15.749 6.850 1.00 55.34 O ATOM 774 CB ALA A 54 5.001 17.108 7.524 1.00 15.13 C ATOM 0 H ALA A 54 4.604 18.840 5.810 1.00 34.21 H new ATOM 0 HA ALA A 54 4.233 15.975 5.891 1.00 41.14 H new ATOM 0 HB1 ALA A 54 4.883 16.293 8.238 1.00 15.13 H new ATOM 0 HB2 ALA A 54 6.018 17.102 7.131 1.00 15.13 H new ATOM 0 HB3 ALA A 54 4.811 18.058 8.023 1.00 15.13 H new ATOM 780 N LEU A 55 1.955 17.938 7.314 1.00 62.22 N ATOM 781 CA LEU A 55 0.571 17.980 7.756 1.00 40.22 C ATOM 782 C LEU A 55 -0.334 18.280 6.556 1.00 21.21 C ATOM 783 O LEU A 55 -0.989 19.321 6.539 1.00 54.22 O ATOM 784 CB LEU A 55 0.426 19.055 8.848 1.00 13.24 C ATOM 785 CG LEU A 55 1.079 18.783 10.210 1.00 11.00 C ATOM 786 CD1 LEU A 55 0.519 17.516 10.862 1.00 31.21 C ATOM 787 CD2 LEU A 55 2.607 18.744 10.227 1.00 53.42 C ATOM 0 H LEU A 55 2.433 18.836 7.393 1.00 62.22 H new ATOM 0 HA LEU A 55 0.274 17.019 8.175 1.00 40.22 H new ATOM 0 HB2 LEU A 55 0.838 19.986 8.459 1.00 13.24 H new ATOM 0 HB3 LEU A 55 -0.638 19.223 9.014 1.00 13.24 H new ATOM 0 HG LEU A 55 0.808 19.662 10.796 1.00 11.00 H new ATOM 0 HD11 LEU A 55 1.005 17.357 11.824 1.00 31.21 H new ATOM 0 HD12 LEU A 55 -0.555 17.628 11.012 1.00 31.21 H new ATOM 0 HD13 LEU A 55 0.707 16.660 10.214 1.00 31.21 H new ATOM 0 HD21 LEU A 55 2.955 18.545 11.241 1.00 53.42 H new ATOM 0 HD22 LEU A 55 2.958 17.956 9.561 1.00 53.42 H new ATOM 0 HD23 LEU A 55 2.999 19.704 9.891 1.00 53.42 H new ATOM 798 N ASP A 56 -0.353 17.418 5.536 1.00 53.41 N ATOM 799 CA ASP A 56 -1.212 17.632 4.366 1.00 45.03 C ATOM 800 C ASP A 56 -2.666 17.305 4.736 1.00 31.10 C ATOM 801 O ASP A 56 -3.373 18.204 5.195 1.00 72.13 O ATOM 802 CB ASP A 56 -0.679 16.889 3.133 1.00 1.12 C ATOM 803 CG ASP A 56 -1.458 17.211 1.850 1.00 33.24 C ATOM 804 OD1 ASP A 56 -2.336 18.105 1.852 1.00 11.21 O ATOM 805 OD2 ASP A 56 -1.225 16.516 0.842 1.00 0.24 O ATOM 0 H ASP A 56 0.212 16.570 5.495 1.00 53.41 H new ATOM 0 HA ASP A 56 -1.194 18.682 4.073 1.00 45.03 H new ATOM 0 HB2 ASP A 56 0.370 17.146 2.987 1.00 1.12 H new ATOM 0 HB3 ASP A 56 -0.722 15.815 3.317 1.00 1.12 H new ATOM 809 N GLN A 57 -3.111 16.040 4.668 1.00 32.34 N ATOM 810 CA GLN A 57 -4.487 15.656 5.002 1.00 72.22 C ATOM 811 C GLN A 57 -4.542 14.645 6.153 1.00 0.45 C ATOM 812 O GLN A 57 -4.905 13.476 6.005 1.00 0.51 O ATOM 813 CB GLN A 57 -5.309 15.296 3.756 1.00 20.41 C ATOM 814 CG GLN A 57 -4.783 14.163 2.867 1.00 42.55 C ATOM 815 CD GLN A 57 -3.893 14.664 1.734 1.00 14.50 C ATOM 816 OE1 GLN A 57 -4.343 15.329 0.805 1.00 15.02 O ATOM 817 NE2 GLN A 57 -2.610 14.366 1.765 1.00 41.01 N ATOM 0 H GLN A 57 -2.525 15.257 4.380 1.00 32.34 H new ATOM 0 HA GLN A 57 -4.996 16.533 5.402 1.00 72.22 H new ATOM 0 HB2 GLN A 57 -6.315 15.030 4.081 1.00 20.41 H new ATOM 0 HB3 GLN A 57 -5.399 16.192 3.142 1.00 20.41 H new ATOM 0 HG2 GLN A 57 -4.221 13.458 3.480 1.00 42.55 H new ATOM 0 HG3 GLN A 57 -5.627 13.617 2.445 1.00 42.55 H new ATOM 0 HE21 GLN A 57 -2.233 13.814 2.535 1.00 41.01 H new ATOM 0 HE22 GLN A 57 -1.994 14.688 1.019 1.00 41.01 H new ATOM 824 N ILE A 58 -4.192 15.122 7.345 1.00 24.55 N ATOM 825 CA ILE A 58 -4.233 14.360 8.587 1.00 0.10 C ATOM 826 C ILE A 58 -5.262 15.016 9.493 1.00 43.41 C ATOM 827 O ILE A 58 -6.303 14.417 9.768 1.00 45.02 O ATOM 828 CB ILE A 58 -2.815 14.249 9.192 1.00 74.12 C ATOM 829 CG1 ILE A 58 -1.964 13.282 8.331 1.00 73.42 C ATOM 830 CG2 ILE A 58 -2.827 13.766 10.654 1.00 2.54 C ATOM 831 CD1 ILE A 58 -1.056 14.041 7.361 1.00 40.34 C ATOM 0 H ILE A 58 -3.862 16.078 7.475 1.00 24.55 H new ATOM 0 HA ILE A 58 -4.547 13.328 8.429 1.00 0.10 H new ATOM 0 HB ILE A 58 -2.381 15.249 9.189 1.00 74.12 H new ATOM 0 HG12 ILE A 58 -1.357 12.653 8.982 1.00 73.42 H new ATOM 0 HG13 ILE A 58 -2.622 12.618 7.770 1.00 73.42 H new ATOM 0 HG21 ILE A 58 -1.804 13.707 11.026 1.00 2.54 H new ATOM 0 HG22 ILE A 58 -3.395 14.468 11.264 1.00 2.54 H new ATOM 0 HG23 ILE A 58 -3.290 12.781 10.708 1.00 2.54 H new ATOM 0 HD11 ILE A 58 -0.475 13.330 6.774 1.00 40.34 H new ATOM 0 HD12 ILE A 58 -1.665 14.650 6.693 1.00 40.34 H new ATOM 0 HD13 ILE A 58 -0.380 14.685 7.924 1.00 40.34 H new ATOM 842 N GLN A 59 -4.967 16.232 9.940 1.00 14.43 N ATOM 843 CA GLN A 59 -5.566 16.889 11.075 1.00 41.03 C ATOM 844 C GLN A 59 -6.090 18.228 10.600 1.00 21.41 C ATOM 845 O GLN A 59 -5.334 19.013 10.023 1.00 40.43 O ATOM 846 CB GLN A 59 -4.553 16.993 12.210 1.00 33.32 C ATOM 847 CG GLN A 59 -3.142 17.481 11.857 1.00 1.24 C ATOM 848 CD GLN A 59 -2.165 17.088 12.957 1.00 64.42 C ATOM 849 OE1 GLN A 59 -1.744 15.937 13.052 1.00 43.12 O ATOM 850 NE2 GLN A 59 -1.765 18.023 13.788 1.00 15.24 N ATOM 0 H GLN A 59 -4.261 16.812 9.487 1.00 14.43 H new ATOM 0 HA GLN A 59 -6.403 16.322 11.482 1.00 41.03 H new ATOM 0 HB2 GLN A 59 -4.962 17.664 12.965 1.00 33.32 H new ATOM 0 HB3 GLN A 59 -4.463 16.010 12.672 1.00 33.32 H new ATOM 0 HG2 GLN A 59 -2.826 17.049 10.907 1.00 1.24 H new ATOM 0 HG3 GLN A 59 -3.144 18.564 11.730 1.00 1.24 H new ATOM 0 HE21 GLN A 59 -2.123 18.974 13.697 1.00 15.24 H new ATOM 0 HE22 GLN A 59 -1.096 17.798 14.525 1.00 15.24 H new ATOM 857 N GLY A 60 -7.389 18.452 10.754 1.00 3.11 N ATOM 858 CA GLY A 60 -8.022 19.674 10.293 1.00 53.41 C ATOM 859 C GLY A 60 -8.105 19.766 8.770 1.00 34.13 C ATOM 860 O GLY A 60 -8.663 20.741 8.283 1.00 22.21 O ATOM 0 H GLY A 60 -8.028 17.793 11.200 1.00 3.11 H new ATOM 0 HA2 GLY A 60 -9.027 19.736 10.710 1.00 53.41 H new ATOM 0 HA3 GLY A 60 -7.466 20.531 10.673 1.00 53.41 H new ATOM 864 N ASN A 61 -7.632 18.774 8.008 1.00 54.52 N ATOM 865 CA ASN A 61 -7.912 18.619 6.579 1.00 15.50 C ATOM 866 C ASN A 61 -8.428 17.197 6.405 1.00 20.23 C ATOM 867 O ASN A 61 -7.835 16.282 6.985 1.00 42.42 O ATOM 868 CB ASN A 61 -6.643 18.828 5.734 1.00 2.43 C ATOM 869 CG ASN A 61 -6.278 20.285 5.465 1.00 61.43 C ATOM 870 OD1 ASN A 61 -6.999 21.212 5.826 1.00 52.24 O ATOM 871 ND2 ASN A 61 -5.109 20.527 4.902 1.00 71.15 N ATOM 0 H ASN A 61 -7.029 18.039 8.378 1.00 54.52 H new ATOM 0 HA ASN A 61 -8.637 19.361 6.244 1.00 15.50 H new ATOM 0 HB2 ASN A 61 -5.805 18.347 6.239 1.00 2.43 H new ATOM 0 HB3 ASN A 61 -6.773 18.320 4.779 1.00 2.43 H new ATOM 0 HD21 ASN A 61 -4.799 21.489 4.764 1.00 71.15 H new ATOM 0 HD22 ASN A 61 -4.516 19.752 4.605 1.00 71.15 H new ATOM 877 N LYS A 62 -9.520 17.014 5.657 1.00 60.13 N ATOM 878 CA LYS A 62 -10.149 15.720 5.399 1.00 2.52 C ATOM 879 C LYS A 62 -10.592 15.652 3.929 1.00 14.11 C ATOM 880 O LYS A 62 -10.631 16.684 3.262 1.00 4.14 O ATOM 881 CB LYS A 62 -11.346 15.480 6.339 1.00 61.13 C ATOM 882 CG LYS A 62 -10.984 15.289 7.822 1.00 21.14 C ATOM 883 CD LYS A 62 -10.951 16.590 8.647 1.00 60.33 C ATOM 884 CE LYS A 62 -12.043 16.602 9.728 1.00 11.21 C ATOM 885 NZ LYS A 62 -13.400 16.644 9.143 1.00 43.41 N ATOM 0 H LYS A 62 -10.004 17.788 5.201 1.00 60.13 H new ATOM 0 HA LYS A 62 -9.420 14.933 5.594 1.00 2.52 H new ATOM 0 HB2 LYS A 62 -12.030 16.325 6.254 1.00 61.13 H new ATOM 0 HB3 LYS A 62 -11.886 14.597 5.996 1.00 61.13 H new ATOM 0 HG2 LYS A 62 -11.704 14.606 8.273 1.00 21.14 H new ATOM 0 HG3 LYS A 62 -10.007 14.809 7.885 1.00 21.14 H new ATOM 0 HD2 LYS A 62 -9.973 16.700 9.116 1.00 60.33 H new ATOM 0 HD3 LYS A 62 -11.085 17.445 7.984 1.00 60.33 H new ATOM 0 HE2 LYS A 62 -11.945 15.714 10.353 1.00 11.21 H new ATOM 0 HE3 LYS A 62 -11.901 17.466 10.377 1.00 11.21 H new ATOM 0 HZ1 LYS A 62 -14.107 16.651 9.906 1.00 43.41 H new ATOM 0 HZ2 LYS A 62 -13.503 17.504 8.567 1.00 43.41 H new ATOM 0 HZ3 LYS A 62 -13.546 15.807 8.544 1.00 43.41 H new ATOM 895 N ASP A 63 -10.981 14.465 3.466 1.00 65.35 N ATOM 896 CA ASP A 63 -11.334 14.081 2.094 1.00 73.32 C ATOM 897 C ASP A 63 -10.091 13.948 1.216 1.00 55.43 C ATOM 898 O ASP A 63 -9.594 14.936 0.674 1.00 61.32 O ATOM 899 CB ASP A 63 -12.457 14.927 1.468 1.00 20.12 C ATOM 900 CG ASP A 63 -13.217 14.172 0.368 1.00 64.51 C ATOM 901 OD1 ASP A 63 -13.443 12.945 0.503 1.00 43.44 O ATOM 902 OD2 ASP A 63 -13.663 14.824 -0.605 1.00 13.04 O ATOM 0 H ASP A 63 -11.066 13.670 4.100 1.00 65.35 H new ATOM 0 HA ASP A 63 -11.779 13.088 2.158 1.00 73.32 H new ATOM 0 HB2 ASP A 63 -13.157 15.230 2.247 1.00 20.12 H new ATOM 0 HB3 ASP A 63 -12.031 15.839 1.050 1.00 20.12 H new ATOM 906 N PHE A 64 -9.545 12.725 1.147 1.00 54.43 N ATOM 907 CA PHE A 64 -8.302 12.376 0.443 1.00 11.30 C ATOM 908 C PHE A 64 -8.336 12.785 -1.043 1.00 64.41 C ATOM 909 O PHE A 64 -9.422 12.985 -1.589 1.00 31.20 O ATOM 910 CB PHE A 64 -8.074 10.852 0.542 1.00 3.13 C ATOM 911 CG PHE A 64 -8.082 10.272 1.944 1.00 75.42 C ATOM 912 CD1 PHE A 64 -7.175 10.736 2.916 1.00 63.23 C ATOM 913 CD2 PHE A 64 -9.016 9.276 2.286 1.00 60.31 C ATOM 914 CE1 PHE A 64 -7.249 10.255 4.237 1.00 13.34 C ATOM 915 CE2 PHE A 64 -9.070 8.781 3.599 1.00 60.22 C ATOM 916 CZ PHE A 64 -8.205 9.288 4.583 1.00 74.34 C ATOM 0 H PHE A 64 -9.975 11.918 1.599 1.00 54.43 H new ATOM 0 HA PHE A 64 -7.488 12.923 0.919 1.00 11.30 H new ATOM 0 HB2 PHE A 64 -8.845 10.350 -0.043 1.00 3.13 H new ATOM 0 HB3 PHE A 64 -7.117 10.616 0.077 1.00 3.13 H new ATOM 0 HD1 PHE A 64 -6.422 11.462 2.648 1.00 63.23 H new ATOM 0 HD2 PHE A 64 -9.693 8.892 1.537 1.00 60.31 H new ATOM 0 HE1 PHE A 64 -6.568 10.631 4.986 1.00 13.34 H new ATOM 0 HE2 PHE A 64 -9.779 8.007 3.853 1.00 60.22 H new ATOM 0 HZ PHE A 64 -8.276 8.935 5.601 1.00 74.34 H new ATOM 925 N PRO A 65 -7.185 12.879 -1.733 1.00 72.22 N ATOM 926 CA PRO A 65 -7.156 13.042 -3.182 1.00 71.21 C ATOM 927 C PRO A 65 -7.539 11.738 -3.894 1.00 4.42 C ATOM 928 O PRO A 65 -7.448 10.637 -3.335 1.00 60.11 O ATOM 929 CB PRO A 65 -5.720 13.467 -3.508 1.00 51.42 C ATOM 930 CG PRO A 65 -4.904 12.794 -2.407 1.00 44.23 C ATOM 931 CD PRO A 65 -5.831 12.871 -1.195 1.00 21.30 C ATOM 0 HA PRO A 65 -7.878 13.783 -3.525 1.00 71.21 H new ATOM 0 HB2 PRO A 65 -5.415 13.131 -4.499 1.00 51.42 H new ATOM 0 HB3 PRO A 65 -5.606 14.551 -3.490 1.00 51.42 H new ATOM 0 HG2 PRO A 65 -4.657 11.763 -2.661 1.00 44.23 H new ATOM 0 HG3 PRO A 65 -3.962 13.313 -2.228 1.00 44.23 H new ATOM 0 HD2 PRO A 65 -5.679 12.020 -0.531 1.00 21.30 H new ATOM 0 HD3 PRO A 65 -5.637 13.770 -0.610 1.00 21.30 H new ATOM 936 N GLU A 66 -7.927 11.854 -5.163 1.00 2.24 N ATOM 937 CA GLU A 66 -8.113 10.707 -6.037 1.00 33.21 C ATOM 938 C GLU A 66 -6.764 10.313 -6.650 1.00 1.14 C ATOM 939 O GLU A 66 -5.768 11.044 -6.575 1.00 3.14 O ATOM 940 CB GLU A 66 -9.130 11.046 -7.132 1.00 52.03 C ATOM 941 CG GLU A 66 -10.565 11.220 -6.620 1.00 20.32 C ATOM 942 CD GLU A 66 -11.543 11.314 -7.792 1.00 41.24 C ATOM 943 OE1 GLU A 66 -11.280 12.113 -8.719 1.00 52.32 O ATOM 944 OE2 GLU A 66 -12.555 10.574 -7.808 1.00 45.34 O ATOM 0 H GLU A 66 -8.121 12.750 -5.611 1.00 2.24 H new ATOM 0 HA GLU A 66 -8.498 9.864 -5.463 1.00 33.21 H new ATOM 0 HB2 GLU A 66 -8.819 11.964 -7.630 1.00 52.03 H new ATOM 0 HB3 GLU A 66 -9.117 10.256 -7.883 1.00 52.03 H new ATOM 0 HG2 GLU A 66 -10.834 10.379 -5.981 1.00 20.32 H new ATOM 0 HG3 GLU A 66 -10.633 12.120 -6.009 1.00 20.32 H new ATOM 949 N ILE A 67 -6.730 9.167 -7.327 1.00 51.03 N ATOM 950 CA ILE A 67 -5.501 8.548 -7.805 1.00 1.05 C ATOM 951 C ILE A 67 -5.614 8.221 -9.296 1.00 43.04 C ATOM 952 O ILE A 67 -6.723 8.218 -9.830 1.00 64.22 O ATOM 953 CB ILE A 67 -5.176 7.325 -6.928 1.00 2.01 C ATOM 954 CG1 ILE A 67 -6.205 6.185 -7.106 1.00 24.34 C ATOM 955 CG2 ILE A 67 -5.083 7.741 -5.444 1.00 63.41 C ATOM 956 CD1 ILE A 67 -5.558 4.821 -6.879 1.00 43.41 C ATOM 0 H ILE A 67 -7.569 8.637 -7.561 1.00 51.03 H new ATOM 0 HA ILE A 67 -4.663 9.239 -7.714 1.00 1.05 H new ATOM 0 HB ILE A 67 -4.210 6.939 -7.255 1.00 2.01 H new ATOM 0 HG12 ILE A 67 -7.029 6.322 -6.405 1.00 24.34 H new ATOM 0 HG13 ILE A 67 -6.630 6.227 -8.109 1.00 24.34 H new ATOM 0 HG21 ILE A 67 -4.853 6.867 -4.835 1.00 63.41 H new ATOM 0 HG22 ILE A 67 -4.296 8.485 -5.323 1.00 63.41 H new ATOM 0 HG23 ILE A 67 -6.035 8.165 -5.125 1.00 63.41 H new ATOM 0 HD11 ILE A 67 -6.305 4.038 -7.011 1.00 43.41 H new ATOM 0 HD12 ILE A 67 -4.751 4.677 -7.597 1.00 43.41 H new ATOM 0 HD13 ILE A 67 -5.156 4.773 -5.867 1.00 43.41 H new ATOM 967 N GLN A 68 -4.499 7.908 -9.963 1.00 32.41 N ATOM 968 CA GLN A 68 -4.495 7.415 -11.335 1.00 72.22 C ATOM 969 C GLN A 68 -3.545 6.242 -11.470 1.00 0.00 C ATOM 970 O GLN A 68 -2.475 6.192 -10.859 1.00 72.53 O ATOM 971 CB GLN A 68 -4.080 8.499 -12.336 1.00 4.42 C ATOM 972 CG GLN A 68 -5.123 9.594 -12.533 1.00 1.03 C ATOM 973 CD GLN A 68 -6.506 9.074 -12.894 1.00 3.52 C ATOM 974 OE1 GLN A 68 -6.653 8.175 -13.717 1.00 34.25 O ATOM 975 NE2 GLN A 68 -7.548 9.611 -12.283 1.00 15.50 N ATOM 0 H GLN A 68 -3.567 7.992 -9.558 1.00 32.41 H new ATOM 0 HA GLN A 68 -5.515 7.106 -11.562 1.00 72.22 H new ATOM 0 HB2 GLN A 68 -3.149 8.955 -11.997 1.00 4.42 H new ATOM 0 HB3 GLN A 68 -3.874 8.031 -13.298 1.00 4.42 H new ATOM 0 HG2 GLN A 68 -5.195 10.182 -11.618 1.00 1.03 H new ATOM 0 HG3 GLN A 68 -4.783 10.268 -13.319 1.00 1.03 H new ATOM 0 HE21 GLN A 68 -7.411 10.357 -11.601 1.00 15.50 H new ATOM 0 HE22 GLN A 68 -8.489 9.279 -12.493 1.00 15.50 H new ATOM 982 N LEU A 69 -3.934 5.314 -12.329 1.00 62.23 N ATOM 983 CA LEU A 69 -3.187 4.103 -12.650 1.00 12.20 C ATOM 984 C LEU A 69 -3.636 3.580 -14.011 1.00 74.53 C ATOM 985 O LEU A 69 -4.428 4.225 -14.704 1.00 24.53 O ATOM 986 CB LEU A 69 -3.268 3.059 -11.512 1.00 34.43 C ATOM 987 CG LEU A 69 -4.454 2.078 -11.518 1.00 54.34 C ATOM 988 CD1 LEU A 69 -4.363 1.184 -10.279 1.00 1.32 C ATOM 989 CD2 LEU A 69 -5.825 2.767 -11.540 1.00 13.23 C ATOM 0 H LEU A 69 -4.812 5.384 -12.843 1.00 62.23 H new ATOM 0 HA LEU A 69 -2.125 4.335 -12.729 1.00 12.20 H new ATOM 0 HB2 LEU A 69 -2.349 2.473 -11.530 1.00 34.43 H new ATOM 0 HB3 LEU A 69 -3.284 3.598 -10.565 1.00 34.43 H new ATOM 0 HG LEU A 69 -4.381 1.499 -12.439 1.00 54.34 H new ATOM 0 HD11 LEU A 69 -5.199 0.484 -10.273 1.00 1.32 H new ATOM 0 HD12 LEU A 69 -3.425 0.629 -10.299 1.00 1.32 H new ATOM 0 HD13 LEU A 69 -4.400 1.801 -9.381 1.00 1.32 H new ATOM 0 HD21 LEU A 69 -6.611 2.012 -11.543 1.00 13.23 H new ATOM 0 HD22 LEU A 69 -5.930 3.397 -10.657 1.00 13.23 H new ATOM 0 HD23 LEU A 69 -5.909 3.382 -12.436 1.00 13.23 H new ATOM 1000 N ASP A 70 -3.062 2.468 -14.447 1.00 12.23 N ATOM 1001 CA ASP A 70 -3.402 1.813 -15.706 1.00 0.30 C ATOM 1002 C ASP A 70 -4.604 0.869 -15.580 1.00 35.42 C ATOM 1003 O ASP A 70 -5.210 0.784 -14.514 1.00 64.22 O ATOM 1004 CB ASP A 70 -2.154 1.126 -16.267 1.00 72.21 C ATOM 1005 CG ASP A 70 -1.892 1.700 -17.647 1.00 24.31 C ATOM 1006 OD1 ASP A 70 -2.651 1.350 -18.572 1.00 62.53 O ATOM 1007 OD2 ASP A 70 -1.020 2.601 -17.746 1.00 1.14 O ATOM 0 H ASP A 70 -2.331 1.984 -13.926 1.00 12.23 H new ATOM 0 HA ASP A 70 -3.728 2.571 -16.418 1.00 0.30 H new ATOM 0 HB2 ASP A 70 -1.298 1.295 -15.614 1.00 72.21 H new ATOM 0 HB3 ASP A 70 -2.304 0.048 -16.323 1.00 72.21 H new ATOM 1011 N ASN A 71 -4.985 0.184 -16.661 1.00 13.10 N ATOM 1012 CA ASN A 71 -6.196 -0.647 -16.706 1.00 41.32 C ATOM 1013 C ASN A 71 -5.955 -2.021 -16.055 1.00 3.24 C ATOM 1014 O ASN A 71 -6.068 -3.068 -16.698 1.00 13.45 O ATOM 1015 CB ASN A 71 -6.681 -0.779 -18.158 1.00 1.24 C ATOM 1016 CG ASN A 71 -8.178 -1.055 -18.260 1.00 1.41 C ATOM 1017 OD1 ASN A 71 -8.884 -0.376 -18.998 1.00 15.53 O ATOM 1018 ND2 ASN A 71 -8.732 -2.012 -17.536 1.00 42.43 N ATOM 0 H ASN A 71 -4.461 0.189 -17.536 1.00 13.10 H new ATOM 0 HA ASN A 71 -6.980 -0.160 -16.126 1.00 41.32 H new ATOM 0 HB2 ASN A 71 -6.448 0.138 -18.699 1.00 1.24 H new ATOM 0 HB3 ASN A 71 -6.134 -1.585 -18.647 1.00 1.24 H new ATOM 0 HD21 ASN A 71 -9.736 -2.179 -17.595 1.00 42.43 H new ATOM 0 HD22 ASN A 71 -8.155 -2.583 -16.919 1.00 42.43 H new ATOM 1024 N ILE A 72 -5.546 -2.015 -14.795 1.00 52.13 N ATOM 1025 CA ILE A 72 -4.999 -3.162 -14.076 1.00 42.41 C ATOM 1026 C ILE A 72 -6.135 -3.830 -13.301 1.00 12.23 C ATOM 1027 O ILE A 72 -6.883 -3.163 -12.582 1.00 40.04 O ATOM 1028 CB ILE A 72 -3.847 -2.714 -13.148 1.00 33.10 C ATOM 1029 CG1 ILE A 72 -2.715 -1.994 -13.919 1.00 41.41 C ATOM 1030 CG2 ILE A 72 -3.230 -3.897 -12.379 1.00 60.24 C ATOM 1031 CD1 ILE A 72 -2.004 -0.949 -13.059 1.00 53.11 C ATOM 0 H ILE A 72 -5.587 -1.175 -14.218 1.00 52.13 H new ATOM 0 HA ILE A 72 -4.577 -3.886 -14.773 1.00 42.41 H new ATOM 0 HB ILE A 72 -4.302 -2.017 -12.444 1.00 33.10 H new ATOM 0 HG12 ILE A 72 -1.990 -2.730 -14.267 1.00 41.41 H new ATOM 0 HG13 ILE A 72 -3.130 -1.512 -14.804 1.00 41.41 H new ATOM 0 HG21 ILE A 72 -2.425 -3.535 -11.740 1.00 60.24 H new ATOM 0 HG22 ILE A 72 -3.996 -4.371 -11.765 1.00 60.24 H new ATOM 0 HG23 ILE A 72 -2.832 -4.624 -13.087 1.00 60.24 H new ATOM 0 HD11 ILE A 72 -1.218 -0.471 -13.643 1.00 53.11 H new ATOM 0 HD12 ILE A 72 -2.722 -0.197 -12.732 1.00 53.11 H new ATOM 0 HD13 ILE A 72 -1.564 -1.433 -12.187 1.00 53.11 H new ATOM 1042 N ASP A 73 -6.224 -5.157 -13.395 1.00 53.11 N ATOM 1043 CA ASP A 73 -7.193 -5.968 -12.666 1.00 61.33 C ATOM 1044 C ASP A 73 -6.450 -6.715 -11.568 1.00 2.02 C ATOM 1045 O ASP A 73 -5.648 -7.605 -11.853 1.00 44.22 O ATOM 1046 CB ASP A 73 -7.929 -6.922 -13.621 1.00 21.13 C ATOM 1047 CG ASP A 73 -9.327 -7.324 -13.147 1.00 25.53 C ATOM 1048 OD1 ASP A 73 -9.963 -6.591 -12.352 1.00 52.34 O ATOM 1049 OD2 ASP A 73 -9.892 -8.281 -13.707 1.00 20.54 O ATOM 0 H ASP A 73 -5.609 -5.708 -13.994 1.00 53.11 H new ATOM 0 HA ASP A 73 -7.958 -5.337 -12.213 1.00 61.33 H new ATOM 0 HB2 ASP A 73 -8.011 -6.448 -14.599 1.00 21.13 H new ATOM 0 HB3 ASP A 73 -7.329 -7.822 -13.752 1.00 21.13 H new ATOM 1053 N TYR A 74 -6.660 -6.335 -10.307 1.00 34.34 N ATOM 1054 CA TYR A 74 -5.979 -6.951 -9.162 1.00 11.44 C ATOM 1055 C TYR A 74 -6.257 -8.457 -9.078 1.00 74.21 C ATOM 1056 O TYR A 74 -5.427 -9.202 -8.565 1.00 44.34 O ATOM 1057 CB TYR A 74 -6.396 -6.271 -7.849 1.00 2.04 C ATOM 1058 CG TYR A 74 -6.267 -4.758 -7.830 1.00 54.51 C ATOM 1059 CD1 TYR A 74 -5.050 -4.137 -8.178 1.00 73.23 C ATOM 1060 CD2 TYR A 74 -7.379 -3.967 -7.479 1.00 13.24 C ATOM 1061 CE1 TYR A 74 -4.955 -2.734 -8.205 1.00 0.54 C ATOM 1062 CE2 TYR A 74 -7.283 -2.566 -7.496 1.00 34.25 C ATOM 1063 CZ TYR A 74 -6.078 -1.943 -7.883 1.00 73.51 C ATOM 1064 OH TYR A 74 -6.005 -0.587 -7.951 1.00 71.34 O ATOM 0 H TYR A 74 -7.307 -5.591 -10.048 1.00 34.34 H new ATOM 0 HA TYR A 74 -4.909 -6.811 -9.313 1.00 11.44 H new ATOM 0 HB2 TYR A 74 -7.433 -6.533 -7.637 1.00 2.04 H new ATOM 0 HB3 TYR A 74 -5.792 -6.681 -7.040 1.00 2.04 H new ATOM 0 HD1 TYR A 74 -4.189 -4.740 -8.424 1.00 73.23 H new ATOM 0 HD2 TYR A 74 -8.308 -4.440 -7.196 1.00 13.24 H new ATOM 0 HE1 TYR A 74 -4.021 -2.262 -8.473 1.00 0.54 H new ATOM 0 HE2 TYR A 74 -8.134 -1.964 -7.212 1.00 34.25 H new ATOM 0 HH TYR A 74 -6.869 -0.200 -7.697 1.00 71.34 H new ATOM 1073 N ASN A 75 -7.395 -8.905 -9.618 1.00 54.55 N ATOM 1074 CA ASN A 75 -7.776 -10.315 -9.734 1.00 11.21 C ATOM 1075 C ASN A 75 -6.747 -11.145 -10.514 1.00 73.33 C ATOM 1076 O ASN A 75 -6.713 -12.363 -10.357 1.00 14.24 O ATOM 1077 CB ASN A 75 -9.165 -10.437 -10.399 1.00 32.55 C ATOM 1078 CG ASN A 75 -10.283 -10.362 -9.381 1.00 1.03 C ATOM 1079 OD1 ASN A 75 -10.801 -11.384 -8.926 1.00 73.51 O ATOM 1080 ND2 ASN A 75 -10.612 -9.164 -8.933 1.00 72.35 N ATOM 0 H ASN A 75 -8.100 -8.274 -9.999 1.00 54.55 H new ATOM 0 HA ASN A 75 -7.813 -10.718 -8.722 1.00 11.21 H new ATOM 0 HB2 ASN A 75 -9.288 -9.641 -11.133 1.00 32.55 H new ATOM 0 HB3 ASN A 75 -9.228 -11.382 -10.939 1.00 32.55 H new ATOM 0 HD21 ASN A 75 -11.309 -9.069 -8.194 1.00 72.35 H new ATOM 0 HD22 ASN A 75 -10.169 -8.333 -9.326 1.00 72.35 H new ATOM 1086 N ASN A 76 -5.906 -10.514 -11.340 1.00 24.13 N ATOM 1087 CA ASN A 76 -4.930 -11.192 -12.192 1.00 72.53 C ATOM 1088 C ASN A 76 -3.585 -11.410 -11.484 1.00 3.04 C ATOM 1089 O ASN A 76 -2.601 -11.726 -12.163 1.00 41.42 O ATOM 1090 CB ASN A 76 -4.699 -10.403 -13.495 1.00 25.42 C ATOM 1091 CG ASN A 76 -5.910 -10.256 -14.400 1.00 34.14 C ATOM 1092 OD1 ASN A 76 -6.977 -10.809 -14.156 1.00 21.10 O ATOM 1093 ND2 ASN A 76 -5.762 -9.514 -15.482 1.00 32.43 N ATOM 0 H ASN A 76 -5.886 -9.499 -11.435 1.00 24.13 H new ATOM 0 HA ASN A 76 -5.351 -12.170 -12.424 1.00 72.53 H new ATOM 0 HB2 ASN A 76 -4.339 -9.407 -13.236 1.00 25.42 H new ATOM 0 HB3 ASN A 76 -3.905 -10.893 -14.058 1.00 25.42 H new ATOM 0 HD21 ASN A 76 -6.542 -9.394 -16.129 1.00 32.43 H new ATOM 0 HD22 ASN A 76 -4.868 -9.060 -15.671 1.00 32.43 H new ATOM 1099 N TYR A 77 -3.489 -11.200 -10.165 1.00 73.21 N ATOM 1100 CA TYR A 77 -2.280 -11.463 -9.392 1.00 13.53 C ATOM 1101 C TYR A 77 -2.644 -12.181 -8.090 1.00 13.12 C ATOM 1102 O TYR A 77 -3.810 -12.206 -7.690 1.00 13.01 O ATOM 1103 CB TYR A 77 -1.509 -10.154 -9.143 1.00 4.40 C ATOM 1104 CG TYR A 77 -1.160 -9.375 -10.403 1.00 0.44 C ATOM 1105 CD1 TYR A 77 0.026 -9.643 -11.122 1.00 22.21 C ATOM 1106 CD2 TYR A 77 -2.059 -8.404 -10.885 1.00 54.42 C ATOM 1107 CE1 TYR A 77 0.312 -8.936 -12.305 1.00 41.21 C ATOM 1108 CE2 TYR A 77 -1.793 -7.715 -12.079 1.00 24.34 C ATOM 1109 CZ TYR A 77 -0.609 -7.982 -12.798 1.00 51.01 C ATOM 1110 OH TYR A 77 -0.400 -7.334 -13.976 1.00 33.24 O ATOM 0 H TYR A 77 -4.260 -10.839 -9.603 1.00 73.21 H new ATOM 0 HA TYR A 77 -1.618 -12.120 -9.956 1.00 13.53 H new ATOM 0 HB2 TYR A 77 -2.104 -9.516 -8.490 1.00 4.40 H new ATOM 0 HB3 TYR A 77 -0.588 -10.386 -8.608 1.00 4.40 H new ATOM 0 HD1 TYR A 77 0.715 -10.393 -10.763 1.00 22.21 H new ATOM 0 HD2 TYR A 77 -2.961 -8.188 -10.331 1.00 54.42 H new ATOM 0 HE1 TYR A 77 1.234 -9.122 -12.836 1.00 41.21 H new ATOM 0 HE2 TYR A 77 -2.495 -6.981 -12.447 1.00 24.34 H new ATOM 0 HH TYR A 77 0.445 -7.636 -14.370 1.00 33.24 H new ATOM 1119 N ASP A 78 -1.643 -12.758 -7.416 1.00 51.22 N ATOM 1120 CA ASP A 78 -1.821 -13.509 -6.157 1.00 55.15 C ATOM 1121 C ASP A 78 -1.018 -12.923 -4.993 1.00 62.43 C ATOM 1122 O ASP A 78 -1.157 -13.354 -3.850 1.00 42.31 O ATOM 1123 CB ASP A 78 -1.427 -14.972 -6.363 1.00 42.03 C ATOM 1124 CG ASP A 78 -1.861 -15.877 -5.197 1.00 15.24 C ATOM 1125 OD1 ASP A 78 -3.070 -15.912 -4.877 1.00 54.25 O ATOM 1126 OD2 ASP A 78 -1.020 -16.661 -4.692 1.00 42.24 O ATOM 0 H ASP A 78 -0.673 -12.719 -7.729 1.00 51.22 H new ATOM 0 HA ASP A 78 -2.876 -13.433 -5.892 1.00 55.15 H new ATOM 0 HB2 ASP A 78 -1.875 -15.338 -7.287 1.00 42.03 H new ATOM 0 HB3 ASP A 78 -0.346 -15.038 -6.485 1.00 42.03 H new ATOM 1130 N LEU A 79 -0.204 -11.903 -5.255 1.00 0.22 N ATOM 1131 CA LEU A 79 0.652 -11.234 -4.284 1.00 43.45 C ATOM 1132 C LEU A 79 0.687 -9.750 -4.663 1.00 2.42 C ATOM 1133 O LEU A 79 0.772 -9.435 -5.853 1.00 1.51 O ATOM 1134 CB LEU A 79 2.064 -11.848 -4.375 1.00 5.34 C ATOM 1135 CG LEU A 79 2.846 -12.047 -3.065 1.00 55.22 C ATOM 1136 CD1 LEU A 79 2.669 -10.905 -2.058 1.00 72.32 C ATOM 1137 CD2 LEU A 79 2.496 -13.402 -2.423 1.00 4.20 C ATOM 0 H LEU A 79 -0.121 -11.505 -6.190 1.00 0.22 H new ATOM 0 HA LEU A 79 0.284 -11.351 -3.265 1.00 43.45 H new ATOM 0 HB2 LEU A 79 1.976 -12.819 -4.863 1.00 5.34 H new ATOM 0 HB3 LEU A 79 2.663 -11.215 -5.030 1.00 5.34 H new ATOM 0 HG LEU A 79 3.901 -12.040 -3.341 1.00 55.22 H new ATOM 0 HD11 LEU A 79 3.250 -11.118 -1.161 1.00 72.32 H new ATOM 0 HD12 LEU A 79 3.015 -9.972 -2.502 1.00 72.32 H new ATOM 0 HD13 LEU A 79 1.615 -10.813 -1.794 1.00 72.32 H new ATOM 0 HD21 LEU A 79 3.060 -13.523 -1.498 1.00 4.20 H new ATOM 0 HD22 LEU A 79 1.429 -13.436 -2.205 1.00 4.20 H new ATOM 0 HD23 LEU A 79 2.751 -14.208 -3.111 1.00 4.20 H new ATOM 1148 N ILE A 80 0.621 -8.826 -3.705 1.00 3.05 N ATOM 1149 CA ILE A 80 0.668 -7.389 -3.984 1.00 43.34 C ATOM 1150 C ILE A 80 1.605 -6.715 -2.981 1.00 31.40 C ATOM 1151 O ILE A 80 1.454 -6.893 -1.769 1.00 71.22 O ATOM 1152 CB ILE A 80 -0.767 -6.800 -3.993 1.00 2.32 C ATOM 1153 CG1 ILE A 80 -1.569 -7.394 -5.180 1.00 15.02 C ATOM 1154 CG2 ILE A 80 -0.728 -5.262 -4.086 1.00 5.31 C ATOM 1155 CD1 ILE A 80 -3.003 -6.885 -5.349 1.00 44.22 C ATOM 0 H ILE A 80 0.533 -9.051 -2.714 1.00 3.05 H new ATOM 0 HA ILE A 80 1.075 -7.199 -4.977 1.00 43.34 H new ATOM 0 HB ILE A 80 -1.261 -7.068 -3.059 1.00 2.32 H new ATOM 0 HG12 ILE A 80 -1.022 -7.189 -6.100 1.00 15.02 H new ATOM 0 HG13 ILE A 80 -1.601 -8.477 -5.064 1.00 15.02 H new ATOM 0 HG21 ILE A 80 -1.746 -4.872 -4.091 1.00 5.31 H new ATOM 0 HG22 ILE A 80 -0.189 -4.859 -3.229 1.00 5.31 H new ATOM 0 HG23 ILE A 80 -0.222 -4.966 -5.005 1.00 5.31 H new ATOM 0 HD11 ILE A 80 -3.462 -7.371 -6.210 1.00 44.22 H new ATOM 0 HD12 ILE A 80 -3.579 -7.115 -4.453 1.00 44.22 H new ATOM 0 HD13 ILE A 80 -2.990 -5.806 -5.505 1.00 44.22 H new ATOM 1166 N LEU A 81 2.570 -5.933 -3.484 1.00 71.11 N ATOM 1167 CA LEU A 81 3.349 -4.983 -2.703 1.00 61.42 C ATOM 1168 C LEU A 81 2.841 -3.578 -2.970 1.00 34.35 C ATOM 1169 O LEU A 81 2.419 -3.237 -4.080 1.00 13.24 O ATOM 1170 CB LEU A 81 4.843 -4.993 -3.079 1.00 72.43 C ATOM 1171 CG LEU A 81 5.709 -6.116 -2.507 1.00 0.10 C ATOM 1172 CD1 LEU A 81 5.835 -5.971 -0.986 1.00 5.54 C ATOM 1173 CD2 LEU A 81 5.256 -7.509 -2.946 1.00 3.10 C ATOM 0 H LEU A 81 2.831 -5.950 -4.470 1.00 71.11 H new ATOM 0 HA LEU A 81 3.240 -5.274 -1.658 1.00 61.42 H new ATOM 0 HB2 LEU A 81 4.916 -5.033 -4.166 1.00 72.43 H new ATOM 0 HB3 LEU A 81 5.275 -4.043 -2.765 1.00 72.43 H new ATOM 0 HG LEU A 81 6.708 -6.011 -2.931 1.00 0.10 H new ATOM 0 HD11 LEU A 81 6.454 -6.778 -0.594 1.00 5.54 H new ATOM 0 HD12 LEU A 81 6.295 -5.012 -0.749 1.00 5.54 H new ATOM 0 HD13 LEU A 81 4.845 -6.020 -0.533 1.00 5.54 H new ATOM 0 HD21 LEU A 81 5.912 -8.260 -2.506 1.00 3.10 H new ATOM 0 HD22 LEU A 81 4.232 -7.681 -2.613 1.00 3.10 H new ATOM 0 HD23 LEU A 81 5.300 -7.580 -4.033 1.00 3.10 H new ATOM 1184 N ILE A 82 3.011 -2.731 -1.961 1.00 20.24 N ATOM 1185 CA ILE A 82 2.716 -1.315 -1.999 1.00 22.33 C ATOM 1186 C ILE A 82 3.908 -0.590 -1.351 1.00 41.31 C ATOM 1187 O ILE A 82 4.485 -1.127 -0.405 1.00 24.22 O ATOM 1188 CB ILE A 82 1.401 -1.052 -1.228 1.00 15.42 C ATOM 1189 CG1 ILE A 82 0.218 -2.022 -1.496 1.00 62.44 C ATOM 1190 CG2 ILE A 82 1.017 0.409 -1.493 1.00 53.35 C ATOM 1191 CD1 ILE A 82 -0.953 -1.897 -0.496 1.00 22.35 C ATOM 0 H ILE A 82 3.375 -3.032 -1.057 1.00 20.24 H new ATOM 0 HA ILE A 82 2.577 -0.952 -3.017 1.00 22.33 H new ATOM 0 HB ILE A 82 1.603 -1.249 -0.175 1.00 15.42 H new ATOM 0 HG12 ILE A 82 -0.160 -1.844 -2.503 1.00 62.44 H new ATOM 0 HG13 ILE A 82 0.592 -3.046 -1.472 1.00 62.44 H new ATOM 0 HG21 ILE A 82 0.091 0.643 -0.967 1.00 53.35 H new ATOM 0 HG22 ILE A 82 1.812 1.064 -1.137 1.00 53.35 H new ATOM 0 HG23 ILE A 82 0.875 0.559 -2.563 1.00 53.35 H new ATOM 0 HD11 ILE A 82 -1.734 -2.611 -0.759 1.00 22.35 H new ATOM 0 HD12 ILE A 82 -0.595 -2.106 0.512 1.00 22.35 H new ATOM 0 HD13 ILE A 82 -1.358 -0.886 -0.535 1.00 22.35 H new ATOM 1202 N GLY A 83 4.274 0.614 -1.810 1.00 35.24 N ATOM 1203 CA GLY A 83 5.313 1.428 -1.173 1.00 3.34 C ATOM 1204 C GLY A 83 4.890 2.888 -1.000 1.00 53.22 C ATOM 1205 O GLY A 83 4.145 3.410 -1.836 1.00 44.35 O ATOM 0 H GLY A 83 3.857 1.049 -2.633 1.00 35.24 H new ATOM 0 HA2 GLY A 83 5.554 1.005 -0.198 1.00 3.34 H new ATOM 0 HA3 GLY A 83 6.222 1.385 -1.773 1.00 3.34 H new ATOM 1209 N SER A 84 5.378 3.570 0.047 1.00 2.24 N ATOM 1210 CA SER A 84 5.069 4.973 0.364 1.00 73.13 C ATOM 1211 C SER A 84 6.088 5.541 1.385 1.00 64.51 C ATOM 1212 O SER A 84 6.603 4.774 2.208 1.00 60.21 O ATOM 1213 CB SER A 84 3.635 5.019 0.922 1.00 74.44 C ATOM 1214 OG SER A 84 3.058 6.304 0.824 1.00 12.20 O ATOM 0 H SER A 84 6.019 3.147 0.718 1.00 2.24 H new ATOM 0 HA SER A 84 5.140 5.592 -0.530 1.00 73.13 H new ATOM 0 HB2 SER A 84 3.015 4.304 0.382 1.00 74.44 H new ATOM 0 HB3 SER A 84 3.645 4.707 1.966 1.00 74.44 H new ATOM 0 HG SER A 84 2.149 6.283 1.189 1.00 12.20 H new ATOM 1219 N PRO A 85 6.390 6.857 1.388 1.00 1.44 N ATOM 1220 CA PRO A 85 7.280 7.482 2.377 1.00 34.24 C ATOM 1221 C PRO A 85 6.641 7.589 3.776 1.00 5.30 C ATOM 1222 O PRO A 85 5.422 7.503 3.929 1.00 43.02 O ATOM 1223 CB PRO A 85 7.586 8.876 1.811 1.00 11.33 C ATOM 1224 CG PRO A 85 6.340 9.205 0.990 1.00 61.35 C ATOM 1225 CD PRO A 85 5.953 7.848 0.409 1.00 75.13 C ATOM 0 HA PRO A 85 8.176 6.879 2.523 1.00 34.24 H new ATOM 0 HB2 PRO A 85 7.749 9.605 2.605 1.00 11.33 H new ATOM 0 HB3 PRO A 85 8.484 8.871 1.194 1.00 11.33 H new ATOM 0 HG2 PRO A 85 5.546 9.622 1.609 1.00 61.35 H new ATOM 0 HG3 PRO A 85 6.551 9.935 0.208 1.00 61.35 H new ATOM 0 HD2 PRO A 85 4.877 7.786 0.243 1.00 75.13 H new ATOM 0 HD3 PRO A 85 6.434 7.684 -0.555 1.00 75.13 H new ATOM 1230 N VAL A 86 7.459 7.827 4.810 1.00 0.31 N ATOM 1231 CA VAL A 86 7.028 7.973 6.203 1.00 12.11 C ATOM 1232 C VAL A 86 8.009 8.917 6.882 1.00 31.44 C ATOM 1233 O VAL A 86 9.209 8.636 6.852 1.00 62.24 O ATOM 1234 CB VAL A 86 7.061 6.641 6.985 1.00 51.35 C ATOM 1235 CG1 VAL A 86 6.194 6.757 8.246 1.00 52.21 C ATOM 1236 CG2 VAL A 86 6.663 5.430 6.149 1.00 63.13 C ATOM 0 H VAL A 86 8.468 7.926 4.695 1.00 0.31 H new ATOM 0 HA VAL A 86 6.001 8.338 6.201 1.00 12.11 H new ATOM 0 HB VAL A 86 8.098 6.466 7.270 1.00 51.35 H new ATOM 0 HG11 VAL A 86 6.221 5.815 8.794 1.00 52.21 H new ATOM 0 HG12 VAL A 86 6.578 7.556 8.880 1.00 52.21 H new ATOM 0 HG13 VAL A 86 5.166 6.982 7.961 1.00 52.21 H new ATOM 0 HG21 VAL A 86 6.710 4.532 6.765 1.00 63.13 H new ATOM 0 HG22 VAL A 86 5.647 5.563 5.777 1.00 63.13 H new ATOM 0 HG23 VAL A 86 7.347 5.329 5.307 1.00 63.13 H new ATOM 1246 N TRP A 87 7.534 9.984 7.534 1.00 42.01 N ATOM 1247 CA TRP A 87 8.428 10.789 8.368 1.00 72.14 C ATOM 1248 C TRP A 87 7.780 11.489 9.555 1.00 31.43 C ATOM 1249 O TRP A 87 8.476 11.928 10.472 1.00 31.10 O ATOM 1250 CB TRP A 87 9.232 11.734 7.473 1.00 22.11 C ATOM 1251 CG TRP A 87 10.572 12.072 8.038 1.00 40.04 C ATOM 1252 CD1 TRP A 87 11.585 11.191 8.180 1.00 24.21 C ATOM 1253 CD2 TRP A 87 11.032 13.317 8.638 1.00 54.32 C ATOM 1254 NE1 TRP A 87 12.642 11.801 8.822 1.00 41.53 N ATOM 1255 CE2 TRP A 87 12.351 13.109 9.143 1.00 71.14 C ATOM 1256 CE3 TRP A 87 10.461 14.594 8.829 1.00 51.13 C ATOM 1257 CZ2 TRP A 87 13.061 14.111 9.821 1.00 42.12 C ATOM 1258 CZ3 TRP A 87 11.167 15.606 9.505 1.00 72.41 C ATOM 1259 CH2 TRP A 87 12.460 15.367 10.004 1.00 61.11 C ATOM 0 H TRP A 87 6.565 10.302 7.503 1.00 42.01 H new ATOM 0 HA TRP A 87 9.103 10.092 8.864 1.00 72.14 H new ATOM 0 HB2 TRP A 87 9.362 11.275 6.493 1.00 22.11 H new ATOM 0 HB3 TRP A 87 8.665 12.653 7.322 1.00 22.11 H new ATOM 0 HD1 TRP A 87 11.570 10.165 7.842 1.00 24.21 H new ATOM 0 HE1 TRP A 87 13.528 11.342 9.033 1.00 41.53 H new ATOM 0 HE3 TRP A 87 9.470 14.797 8.451 1.00 51.13 H new ATOM 0 HZ2 TRP A 87 14.055 13.919 10.197 1.00 42.12 H new ATOM 0 HZ3 TRP A 87 10.712 16.576 9.642 1.00 72.41 H new ATOM 0 HH2 TRP A 87 12.990 16.149 10.528 1.00 61.11 H new ATOM 1269 N SER A 88 6.458 11.491 9.611 1.00 73.33 N ATOM 1270 CA SER A 88 5.668 12.000 10.728 1.00 3.10 C ATOM 1271 C SER A 88 4.578 10.992 11.112 1.00 53.11 C ATOM 1272 O SER A 88 3.489 11.345 11.565 1.00 22.54 O ATOM 1273 CB SER A 88 5.117 13.385 10.364 1.00 31.15 C ATOM 1274 OG SER A 88 4.682 13.388 9.018 1.00 2.14 O ATOM 0 H SER A 88 5.881 11.125 8.853 1.00 73.33 H new ATOM 0 HA SER A 88 6.291 12.122 11.614 1.00 3.10 H new ATOM 0 HB2 SER A 88 4.289 13.642 11.024 1.00 31.15 H new ATOM 0 HB3 SER A 88 5.887 14.143 10.509 1.00 31.15 H new ATOM 0 HG SER A 88 4.187 14.214 8.836 1.00 2.14 H new ATOM 1279 N GLY A 89 4.849 9.706 10.883 1.00 4.42 N ATOM 1280 CA GLY A 89 3.961 8.620 11.255 1.00 64.23 C ATOM 1281 C GLY A 89 2.980 8.323 10.134 1.00 71.31 C ATOM 1282 O GLY A 89 2.810 7.157 9.799 1.00 14.32 O ATOM 0 H GLY A 89 5.706 9.392 10.427 1.00 4.42 H new ATOM 0 HA2 GLY A 89 4.544 7.727 11.481 1.00 64.23 H new ATOM 0 HA3 GLY A 89 3.416 8.883 12.162 1.00 64.23 H new ATOM 1286 N TYR A 90 2.352 9.340 9.551 1.00 14.31 N ATOM 1287 CA TYR A 90 1.487 9.238 8.385 1.00 3.33 C ATOM 1288 C TYR A 90 1.543 10.599 7.678 1.00 31.41 C ATOM 1289 O TYR A 90 0.713 11.457 7.969 1.00 60.43 O ATOM 1290 CB TYR A 90 0.054 8.788 8.770 1.00 33.32 C ATOM 1291 CG TYR A 90 -0.510 9.137 10.151 1.00 42.54 C ATOM 1292 CD1 TYR A 90 -0.150 10.316 10.835 1.00 13.20 C ATOM 1293 CD2 TYR A 90 -1.447 8.272 10.756 1.00 44.12 C ATOM 1294 CE1 TYR A 90 -0.671 10.604 12.105 1.00 62.31 C ATOM 1295 CE2 TYR A 90 -1.958 8.543 12.042 1.00 3.43 C ATOM 1296 CZ TYR A 90 -1.554 9.704 12.733 1.00 1.12 C ATOM 1297 OH TYR A 90 -2.012 10.005 13.976 1.00 64.33 O ATOM 0 H TYR A 90 2.437 10.297 9.894 1.00 14.31 H new ATOM 0 HA TYR A 90 1.828 8.462 7.700 1.00 3.33 H new ATOM 0 HB2 TYR A 90 -0.627 9.202 8.027 1.00 33.32 H new ATOM 0 HB3 TYR A 90 0.016 7.703 8.668 1.00 33.32 H new ATOM 0 HD1 TYR A 90 0.538 11.009 10.374 1.00 13.20 H new ATOM 0 HD2 TYR A 90 -1.777 7.390 10.227 1.00 44.12 H new ATOM 0 HE1 TYR A 90 -0.394 11.521 12.604 1.00 62.31 H new ATOM 0 HE2 TYR A 90 -2.660 7.861 12.498 1.00 3.43 H new ATOM 0 HH TYR A 90 -2.613 9.295 14.284 1.00 64.33 H new ATOM 1306 N PRO A 91 2.564 10.876 6.845 1.00 5.24 N ATOM 1307 CA PRO A 91 2.684 12.160 6.155 1.00 42.01 C ATOM 1308 C PRO A 91 1.730 12.260 4.958 1.00 44.04 C ATOM 1309 O PRO A 91 1.287 13.353 4.613 1.00 73.21 O ATOM 1310 CB PRO A 91 4.143 12.224 5.687 1.00 61.15 C ATOM 1311 CG PRO A 91 4.502 10.756 5.451 1.00 22.33 C ATOM 1312 CD PRO A 91 3.708 10.024 6.539 1.00 23.54 C ATOM 0 HA PRO A 91 2.419 12.987 6.813 1.00 42.01 H new ATOM 0 HB2 PRO A 91 4.248 12.815 4.777 1.00 61.15 H new ATOM 0 HB3 PRO A 91 4.787 12.680 6.439 1.00 61.15 H new ATOM 0 HG2 PRO A 91 4.215 10.427 4.452 1.00 22.33 H new ATOM 0 HG3 PRO A 91 5.574 10.582 5.549 1.00 22.33 H new ATOM 0 HD2 PRO A 91 3.382 9.044 6.191 1.00 23.54 H new ATOM 0 HD3 PRO A 91 4.321 9.860 7.426 1.00 23.54 H new ATOM 1317 N ALA A 92 1.405 11.130 4.322 1.00 0.10 N ATOM 1318 CA ALA A 92 0.801 11.069 3.001 1.00 15.52 C ATOM 1319 C ALA A 92 -0.414 10.146 3.044 1.00 13.04 C ATOM 1320 O ALA A 92 -0.463 9.218 3.863 1.00 34.31 O ATOM 1321 CB ALA A 92 1.857 10.553 2.009 1.00 40.32 C ATOM 0 H ALA A 92 1.563 10.209 4.730 1.00 0.10 H new ATOM 0 HA ALA A 92 0.465 12.055 2.681 1.00 15.52 H new ATOM 0 HB1 ALA A 92 1.423 10.500 1.011 1.00 40.32 H new ATOM 0 HB2 ALA A 92 2.709 11.233 1.999 1.00 40.32 H new ATOM 0 HB3 ALA A 92 2.188 9.560 2.314 1.00 40.32 H new ATOM 1327 N THR A 93 -1.342 10.317 2.107 1.00 2.15 N ATOM 1328 CA THR A 93 -2.479 9.419 1.920 1.00 44.11 C ATOM 1329 C THR A 93 -2.673 9.075 0.431 1.00 74.13 C ATOM 1330 O THR A 93 -3.812 9.040 -0.040 1.00 3.34 O ATOM 1331 CB THR A 93 -3.734 10.115 2.487 1.00 54.42 C ATOM 1332 OG1 THR A 93 -3.837 11.436 2.002 1.00 13.21 O ATOM 1333 CG2 THR A 93 -3.729 10.217 4.013 1.00 25.11 C ATOM 0 H THR A 93 -1.326 11.094 1.446 1.00 2.15 H new ATOM 0 HA THR A 93 -2.300 8.481 2.445 1.00 44.11 H new ATOM 0 HB THR A 93 -4.570 9.494 2.165 1.00 54.42 H new ATOM 0 HG1 THR A 93 -4.676 11.538 1.507 1.00 13.21 H new ATOM 0 HG21 THR A 93 -4.639 10.716 4.347 1.00 25.11 H new ATOM 0 HG22 THR A 93 -3.684 9.217 4.444 1.00 25.11 H new ATOM 0 HG23 THR A 93 -2.860 10.791 4.336 1.00 25.11 H new ATOM 1341 N PRO A 94 -1.633 8.616 -0.290 1.00 45.22 N ATOM 1342 CA PRO A 94 -1.858 7.897 -1.526 1.00 32.31 C ATOM 1343 C PRO A 94 -2.478 6.545 -1.193 1.00 31.40 C ATOM 1344 O PRO A 94 -3.412 6.097 -1.869 1.00 60.15 O ATOM 1345 CB PRO A 94 -0.482 7.772 -2.179 1.00 22.33 C ATOM 1346 CG PRO A 94 0.513 7.888 -1.039 1.00 11.43 C ATOM 1347 CD PRO A 94 -0.204 8.822 -0.091 1.00 43.31 C ATOM 0 HA PRO A 94 -2.545 8.397 -2.209 1.00 32.31 H new ATOM 0 HB2 PRO A 94 -0.377 6.819 -2.697 1.00 22.33 H new ATOM 0 HB3 PRO A 94 -0.325 8.556 -2.920 1.00 22.33 H new ATOM 0 HG2 PRO A 94 0.722 6.922 -0.580 1.00 11.43 H new ATOM 0 HG3 PRO A 94 1.468 8.297 -1.370 1.00 11.43 H new ATOM 0 HD2 PRO A 94 0.076 8.613 0.942 1.00 43.31 H new ATOM 0 HD3 PRO A 94 0.068 9.858 -0.291 1.00 43.31 H new ATOM 1352 N ILE A 95 -1.993 5.881 -0.137 1.00 42.34 N ATOM 1353 CA ILE A 95 -2.389 4.516 0.145 1.00 1.03 C ATOM 1354 C ILE A 95 -3.516 4.580 1.175 1.00 34.40 C ATOM 1355 O ILE A 95 -3.410 4.204 2.346 1.00 31.42 O ATOM 1356 CB ILE A 95 -1.208 3.633 0.582 1.00 13.54 C ATOM 1357 CG1 ILE A 95 0.219 4.066 0.168 1.00 14.51 C ATOM 1358 CG2 ILE A 95 -1.503 2.276 -0.051 1.00 52.11 C ATOM 1359 CD1 ILE A 95 0.505 4.173 -1.337 1.00 15.11 C ATOM 0 H ILE A 95 -1.328 6.275 0.529 1.00 42.34 H new ATOM 0 HA ILE A 95 -2.749 4.030 -0.761 1.00 1.03 H new ATOM 0 HB ILE A 95 -1.164 3.673 1.670 1.00 13.54 H new ATOM 0 HG12 ILE A 95 0.424 5.036 0.622 1.00 14.51 H new ATOM 0 HG13 ILE A 95 0.926 3.357 0.598 1.00 14.51 H new ATOM 0 HG21 ILE A 95 -0.710 1.574 0.206 1.00 52.11 H new ATOM 0 HG22 ILE A 95 -2.456 1.900 0.322 1.00 52.11 H new ATOM 0 HG23 ILE A 95 -1.555 2.383 -1.134 1.00 52.11 H new ATOM 0 HD11 ILE A 95 1.538 4.484 -1.490 1.00 15.11 H new ATOM 0 HD12 ILE A 95 0.345 3.203 -1.808 1.00 15.11 H new ATOM 0 HD13 ILE A 95 -0.165 4.908 -1.783 1.00 15.11 H new ATOM 1370 N LYS A 96 -4.614 5.117 0.680 1.00 15.30 N ATOM 1371 CA LYS A 96 -5.931 5.112 1.268 1.00 65.12 C ATOM 1372 C LYS A 96 -6.858 4.709 0.137 1.00 32.33 C ATOM 1373 O LYS A 96 -7.403 3.612 0.154 1.00 20.14 O ATOM 1374 CB LYS A 96 -6.247 6.496 1.874 1.00 60.25 C ATOM 1375 CG LYS A 96 -6.228 6.464 3.411 1.00 62.24 C ATOM 1376 CD LYS A 96 -7.455 5.708 3.938 1.00 71.44 C ATOM 1377 CE LYS A 96 -7.575 5.797 5.465 1.00 33.40 C ATOM 1378 NZ LYS A 96 -8.783 5.103 5.966 1.00 73.12 N ATOM 0 H LYS A 96 -4.602 5.606 -0.215 1.00 15.30 H new ATOM 0 HA LYS A 96 -6.038 4.417 2.101 1.00 65.12 H new ATOM 0 HB2 LYS A 96 -5.519 7.224 1.517 1.00 60.25 H new ATOM 0 HB3 LYS A 96 -7.226 6.829 1.529 1.00 60.25 H new ATOM 0 HG2 LYS A 96 -5.316 5.981 3.761 1.00 62.24 H new ATOM 0 HG3 LYS A 96 -6.221 7.481 3.804 1.00 62.24 H new ATOM 0 HD2 LYS A 96 -8.356 6.116 3.480 1.00 71.44 H new ATOM 0 HD3 LYS A 96 -7.391 4.661 3.640 1.00 71.44 H new ATOM 0 HE2 LYS A 96 -6.689 5.360 5.925 1.00 33.40 H new ATOM 0 HE3 LYS A 96 -7.607 6.844 5.766 1.00 33.40 H new ATOM 0 HZ1 LYS A 96 -8.827 5.187 7.002 1.00 73.12 H new ATOM 0 HZ2 LYS A 96 -9.631 5.536 5.547 1.00 73.12 H new ATOM 0 HZ3 LYS A 96 -8.741 4.098 5.701 1.00 73.12 H new ATOM 1388 N THR A 97 -6.916 5.530 -0.906 1.00 53.54 N ATOM 1389 CA THR A 97 -7.827 5.359 -2.022 1.00 20.35 C ATOM 1390 C THR A 97 -7.615 4.012 -2.730 1.00 63.32 C ATOM 1391 O THR A 97 -8.584 3.303 -2.989 1.00 14.15 O ATOM 1392 CB THR A 97 -7.640 6.586 -2.939 1.00 44.05 C ATOM 1393 OG1 THR A 97 -7.474 7.754 -2.144 1.00 40.25 O ATOM 1394 CG2 THR A 97 -8.815 6.755 -3.891 1.00 60.34 C ATOM 0 H THR A 97 -6.316 6.350 -0.997 1.00 53.54 H new ATOM 0 HA THR A 97 -8.864 5.317 -1.688 1.00 20.35 H new ATOM 0 HB THR A 97 -6.748 6.429 -3.545 1.00 44.05 H new ATOM 0 HG1 THR A 97 -7.527 8.549 -2.715 1.00 40.25 H new ATOM 0 HG21 THR A 97 -8.650 7.629 -4.522 1.00 60.34 H new ATOM 0 HG22 THR A 97 -8.907 5.867 -4.517 1.00 60.34 H new ATOM 0 HG23 THR A 97 -9.732 6.890 -3.317 1.00 60.34 H new ATOM 1402 N LEU A 98 -6.360 3.602 -2.980 1.00 53.32 N ATOM 1403 CA LEU A 98 -6.054 2.336 -3.662 1.00 74.11 C ATOM 1404 C LEU A 98 -6.627 1.150 -2.889 1.00 71.11 C ATOM 1405 O LEU A 98 -7.241 0.268 -3.475 1.00 33.33 O ATOM 1406 CB LEU A 98 -4.528 2.170 -3.814 1.00 63.13 C ATOM 1407 CG LEU A 98 -4.016 1.266 -4.955 1.00 44.11 C ATOM 1408 CD1 LEU A 98 -4.532 -0.169 -4.948 1.00 51.23 C ATOM 1409 CD2 LEU A 98 -4.260 1.871 -6.328 1.00 12.41 C ATOM 0 H LEU A 98 -5.533 4.137 -2.716 1.00 53.32 H new ATOM 0 HA LEU A 98 -6.514 2.362 -4.650 1.00 74.11 H new ATOM 0 HB2 LEU A 98 -4.095 3.161 -3.951 1.00 63.13 H new ATOM 0 HB3 LEU A 98 -4.138 1.778 -2.875 1.00 63.13 H new ATOM 0 HG LEU A 98 -2.947 1.211 -4.750 1.00 44.11 H new ATOM 0 HD11 LEU A 98 -4.108 -0.712 -5.793 1.00 51.23 H new ATOM 0 HD12 LEU A 98 -4.238 -0.657 -4.019 1.00 51.23 H new ATOM 0 HD13 LEU A 98 -5.619 -0.165 -5.028 1.00 51.23 H new ATOM 0 HD21 LEU A 98 -3.882 1.196 -7.096 1.00 12.41 H new ATOM 0 HD22 LEU A 98 -5.329 2.023 -6.474 1.00 12.41 H new ATOM 0 HD23 LEU A 98 -3.744 2.828 -6.401 1.00 12.41 H new ATOM 1420 N LEU A 99 -6.447 1.139 -1.566 1.00 51.41 N ATOM 1421 CA LEU A 99 -6.886 0.050 -0.691 1.00 52.22 C ATOM 1422 C LEU A 99 -8.373 -0.225 -0.903 1.00 23.31 C ATOM 1423 O LEU A 99 -8.778 -1.377 -1.040 1.00 51.11 O ATOM 1424 CB LEU A 99 -6.599 0.379 0.789 1.00 62.22 C ATOM 1425 CG LEU A 99 -5.099 0.411 1.139 1.00 63.33 C ATOM 1426 CD1 LEU A 99 -4.856 1.099 2.489 1.00 72.34 C ATOM 1427 CD2 LEU A 99 -4.507 -1.005 1.170 1.00 21.53 C ATOM 0 H LEU A 99 -5.985 1.898 -1.065 1.00 51.41 H new ATOM 0 HA LEU A 99 -6.323 -0.847 -0.948 1.00 52.22 H new ATOM 0 HB2 LEU A 99 -7.039 1.347 1.028 1.00 62.22 H new ATOM 0 HB3 LEU A 99 -7.094 -0.361 1.419 1.00 62.22 H new ATOM 0 HG LEU A 99 -4.600 0.985 0.358 1.00 63.33 H new ATOM 0 HD11 LEU A 99 -3.788 1.105 2.707 1.00 72.34 H new ATOM 0 HD12 LEU A 99 -5.224 2.124 2.446 1.00 72.34 H new ATOM 0 HD13 LEU A 99 -5.383 0.557 3.274 1.00 72.34 H new ATOM 0 HD21 LEU A 99 -3.447 -0.951 1.420 1.00 21.53 H new ATOM 0 HD22 LEU A 99 -5.027 -1.600 1.921 1.00 21.53 H new ATOM 0 HD23 LEU A 99 -4.626 -1.471 0.192 1.00 21.53 H new ATOM 1438 N ASP A 100 -9.190 0.821 -0.998 1.00 4.00 N ATOM 1439 CA ASP A 100 -10.637 0.693 -1.174 1.00 41.54 C ATOM 1440 C ASP A 100 -11.036 0.351 -2.616 1.00 2.23 C ATOM 1441 O ASP A 100 -12.213 0.142 -2.909 1.00 21.31 O ATOM 1442 CB ASP A 100 -11.309 1.997 -0.736 1.00 52.04 C ATOM 1443 CG ASP A 100 -12.611 1.811 0.050 1.00 43.34 C ATOM 1444 OD1 ASP A 100 -12.871 0.713 0.600 1.00 32.14 O ATOM 1445 OD2 ASP A 100 -13.297 2.842 0.221 1.00 40.11 O ATOM 0 H ASP A 100 -8.866 1.787 -0.955 1.00 4.00 H new ATOM 0 HA ASP A 100 -10.974 -0.139 -0.555 1.00 41.54 H new ATOM 0 HB2 ASP A 100 -10.608 2.564 -0.123 1.00 52.04 H new ATOM 0 HB3 ASP A 100 -11.517 2.598 -1.621 1.00 52.04 H new ATOM 1449 N GLN A 101 -10.070 0.289 -3.539 1.00 24.22 N ATOM 1450 CA GLN A 101 -10.233 -0.317 -4.860 1.00 41.01 C ATOM 1451 C GLN A 101 -9.813 -1.799 -4.864 1.00 33.53 C ATOM 1452 O GLN A 101 -10.122 -2.515 -5.815 1.00 62.33 O ATOM 1453 CB GLN A 101 -9.472 0.475 -5.942 1.00 45.52 C ATOM 1454 CG GLN A 101 -9.895 1.955 -6.045 1.00 54.34 C ATOM 1455 CD GLN A 101 -9.558 2.592 -7.399 1.00 23.41 C ATOM 1456 OE1 GLN A 101 -9.673 1.955 -8.439 1.00 20.41 O ATOM 1457 NE2 GLN A 101 -9.212 3.870 -7.453 1.00 45.33 N ATOM 0 H GLN A 101 -9.135 0.667 -3.383 1.00 24.22 H new ATOM 0 HA GLN A 101 -11.295 -0.276 -5.101 1.00 41.01 H new ATOM 0 HB2 GLN A 101 -8.404 0.426 -5.731 1.00 45.52 H new ATOM 0 HB3 GLN A 101 -9.628 -0.006 -6.908 1.00 45.52 H new ATOM 0 HG2 GLN A 101 -10.969 2.031 -5.873 1.00 54.34 H new ATOM 0 HG3 GLN A 101 -9.405 2.521 -5.253 1.00 54.34 H new ATOM 0 HE21 GLN A 101 -9.114 4.409 -6.592 1.00 45.33 H new ATOM 0 HE22 GLN A 101 -9.044 4.315 -8.355 1.00 45.33 H new ATOM 1464 N MET A 102 -9.140 -2.306 -3.823 1.00 74.25 N ATOM 1465 CA MET A 102 -8.704 -3.707 -3.743 1.00 1.43 C ATOM 1466 C MET A 102 -9.713 -4.603 -3.012 1.00 44.13 C ATOM 1467 O MET A 102 -9.363 -5.727 -2.658 1.00 15.02 O ATOM 1468 CB MET A 102 -7.350 -3.822 -3.034 1.00 44.01 C ATOM 1469 CG MET A 102 -6.213 -3.018 -3.662 1.00 72.42 C ATOM 1470 SD MET A 102 -4.699 -3.016 -2.651 1.00 54.11 S ATOM 1471 CE MET A 102 -4.347 -4.794 -2.618 1.00 53.43 C ATOM 0 H MET A 102 -8.881 -1.752 -3.007 1.00 74.25 H new ATOM 0 HA MET A 102 -8.621 -4.050 -4.774 1.00 1.43 H new ATOM 0 HB2 MET A 102 -7.472 -3.501 -2.000 1.00 44.01 H new ATOM 0 HB3 MET A 102 -7.060 -4.872 -3.009 1.00 44.01 H new ATOM 0 HG2 MET A 102 -5.986 -3.428 -4.646 1.00 72.42 H new ATOM 0 HG3 MET A 102 -6.543 -1.990 -3.814 1.00 72.42 H new ATOM 0 HE1 MET A 102 -3.295 -4.952 -2.379 1.00 53.43 H new ATOM 0 HE2 MET A 102 -4.968 -5.274 -1.861 1.00 53.43 H new ATOM 0 HE3 MET A 102 -4.566 -5.226 -3.594 1.00 53.43 H new ATOM 1479 N LYS A 103 -10.947 -4.139 -2.766 1.00 40.42 N ATOM 1480 CA LYS A 103 -11.968 -4.836 -1.972 1.00 73.35 C ATOM 1481 C LYS A 103 -12.036 -6.313 -2.357 1.00 22.20 C ATOM 1482 O LYS A 103 -12.038 -7.181 -1.481 1.00 23.40 O ATOM 1483 CB LYS A 103 -13.355 -4.209 -2.214 1.00 42.34 C ATOM 1484 CG LYS A 103 -13.540 -2.737 -1.805 1.00 52.55 C ATOM 1485 CD LYS A 103 -14.253 -2.530 -0.460 1.00 53.21 C ATOM 1486 CE LYS A 103 -13.263 -2.437 0.700 1.00 43.02 C ATOM 1487 NZ LYS A 103 -13.931 -2.146 1.984 1.00 11.10 N ATOM 0 H LYS A 103 -11.271 -3.241 -3.125 1.00 40.42 H new ATOM 0 HA LYS A 103 -11.692 -4.741 -0.922 1.00 73.35 H new ATOM 0 HB2 LYS A 103 -13.585 -4.297 -3.276 1.00 42.34 H new ATOM 0 HB3 LYS A 103 -14.094 -4.805 -1.678 1.00 42.34 H new ATOM 0 HG2 LYS A 103 -12.561 -2.261 -1.759 1.00 52.55 H new ATOM 0 HG3 LYS A 103 -14.106 -2.226 -2.584 1.00 52.55 H new ATOM 0 HD2 LYS A 103 -14.850 -1.619 -0.502 1.00 53.21 H new ATOM 0 HD3 LYS A 103 -14.943 -3.355 -0.284 1.00 53.21 H new ATOM 0 HE2 LYS A 103 -12.714 -3.375 0.783 1.00 43.02 H new ATOM 0 HE3 LYS A 103 -12.531 -1.657 0.489 1.00 43.02 H new ATOM 0 HZ1 LYS A 103 -13.220 -2.092 2.741 1.00 11.10 H new ATOM 0 HZ2 LYS A 103 -14.434 -1.238 1.916 1.00 11.10 H new ATOM 0 HZ3 LYS A 103 -14.611 -2.903 2.201 1.00 11.10 H new ATOM 1497 N ASN A 104 -12.039 -6.595 -3.660 1.00 74.44 N ATOM 1498 CA ASN A 104 -12.220 -7.914 -4.248 1.00 75.25 C ATOM 1499 C ASN A 104 -10.918 -8.372 -4.891 1.00 0.20 C ATOM 1500 O ASN A 104 -10.878 -8.714 -6.074 1.00 13.34 O ATOM 1501 CB ASN A 104 -13.395 -7.882 -5.230 1.00 44.33 C ATOM 1502 CG ASN A 104 -14.664 -7.493 -4.502 1.00 2.31 C ATOM 1503 OD1 ASN A 104 -15.211 -8.278 -3.730 1.00 31.44 O ATOM 1504 ND2 ASN A 104 -15.147 -6.279 -4.685 1.00 0.21 N ATOM 0 H ASN A 104 -11.908 -5.870 -4.366 1.00 74.44 H new ATOM 0 HA ASN A 104 -12.468 -8.645 -3.478 1.00 75.25 H new ATOM 0 HB2 ASN A 104 -13.192 -7.171 -6.031 1.00 44.33 H new ATOM 0 HB3 ASN A 104 -13.518 -8.860 -5.696 1.00 44.33 H new ATOM 0 HD21 ASN A 104 -15.984 -5.982 -4.183 1.00 0.21 H new ATOM 0 HD22 ASN A 104 -14.684 -5.637 -5.328 1.00 0.21 H new ATOM 1510 N TYR A 105 -9.849 -8.359 -4.097 1.00 60.35 N ATOM 1511 CA TYR A 105 -8.600 -9.070 -4.351 1.00 32.55 C ATOM 1512 C TYR A 105 -8.560 -10.427 -3.611 1.00 11.30 C ATOM 1513 O TYR A 105 -9.348 -10.671 -2.689 1.00 65.35 O ATOM 1514 CB TYR A 105 -7.479 -8.108 -3.932 1.00 40.04 C ATOM 1515 CG TYR A 105 -6.106 -8.718 -3.867 1.00 24.11 C ATOM 1516 CD1 TYR A 105 -5.493 -9.194 -5.040 1.00 24.10 C ATOM 1517 CD2 TYR A 105 -5.481 -8.875 -2.617 1.00 25.52 C ATOM 1518 CE1 TYR A 105 -4.250 -9.839 -4.965 1.00 21.24 C ATOM 1519 CE2 TYR A 105 -4.240 -9.520 -2.537 1.00 1.22 C ATOM 1520 CZ TYR A 105 -3.626 -10.005 -3.709 1.00 75.33 C ATOM 1521 OH TYR A 105 -2.436 -10.636 -3.600 1.00 41.23 O ATOM 0 H TYR A 105 -9.830 -7.831 -3.224 1.00 60.35 H new ATOM 0 HA TYR A 105 -8.487 -9.338 -5.401 1.00 32.55 H new ATOM 0 HB2 TYR A 105 -7.456 -7.274 -4.633 1.00 40.04 H new ATOM 0 HB3 TYR A 105 -7.723 -7.695 -2.953 1.00 40.04 H new ATOM 0 HD1 TYR A 105 -5.978 -9.063 -5.996 1.00 24.10 H new ATOM 0 HD2 TYR A 105 -5.956 -8.500 -1.722 1.00 25.52 H new ATOM 0 HE1 TYR A 105 -3.773 -10.206 -5.862 1.00 21.24 H new ATOM 0 HE2 TYR A 105 -3.755 -9.645 -1.580 1.00 1.22 H new ATOM 0 HH TYR A 105 -1.775 -10.024 -3.213 1.00 41.23 H new ATOM 1530 N ARG A 106 -7.651 -11.329 -4.007 1.00 2.53 N ATOM 1531 CA ARG A 106 -7.396 -12.651 -3.433 1.00 3.42 C ATOM 1532 C ARG A 106 -5.891 -12.830 -3.353 1.00 43.51 C ATOM 1533 O ARG A 106 -5.212 -12.535 -4.335 1.00 51.03 O ATOM 1534 CB ARG A 106 -7.928 -13.762 -4.338 1.00 41.31 C ATOM 1535 CG ARG A 106 -9.454 -13.823 -4.421 1.00 2.22 C ATOM 1536 CD ARG A 106 -9.931 -15.269 -4.495 1.00 32.12 C ATOM 1537 NE ARG A 106 -11.180 -15.374 -5.263 1.00 0.03 N ATOM 1538 CZ ARG A 106 -12.017 -16.412 -5.262 1.00 2.41 C ATOM 1539 NH1 ARG A 106 -11.854 -17.426 -4.418 1.00 12.40 N ATOM 1540 NH2 ARG A 106 -13.032 -16.423 -6.122 1.00 63.14 N ATOM 0 H ARG A 106 -7.032 -11.136 -4.794 1.00 2.53 H new ATOM 0 HA ARG A 106 -7.886 -12.712 -2.461 1.00 3.42 H new ATOM 0 HB2 ARG A 106 -7.526 -13.622 -5.341 1.00 41.31 H new ATOM 0 HB3 ARG A 106 -7.556 -14.720 -3.976 1.00 41.31 H new ATOM 0 HG2 ARG A 106 -9.891 -13.335 -3.550 1.00 2.22 H new ATOM 0 HG3 ARG A 106 -9.798 -13.276 -5.299 1.00 2.22 H new ATOM 0 HD2 ARG A 106 -9.162 -15.886 -4.959 1.00 32.12 H new ATOM 0 HD3 ARG A 106 -10.086 -15.656 -3.488 1.00 32.12 H new ATOM 0 HE ARG A 106 -11.430 -14.579 -5.851 1.00 0.03 H new ATOM 0 HH11 ARG A 106 -11.078 -17.419 -3.756 1.00 12.40 H new ATOM 0 HH12 ARG A 106 -12.505 -18.211 -4.432 1.00 12.40 H new ATOM 0 HH21 ARG A 106 -13.161 -15.645 -6.769 1.00 63.14 H new ATOM 0 HH22 ARG A 106 -13.681 -17.209 -6.134 1.00 63.14 H new ATOM 1551 N GLY A 107 -5.384 -13.348 -2.238 1.00 53.14 N ATOM 1552 CA GLY A 107 -3.961 -13.557 -2.050 1.00 13.51 C ATOM 1553 C GLY A 107 -3.480 -12.781 -0.835 1.00 11.22 C ATOM 1554 O GLY A 107 -4.069 -12.886 0.250 1.00 54.21 O ATOM 0 H GLY A 107 -5.953 -13.633 -1.441 1.00 53.14 H new ATOM 0 HA2 GLY A 107 -3.755 -14.619 -1.919 1.00 13.51 H new ATOM 0 HA3 GLY A 107 -3.417 -13.234 -2.937 1.00 13.51 H new ATOM 1558 N GLU A 108 -2.401 -12.016 -0.992 1.00 44.14 N ATOM 1559 CA GLU A 108 -1.548 -11.543 0.083 1.00 25.11 C ATOM 1560 C GLU A 108 -1.142 -10.107 -0.214 1.00 43.21 C ATOM 1561 O GLU A 108 -0.585 -9.842 -1.278 1.00 54.32 O ATOM 1562 CB GLU A 108 -0.299 -12.432 0.151 1.00 44.45 C ATOM 1563 CG GLU A 108 -0.585 -13.796 0.786 1.00 32.43 C ATOM 1564 CD GLU A 108 0.660 -14.693 0.801 1.00 54.41 C ATOM 1565 OE1 GLU A 108 1.444 -14.581 1.774 1.00 5.41 O ATOM 1566 OE2 GLU A 108 0.824 -15.510 -0.140 1.00 60.33 O ATOM 0 H GLU A 108 -2.090 -11.699 -1.910 1.00 44.14 H new ATOM 0 HA GLU A 108 -2.075 -11.584 1.036 1.00 25.11 H new ATOM 0 HB2 GLU A 108 0.094 -12.578 -0.855 1.00 44.45 H new ATOM 0 HB3 GLU A 108 0.475 -11.923 0.725 1.00 44.45 H new ATOM 0 HG2 GLU A 108 -0.942 -13.654 1.806 1.00 32.43 H new ATOM 0 HG3 GLU A 108 -1.384 -14.293 0.235 1.00 32.43 H new ATOM 1571 N VAL A 109 -1.400 -9.183 0.715 1.00 41.41 N ATOM 1572 CA VAL A 109 -0.913 -7.806 0.564 1.00 24.50 C ATOM 1573 C VAL A 109 0.167 -7.525 1.613 1.00 62.33 C ATOM 1574 O VAL A 109 -0.051 -7.782 2.802 1.00 21.53 O ATOM 1575 CB VAL A 109 -2.058 -6.775 0.635 1.00 42.03 C ATOM 1576 CG1 VAL A 109 -1.620 -5.464 -0.034 1.00 14.02 C ATOM 1577 CG2 VAL A 109 -3.367 -7.215 -0.044 1.00 71.12 C ATOM 0 H VAL A 109 -1.934 -9.357 1.567 1.00 41.41 H new ATOM 0 HA VAL A 109 -0.474 -7.704 -0.428 1.00 24.50 H new ATOM 0 HB VAL A 109 -2.262 -6.659 1.699 1.00 42.03 H new ATOM 0 HG11 VAL A 109 -2.433 -4.739 0.019 1.00 14.02 H new ATOM 0 HG12 VAL A 109 -0.745 -5.067 0.481 1.00 14.02 H new ATOM 0 HG13 VAL A 109 -1.371 -5.654 -1.078 1.00 14.02 H new ATOM 0 HG21 VAL A 109 -4.112 -6.426 0.057 1.00 71.12 H new ATOM 0 HG22 VAL A 109 -3.182 -7.406 -1.101 1.00 71.12 H new ATOM 0 HG23 VAL A 109 -3.735 -8.125 0.430 1.00 71.12 H new ATOM 1587 N ALA A 110 1.298 -6.949 1.201 1.00 1.42 N ATOM 1588 CA ALA A 110 2.252 -6.293 2.091 1.00 13.50 C ATOM 1589 C ALA A 110 2.487 -4.865 1.600 1.00 35.41 C ATOM 1590 O ALA A 110 2.173 -4.524 0.457 1.00 11.32 O ATOM 1591 CB ALA A 110 3.570 -7.069 2.145 1.00 44.12 C ATOM 0 H ALA A 110 1.580 -6.926 0.221 1.00 1.42 H new ATOM 0 HA ALA A 110 1.844 -6.268 3.101 1.00 13.50 H new ATOM 0 HB1 ALA A 110 4.264 -6.561 2.814 1.00 44.12 H new ATOM 0 HB2 ALA A 110 3.383 -8.078 2.513 1.00 44.12 H new ATOM 0 HB3 ALA A 110 4.002 -7.122 1.146 1.00 44.12 H new ATOM 1597 N SER A 111 3.071 -4.025 2.452 1.00 0.15 N ATOM 1598 CA SER A 111 3.211 -2.608 2.175 1.00 44.24 C ATOM 1599 C SER A 111 4.467 -2.091 2.873 1.00 13.05 C ATOM 1600 O SER A 111 4.410 -1.783 4.065 1.00 34.23 O ATOM 1601 CB SER A 111 1.930 -1.941 2.677 1.00 12.03 C ATOM 1602 OG SER A 111 1.779 -0.617 2.209 1.00 61.11 O ATOM 0 H SER A 111 3.458 -4.313 3.351 1.00 0.15 H new ATOM 0 HA SER A 111 3.333 -2.388 1.114 1.00 44.24 H new ATOM 0 HB2 SER A 111 1.071 -2.533 2.361 1.00 12.03 H new ATOM 0 HB3 SER A 111 1.931 -1.938 3.767 1.00 12.03 H new ATOM 0 HG SER A 111 0.945 -0.240 2.558 1.00 61.11 H new ATOM 1607 N PHE A 112 5.591 -2.026 2.157 1.00 20.11 N ATOM 1608 CA PHE A 112 6.925 -1.773 2.701 1.00 61.32 C ATOM 1609 C PHE A 112 7.187 -0.265 2.767 1.00 20.53 C ATOM 1610 O PHE A 112 6.652 0.473 1.934 1.00 12.45 O ATOM 1611 CB PHE A 112 7.964 -2.486 1.813 1.00 31.52 C ATOM 1612 CG PHE A 112 8.111 -1.921 0.404 1.00 32.22 C ATOM 1613 CD1 PHE A 112 7.219 -2.287 -0.626 1.00 60.23 C ATOM 1614 CD2 PHE A 112 9.149 -1.010 0.124 1.00 72.24 C ATOM 1615 CE1 PHE A 112 7.342 -1.722 -1.907 1.00 74.21 C ATOM 1616 CE2 PHE A 112 9.275 -0.452 -1.161 1.00 52.45 C ATOM 1617 CZ PHE A 112 8.366 -0.801 -2.175 1.00 75.42 C ATOM 0 H PHE A 112 5.597 -2.153 1.145 1.00 20.11 H new ATOM 0 HA PHE A 112 7.000 -2.164 3.716 1.00 61.32 H new ATOM 0 HB2 PHE A 112 8.934 -2.441 2.308 1.00 31.52 H new ATOM 0 HB3 PHE A 112 7.693 -3.539 1.738 1.00 31.52 H new ATOM 0 HD1 PHE A 112 6.437 -3.006 -0.429 1.00 60.23 H new ATOM 0 HD2 PHE A 112 9.851 -0.739 0.899 1.00 72.24 H new ATOM 0 HE1 PHE A 112 6.647 -1.997 -2.687 1.00 74.21 H new ATOM 0 HE2 PHE A 112 10.072 0.246 -1.369 1.00 52.45 H new ATOM 0 HZ PHE A 112 8.456 -0.361 -3.157 1.00 75.42 H new ATOM 1626 N PHE A 113 8.046 0.218 3.676 1.00 12.20 N ATOM 1627 CA PHE A 113 8.411 1.641 3.744 1.00 35.54 C ATOM 1628 C PHE A 113 9.906 1.867 3.576 1.00 21.41 C ATOM 1629 O PHE A 113 10.732 1.041 3.963 1.00 74.21 O ATOM 1630 CB PHE A 113 7.917 2.322 5.029 1.00 24.32 C ATOM 1631 CG PHE A 113 8.260 1.649 6.340 1.00 22.15 C ATOM 1632 CD1 PHE A 113 9.446 1.939 7.037 1.00 1.10 C ATOM 1633 CD2 PHE A 113 7.335 0.756 6.894 1.00 33.43 C ATOM 1634 CE1 PHE A 113 9.691 1.332 8.282 1.00 21.22 C ATOM 1635 CE2 PHE A 113 7.606 0.100 8.103 1.00 44.15 C ATOM 1636 CZ PHE A 113 8.791 0.380 8.795 1.00 42.42 C ATOM 0 H PHE A 113 8.504 -0.361 4.380 1.00 12.20 H new ATOM 0 HA PHE A 113 7.899 2.106 2.902 1.00 35.54 H new ATOM 0 HB2 PHE A 113 8.321 3.334 5.052 1.00 24.32 H new ATOM 0 HB3 PHE A 113 6.832 2.413 4.969 1.00 24.32 H new ATOM 0 HD1 PHE A 113 10.167 2.626 6.618 1.00 1.10 H new ATOM 0 HD2 PHE A 113 6.401 0.570 6.384 1.00 33.43 H new ATOM 0 HE1 PHE A 113 10.573 1.598 8.846 1.00 21.22 H new ATOM 0 HE2 PHE A 113 6.904 -0.618 8.499 1.00 44.15 H new ATOM 0 HZ PHE A 113 9.013 -0.133 9.719 1.00 42.42 H new ATOM 1645 N THR A 114 10.249 3.036 3.045 1.00 43.42 N ATOM 1646 CA THR A 114 11.605 3.471 2.747 1.00 13.20 C ATOM 1647 C THR A 114 12.249 4.267 3.895 1.00 73.11 C ATOM 1648 O THR A 114 13.464 4.487 3.873 1.00 74.53 O ATOM 1649 CB THR A 114 11.526 4.321 1.461 1.00 5.22 C ATOM 1650 OG1 THR A 114 10.379 5.159 1.495 1.00 53.41 O ATOM 1651 CG2 THR A 114 11.435 3.444 0.207 1.00 65.24 C ATOM 0 H THR A 114 9.552 3.739 2.799 1.00 43.42 H new ATOM 0 HA THR A 114 12.245 2.599 2.613 1.00 13.20 H new ATOM 0 HB THR A 114 12.438 4.917 1.417 1.00 5.22 H new ATOM 0 HG1 THR A 114 10.341 5.694 0.675 1.00 53.41 H new ATOM 0 HG21 THR A 114 11.381 4.079 -0.678 1.00 65.24 H new ATOM 0 HG22 THR A 114 12.317 2.807 0.144 1.00 65.24 H new ATOM 0 HG23 THR A 114 10.542 2.822 0.262 1.00 65.24 H new ATOM 1659 N SER A 115 11.475 4.727 4.884 1.00 52.44 N ATOM 1660 CA SER A 115 11.892 5.739 5.851 1.00 55.51 C ATOM 1661 C SER A 115 11.270 5.461 7.215 1.00 2.00 C ATOM 1662 O SER A 115 10.137 4.992 7.284 1.00 21.43 O ATOM 1663 CB SER A 115 11.453 7.102 5.315 1.00 75.13 C ATOM 1664 OG SER A 115 12.254 7.437 4.195 1.00 52.34 O ATOM 0 H SER A 115 10.522 4.397 5.035 1.00 52.44 H new ATOM 0 HA SER A 115 12.974 5.721 5.981 1.00 55.51 H new ATOM 0 HB2 SER A 115 10.401 7.074 5.031 1.00 75.13 H new ATOM 0 HB3 SER A 115 11.553 7.862 6.090 1.00 75.13 H new ATOM 0 HG SER A 115 11.977 8.309 3.844 1.00 52.34 H new ATOM 1669 N ALA A 116 12.016 5.717 8.294 1.00 75.21 N ATOM 1670 CA ALA A 116 11.685 5.242 9.640 1.00 34.13 C ATOM 1671 C ALA A 116 12.159 6.187 10.756 1.00 53.01 C ATOM 1672 O ALA A 116 12.004 5.852 11.933 1.00 63.51 O ATOM 1673 CB ALA A 116 12.339 3.865 9.819 1.00 20.51 C ATOM 0 H ALA A 116 12.875 6.265 8.257 1.00 75.21 H new ATOM 0 HA ALA A 116 10.599 5.195 9.726 1.00 34.13 H new ATOM 0 HB1 ALA A 116 12.112 3.481 10.814 1.00 20.51 H new ATOM 0 HB2 ALA A 116 11.951 3.178 9.067 1.00 20.51 H new ATOM 0 HB3 ALA A 116 13.419 3.957 9.703 1.00 20.51 H new ATOM 1679 N GLY A 117 12.769 7.324 10.396 1.00 45.21 N ATOM 1680 CA GLY A 117 13.749 8.052 11.193 1.00 34.40 C ATOM 1681 C GLY A 117 13.365 8.186 12.650 1.00 12.32 C ATOM 1682 O GLY A 117 14.085 7.709 13.527 1.00 52.32 O ATOM 0 H GLY A 117 12.580 7.776 9.501 1.00 45.21 H new ATOM 0 HA2 GLY A 117 14.711 7.543 11.125 1.00 34.40 H new ATOM 0 HA3 GLY A 117 13.884 9.047 10.768 1.00 34.40 H new ATOM 1686 N THR A 118 12.240 8.835 12.915 1.00 14.33 N ATOM 1687 CA THR A 118 11.706 9.039 14.253 1.00 4.20 C ATOM 1688 C THR A 118 10.258 8.525 14.323 1.00 33.41 C ATOM 1689 O THR A 118 9.572 8.730 15.324 1.00 54.04 O ATOM 1690 CB THR A 118 11.858 10.521 14.658 1.00 44.14 C ATOM 1691 OG1 THR A 118 12.926 11.187 13.989 1.00 32.12 O ATOM 1692 CG2 THR A 118 12.133 10.641 16.158 1.00 51.25 C ATOM 0 H THR A 118 11.658 9.245 12.185 1.00 14.33 H new ATOM 0 HA THR A 118 12.273 8.460 14.982 1.00 4.20 H new ATOM 0 HB THR A 118 10.916 10.991 14.376 1.00 44.14 H new ATOM 0 HG1 THR A 118 12.968 12.120 14.287 1.00 32.12 H new ATOM 0 HG21 THR A 118 12.237 11.692 16.426 1.00 51.25 H new ATOM 0 HG22 THR A 118 11.304 10.205 16.716 1.00 51.25 H new ATOM 0 HG23 THR A 118 13.054 10.111 16.403 1.00 51.25 H new ATOM 1700 N ASN A 119 9.776 7.842 13.277 1.00 73.43 N ATOM 1701 CA ASN A 119 8.446 7.261 13.225 1.00 24.12 C ATOM 1702 C ASN A 119 8.529 5.902 12.549 1.00 44.41 C ATOM 1703 O ASN A 119 8.506 5.803 11.322 1.00 0.24 O ATOM 1704 CB ASN A 119 7.458 8.190 12.507 1.00 54.13 C ATOM 1705 CG ASN A 119 6.608 9.004 13.469 1.00 53.23 C ATOM 1706 OD1 ASN A 119 6.561 10.222 13.377 1.00 60.14 O ATOM 1707 ND2 ASN A 119 5.844 8.361 14.336 1.00 23.32 N ATOM 0 H ASN A 119 10.319 7.679 12.429 1.00 73.43 H new ATOM 0 HA ASN A 119 8.068 7.132 14.239 1.00 24.12 H new ATOM 0 HB2 ASN A 119 8.011 8.867 11.856 1.00 54.13 H new ATOM 0 HB3 ASN A 119 6.806 7.595 11.868 1.00 54.13 H new ATOM 0 HD21 ASN A 119 5.206 8.882 14.938 1.00 23.32 H new ATOM 0 HD22 ASN A 119 5.893 7.344 14.403 1.00 23.32 H new ATOM 1713 N HIS A 120 8.610 4.856 13.366 1.00 1.51 N ATOM 1714 CA HIS A 120 8.705 3.466 12.954 1.00 23.31 C ATOM 1715 C HIS A 120 7.537 2.718 13.585 1.00 11.30 C ATOM 1716 O HIS A 120 6.580 2.380 12.891 1.00 24.30 O ATOM 1717 CB HIS A 120 10.087 2.936 13.365 1.00 31.34 C ATOM 1718 CG HIS A 120 10.365 1.497 13.040 1.00 14.10 C ATOM 1719 ND1 HIS A 120 10.838 0.525 13.895 1.00 1.04 N ATOM 1720 CD2 HIS A 120 10.352 0.975 11.782 1.00 53.12 C ATOM 1721 CE1 HIS A 120 11.114 -0.559 13.148 1.00 1.04 C ATOM 1722 NE2 HIS A 120 10.880 -0.312 11.848 1.00 52.04 N ATOM 0 H HIS A 120 8.611 4.963 14.380 1.00 1.51 H new ATOM 0 HA HIS A 120 8.629 3.331 11.875 1.00 23.31 H new ATOM 0 HB2 HIS A 120 10.847 3.550 12.882 1.00 31.34 H new ATOM 0 HB3 HIS A 120 10.201 3.073 14.440 1.00 31.34 H new ATOM 0 HD2 HIS A 120 9.996 1.471 10.891 1.00 53.12 H new ATOM 0 HE1 HIS A 120 11.474 -1.499 13.539 1.00 1.04 H new ATOM 0 HE2 HIS A 120 11.054 -0.942 11.065 1.00 52.04 H new ATOM 1729 N LYS A 121 7.548 2.550 14.913 1.00 3.44 N ATOM 1730 CA LYS A 121 6.514 1.800 15.631 1.00 31.34 C ATOM 1731 C LYS A 121 5.117 2.369 15.367 1.00 53.25 C ATOM 1732 O LYS A 121 4.184 1.583 15.213 1.00 13.10 O ATOM 1733 CB LYS A 121 6.816 1.769 17.140 1.00 40.41 C ATOM 1734 CG LYS A 121 8.147 1.097 17.528 1.00 2.35 C ATOM 1735 CD LYS A 121 8.177 -0.434 17.375 1.00 64.31 C ATOM 1736 CE LYS A 121 7.340 -1.128 18.462 1.00 11.21 C ATOM 1737 NZ LYS A 121 7.482 -2.600 18.419 1.00 53.42 N ATOM 0 H LYS A 121 8.275 2.931 15.519 1.00 3.44 H new ATOM 0 HA LYS A 121 6.526 0.777 15.254 1.00 31.34 H new ATOM 0 HB2 LYS A 121 6.821 2.793 17.514 1.00 40.41 H new ATOM 0 HB3 LYS A 121 6.003 1.249 17.647 1.00 40.41 H new ATOM 0 HG2 LYS A 121 8.942 1.523 16.916 1.00 2.35 H new ATOM 0 HG3 LYS A 121 8.373 1.347 18.565 1.00 2.35 H new ATOM 0 HD2 LYS A 121 7.797 -0.709 16.391 1.00 64.31 H new ATOM 0 HD3 LYS A 121 9.207 -0.785 17.429 1.00 64.31 H new ATOM 0 HE2 LYS A 121 7.646 -0.763 19.443 1.00 11.21 H new ATOM 0 HE3 LYS A 121 6.291 -0.862 18.336 1.00 11.21 H new ATOM 0 HZ1 LYS A 121 6.901 -3.027 19.169 1.00 53.42 H new ATOM 0 HZ2 LYS A 121 7.166 -2.952 17.493 1.00 53.42 H new ATOM 0 HZ3 LYS A 121 8.479 -2.857 18.565 1.00 53.42 H new ATOM 1747 N ALA A 122 4.959 3.697 15.267 1.00 2.24 N ATOM 1748 CA ALA A 122 3.671 4.298 14.954 1.00 35.25 C ATOM 1749 C ALA A 122 3.124 3.786 13.629 1.00 35.40 C ATOM 1750 O ALA A 122 1.962 3.410 13.565 1.00 24.52 O ATOM 1751 CB ALA A 122 3.796 5.819 14.884 1.00 1.01 C ATOM 0 H ALA A 122 5.714 4.370 15.400 1.00 2.24 H new ATOM 0 HA ALA A 122 2.981 4.018 15.750 1.00 35.25 H new ATOM 0 HB1 ALA A 122 2.824 6.253 14.649 1.00 1.01 H new ATOM 0 HB2 ALA A 122 4.141 6.200 15.845 1.00 1.01 H new ATOM 0 HB3 ALA A 122 4.512 6.090 14.108 1.00 1.01 H new ATOM 1757 N TYR A 123 3.950 3.777 12.582 1.00 62.23 N ATOM 1758 CA TYR A 123 3.511 3.517 11.220 1.00 72.21 C ATOM 1759 C TYR A 123 2.860 2.135 11.095 1.00 24.33 C ATOM 1760 O TYR A 123 1.801 2.008 10.486 1.00 2.54 O ATOM 1761 CB TYR A 123 4.704 3.696 10.274 1.00 61.31 C ATOM 1762 CG TYR A 123 4.346 3.384 8.841 1.00 33.22 C ATOM 1763 CD1 TYR A 123 3.757 4.366 8.024 1.00 3.02 C ATOM 1764 CD2 TYR A 123 4.504 2.072 8.364 1.00 41.14 C ATOM 1765 CE1 TYR A 123 3.285 4.030 6.748 1.00 33.25 C ATOM 1766 CE2 TYR A 123 4.012 1.726 7.099 1.00 22.34 C ATOM 1767 CZ TYR A 123 3.376 2.700 6.297 1.00 40.51 C ATOM 1768 OH TYR A 123 2.838 2.372 5.095 1.00 34.25 O ATOM 0 H TYR A 123 4.952 3.952 12.662 1.00 62.23 H new ATOM 0 HA TYR A 123 2.738 4.232 10.939 1.00 72.21 H new ATOM 0 HB2 TYR A 123 5.068 4.721 10.341 1.00 61.31 H new ATOM 0 HB3 TYR A 123 5.519 3.047 10.593 1.00 61.31 H new ATOM 0 HD1 TYR A 123 3.668 5.381 8.381 1.00 3.02 H new ATOM 0 HD2 TYR A 123 5.004 1.332 8.971 1.00 41.14 H new ATOM 0 HE1 TYR A 123 2.853 4.789 6.113 1.00 33.25 H new ATOM 0 HE2 TYR A 123 4.119 0.714 6.737 1.00 22.34 H new ATOM 0 HH TYR A 123 2.982 1.418 4.922 1.00 34.25 H new ATOM 1777 N VAL A 124 3.453 1.117 11.726 1.00 75.12 N ATOM 1778 CA VAL A 124 2.931 -0.249 11.733 1.00 52.33 C ATOM 1779 C VAL A 124 1.495 -0.282 12.307 1.00 34.40 C ATOM 1780 O VAL A 124 0.642 -1.007 11.794 1.00 72.54 O ATOM 1781 CB VAL A 124 3.936 -1.154 12.489 1.00 32.30 C ATOM 1782 CG1 VAL A 124 3.486 -2.621 12.524 1.00 5.32 C ATOM 1783 CG2 VAL A 124 5.355 -1.104 11.871 1.00 40.11 C ATOM 0 H VAL A 124 4.320 1.222 12.253 1.00 75.12 H new ATOM 0 HA VAL A 124 2.839 -0.639 10.719 1.00 52.33 H new ATOM 0 HB VAL A 124 3.966 -0.756 13.503 1.00 32.30 H new ATOM 0 HG11 VAL A 124 4.223 -3.215 13.064 1.00 5.32 H new ATOM 0 HG12 VAL A 124 2.522 -2.694 13.027 1.00 5.32 H new ATOM 0 HG13 VAL A 124 3.393 -2.997 11.505 1.00 5.32 H new ATOM 0 HG21 VAL A 124 6.021 -1.755 12.437 1.00 40.11 H new ATOM 0 HG22 VAL A 124 5.313 -1.440 10.835 1.00 40.11 H new ATOM 0 HG23 VAL A 124 5.731 -0.082 11.906 1.00 40.11 H new ATOM 1793 N SER A 125 1.210 0.531 13.333 1.00 21.24 N ATOM 1794 CA SER A 125 -0.119 0.677 13.913 1.00 72.23 C ATOM 1795 C SER A 125 -1.011 1.490 12.975 1.00 20.13 C ATOM 1796 O SER A 125 -2.087 1.030 12.616 1.00 2.20 O ATOM 1797 CB SER A 125 0.013 1.319 15.298 1.00 12.52 C ATOM 1798 OG SER A 125 -1.219 1.513 15.961 1.00 31.35 O ATOM 0 H SER A 125 1.914 1.113 13.787 1.00 21.24 H new ATOM 0 HA SER A 125 -0.593 -0.297 14.036 1.00 72.23 H new ATOM 0 HB2 SER A 125 0.653 0.692 15.918 1.00 12.52 H new ATOM 0 HB3 SER A 125 0.514 2.282 15.195 1.00 12.52 H new ATOM 0 HG SER A 125 -1.058 1.924 16.836 1.00 31.35 H new ATOM 1803 N HIS A 126 -0.563 2.670 12.539 1.00 5.05 N ATOM 1804 CA HIS A 126 -1.320 3.565 11.666 1.00 23.24 C ATOM 1805 C HIS A 126 -1.883 2.818 10.458 1.00 25.13 C ATOM 1806 O HIS A 126 -3.048 2.991 10.095 1.00 2.41 O ATOM 1807 CB HIS A 126 -0.415 4.701 11.170 1.00 51.32 C ATOM 1808 CG HIS A 126 0.082 5.667 12.215 1.00 33.31 C ATOM 1809 ND1 HIS A 126 0.994 6.665 11.977 1.00 31.13 N ATOM 1810 CD2 HIS A 126 -0.368 5.814 13.500 1.00 1.24 C ATOM 1811 CE1 HIS A 126 1.057 7.431 13.079 1.00 13.21 C ATOM 1812 NE2 HIS A 126 0.272 6.934 14.047 1.00 53.34 N ATOM 0 H HIS A 126 0.356 3.036 12.789 1.00 5.05 H new ATOM 0 HA HIS A 126 -2.149 3.970 12.246 1.00 23.24 H new ATOM 0 HB2 HIS A 126 0.450 4.258 10.676 1.00 51.32 H new ATOM 0 HB3 HIS A 126 -0.960 5.266 10.414 1.00 51.32 H new ATOM 0 HD1 HIS A 126 1.528 6.801 11.118 1.00 31.13 H new ATOM 0 HD2 HIS A 126 -1.086 5.181 14.001 1.00 1.24 H new ATOM 0 HE1 HIS A 126 1.657 8.324 13.173 1.00 13.21 H new ATOM 1819 N PHE A 127 -1.043 1.997 9.827 1.00 0.23 N ATOM 1820 CA PHE A 127 -1.418 1.243 8.651 1.00 42.43 C ATOM 1821 C PHE A 127 -2.433 0.138 8.964 1.00 74.21 C ATOM 1822 O PHE A 127 -3.267 -0.145 8.112 1.00 74.32 O ATOM 1823 CB PHE A 127 -0.155 0.676 7.999 1.00 34.23 C ATOM 1824 CG PHE A 127 -0.457 -0.106 6.742 1.00 34.22 C ATOM 1825 CD1 PHE A 127 -1.159 0.505 5.686 1.00 71.44 C ATOM 1826 CD2 PHE A 127 -0.090 -1.459 6.651 1.00 75.41 C ATOM 1827 CE1 PHE A 127 -1.498 -0.243 4.550 1.00 75.51 C ATOM 1828 CE2 PHE A 127 -0.408 -2.199 5.501 1.00 14.33 C ATOM 1829 CZ PHE A 127 -1.114 -1.588 4.456 1.00 1.23 C ATOM 0 H PHE A 127 -0.080 1.842 10.126 1.00 0.23 H new ATOM 0 HA PHE A 127 -1.916 1.916 7.953 1.00 42.43 H new ATOM 0 HB2 PHE A 127 0.526 1.493 7.760 1.00 34.23 H new ATOM 0 HB3 PHE A 127 0.359 0.030 8.711 1.00 34.23 H new ATOM 0 HD1 PHE A 127 -1.436 1.547 5.751 1.00 71.44 H new ATOM 0 HD2 PHE A 127 0.438 -1.931 7.467 1.00 75.41 H new ATOM 0 HE1 PHE A 127 -2.055 0.217 3.747 1.00 75.51 H new ATOM 0 HE2 PHE A 127 -0.110 -3.234 5.422 1.00 14.33 H new ATOM 0 HZ PHE A 127 -1.364 -2.157 3.573 1.00 1.23 H new ATOM 1838 N ASN A 128 -2.420 -0.455 10.166 1.00 12.14 N ATOM 1839 CA ASN A 128 -3.443 -1.426 10.570 1.00 23.41 C ATOM 1840 C ASN A 128 -4.817 -0.783 10.450 1.00 54.35 C ATOM 1841 O ASN A 128 -5.733 -1.380 9.882 1.00 4.32 O ATOM 1842 CB ASN A 128 -3.226 -1.966 12.000 1.00 33.24 C ATOM 1843 CG ASN A 128 -2.497 -3.296 12.018 1.00 60.15 C ATOM 1844 OD1 ASN A 128 -3.109 -4.332 12.270 1.00 2.45 O ATOM 1845 ND2 ASN A 128 -1.195 -3.322 11.793 1.00 2.11 N ATOM 0 H ASN A 128 -1.710 -0.278 10.876 1.00 12.14 H new ATOM 0 HA ASN A 128 -3.367 -2.284 9.902 1.00 23.41 H new ATOM 0 HB2 ASN A 128 -2.658 -1.237 12.577 1.00 33.24 H new ATOM 0 HB3 ASN A 128 -4.192 -2.079 12.492 1.00 33.24 H new ATOM 0 HD21 ASN A 128 -0.689 -4.207 11.828 1.00 2.11 H new ATOM 0 HD22 ASN A 128 -0.696 -2.457 11.585 1.00 2.11 H new ATOM 1851 N GLU A 129 -4.953 0.441 10.953 1.00 12.25 N ATOM 1852 CA GLU A 129 -6.220 1.151 10.976 1.00 24.23 C ATOM 1853 C GLU A 129 -6.669 1.509 9.561 1.00 12.33 C ATOM 1854 O GLU A 129 -7.838 1.352 9.205 1.00 64.24 O ATOM 1855 CB GLU A 129 -6.116 2.421 11.823 1.00 4.40 C ATOM 1856 CG GLU A 129 -5.325 2.280 13.123 1.00 22.11 C ATOM 1857 CD GLU A 129 -5.795 1.167 14.058 1.00 22.25 C ATOM 1858 OE1 GLU A 129 -6.714 1.428 14.864 1.00 14.22 O ATOM 1859 OE2 GLU A 129 -5.202 0.061 14.091 1.00 71.34 O ATOM 0 H GLU A 129 -4.179 0.968 11.358 1.00 12.25 H new ATOM 0 HA GLU A 129 -6.962 0.490 11.423 1.00 24.23 H new ATOM 0 HB2 GLU A 129 -5.654 3.203 11.220 1.00 4.40 H new ATOM 0 HB3 GLU A 129 -7.124 2.759 12.066 1.00 4.40 H new ATOM 0 HG2 GLU A 129 -4.278 2.105 12.874 1.00 22.11 H new ATOM 0 HG3 GLU A 129 -5.371 3.227 13.661 1.00 22.11 H new ATOM 1864 N TRP A 130 -5.740 2.012 8.743 1.00 71.41 N ATOM 1865 CA TRP A 130 -6.024 2.518 7.412 1.00 73.55 C ATOM 1866 C TRP A 130 -6.185 1.394 6.382 1.00 61.42 C ATOM 1867 O TRP A 130 -6.598 1.685 5.261 1.00 3.45 O ATOM 1868 CB TRP A 130 -4.960 3.559 7.030 1.00 11.33 C ATOM 1869 CG TRP A 130 -5.089 4.911 7.691 1.00 54.01 C ATOM 1870 CD1 TRP A 130 -5.936 5.247 8.697 1.00 25.21 C ATOM 1871 CD2 TRP A 130 -4.385 6.149 7.361 1.00 34.53 C ATOM 1872 NE1 TRP A 130 -5.824 6.592 8.983 1.00 24.44 N ATOM 1873 CE2 TRP A 130 -4.893 7.205 8.175 1.00 41.21 C ATOM 1874 CE3 TRP A 130 -3.383 6.493 6.429 1.00 64.41 C ATOM 1875 CZ2 TRP A 130 -4.455 8.534 8.043 1.00 45.41 C ATOM 1876 CZ3 TRP A 130 -2.884 7.805 6.341 1.00 53.32 C ATOM 1877 CH2 TRP A 130 -3.431 8.830 7.131 1.00 1.21 C ATOM 0 H TRP A 130 -4.755 2.077 8.999 1.00 71.41 H new ATOM 0 HA TRP A 130 -6.992 3.018 7.417 1.00 73.55 H new ATOM 0 HB2 TRP A 130 -3.978 3.151 7.271 1.00 11.33 H new ATOM 0 HB3 TRP A 130 -4.990 3.700 5.950 1.00 11.33 H new ATOM 0 HD1 TRP A 130 -6.601 4.561 9.200 1.00 25.21 H new ATOM 0 HE1 TRP A 130 -6.364 7.072 9.703 1.00 24.44 H new ATOM 0 HE3 TRP A 130 -2.991 5.733 5.769 1.00 64.41 H new ATOM 0 HZ2 TRP A 130 -4.901 9.318 8.637 1.00 45.41 H new ATOM 0 HZ3 TRP A 130 -2.074 8.026 5.661 1.00 53.32 H new ATOM 0 HH2 TRP A 130 -3.065 9.842 7.037 1.00 1.21 H new ATOM 1887 N ALA A 131 -5.929 0.132 6.752 1.00 12.02 N ATOM 1888 CA ALA A 131 -6.028 -1.020 5.853 1.00 4.52 C ATOM 1889 C ALA A 131 -7.173 -1.970 6.211 1.00 35.12 C ATOM 1890 O ALA A 131 -7.482 -2.856 5.415 1.00 20.34 O ATOM 1891 CB ALA A 131 -4.692 -1.773 5.828 1.00 75.55 C ATOM 0 H ALA A 131 -5.643 -0.118 7.699 1.00 12.02 H new ATOM 0 HA ALA A 131 -6.255 -0.632 4.860 1.00 4.52 H new ATOM 0 HB1 ALA A 131 -4.770 -2.629 5.158 1.00 75.55 H new ATOM 0 HB2 ALA A 131 -3.905 -1.106 5.475 1.00 75.55 H new ATOM 0 HB3 ALA A 131 -4.451 -2.119 6.833 1.00 75.55 H new ATOM 1897 N ASP A 132 -7.800 -1.774 7.373 1.00 3.35 N ATOM 1898 CA ASP A 132 -8.844 -2.608 7.965 1.00 14.02 C ATOM 1899 C ASP A 132 -9.904 -3.006 6.934 1.00 13.03 C ATOM 1900 O ASP A 132 -10.700 -2.173 6.484 1.00 23.53 O ATOM 1901 CB ASP A 132 -9.450 -1.849 9.148 1.00 73.14 C ATOM 1902 CG ASP A 132 -10.763 -2.441 9.649 1.00 44.14 C ATOM 1903 OD1 ASP A 132 -10.909 -3.680 9.648 1.00 5.13 O ATOM 1904 OD2 ASP A 132 -11.628 -1.658 10.104 1.00 25.30 O ATOM 0 H ASP A 132 -7.575 -0.974 7.964 1.00 3.35 H new ATOM 0 HA ASP A 132 -8.411 -3.543 8.319 1.00 14.02 H new ATOM 0 HB2 ASP A 132 -8.731 -1.837 9.967 1.00 73.14 H new ATOM 0 HB3 ASP A 132 -9.617 -0.812 8.856 1.00 73.14 H new ATOM 1908 N GLY A 133 -9.870 -4.273 6.527 1.00 40.14 N ATOM 1909 CA GLY A 133 -10.726 -4.837 5.493 1.00 51.02 C ATOM 1910 C GLY A 133 -9.975 -5.652 4.445 1.00 72.55 C ATOM 1911 O GLY A 133 -10.624 -6.255 3.587 1.00 15.42 O ATOM 0 H GLY A 133 -9.223 -4.955 6.923 1.00 40.14 H new ATOM 0 HA2 GLY A 133 -11.477 -5.472 5.963 1.00 51.02 H new ATOM 0 HA3 GLY A 133 -11.260 -4.027 4.995 1.00 51.02 H new ATOM 1915 N LEU A 134 -8.640 -5.695 4.473 1.00 60.23 N ATOM 1916 CA LEU A 134 -7.838 -6.505 3.566 1.00 1.42 C ATOM 1917 C LEU A 134 -6.785 -7.278 4.340 1.00 65.51 C ATOM 1918 O LEU A 134 -6.198 -6.774 5.295 1.00 34.25 O ATOM 1919 CB LEU A 134 -7.129 -5.612 2.545 1.00 23.51 C ATOM 1920 CG LEU A 134 -8.042 -4.895 1.552 1.00 43.12 C ATOM 1921 CD1 LEU A 134 -7.191 -3.834 0.857 1.00 5.40 C ATOM 1922 CD2 LEU A 134 -8.650 -5.850 0.525 1.00 44.55 C ATOM 0 H LEU A 134 -8.083 -5.159 5.138 1.00 60.23 H new ATOM 0 HA LEU A 134 -8.505 -7.199 3.054 1.00 1.42 H new ATOM 0 HB2 LEU A 134 -6.549 -4.863 3.084 1.00 23.51 H new ATOM 0 HB3 LEU A 134 -6.420 -6.222 1.985 1.00 23.51 H new ATOM 0 HG LEU A 134 -8.884 -4.451 2.082 1.00 43.12 H new ATOM 0 HD11 LEU A 134 -7.802 -3.293 0.135 1.00 5.40 H new ATOM 0 HD12 LEU A 134 -6.802 -3.136 1.599 1.00 5.40 H new ATOM 0 HD13 LEU A 134 -6.360 -4.315 0.341 1.00 5.40 H new ATOM 0 HD21 LEU A 134 -9.290 -5.291 -0.157 1.00 44.55 H new ATOM 0 HD22 LEU A 134 -7.852 -6.333 -0.040 1.00 44.55 H new ATOM 0 HD23 LEU A 134 -9.241 -6.608 1.039 1.00 44.55 H new ATOM 1933 N ASN A 135 -6.469 -8.470 3.841 1.00 44.03 N ATOM 1934 CA ASN A 135 -5.437 -9.364 4.348 1.00 62.41 C ATOM 1935 C ASN A 135 -4.051 -8.732 4.260 1.00 3.20 C ATOM 1936 O ASN A 135 -3.472 -8.665 3.172 1.00 1.00 O ATOM 1937 CB ASN A 135 -5.458 -10.637 3.513 1.00 13.12 C ATOM 1938 CG ASN A 135 -4.506 -11.678 4.061 1.00 21.31 C ATOM 1939 OD1 ASN A 135 -3.558 -12.112 3.255 1.00 71.12 O flip ATOM 1940 ND2 ASN A 135 -4.645 -12.122 5.197 1.00 35.42 N flip ATOM 0 H ASN A 135 -6.952 -8.857 3.030 1.00 44.03 H new ATOM 0 HA ASN A 135 -5.642 -9.575 5.398 1.00 62.41 H new ATOM 0 HB2 ASN A 135 -6.469 -11.043 3.493 1.00 13.12 H new ATOM 0 HB3 ASN A 135 -5.188 -10.402 2.483 1.00 13.12 H new ATOM 0 HD21 ASN A 135 -5.389 -11.765 5.797 1.00 35.42 H new ATOM 0 HD22 ASN A 135 -4.017 -12.848 5.541 1.00 35.42 H new ATOM 1946 N VAL A 136 -3.537 -8.205 5.366 1.00 52.41 N ATOM 1947 CA VAL A 136 -2.163 -7.734 5.467 1.00 73.42 C ATOM 1948 C VAL A 136 -1.330 -8.887 6.014 1.00 0.21 C ATOM 1949 O VAL A 136 -1.686 -9.453 7.048 1.00 71.52 O ATOM 1950 CB VAL A 136 -2.051 -6.513 6.407 1.00 73.41 C ATOM 1951 CG1 VAL A 136 -0.591 -6.053 6.527 1.00 71.11 C ATOM 1952 CG2 VAL A 136 -2.903 -5.311 5.980 1.00 42.31 C ATOM 0 H VAL A 136 -4.071 -8.092 6.228 1.00 52.41 H new ATOM 0 HA VAL A 136 -1.808 -7.417 4.486 1.00 73.42 H new ATOM 0 HB VAL A 136 -2.434 -6.861 7.366 1.00 73.41 H new ATOM 0 HG11 VAL A 136 -0.534 -5.192 7.193 1.00 71.11 H new ATOM 0 HG12 VAL A 136 0.014 -6.865 6.931 1.00 71.11 H new ATOM 0 HG13 VAL A 136 -0.215 -5.775 5.542 1.00 71.11 H new ATOM 0 HG21 VAL A 136 -2.767 -4.497 6.692 1.00 42.31 H new ATOM 0 HG22 VAL A 136 -2.594 -4.980 4.988 1.00 42.31 H new ATOM 0 HG23 VAL A 136 -3.954 -5.600 5.955 1.00 42.31 H new ATOM 1962 N ILE A 137 -0.214 -9.194 5.351 1.00 20.54 N ATOM 1963 CA ILE A 137 0.723 -10.235 5.765 1.00 15.23 C ATOM 1964 C ILE A 137 2.151 -9.705 5.915 1.00 21.30 C ATOM 1965 O ILE A 137 3.069 -10.507 6.087 1.00 43.01 O ATOM 1966 CB ILE A 137 0.618 -11.473 4.843 1.00 2.30 C ATOM 1967 CG1 ILE A 137 0.891 -11.237 3.344 1.00 13.32 C ATOM 1968 CG2 ILE A 137 -0.787 -12.078 4.953 1.00 73.34 C ATOM 1969 CD1 ILE A 137 2.343 -10.938 2.956 1.00 11.40 C ATOM 0 H ILE A 137 0.068 -8.716 4.495 1.00 20.54 H new ATOM 0 HA ILE A 137 0.437 -10.566 6.764 1.00 15.23 H new ATOM 0 HB ILE A 137 1.409 -12.131 5.202 1.00 2.30 H new ATOM 0 HG12 ILE A 137 0.565 -12.120 2.794 1.00 13.32 H new ATOM 0 HG13 ILE A 137 0.270 -10.406 3.010 1.00 13.32 H new ATOM 0 HG21 ILE A 137 -0.860 -12.950 4.303 1.00 73.34 H new ATOM 0 HG22 ILE A 137 -0.974 -12.377 5.984 1.00 73.34 H new ATOM 0 HG23 ILE A 137 -1.527 -11.337 4.650 1.00 73.34 H new ATOM 0 HD11 ILE A 137 2.409 -10.791 1.878 1.00 11.40 H new ATOM 0 HD12 ILE A 137 2.677 -10.035 3.467 1.00 11.40 H new ATOM 0 HD13 ILE A 137 2.977 -11.775 3.247 1.00 11.40 H new ATOM 1980 N GLY A 138 2.384 -8.392 5.848 1.00 45.21 N ATOM 1981 CA GLY A 138 3.727 -7.863 6.016 1.00 44.02 C ATOM 1982 C GLY A 138 3.742 -6.354 6.108 1.00 0.11 C ATOM 1983 O GLY A 138 3.336 -5.671 5.164 1.00 23.14 O ATOM 0 H GLY A 138 1.665 -7.688 5.680 1.00 45.21 H new ATOM 0 HA2 GLY A 138 4.171 -8.284 6.918 1.00 44.02 H new ATOM 0 HA3 GLY A 138 4.347 -8.180 5.178 1.00 44.02 H new ATOM 1987 N VAL A 139 4.261 -5.827 7.213 1.00 24.10 N ATOM 1988 CA VAL A 139 4.467 -4.402 7.424 1.00 60.35 C ATOM 1989 C VAL A 139 5.879 -4.279 8.001 1.00 1.43 C ATOM 1990 O VAL A 139 6.045 -4.329 9.221 1.00 62.52 O ATOM 1991 CB VAL A 139 3.344 -3.802 8.307 1.00 53.04 C ATOM 1992 CG1 VAL A 139 3.382 -2.269 8.357 1.00 74.11 C ATOM 1993 CG2 VAL A 139 1.946 -4.188 7.811 1.00 31.23 C ATOM 0 H VAL A 139 4.557 -6.396 8.006 1.00 24.10 H new ATOM 0 HA VAL A 139 4.403 -3.817 6.507 1.00 60.35 H new ATOM 0 HB VAL A 139 3.531 -4.216 9.298 1.00 53.04 H new ATOM 0 HG11 VAL A 139 2.572 -1.905 8.990 1.00 74.11 H new ATOM 0 HG12 VAL A 139 4.338 -1.942 8.767 1.00 74.11 H new ATOM 0 HG13 VAL A 139 3.263 -1.869 7.350 1.00 74.11 H new ATOM 0 HG21 VAL A 139 1.193 -3.744 8.462 1.00 31.23 H new ATOM 0 HG22 VAL A 139 1.807 -3.822 6.794 1.00 31.23 H new ATOM 0 HG23 VAL A 139 1.842 -5.273 7.824 1.00 31.23 H new ATOM 2003 N ALA A 140 6.887 -4.220 7.120 1.00 44.04 N ATOM 2004 CA ALA A 140 8.301 -4.080 7.449 1.00 61.31 C ATOM 2005 C ALA A 140 8.901 -2.846 6.747 1.00 20.54 C ATOM 2006 O ALA A 140 8.346 -2.363 5.751 1.00 43.04 O ATOM 2007 CB ALA A 140 9.028 -5.365 7.033 1.00 23.45 C ATOM 0 H ALA A 140 6.725 -4.271 6.114 1.00 44.04 H new ATOM 0 HA ALA A 140 8.421 -3.930 8.522 1.00 61.31 H new ATOM 0 HB1 ALA A 140 10.088 -5.277 7.272 1.00 23.45 H new ATOM 0 HB2 ALA A 140 8.604 -6.213 7.570 1.00 23.45 H new ATOM 0 HB3 ALA A 140 8.910 -5.519 5.960 1.00 23.45 H new ATOM 2013 N ARG A 141 10.050 -2.345 7.225 1.00 2.53 N ATOM 2014 CA ARG A 141 10.911 -1.457 6.445 1.00 24.51 C ATOM 2015 C ARG A 141 11.535 -2.281 5.327 1.00 14.13 C ATOM 2016 O ARG A 141 11.971 -3.401 5.593 1.00 21.10 O ATOM 2017 CB ARG A 141 12.027 -0.872 7.332 1.00 64.51 C ATOM 2018 CG ARG A 141 12.858 0.232 6.657 1.00 71.44 C ATOM 2019 CD ARG A 141 14.075 0.640 7.506 1.00 34.52 C ATOM 2020 NE ARG A 141 15.194 1.077 6.643 1.00 2.53 N ATOM 2021 CZ ARG A 141 16.013 2.135 6.760 1.00 20.41 C ATOM 2022 NH1 ARG A 141 15.942 2.936 7.820 1.00 4.21 N ATOM 2023 NH2 ARG A 141 16.908 2.396 5.809 1.00 71.34 N ATOM 0 H ARG A 141 10.403 -2.546 8.160 1.00 2.53 H new ATOM 0 HA ARG A 141 10.325 -0.631 6.042 1.00 24.51 H new ATOM 0 HB2 ARG A 141 11.579 -0.469 8.241 1.00 64.51 H new ATOM 0 HB3 ARG A 141 12.694 -1.679 7.636 1.00 64.51 H new ATOM 0 HG2 ARG A 141 13.197 -0.115 5.681 1.00 71.44 H new ATOM 0 HG3 ARG A 141 12.228 1.105 6.484 1.00 71.44 H new ATOM 0 HD2 ARG A 141 13.797 1.446 8.185 1.00 34.52 H new ATOM 0 HD3 ARG A 141 14.392 -0.201 8.123 1.00 34.52 H new ATOM 0 HE ARG A 141 15.371 0.483 5.833 1.00 2.53 H new ATOM 0 HH11 ARG A 141 15.260 2.750 8.555 1.00 4.21 H new ATOM 0 HH12 ARG A 141 16.570 3.736 7.897 1.00 4.21 H new ATOM 0 HH21 ARG A 141 16.972 1.792 4.990 1.00 71.34 H new ATOM 0 HH22 ARG A 141 17.529 3.200 5.900 1.00 71.34 H new ATOM 2034 N ASP A 142 11.665 -1.641 4.167 1.00 24.42 N ATOM 2035 CA ASP A 142 12.488 -2.014 3.014 1.00 65.25 C ATOM 2036 C ASP A 142 12.415 -3.496 2.633 1.00 40.33 C ATOM 2037 O ASP A 142 11.384 -4.130 2.841 1.00 62.41 O ATOM 2038 CB ASP A 142 13.902 -1.410 3.105 1.00 73.13 C ATOM 2039 CG ASP A 142 14.793 -1.893 4.252 1.00 74.23 C ATOM 2040 OD1 ASP A 142 14.826 -3.090 4.583 1.00 65.42 O ATOM 2041 OD2 ASP A 142 15.490 -1.012 4.812 1.00 44.14 O ATOM 0 H ASP A 142 11.155 -0.775 3.993 1.00 24.42 H new ATOM 0 HA ASP A 142 12.037 -1.545 2.140 1.00 65.25 H new ATOM 0 HB2 ASP A 142 14.418 -1.614 2.167 1.00 73.13 H new ATOM 0 HB3 ASP A 142 13.803 -0.328 3.186 1.00 73.13 H new ATOM 2045 N ASP A 143 13.436 -4.010 1.942 1.00 53.23 N ATOM 2046 CA ASP A 143 13.548 -5.371 1.408 1.00 2.40 C ATOM 2047 C ASP A 143 13.799 -6.431 2.491 1.00 31.30 C ATOM 2048 O ASP A 143 14.049 -7.590 2.169 1.00 22.33 O ATOM 2049 CB ASP A 143 14.648 -5.438 0.325 1.00 40.04 C ATOM 2050 CG ASP A 143 15.984 -4.833 0.781 1.00 12.00 C ATOM 2051 OD1 ASP A 143 16.169 -3.594 0.659 1.00 65.41 O ATOM 2052 OD2 ASP A 143 16.887 -5.558 1.250 1.00 75.14 O ATOM 0 H ASP A 143 14.261 -3.450 1.726 1.00 53.23 H new ATOM 0 HA ASP A 143 12.582 -5.607 0.962 1.00 2.40 H new ATOM 0 HB2 ASP A 143 14.806 -6.478 0.041 1.00 40.04 H new ATOM 0 HB3 ASP A 143 14.304 -4.913 -0.566 1.00 40.04 H new ATOM 2056 N SER A 144 13.740 -6.069 3.771 1.00 31.55 N ATOM 2057 CA SER A 144 14.084 -6.931 4.894 1.00 3.25 C ATOM 2058 C SER A 144 13.282 -8.248 4.979 1.00 73.34 C ATOM 2059 O SER A 144 13.693 -9.120 5.742 1.00 63.34 O ATOM 2060 CB SER A 144 13.907 -6.101 6.175 1.00 60.12 C ATOM 2061 OG SER A 144 14.969 -6.303 7.091 1.00 25.30 O ATOM 0 H SER A 144 13.442 -5.138 4.062 1.00 31.55 H new ATOM 0 HA SER A 144 15.113 -7.261 4.755 1.00 3.25 H new ATOM 0 HB2 SER A 144 13.848 -5.044 5.916 1.00 60.12 H new ATOM 0 HB3 SER A 144 12.963 -6.366 6.651 1.00 60.12 H new ATOM 0 HG SER A 144 14.820 -5.757 7.891 1.00 25.30 H new ATOM 2066 N GLU A 145 12.156 -8.435 4.280 1.00 42.12 N ATOM 2067 CA GLU A 145 11.272 -9.590 4.488 1.00 5.10 C ATOM 2068 C GLU A 145 10.761 -10.211 3.177 1.00 41.41 C ATOM 2069 O GLU A 145 9.860 -11.050 3.199 1.00 72.31 O ATOM 2070 CB GLU A 145 10.091 -9.161 5.380 1.00 42.03 C ATOM 2071 CG GLU A 145 10.511 -8.592 6.755 1.00 72.23 C ATOM 2072 CD GLU A 145 9.502 -8.835 7.882 1.00 22.13 C ATOM 2073 OE1 GLU A 145 8.757 -9.833 7.817 1.00 11.53 O ATOM 2074 OE2 GLU A 145 9.568 -8.156 8.934 1.00 64.51 O ATOM 0 H GLU A 145 11.832 -7.793 3.557 1.00 42.12 H new ATOM 0 HA GLU A 145 11.858 -10.368 4.977 1.00 5.10 H new ATOM 0 HB2 GLU A 145 9.505 -8.409 4.851 1.00 42.03 H new ATOM 0 HB3 GLU A 145 9.439 -10.020 5.538 1.00 42.03 H new ATOM 0 HG2 GLU A 145 11.466 -9.033 7.039 1.00 72.23 H new ATOM 0 HG3 GLU A 145 10.673 -7.519 6.655 1.00 72.23 H new ATOM 2079 N VAL A 146 11.322 -9.844 2.023 1.00 60.31 N ATOM 2080 CA VAL A 146 10.797 -10.172 0.691 1.00 34.34 C ATOM 2081 C VAL A 146 10.579 -11.669 0.462 1.00 42.31 C ATOM 2082 O VAL A 146 9.688 -12.037 -0.306 1.00 0.33 O ATOM 2083 CB VAL A 146 11.786 -9.613 -0.372 1.00 21.24 C ATOM 2084 CG1 VAL A 146 11.428 -9.980 -1.819 1.00 45.55 C ATOM 2085 CG2 VAL A 146 11.869 -8.084 -0.332 1.00 2.43 C ATOM 0 H VAL A 146 12.180 -9.294 1.986 1.00 60.31 H new ATOM 0 HA VAL A 146 9.812 -9.714 0.605 1.00 34.34 H new ATOM 0 HB VAL A 146 12.734 -10.078 -0.101 1.00 21.24 H new ATOM 0 HG11 VAL A 146 12.167 -9.552 -2.496 1.00 45.55 H new ATOM 0 HG12 VAL A 146 11.421 -11.064 -1.928 1.00 45.55 H new ATOM 0 HG13 VAL A 146 10.442 -9.585 -2.061 1.00 45.55 H new ATOM 0 HG21 VAL A 146 12.571 -7.738 -1.091 1.00 2.43 H new ATOM 0 HG22 VAL A 146 10.884 -7.661 -0.529 1.00 2.43 H new ATOM 0 HG23 VAL A 146 12.211 -7.764 0.652 1.00 2.43 H new ATOM 2095 N ASP A 147 11.345 -12.541 1.119 1.00 0.11 N ATOM 2096 CA ASP A 147 11.298 -13.973 0.835 1.00 72.34 C ATOM 2097 C ASP A 147 10.001 -14.535 1.396 1.00 71.11 C ATOM 2098 O ASP A 147 9.341 -15.405 0.832 1.00 20.14 O ATOM 2099 CB ASP A 147 12.495 -14.644 1.508 1.00 72.33 C ATOM 2100 CG ASP A 147 12.591 -16.127 1.153 1.00 13.03 C ATOM 2101 OD1 ASP A 147 12.970 -16.417 -0.005 1.00 3.53 O ATOM 2102 OD2 ASP A 147 12.414 -16.965 2.076 1.00 11.45 O ATOM 0 H ASP A 147 12.005 -12.279 1.851 1.00 0.11 H new ATOM 0 HA ASP A 147 11.338 -14.157 -0.239 1.00 72.34 H new ATOM 0 HB2 ASP A 147 13.412 -14.138 1.206 1.00 72.33 H new ATOM 0 HB3 ASP A 147 12.412 -14.534 2.589 1.00 72.33 H new ATOM 2106 N LYS A 148 9.610 -13.956 2.527 1.00 11.21 N ATOM 2107 CA LYS A 148 8.472 -14.322 3.314 1.00 35.55 C ATOM 2108 C LYS A 148 7.179 -14.081 2.582 1.00 35.25 C ATOM 2109 O LYS A 148 6.221 -14.811 2.821 1.00 31.23 O ATOM 2110 CB LYS A 148 8.489 -13.465 4.584 1.00 71.25 C ATOM 2111 CG LYS A 148 7.964 -14.342 5.699 1.00 54.13 C ATOM 2112 CD LYS A 148 7.844 -13.643 7.064 1.00 42.21 C ATOM 2113 CE LYS A 148 6.900 -12.437 7.050 1.00 2.14 C ATOM 2114 NZ LYS A 148 6.906 -11.724 8.338 1.00 15.41 N ATOM 0 H LYS A 148 10.122 -13.171 2.930 1.00 11.21 H new ATOM 0 HA LYS A 148 8.530 -15.387 3.540 1.00 35.55 H new ATOM 0 HB2 LYS A 148 9.499 -13.119 4.805 1.00 71.25 H new ATOM 0 HB3 LYS A 148 7.867 -12.578 4.462 1.00 71.25 H new ATOM 0 HG2 LYS A 148 6.983 -14.722 5.413 1.00 54.13 H new ATOM 0 HG3 LYS A 148 8.622 -15.205 5.804 1.00 54.13 H new ATOM 0 HD2 LYS A 148 7.491 -14.363 7.802 1.00 42.21 H new ATOM 0 HD3 LYS A 148 8.833 -13.317 7.385 1.00 42.21 H new ATOM 0 HE2 LYS A 148 7.196 -11.753 6.254 1.00 2.14 H new ATOM 0 HE3 LYS A 148 5.887 -12.771 6.824 1.00 2.14 H new ATOM 0 HZ1 LYS A 148 5.931 -11.475 8.601 1.00 15.41 H new ATOM 0 HZ2 LYS A 148 7.317 -12.336 9.072 1.00 15.41 H new ATOM 0 HZ3 LYS A 148 7.474 -10.857 8.252 1.00 15.41 H new ATOM 2124 N TRP A 149 7.139 -13.062 1.728 1.00 43.11 N ATOM 2125 CA TRP A 149 5.925 -12.747 0.998 1.00 22.40 C ATOM 2126 C TRP A 149 6.061 -13.201 -0.454 1.00 53.32 C ATOM 2127 O TRP A 149 5.332 -12.708 -1.305 1.00 22.55 O ATOM 2128 CB TRP A 149 5.609 -11.265 1.108 1.00 52.14 C ATOM 2129 CG TRP A 149 5.839 -10.625 2.439 1.00 23.25 C ATOM 2130 CD1 TRP A 149 5.601 -11.166 3.651 1.00 3.44 C ATOM 2131 CD2 TRP A 149 6.370 -9.303 2.698 1.00 41.14 C ATOM 2132 NE1 TRP A 149 5.925 -10.249 4.624 1.00 60.14 N ATOM 2133 CE2 TRP A 149 6.449 -9.092 4.098 1.00 22.14 C ATOM 2134 CE3 TRP A 149 6.810 -8.265 1.871 1.00 75.42 C ATOM 2135 CZ2 TRP A 149 6.962 -7.910 4.652 1.00 51.13 C ATOM 2136 CZ3 TRP A 149 7.310 -7.072 2.413 1.00 42.54 C ATOM 2137 CH2 TRP A 149 7.429 -6.901 3.799 1.00 11.32 C ATOM 0 H TRP A 149 7.928 -12.448 1.529 1.00 43.11 H new ATOM 0 HA TRP A 149 5.086 -13.286 1.437 1.00 22.40 H new ATOM 0 HB2 TRP A 149 6.207 -10.734 0.368 1.00 52.14 H new ATOM 0 HB3 TRP A 149 4.563 -11.119 0.837 1.00 52.14 H new ATOM 0 HD1 TRP A 149 5.218 -12.160 3.829 1.00 3.44 H new ATOM 0 HE1 TRP A 149 5.792 -10.409 5.622 1.00 60.14 H new ATOM 0 HE3 TRP A 149 6.764 -8.384 0.799 1.00 75.42 H new ATOM 0 HZ2 TRP A 149 6.997 -7.779 5.723 1.00 51.13 H new ATOM 0 HZ3 TRP A 149 7.608 -6.272 1.752 1.00 42.54 H new ATOM 0 HH2 TRP A 149 7.874 -6.004 4.204 1.00 11.32 H new ATOM 2147 N SER A 150 7.014 -14.075 -0.768 1.00 3.40 N ATOM 2148 CA SER A 150 7.210 -14.621 -2.100 1.00 40.31 C ATOM 2149 C SER A 150 6.989 -16.130 -2.027 1.00 15.51 C ATOM 2150 O SER A 150 6.267 -16.661 -2.868 1.00 63.41 O ATOM 2151 CB SER A 150 8.587 -14.205 -2.622 1.00 0.31 C ATOM 2152 OG SER A 150 8.730 -14.532 -3.993 1.00 23.31 O ATOM 0 H SER A 150 7.684 -14.429 -0.085 1.00 3.40 H new ATOM 0 HA SER A 150 6.493 -14.227 -2.821 1.00 40.31 H new ATOM 0 HB2 SER A 150 8.723 -13.132 -2.484 1.00 0.31 H new ATOM 0 HB3 SER A 150 9.365 -14.702 -2.043 1.00 0.31 H new ATOM 0 HG SER A 150 9.663 -14.404 -4.264 1.00 23.31 H new ATOM 2157 N LYS A 151 7.522 -16.796 -1.003 1.00 14.04 N ATOM 2158 CA LYS A 151 7.467 -18.234 -0.767 1.00 42.13 C ATOM 2159 C LYS A 151 6.083 -18.840 -0.946 1.00 64.22 C ATOM 2160 O LYS A 151 5.993 -19.991 -1.430 1.00 75.12 O ATOM 2161 CB LYS A 151 8.117 -18.517 0.595 1.00 20.41 C ATOM 2162 CG LYS A 151 7.483 -17.855 1.821 1.00 31.42 C ATOM 2163 CD LYS A 151 6.229 -18.562 2.348 1.00 72.21 C ATOM 2164 CE LYS A 151 5.944 -18.188 3.800 1.00 62.22 C ATOM 2165 NZ LYS A 151 6.954 -18.731 4.733 1.00 3.32 N ATOM 0 H LYS A 151 8.037 -16.311 -0.269 1.00 14.04 H new ATOM 0 HA LYS A 151 8.038 -18.748 -1.540 1.00 42.13 H new ATOM 0 HB2 LYS A 151 8.114 -19.595 0.754 1.00 20.41 H new ATOM 0 HB3 LYS A 151 9.160 -18.205 0.543 1.00 20.41 H new ATOM 0 HG2 LYS A 151 8.224 -17.813 2.619 1.00 31.42 H new ATOM 0 HG3 LYS A 151 7.226 -16.826 1.570 1.00 31.42 H new ATOM 0 HD2 LYS A 151 5.373 -18.296 1.728 1.00 72.21 H new ATOM 0 HD3 LYS A 151 6.358 -19.641 2.268 1.00 72.21 H new ATOM 0 HE2 LYS A 151 5.915 -17.102 3.893 1.00 62.22 H new ATOM 0 HE3 LYS A 151 4.958 -18.559 4.081 1.00 62.22 H new ATOM 0 HZ1 LYS A 151 6.561 -18.753 5.696 1.00 3.32 H new ATOM 0 HZ2 LYS A 151 7.212 -19.696 4.442 1.00 3.32 H new ATOM 0 HZ3 LYS A 151 7.801 -18.127 4.718 1.00 3.32 H new TER 2175 LYS A 151