USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1038 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 63 SER OG : rot -61:sc= 1.07 USER MOD Set 1.2: A 66 ASN : amide:sc= 1.32 K(o=2.4,f=-3.8!) USER MOD Set 2.1: A 22 GLN : amide:sc= -1.98 K(o=-3.9,f=-7.7!) USER MOD Set 2.2: A 24 MET CE :methyl -142:sc= -1.89 (180deg=0) USER MOD Set 3.1: A -3 HIS : no HD1:sc= -0.963 X(o=-1.9,f=-2.3) USER MOD Set 3.2: A -5 HIS : no HD1:sc= -0.972 K(o=-1.9,f=-2.6) USER MOD Set 4.1: A -2 HIS : no HD1:sc= -0.454 K(o=-0.96,f=-0.011) USER MOD Set 4.2: A -4 HIS : no HD1:sc= -0.508 K(o=-0.96,f=-0.011) USER MOD Single : A 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -5 HIS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= -0.0242 USER MOD Single : A 18 LYS NZ :NH3+ -171:sc= 0.0596 (180deg=0.0491) USER MOD Single : A 23 HIS : no HE2:sc= -1.92 K(o=-1.9,f=-3.4!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HE2:sc= -2.16 K(o=-2.2,f=-8.1!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 31:sc= 0.423 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.256 USER MOD Single : A 57 SER OG : rot 1:sc= 0.603! USER MOD Single : A 58 ASN : amide:sc= -0.173 X(o=-0.17,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= -1.01 K(o=-1,f=-2.6!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -75:sc= 0.307 USER MOD Single : A 77 HIS : no HD1:sc= -2 K(o=-2,f=-4.5!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot -14:sc= 0.0286 USER MOD Single : A 101 ASN : amide:sc= -2.5 K(o=-2.5,f=-5.4!) USER MOD Single : A 106 LYS NZ :NH3+ 162:sc= -0.206 (180deg=-0.361) USER MOD Single : A 109 HIS : no HD1:sc= -0.157 X(o=-0.16,f=-0.33) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= -0.643 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot -30:sc= -0.834 USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 140 LYS NZ :NH3+ 147:sc= 1.11 (180deg=-0.041) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A -5 106.254 24.656 45.900 1.00 0.00 N ATOM 2 CA HIS A -5 105.480 25.767 46.521 1.00 0.00 C ATOM 3 C HIS A -5 104.827 26.603 45.426 1.00 0.00 C ATOM 4 O HIS A -5 105.476 26.983 44.451 1.00 0.00 O ATOM 5 CB HIS A -5 106.424 26.639 47.351 1.00 0.00 C ATOM 6 CG HIS A -5 105.718 27.723 48.120 1.00 0.00 C ATOM 7 ND1 HIS A -5 104.823 27.442 49.139 1.00 0.00 N ATOM 8 CD2 HIS A -5 105.766 29.092 48.030 1.00 0.00 C ATOM 9 CE1 HIS A -5 104.372 28.616 49.618 1.00 0.00 C ATOM 10 NE2 HIS A -5 104.914 29.654 48.977 1.00 0.00 N ATOM 0 H1 HIS A -5 106.700 24.085 46.646 1.00 0.00 H new ATOM 0 H2 HIS A -5 105.614 24.057 45.341 1.00 0.00 H new ATOM 0 H3 HIS A -5 106.989 25.050 45.279 1.00 0.00 H new ATOM 0 HA HIS A -5 104.705 25.359 47.170 1.00 0.00 H new ATOM 0 HB2 HIS A -5 106.971 26.006 48.050 1.00 0.00 H new ATOM 0 HB3 HIS A -5 107.161 27.094 46.690 1.00 0.00 H new ATOM 0 HD2 HIS A -5 106.373 29.649 47.331 1.00 0.00 H new ATOM 0 HE1 HIS A -5 103.658 28.707 50.423 1.00 0.00 H new ATOM 0 HE2 HIS A -5 104.741 30.645 49.145 1.00 0.00 H new ATOM 20 N HIS A -4 103.538 26.886 45.592 1.00 0.00 N ATOM 21 CA HIS A -4 102.795 27.672 44.610 1.00 0.00 C ATOM 22 C HIS A -4 102.058 28.821 45.291 1.00 0.00 C ATOM 23 O HIS A -4 101.609 28.694 46.431 1.00 0.00 O ATOM 24 CB HIS A -4 101.788 26.778 43.884 1.00 0.00 C ATOM 25 CG HIS A -4 101.045 27.486 42.783 1.00 0.00 C ATOM 26 ND1 HIS A -4 101.680 27.946 41.641 1.00 0.00 N ATOM 27 CD2 HIS A -4 99.721 27.819 42.636 1.00 0.00 C ATOM 28 CE1 HIS A -4 100.748 28.526 40.864 1.00 0.00 C ATOM 29 NE2 HIS A -4 99.536 28.475 41.422 1.00 0.00 N ATOM 0 H HIS A -4 102.987 26.584 46.395 1.00 0.00 H new ATOM 0 HA HIS A -4 103.502 28.085 43.890 1.00 0.00 H new ATOM 0 HB2 HIS A -4 102.312 25.919 43.465 1.00 0.00 H new ATOM 0 HB3 HIS A -4 101.070 26.391 44.607 1.00 0.00 H new ATOM 0 HD2 HIS A -4 98.942 27.605 43.353 1.00 0.00 H new ATOM 0 HE1 HIS A -4 100.955 28.978 39.905 1.00 0.00 H new ATOM 0 HE2 HIS A -4 98.663 28.838 41.041 1.00 0.00 H new ATOM 37 N HIS A -3 101.937 29.941 44.584 1.00 0.00 N ATOM 38 CA HIS A -3 101.257 31.116 45.123 1.00 0.00 C ATOM 39 C HIS A -3 99.970 31.389 44.353 1.00 0.00 C ATOM 40 O HIS A -3 99.919 31.227 43.134 1.00 0.00 O ATOM 41 CB HIS A -3 102.174 32.336 45.030 1.00 0.00 C ATOM 42 CG HIS A -3 103.415 32.219 45.870 1.00 0.00 C ATOM 43 ND1 HIS A -3 104.606 31.722 45.366 1.00 0.00 N ATOM 44 CD2 HIS A -3 103.667 32.531 47.184 1.00 0.00 C ATOM 45 CE1 HIS A -3 105.511 31.749 46.360 1.00 0.00 C ATOM 46 NE2 HIS A -3 104.993 32.233 47.491 1.00 0.00 N ATOM 0 H HIS A -3 102.300 30.060 43.638 1.00 0.00 H new ATOM 0 HA HIS A -3 101.010 30.923 46.167 1.00 0.00 H new ATOM 0 HB2 HIS A -3 102.462 32.486 43.989 1.00 0.00 H new ATOM 0 HB3 HIS A -3 101.619 33.222 45.338 1.00 0.00 H new ATOM 0 HD2 HIS A -3 102.947 32.945 47.874 1.00 0.00 H new ATOM 0 HE1 HIS A -3 106.534 31.419 46.256 1.00 0.00 H new ATOM 0 HE2 HIS A -3 105.466 32.358 48.386 1.00 0.00 H new ATOM 54 N HIS A -2 98.930 31.804 45.073 1.00 0.00 N ATOM 55 CA HIS A -2 97.641 32.098 44.455 1.00 0.00 C ATOM 56 C HIS A -2 97.357 33.596 44.499 1.00 0.00 C ATOM 57 O HIS A -2 97.619 34.259 45.503 1.00 0.00 O ATOM 58 CB HIS A -2 96.528 31.348 45.190 1.00 0.00 C ATOM 59 CG HIS A -2 96.673 29.852 45.130 1.00 0.00 C ATOM 60 ND1 HIS A -2 96.440 29.133 43.969 1.00 0.00 N ATOM 61 CD2 HIS A -2 97.027 28.926 46.081 1.00 0.00 C ATOM 62 CE1 HIS A -2 96.652 27.834 44.247 1.00 0.00 C ATOM 63 NE2 HIS A -2 97.013 27.651 45.520 1.00 0.00 N ATOM 0 H HIS A -2 98.955 31.944 46.083 1.00 0.00 H new ATOM 0 HA HIS A -2 97.675 31.774 43.415 1.00 0.00 H new ATOM 0 HB2 HIS A -2 96.516 31.663 46.234 1.00 0.00 H new ATOM 0 HB3 HIS A -2 95.566 31.630 44.761 1.00 0.00 H new ATOM 0 HD2 HIS A -2 97.278 29.152 47.107 1.00 0.00 H new ATOM 0 HE1 HIS A -2 96.543 27.036 43.528 1.00 0.00 H new ATOM 0 HE2 HIS A -2 97.231 26.768 45.982 1.00 0.00 H new ATOM 71 N HIS A -1 96.819 34.124 43.403 1.00 0.00 N ATOM 72 CA HIS A -1 96.503 35.547 43.316 1.00 0.00 C ATOM 73 C HIS A -1 95.075 35.746 42.817 1.00 0.00 C ATOM 74 O HIS A -1 94.450 34.817 42.307 1.00 0.00 O ATOM 75 CB HIS A -1 97.479 36.240 42.365 1.00 0.00 C ATOM 76 CG HIS A -1 98.919 36.094 42.774 1.00 0.00 C ATOM 77 ND1 HIS A -1 99.440 36.738 43.884 1.00 0.00 N ATOM 78 CD2 HIS A -1 99.960 35.381 42.231 1.00 0.00 C ATOM 79 CE1 HIS A -1 100.740 36.404 43.974 1.00 0.00 C ATOM 80 NE2 HIS A -1 101.109 35.579 42.992 1.00 0.00 N ATOM 0 H HIS A -1 96.593 33.589 42.564 1.00 0.00 H new ATOM 0 HA HIS A -1 96.594 35.984 44.310 1.00 0.00 H new ATOM 0 HB2 HIS A -1 97.351 35.830 41.363 1.00 0.00 H new ATOM 0 HB3 HIS A -1 97.230 37.300 42.310 1.00 0.00 H new ATOM 0 HD2 HIS A -1 99.897 34.761 41.349 1.00 0.00 H new ATOM 0 HE1 HIS A -1 101.405 36.760 44.747 1.00 0.00 H new ATOM 0 HE2 HIS A -1 102.034 35.179 42.833 1.00 0.00 H new ATOM 88 N HIS A 0 94.566 36.966 42.964 1.00 0.00 N ATOM 89 CA HIS A 0 93.208 37.285 42.529 1.00 0.00 C ATOM 90 C HIS A 0 93.241 38.229 41.331 1.00 0.00 C ATOM 91 O HIS A 0 94.023 39.179 41.298 1.00 0.00 O ATOM 92 CB HIS A 0 92.436 37.942 43.673 1.00 0.00 C ATOM 93 CG HIS A 0 92.230 37.033 44.855 1.00 0.00 C ATOM 94 ND1 HIS A 0 93.119 36.988 45.916 1.00 0.00 N ATOM 95 CD2 HIS A 0 91.240 36.130 45.156 1.00 0.00 C ATOM 96 CE1 HIS A 0 92.653 36.087 46.798 1.00 0.00 C ATOM 97 NE2 HIS A 0 91.510 35.533 46.385 1.00 0.00 N ATOM 0 H HIS A 0 95.071 37.749 43.380 1.00 0.00 H new ATOM 0 HA HIS A 0 92.711 36.360 42.238 1.00 0.00 H new ATOM 0 HB2 HIS A 0 92.972 38.833 43.999 1.00 0.00 H new ATOM 0 HB3 HIS A 0 91.465 38.272 43.304 1.00 0.00 H new ATOM 0 HD2 HIS A 0 90.383 35.916 44.535 1.00 0.00 H new ATOM 0 HE1 HIS A 0 93.144 35.841 47.728 1.00 0.00 H new ATOM 0 HE2 HIS A 0 90.955 34.825 46.866 1.00 0.00 H new ATOM 105 N SER A 1 92.386 37.960 40.349 1.00 0.00 N ATOM 106 CA SER A 1 92.329 38.788 39.151 1.00 0.00 C ATOM 107 C SER A 1 91.895 40.208 39.498 1.00 0.00 C ATOM 108 O SER A 1 91.217 40.433 40.500 1.00 0.00 O ATOM 109 CB SER A 1 91.347 38.184 38.146 1.00 0.00 C ATOM 110 OG SER A 1 91.753 36.858 37.836 1.00 0.00 O ATOM 0 H SER A 1 91.728 37.181 40.359 1.00 0.00 H new ATOM 0 HA SER A 1 93.325 38.824 38.710 1.00 0.00 H new ATOM 0 HB2 SER A 1 90.339 38.181 38.561 1.00 0.00 H new ATOM 0 HB3 SER A 1 91.317 38.789 37.240 1.00 0.00 H new ATOM 0 HG SER A 1 91.126 36.466 37.193 1.00 0.00 H new ATOM 116 N SER A 2 92.291 41.163 38.661 1.00 0.00 N ATOM 117 CA SER A 2 91.938 42.565 38.873 1.00 0.00 C ATOM 118 C SER A 2 91.161 43.104 37.678 1.00 0.00 C ATOM 119 O SER A 2 91.369 42.671 36.544 1.00 0.00 O ATOM 120 CB SER A 2 93.205 43.396 39.075 1.00 0.00 C ATOM 121 OG SER A 2 93.926 42.885 40.188 1.00 0.00 O ATOM 0 H SER A 2 92.857 40.992 37.829 1.00 0.00 H new ATOM 0 HA SER A 2 91.312 42.634 39.763 1.00 0.00 H new ATOM 0 HB2 SER A 2 93.824 43.361 38.178 1.00 0.00 H new ATOM 0 HB3 SER A 2 92.946 44.441 39.243 1.00 0.00 H new ATOM 0 HG SER A 2 94.741 43.414 40.321 1.00 0.00 H new ATOM 127 N GLY A 3 90.264 44.050 37.936 1.00 0.00 N ATOM 128 CA GLY A 3 89.460 44.637 36.870 1.00 0.00 C ATOM 129 C GLY A 3 90.348 45.281 35.810 1.00 0.00 C ATOM 130 O GLY A 3 91.343 45.932 36.133 1.00 0.00 O ATOM 0 H GLY A 3 90.076 44.424 38.866 1.00 0.00 H new ATOM 0 HA2 GLY A 3 88.839 43.867 36.411 1.00 0.00 H new ATOM 0 HA3 GLY A 3 88.785 45.384 37.287 1.00 0.00 H new ATOM 134 N LEU A 4 89.984 45.095 34.546 1.00 0.00 N ATOM 135 CA LEU A 4 90.760 45.654 33.445 1.00 0.00 C ATOM 136 C LEU A 4 90.138 46.956 32.954 1.00 0.00 C ATOM 137 O LEU A 4 88.916 47.081 32.875 1.00 0.00 O ATOM 138 CB LEU A 4 90.831 44.652 32.289 1.00 0.00 C ATOM 139 CG LEU A 4 91.428 43.328 32.775 1.00 0.00 C ATOM 140 CD1 LEU A 4 91.403 42.310 31.632 1.00 0.00 C ATOM 141 CD2 LEU A 4 92.876 43.545 33.219 1.00 0.00 C ATOM 0 H LEU A 4 89.161 44.565 34.259 1.00 0.00 H new ATOM 0 HA LEU A 4 91.767 45.861 33.808 1.00 0.00 H new ATOM 0 HB2 LEU A 4 89.834 44.483 31.883 1.00 0.00 H new ATOM 0 HB3 LEU A 4 91.439 45.059 31.481 1.00 0.00 H new ATOM 0 HG LEU A 4 90.841 42.957 33.615 1.00 0.00 H new ATOM 0 HD11 LEU A 4 91.828 41.367 31.976 1.00 0.00 H new ATOM 0 HD12 LEU A 4 90.374 42.149 31.310 1.00 0.00 H new ATOM 0 HD13 LEU A 4 91.990 42.688 30.795 1.00 0.00 H new ATOM 0 HD21 LEU A 4 93.296 42.600 33.564 1.00 0.00 H new ATOM 0 HD22 LEU A 4 93.462 43.918 32.379 1.00 0.00 H new ATOM 0 HD23 LEU A 4 92.903 44.272 34.031 1.00 0.00 H new ATOM 153 N VAL A 5 90.989 47.924 32.624 1.00 0.00 N ATOM 154 CA VAL A 5 90.514 49.208 32.123 1.00 0.00 C ATOM 155 C VAL A 5 89.893 49.045 30.734 1.00 0.00 C ATOM 156 O VAL A 5 90.243 48.105 30.017 1.00 0.00 O ATOM 157 CB VAL A 5 91.672 50.207 32.059 1.00 0.00 C ATOM 158 CG1 VAL A 5 92.230 50.433 33.466 1.00 0.00 C ATOM 159 CG2 VAL A 5 92.779 49.655 31.158 1.00 0.00 C ATOM 0 H VAL A 5 92.003 47.844 32.694 1.00 0.00 H new ATOM 0 HA VAL A 5 89.752 49.585 32.805 1.00 0.00 H new ATOM 0 HB VAL A 5 91.310 51.152 31.653 1.00 0.00 H new ATOM 0 HG11 VAL A 5 93.055 51.144 33.420 1.00 0.00 H new ATOM 0 HG12 VAL A 5 91.444 50.829 34.110 1.00 0.00 H new ATOM 0 HG13 VAL A 5 92.589 49.487 33.871 1.00 0.00 H new ATOM 0 HG21 VAL A 5 93.602 50.368 31.114 1.00 0.00 H new ATOM 0 HG22 VAL A 5 93.140 48.709 31.562 1.00 0.00 H new ATOM 0 HG23 VAL A 5 92.385 49.494 30.155 1.00 0.00 H new ATOM 169 N PRO A 6 88.991 49.918 30.332 1.00 0.00 N ATOM 170 CA PRO A 6 88.346 49.805 28.987 1.00 0.00 C ATOM 171 C PRO A 6 89.355 49.978 27.855 1.00 0.00 C ATOM 172 O PRO A 6 89.904 51.062 27.659 1.00 0.00 O ATOM 173 CB PRO A 6 87.297 50.923 28.966 1.00 0.00 C ATOM 174 CG PRO A 6 87.738 51.902 29.999 1.00 0.00 C ATOM 175 CD PRO A 6 88.478 51.095 31.064 1.00 0.00 C ATOM 0 HA PRO A 6 87.908 48.819 28.833 1.00 0.00 H new ATOM 0 HB2 PRO A 6 87.240 51.389 27.982 1.00 0.00 H new ATOM 0 HB3 PRO A 6 86.304 50.534 29.192 1.00 0.00 H new ATOM 0 HG2 PRO A 6 88.389 52.660 29.564 1.00 0.00 H new ATOM 0 HG3 PRO A 6 86.884 52.424 30.430 1.00 0.00 H new ATOM 0 HD2 PRO A 6 89.288 51.672 31.510 1.00 0.00 H new ATOM 0 HD3 PRO A 6 87.812 50.801 31.875 1.00 0.00 H new ATOM 183 N ARG A 7 89.592 48.900 27.112 1.00 0.00 N ATOM 184 CA ARG A 7 90.538 48.929 25.998 1.00 0.00 C ATOM 185 C ARG A 7 89.855 48.489 24.707 1.00 0.00 C ATOM 186 O ARG A 7 88.882 47.735 24.734 1.00 0.00 O ATOM 187 CB ARG A 7 91.717 48.000 26.293 1.00 0.00 C ATOM 188 CG ARG A 7 92.474 48.507 27.521 1.00 0.00 C ATOM 189 CD ARG A 7 93.672 47.597 27.797 1.00 0.00 C ATOM 190 NE ARG A 7 94.681 47.754 26.746 1.00 0.00 N ATOM 191 CZ ARG A 7 95.984 47.482 26.925 1.00 0.00 C ATOM 192 NH1 ARG A 7 96.458 47.049 28.068 1.00 0.00 N ATOM 193 NH2 ARG A 7 96.806 47.655 25.926 1.00 0.00 N ATOM 0 H ARG A 7 89.143 47.996 27.260 1.00 0.00 H new ATOM 0 HA ARG A 7 90.900 49.950 25.877 1.00 0.00 H new ATOM 0 HB2 ARG A 7 91.359 46.985 26.467 1.00 0.00 H new ATOM 0 HB3 ARG A 7 92.385 47.959 25.433 1.00 0.00 H new ATOM 0 HG2 ARG A 7 92.812 49.530 27.356 1.00 0.00 H new ATOM 0 HG3 ARG A 7 91.812 48.526 28.387 1.00 0.00 H new ATOM 0 HD2 ARG A 7 94.106 47.840 28.767 1.00 0.00 H new ATOM 0 HD3 ARG A 7 93.345 46.558 27.845 1.00 0.00 H new ATOM 0 HE ARG A 7 94.378 48.087 25.831 1.00 0.00 H new ATOM 0 HH11 ARG A 7 95.831 46.908 28.860 1.00 0.00 H new ATOM 0 HH12 ARG A 7 97.454 46.853 28.166 1.00 0.00 H new ATOM 0 HH21 ARG A 7 96.455 47.991 25.029 1.00 0.00 H new ATOM 0 HH22 ARG A 7 97.799 47.454 26.042 1.00 0.00 H new ATOM 207 N GLY A 8 90.372 48.965 23.579 1.00 0.00 N ATOM 208 CA GLY A 8 89.804 48.613 22.283 1.00 0.00 C ATOM 209 C GLY A 8 90.311 47.251 21.818 1.00 0.00 C ATOM 210 O GLY A 8 91.051 46.577 22.535 1.00 0.00 O ATOM 0 H GLY A 8 91.177 49.590 23.536 1.00 0.00 H new ATOM 0 HA2 GLY A 8 88.716 48.597 22.351 1.00 0.00 H new ATOM 0 HA3 GLY A 8 90.067 49.374 21.548 1.00 0.00 H new ATOM 214 N SER A 9 89.910 46.854 20.613 1.00 0.00 N ATOM 215 CA SER A 9 90.314 45.563 20.060 1.00 0.00 C ATOM 216 C SER A 9 91.133 45.758 18.788 1.00 0.00 C ATOM 217 O SER A 9 90.860 46.658 17.993 1.00 0.00 O ATOM 218 CB SER A 9 89.075 44.725 19.743 1.00 0.00 C ATOM 219 OG SER A 9 89.483 43.432 19.318 1.00 0.00 O ATOM 0 H SER A 9 89.307 47.405 20.002 1.00 0.00 H new ATOM 0 HA SER A 9 90.927 45.047 20.799 1.00 0.00 H new ATOM 0 HB2 SER A 9 88.438 44.647 20.624 1.00 0.00 H new ATOM 0 HB3 SER A 9 88.484 45.207 18.964 1.00 0.00 H new ATOM 0 HG SER A 9 88.692 42.890 19.115 1.00 0.00 H new ATOM 225 N GLY A 10 92.136 44.908 18.603 1.00 0.00 N ATOM 226 CA GLY A 10 92.987 44.987 17.420 1.00 0.00 C ATOM 227 C GLY A 10 93.455 43.601 16.993 1.00 0.00 C ATOM 228 O GLY A 10 93.137 42.603 17.639 1.00 0.00 O ATOM 0 H GLY A 10 92.380 44.160 19.252 1.00 0.00 H new ATOM 0 HA2 GLY A 10 92.439 45.458 16.604 1.00 0.00 H new ATOM 0 HA3 GLY A 10 93.851 45.618 17.630 1.00 0.00 H new ATOM 232 N MET A 11 94.211 43.545 15.899 1.00 0.00 N ATOM 233 CA MET A 11 94.720 42.275 15.386 1.00 0.00 C ATOM 234 C MET A 11 96.241 42.312 15.278 1.00 0.00 C ATOM 235 O MET A 11 96.830 43.364 15.031 1.00 0.00 O ATOM 236 CB MET A 11 94.118 41.993 14.009 1.00 0.00 C ATOM 237 CG MET A 11 92.605 41.806 14.140 1.00 0.00 C ATOM 238 SD MET A 11 91.911 41.360 12.529 1.00 0.00 S ATOM 239 CE MET A 11 90.170 41.357 13.026 1.00 0.00 C ATOM 0 H MET A 11 94.484 44.361 15.352 1.00 0.00 H new ATOM 0 HA MET A 11 94.435 41.483 16.079 1.00 0.00 H new ATOM 0 HB2 MET A 11 94.335 42.817 13.330 1.00 0.00 H new ATOM 0 HB3 MET A 11 94.570 41.099 13.580 1.00 0.00 H new ATOM 0 HG2 MET A 11 92.386 41.027 14.871 1.00 0.00 H new ATOM 0 HG3 MET A 11 92.144 42.724 14.505 1.00 0.00 H new ATOM 0 HE1 MET A 11 89.547 41.101 12.169 1.00 0.00 H new ATOM 0 HE2 MET A 11 90.019 40.622 13.816 1.00 0.00 H new ATOM 0 HE3 MET A 11 89.895 42.346 13.393 1.00 0.00 H new ATOM 249 N LYS A 12 96.870 41.156 15.464 1.00 0.00 N ATOM 250 CA LYS A 12 98.325 41.055 15.379 1.00 0.00 C ATOM 251 C LYS A 12 98.741 39.818 14.582 1.00 0.00 C ATOM 252 O LYS A 12 97.962 38.879 14.425 1.00 0.00 O ATOM 253 CB LYS A 12 98.928 41.036 16.793 1.00 0.00 C ATOM 254 CG LYS A 12 98.552 39.747 17.536 1.00 0.00 C ATOM 255 CD LYS A 12 99.060 39.822 18.977 1.00 0.00 C ATOM 256 CE LYS A 12 98.967 38.438 19.624 1.00 0.00 C ATOM 257 NZ LYS A 12 99.288 38.545 21.075 1.00 0.00 N ATOM 0 H LYS A 12 96.397 40.277 15.674 1.00 0.00 H new ATOM 0 HA LYS A 12 98.709 41.927 14.850 1.00 0.00 H new ATOM 0 HB2 LYS A 12 100.013 41.120 16.730 1.00 0.00 H new ATOM 0 HB3 LYS A 12 98.573 41.900 17.355 1.00 0.00 H new ATOM 0 HG2 LYS A 12 97.470 39.612 17.527 1.00 0.00 H new ATOM 0 HG3 LYS A 12 98.985 38.884 17.031 1.00 0.00 H new ATOM 0 HD2 LYS A 12 100.092 40.174 18.992 1.00 0.00 H new ATOM 0 HD3 LYS A 12 98.470 40.541 19.545 1.00 0.00 H new ATOM 0 HE2 LYS A 12 97.965 38.030 19.492 1.00 0.00 H new ATOM 0 HE3 LYS A 12 99.659 37.750 19.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 99.225 37.605 21.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 100.252 38.917 21.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 98.611 39.188 21.534 1.00 0.00 H new ATOM 271 N GLU A 13 99.974 39.827 14.084 1.00 0.00 N ATOM 272 CA GLU A 13 100.492 38.700 13.314 1.00 0.00 C ATOM 273 C GLU A 13 101.511 37.916 14.135 1.00 0.00 C ATOM 274 O GLU A 13 102.249 38.490 14.936 1.00 0.00 O ATOM 275 CB GLU A 13 101.152 39.205 12.030 1.00 0.00 C ATOM 276 CG GLU A 13 100.113 39.933 11.171 1.00 0.00 C ATOM 277 CD GLU A 13 98.980 38.995 10.744 1.00 0.00 C ATOM 278 OE1 GLU A 13 99.155 37.787 10.809 1.00 0.00 O ATOM 279 OE2 GLU A 13 97.944 39.505 10.353 1.00 0.00 O ATOM 0 H GLU A 13 100.631 40.599 14.199 1.00 0.00 H new ATOM 0 HA GLU A 13 99.660 38.043 13.061 1.00 0.00 H new ATOM 0 HB2 GLU A 13 101.975 39.878 12.272 1.00 0.00 H new ATOM 0 HB3 GLU A 13 101.577 38.369 11.474 1.00 0.00 H new ATOM 0 HG2 GLU A 13 99.700 40.772 11.731 1.00 0.00 H new ATOM 0 HG3 GLU A 13 100.597 40.347 10.286 1.00 0.00 H new ATOM 286 N THR A 14 101.546 36.603 13.929 1.00 0.00 N ATOM 287 CA THR A 14 102.483 35.748 14.651 1.00 0.00 C ATOM 288 C THR A 14 103.069 34.682 13.727 1.00 0.00 C ATOM 289 O THR A 14 102.498 34.372 12.681 1.00 0.00 O ATOM 290 CB THR A 14 101.778 35.095 15.847 1.00 0.00 C ATOM 291 OG1 THR A 14 102.721 34.347 16.599 1.00 0.00 O ATOM 292 CG2 THR A 14 100.648 34.177 15.370 1.00 0.00 C ATOM 0 H THR A 14 100.941 36.110 13.272 1.00 0.00 H new ATOM 0 HA THR A 14 103.305 36.363 15.017 1.00 0.00 H new ATOM 0 HB THR A 14 101.347 35.876 16.473 1.00 0.00 H new ATOM 0 HG1 THR A 14 102.273 33.931 17.364 1.00 0.00 H new ATOM 0 HG21 THR A 14 100.160 33.723 16.232 1.00 0.00 H new ATOM 0 HG22 THR A 14 99.920 34.759 14.806 1.00 0.00 H new ATOM 0 HG23 THR A 14 101.059 33.395 14.732 1.00 0.00 H new ATOM 300 N ALA A 15 104.210 34.126 14.120 1.00 0.00 N ATOM 301 CA ALA A 15 104.855 33.086 13.327 1.00 0.00 C ATOM 302 C ALA A 15 105.514 32.052 14.235 1.00 0.00 C ATOM 303 O ALA A 15 105.934 32.368 15.347 1.00 0.00 O ATOM 304 CB ALA A 15 105.907 33.707 12.407 1.00 0.00 C ATOM 0 H ALA A 15 104.704 34.376 14.977 1.00 0.00 H new ATOM 0 HA ALA A 15 104.094 32.590 12.724 1.00 0.00 H new ATOM 0 HB1 ALA A 15 106.384 32.923 11.818 1.00 0.00 H new ATOM 0 HB2 ALA A 15 105.429 34.423 11.738 1.00 0.00 H new ATOM 0 HB3 ALA A 15 106.659 34.218 13.008 1.00 0.00 H new ATOM 310 N ALA A 16 105.601 30.817 13.752 1.00 0.00 N ATOM 311 CA ALA A 16 106.211 29.745 14.531 1.00 0.00 C ATOM 312 C ALA A 16 107.721 29.940 14.626 1.00 0.00 C ATOM 313 O ALA A 16 108.369 30.323 13.651 1.00 0.00 O ATOM 314 CB ALA A 16 105.909 28.393 13.884 1.00 0.00 C ATOM 0 H ALA A 16 105.260 30.535 12.833 1.00 0.00 H new ATOM 0 HA ALA A 16 105.791 29.769 15.536 1.00 0.00 H new ATOM 0 HB1 ALA A 16 106.368 27.598 14.472 1.00 0.00 H new ATOM 0 HB2 ALA A 16 104.830 28.240 13.847 1.00 0.00 H new ATOM 0 HB3 ALA A 16 106.313 28.376 12.872 1.00 0.00 H new ATOM 320 N ALA A 17 108.274 29.674 15.804 1.00 0.00 N ATOM 321 CA ALA A 17 109.711 29.805 16.010 1.00 0.00 C ATOM 322 C ALA A 17 110.461 28.704 15.269 1.00 0.00 C ATOM 323 O ALA A 17 109.979 27.575 15.164 1.00 0.00 O ATOM 324 CB ALA A 17 110.034 29.730 17.503 1.00 0.00 C ATOM 0 H ALA A 17 107.753 29.368 16.626 1.00 0.00 H new ATOM 0 HA ALA A 17 110.028 30.772 15.619 1.00 0.00 H new ATOM 0 HB1 ALA A 17 111.110 29.829 17.648 1.00 0.00 H new ATOM 0 HB2 ALA A 17 109.522 30.537 18.027 1.00 0.00 H new ATOM 0 HB3 ALA A 17 109.701 28.771 17.900 1.00 0.00 H new ATOM 330 N LYS A 18 111.640 29.036 14.756 1.00 0.00 N ATOM 331 CA LYS A 18 112.451 28.059 14.038 1.00 0.00 C ATOM 332 C LYS A 18 113.145 27.121 15.020 1.00 0.00 C ATOM 333 O LYS A 18 113.748 27.566 15.996 1.00 0.00 O ATOM 334 CB LYS A 18 113.500 28.779 13.184 1.00 0.00 C ATOM 335 CG LYS A 18 114.247 27.769 12.309 1.00 0.00 C ATOM 336 CD LYS A 18 113.356 27.330 11.145 1.00 0.00 C ATOM 337 CE LYS A 18 114.144 26.397 10.224 1.00 0.00 C ATOM 338 NZ LYS A 18 114.092 25.008 10.763 1.00 0.00 N ATOM 0 H LYS A 18 112.053 29.966 14.823 1.00 0.00 H new ATOM 0 HA LYS A 18 111.799 27.473 13.391 1.00 0.00 H new ATOM 0 HB2 LYS A 18 113.018 29.529 12.557 1.00 0.00 H new ATOM 0 HB3 LYS A 18 114.205 29.306 13.827 1.00 0.00 H new ATOM 0 HG2 LYS A 18 115.166 28.215 11.927 1.00 0.00 H new ATOM 0 HG3 LYS A 18 114.536 26.903 12.904 1.00 0.00 H new ATOM 0 HD2 LYS A 18 112.469 26.821 11.523 1.00 0.00 H new ATOM 0 HD3 LYS A 18 113.011 28.201 10.589 1.00 0.00 H new ATOM 0 HE2 LYS A 18 113.727 26.424 9.217 1.00 0.00 H new ATOM 0 HE3 LYS A 18 115.179 26.731 10.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 114.748 24.403 10.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 114.366 25.014 11.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 113.125 24.636 10.671 1.00 0.00 H new ATOM 352 N PHE A 19 113.055 25.820 14.754 1.00 0.00 N ATOM 353 CA PHE A 19 113.669 24.819 15.623 1.00 0.00 C ATOM 354 C PHE A 19 114.767 24.064 14.881 1.00 0.00 C ATOM 355 O PHE A 19 114.671 23.836 13.675 1.00 0.00 O ATOM 356 CB PHE A 19 112.607 23.828 16.102 1.00 0.00 C ATOM 357 CG PHE A 19 111.513 24.469 16.924 1.00 0.00 C ATOM 358 CD1 PHE A 19 111.695 24.665 18.298 1.00 0.00 C ATOM 359 CD2 PHE A 19 110.319 24.867 16.311 1.00 0.00 C ATOM 360 CE1 PHE A 19 110.682 25.260 19.059 1.00 0.00 C ATOM 361 CE2 PHE A 19 109.306 25.460 17.072 1.00 0.00 C ATOM 362 CZ PHE A 19 109.487 25.658 18.447 1.00 0.00 C ATOM 0 H PHE A 19 112.565 25.435 13.947 1.00 0.00 H new ATOM 0 HA PHE A 19 114.109 25.329 16.480 1.00 0.00 H new ATOM 0 HB2 PHE A 19 112.161 23.339 15.236 1.00 0.00 H new ATOM 0 HB3 PHE A 19 113.088 23.050 16.695 1.00 0.00 H new ATOM 0 HD1 PHE A 19 112.616 24.357 18.771 1.00 0.00 H new ATOM 0 HD2 PHE A 19 110.180 24.716 15.251 1.00 0.00 H new ATOM 0 HE1 PHE A 19 110.822 25.412 20.119 1.00 0.00 H new ATOM 0 HE2 PHE A 19 108.384 25.765 16.599 1.00 0.00 H new ATOM 0 HZ PHE A 19 108.706 26.117 19.034 1.00 0.00 H new ATOM 372 N GLU A 20 115.812 23.683 15.610 1.00 0.00 N ATOM 373 CA GLU A 20 116.928 22.944 15.023 1.00 0.00 C ATOM 374 C GLU A 20 117.030 21.554 15.642 1.00 0.00 C ATOM 375 O GLU A 20 116.589 21.332 16.770 1.00 0.00 O ATOM 376 CB GLU A 20 118.236 23.703 15.259 1.00 0.00 C ATOM 377 CG GLU A 20 118.165 25.072 14.571 1.00 0.00 C ATOM 378 CD GLU A 20 119.483 25.842 14.702 1.00 0.00 C ATOM 379 OE1 GLU A 20 120.347 25.425 15.461 1.00 0.00 O ATOM 380 OE2 GLU A 20 119.611 26.852 14.030 1.00 0.00 O ATOM 0 H GLU A 20 115.910 23.873 16.607 1.00 0.00 H new ATOM 0 HA GLU A 20 116.752 22.844 13.952 1.00 0.00 H new ATOM 0 HB2 GLU A 20 118.407 23.830 16.328 1.00 0.00 H new ATOM 0 HB3 GLU A 20 119.077 23.130 14.867 1.00 0.00 H new ATOM 0 HG2 GLU A 20 117.926 24.937 13.516 1.00 0.00 H new ATOM 0 HG3 GLU A 20 117.357 25.658 15.009 1.00 0.00 H new ATOM 387 N ARG A 21 117.611 20.619 14.896 1.00 0.00 N ATOM 388 CA ARG A 21 117.771 19.256 15.386 1.00 0.00 C ATOM 389 C ARG A 21 119.031 18.618 14.806 1.00 0.00 C ATOM 390 O ARG A 21 119.549 19.065 13.782 1.00 0.00 O ATOM 391 CB ARG A 21 116.541 18.421 15.016 1.00 0.00 C ATOM 392 CG ARG A 21 116.366 18.398 13.495 1.00 0.00 C ATOM 393 CD ARG A 21 115.056 17.694 13.140 1.00 0.00 C ATOM 394 NE ARG A 21 115.042 16.334 13.691 1.00 0.00 N ATOM 395 CZ ARG A 21 113.921 15.623 13.878 1.00 0.00 C ATOM 396 NH1 ARG A 21 112.734 16.095 13.581 1.00 0.00 N ATOM 397 NH2 ARG A 21 114.014 14.419 14.374 1.00 0.00 N ATOM 0 H ARG A 21 117.976 20.779 13.957 1.00 0.00 H new ATOM 0 HA ARG A 21 117.870 19.287 16.471 1.00 0.00 H new ATOM 0 HB2 ARG A 21 116.654 17.405 15.393 1.00 0.00 H new ATOM 0 HB3 ARG A 21 115.651 18.839 15.487 1.00 0.00 H new ATOM 0 HG2 ARG A 21 116.361 19.415 13.104 1.00 0.00 H new ATOM 0 HG3 ARG A 21 117.206 17.882 13.030 1.00 0.00 H new ATOM 0 HD2 ARG A 21 114.212 18.261 13.533 1.00 0.00 H new ATOM 0 HD3 ARG A 21 114.938 17.656 12.057 1.00 0.00 H new ATOM 0 HE ARG A 21 115.933 15.907 13.945 1.00 0.00 H new ATOM 0 HH11 ARG A 21 112.641 17.034 13.193 1.00 0.00 H new ATOM 0 HH12 ARG A 21 111.904 15.523 13.738 1.00 0.00 H new ATOM 0 HH21 ARG A 21 114.928 14.035 14.612 1.00 0.00 H new ATOM 0 HH22 ARG A 21 113.172 13.863 14.524 1.00 0.00 H new ATOM 411 N GLN A 22 119.517 17.572 15.467 1.00 0.00 N ATOM 412 CA GLN A 22 120.731 16.890 15.026 1.00 0.00 C ATOM 413 C GLN A 22 120.389 15.562 14.357 1.00 0.00 C ATOM 414 O GLN A 22 119.612 14.769 14.888 1.00 0.00 O ATOM 415 CB GLN A 22 121.648 16.641 16.225 1.00 0.00 C ATOM 416 CG GLN A 22 122.979 16.061 15.743 1.00 0.00 C ATOM 417 CD GLN A 22 123.830 15.646 16.939 1.00 0.00 C ATOM 418 OE1 GLN A 22 123.386 14.858 17.775 1.00 0.00 O ATOM 419 NE2 GLN A 22 125.035 16.130 17.071 1.00 0.00 N ATOM 0 H GLN A 22 119.092 17.179 16.307 1.00 0.00 H new ATOM 0 HA GLN A 22 121.242 17.524 14.301 1.00 0.00 H new ATOM 0 HB2 GLN A 22 121.820 17.573 16.764 1.00 0.00 H new ATOM 0 HB3 GLN A 22 121.172 15.953 16.923 1.00 0.00 H new ATOM 0 HG2 GLN A 22 122.798 15.201 15.099 1.00 0.00 H new ATOM 0 HG3 GLN A 22 123.512 16.800 15.146 1.00 0.00 H new ATOM 0 HE21 GLN A 22 125.401 16.782 16.378 1.00 0.00 H new ATOM 0 HE22 GLN A 22 125.610 15.856 17.867 1.00 0.00 H new ATOM 428 N HIS A 23 120.978 15.327 13.187 1.00 0.00 N ATOM 429 CA HIS A 23 120.752 14.086 12.451 1.00 0.00 C ATOM 430 C HIS A 23 122.060 13.318 12.289 1.00 0.00 C ATOM 431 O HIS A 23 123.110 13.909 12.037 1.00 0.00 O ATOM 432 CB HIS A 23 120.170 14.397 11.071 1.00 0.00 C ATOM 433 CG HIS A 23 118.826 15.067 11.124 1.00 0.00 C ATOM 434 ND1 HIS A 23 117.678 14.393 11.509 1.00 0.00 N ATOM 435 CD2 HIS A 23 118.428 16.351 10.839 1.00 0.00 C ATOM 436 CE1 HIS A 23 116.656 15.264 11.447 1.00 0.00 C ATOM 437 NE2 HIS A 23 117.056 16.472 11.045 1.00 0.00 N ATOM 0 H HIS A 23 121.615 15.979 12.729 1.00 0.00 H new ATOM 0 HA HIS A 23 120.048 13.473 13.013 1.00 0.00 H new ATOM 0 HB2 HIS A 23 120.865 15.038 10.528 1.00 0.00 H new ATOM 0 HB3 HIS A 23 120.083 13.470 10.505 1.00 0.00 H new ATOM 0 HD1 HIS A 23 117.619 13.414 11.789 1.00 0.00 H new ATOM 0 HD2 HIS A 23 119.080 17.145 10.506 1.00 0.00 H new ATOM 0 HE1 HIS A 23 115.634 15.016 11.693 1.00 0.00 H new ATOM 445 N MET A 24 121.989 11.997 12.433 1.00 0.00 N ATOM 446 CA MET A 24 123.172 11.149 12.301 1.00 0.00 C ATOM 447 C MET A 24 122.917 10.030 11.298 1.00 0.00 C ATOM 448 O MET A 24 121.769 9.676 11.027 1.00 0.00 O ATOM 449 CB MET A 24 123.532 10.542 13.659 1.00 0.00 C ATOM 450 CG MET A 24 123.941 11.654 14.626 1.00 0.00 C ATOM 451 SD MET A 24 124.479 10.920 16.192 1.00 0.00 S ATOM 452 CE MET A 24 124.735 12.467 17.096 1.00 0.00 C ATOM 0 H MET A 24 121.128 11.491 12.640 1.00 0.00 H new ATOM 0 HA MET A 24 123.999 11.763 11.945 1.00 0.00 H new ATOM 0 HB2 MET A 24 122.680 9.992 14.060 1.00 0.00 H new ATOM 0 HB3 MET A 24 124.347 9.828 13.545 1.00 0.00 H new ATOM 0 HG2 MET A 24 124.746 12.249 14.195 1.00 0.00 H new ATOM 0 HG3 MET A 24 123.103 12.329 14.797 1.00 0.00 H new ATOM 0 HE1 MET A 24 125.615 12.375 17.733 1.00 0.00 H new ATOM 0 HE2 MET A 24 124.884 13.282 16.388 1.00 0.00 H new ATOM 0 HE3 MET A 24 123.861 12.677 17.713 1.00 0.00 H new ATOM 462 N ASP A 25 123.993 9.474 10.752 1.00 0.00 N ATOM 463 CA ASP A 25 123.873 8.379 9.797 1.00 0.00 C ATOM 464 C ASP A 25 123.581 7.067 10.517 1.00 0.00 C ATOM 465 O ASP A 25 123.602 7.006 11.746 1.00 0.00 O ATOM 466 CB ASP A 25 125.165 8.252 8.979 1.00 0.00 C ATOM 467 CG ASP A 25 126.381 8.010 9.877 1.00 0.00 C ATOM 468 OD1 ASP A 25 126.207 7.628 11.025 1.00 0.00 O ATOM 469 OD2 ASP A 25 127.485 8.208 9.394 1.00 0.00 O ATOM 0 H ASP A 25 124.951 9.761 10.952 1.00 0.00 H new ATOM 0 HA ASP A 25 123.043 8.597 9.124 1.00 0.00 H new ATOM 0 HB2 ASP A 25 125.067 7.431 8.269 1.00 0.00 H new ATOM 0 HB3 ASP A 25 125.318 9.160 8.396 1.00 0.00 H new ATOM 474 N SER A 26 123.309 6.018 9.747 1.00 0.00 N ATOM 475 CA SER A 26 123.006 4.717 10.331 1.00 0.00 C ATOM 476 C SER A 26 124.247 4.139 11.018 1.00 0.00 C ATOM 477 O SER A 26 125.367 4.433 10.598 1.00 0.00 O ATOM 478 CB SER A 26 122.528 3.754 9.244 1.00 0.00 C ATOM 479 OG SER A 26 121.537 4.398 8.453 1.00 0.00 O ATOM 0 H SER A 26 123.292 6.042 8.727 1.00 0.00 H new ATOM 0 HA SER A 26 122.217 4.845 11.072 1.00 0.00 H new ATOM 0 HB2 SER A 26 123.366 3.447 8.619 1.00 0.00 H new ATOM 0 HB3 SER A 26 122.119 2.850 9.696 1.00 0.00 H new ATOM 0 HG SER A 26 121.228 3.785 7.753 1.00 0.00 H new ATOM 485 N PRO A 27 124.089 3.334 12.048 1.00 0.00 N ATOM 486 CA PRO A 27 125.253 2.736 12.760 1.00 0.00 C ATOM 487 C PRO A 27 125.670 1.396 12.163 1.00 0.00 C ATOM 488 O PRO A 27 125.009 0.873 11.266 1.00 0.00 O ATOM 489 CB PRO A 27 124.725 2.557 14.182 1.00 0.00 C ATOM 490 CG PRO A 27 123.264 2.290 14.024 1.00 0.00 C ATOM 491 CD PRO A 27 122.831 2.890 12.681 1.00 0.00 C ATOM 0 HA PRO A 27 126.146 3.358 12.696 1.00 0.00 H new ATOM 0 HB2 PRO A 27 125.225 1.730 14.687 1.00 0.00 H new ATOM 0 HB3 PRO A 27 124.900 3.450 14.783 1.00 0.00 H new ATOM 0 HG2 PRO A 27 123.065 1.219 14.048 1.00 0.00 H new ATOM 0 HG3 PRO A 27 122.701 2.737 14.843 1.00 0.00 H new ATOM 0 HD2 PRO A 27 122.316 2.153 12.065 1.00 0.00 H new ATOM 0 HD3 PRO A 27 122.143 3.723 12.823 1.00 0.00 H new ATOM 499 N ASP A 28 126.770 0.846 12.666 1.00 0.00 N ATOM 500 CA ASP A 28 127.247 -0.450 12.201 1.00 0.00 C ATOM 501 C ASP A 28 126.283 -1.553 12.627 1.00 0.00 C ATOM 502 O ASP A 28 125.661 -1.468 13.687 1.00 0.00 O ATOM 503 CB ASP A 28 128.639 -0.734 12.773 1.00 0.00 C ATOM 504 CG ASP A 28 129.650 0.288 12.257 1.00 0.00 C ATOM 505 OD1 ASP A 28 129.476 0.767 11.149 1.00 0.00 O ATOM 506 OD2 ASP A 28 130.587 0.578 12.983 1.00 0.00 O ATOM 0 H ASP A 28 127.345 1.275 13.391 1.00 0.00 H new ATOM 0 HA ASP A 28 127.303 -0.429 11.113 1.00 0.00 H new ATOM 0 HB2 ASP A 28 128.604 -0.702 13.862 1.00 0.00 H new ATOM 0 HB3 ASP A 28 128.955 -1.739 12.494 1.00 0.00 H new ATOM 511 N LEU A 29 126.163 -2.586 11.800 1.00 0.00 N ATOM 512 CA LEU A 29 125.256 -3.687 12.101 1.00 0.00 C ATOM 513 C LEU A 29 125.997 -4.810 12.819 1.00 0.00 C ATOM 514 O LEU A 29 127.023 -5.297 12.342 1.00 0.00 O ATOM 515 CB LEU A 29 124.639 -4.223 10.807 1.00 0.00 C ATOM 516 CG LEU A 29 123.572 -5.268 11.141 1.00 0.00 C ATOM 517 CD1 LEU A 29 122.352 -4.576 11.749 1.00 0.00 C ATOM 518 CD2 LEU A 29 123.158 -5.998 9.862 1.00 0.00 C ATOM 0 H LEU A 29 126.677 -2.684 10.924 1.00 0.00 H new ATOM 0 HA LEU A 29 124.465 -3.315 12.753 1.00 0.00 H new ATOM 0 HB2 LEU A 29 124.196 -3.406 10.238 1.00 0.00 H new ATOM 0 HB3 LEU A 29 125.413 -4.666 10.180 1.00 0.00 H new ATOM 0 HG LEU A 29 123.976 -5.985 11.856 1.00 0.00 H new ATOM 0 HD11 LEU A 29 121.592 -5.321 11.987 1.00 0.00 H new ATOM 0 HD12 LEU A 29 122.646 -4.054 12.660 1.00 0.00 H new ATOM 0 HD13 LEU A 29 121.947 -3.859 11.035 1.00 0.00 H new ATOM 0 HD21 LEU A 29 122.398 -6.743 10.098 1.00 0.00 H new ATOM 0 HD22 LEU A 29 122.754 -5.280 9.148 1.00 0.00 H new ATOM 0 HD23 LEU A 29 124.027 -6.492 9.427 1.00 0.00 H new ATOM 530 N GLY A 30 125.469 -5.216 13.970 1.00 0.00 N ATOM 531 CA GLY A 30 126.084 -6.283 14.751 1.00 0.00 C ATOM 532 C GLY A 30 125.526 -7.645 14.352 1.00 0.00 C ATOM 533 O GLY A 30 124.772 -7.760 13.386 1.00 0.00 O ATOM 0 H GLY A 30 124.621 -4.824 14.380 1.00 0.00 H new ATOM 0 HA2 GLY A 30 127.164 -6.271 14.603 1.00 0.00 H new ATOM 0 HA3 GLY A 30 125.906 -6.110 15.812 1.00 0.00 H new ATOM 537 N THR A 31 125.903 -8.674 15.104 1.00 0.00 N ATOM 538 CA THR A 31 125.421 -10.024 14.835 1.00 0.00 C ATOM 539 C THR A 31 123.958 -10.156 15.243 1.00 0.00 C ATOM 540 O THR A 31 123.536 -9.605 16.259 1.00 0.00 O ATOM 541 CB THR A 31 126.264 -11.043 15.605 1.00 0.00 C ATOM 542 OG1 THR A 31 127.637 -10.847 15.300 1.00 0.00 O ATOM 543 CG2 THR A 31 125.848 -12.460 15.205 1.00 0.00 C ATOM 0 H THR A 31 126.537 -8.600 15.900 1.00 0.00 H new ATOM 0 HA THR A 31 125.509 -10.218 13.766 1.00 0.00 H new ATOM 0 HB THR A 31 126.107 -10.909 16.675 1.00 0.00 H new ATOM 0 HG1 THR A 31 128.178 -11.498 15.794 1.00 0.00 H new ATOM 0 HG21 THR A 31 126.449 -13.184 15.754 1.00 0.00 H new ATOM 0 HG22 THR A 31 124.794 -12.610 15.441 1.00 0.00 H new ATOM 0 HG23 THR A 31 126.004 -12.596 14.135 1.00 0.00 H new ATOM 551 N ASP A 32 123.188 -10.889 14.446 1.00 0.00 N ATOM 552 CA ASP A 32 121.767 -11.064 14.725 1.00 0.00 C ATOM 553 C ASP A 32 121.560 -11.692 16.101 1.00 0.00 C ATOM 554 O ASP A 32 122.223 -12.666 16.457 1.00 0.00 O ATOM 555 CB ASP A 32 121.124 -11.945 13.648 1.00 0.00 C ATOM 556 CG ASP A 32 121.728 -13.349 13.656 1.00 0.00 C ATOM 557 OD1 ASP A 32 122.879 -13.485 14.039 1.00 0.00 O ATOM 558 OD2 ASP A 32 121.026 -14.272 13.277 1.00 0.00 O ATOM 0 H ASP A 32 123.520 -11.368 13.609 1.00 0.00 H new ATOM 0 HA ASP A 32 121.292 -10.083 14.717 1.00 0.00 H new ATOM 0 HB2 ASP A 32 120.049 -12.007 13.818 1.00 0.00 H new ATOM 0 HB3 ASP A 32 121.266 -11.490 12.668 1.00 0.00 H new ATOM 563 N ASP A 33 120.636 -11.123 16.867 1.00 0.00 N ATOM 564 CA ASP A 33 120.347 -11.625 18.206 1.00 0.00 C ATOM 565 C ASP A 33 119.654 -12.982 18.136 1.00 0.00 C ATOM 566 O ASP A 33 118.938 -13.277 17.179 1.00 0.00 O ATOM 567 CB ASP A 33 119.454 -10.632 18.955 1.00 0.00 C ATOM 568 CG ASP A 33 120.181 -9.304 19.155 1.00 0.00 C ATOM 569 OD1 ASP A 33 121.395 -9.318 19.274 1.00 0.00 O ATOM 570 OD2 ASP A 33 119.508 -8.286 19.187 1.00 0.00 O ATOM 0 H ASP A 33 120.076 -10.318 16.586 1.00 0.00 H new ATOM 0 HA ASP A 33 121.291 -11.741 18.739 1.00 0.00 H new ATOM 0 HB2 ASP A 33 118.533 -10.468 18.395 1.00 0.00 H new ATOM 0 HB3 ASP A 33 119.170 -11.047 19.922 1.00 0.00 H new ATOM 575 N ASP A 34 119.873 -13.803 19.158 1.00 0.00 N ATOM 576 CA ASP A 34 119.250 -15.120 19.217 1.00 0.00 C ATOM 577 C ASP A 34 117.731 -14.990 19.197 1.00 0.00 C ATOM 578 O ASP A 34 117.184 -13.942 19.540 1.00 0.00 O ATOM 579 CB ASP A 34 119.686 -15.849 20.491 1.00 0.00 C ATOM 580 CG ASP A 34 121.193 -16.099 20.476 1.00 0.00 C ATOM 581 OD1 ASP A 34 121.742 -16.267 19.399 1.00 0.00 O ATOM 582 OD2 ASP A 34 121.777 -16.120 21.546 1.00 0.00 O ATOM 0 H ASP A 34 120.474 -13.581 19.952 1.00 0.00 H new ATOM 0 HA ASP A 34 119.568 -15.693 18.346 1.00 0.00 H new ATOM 0 HB2 ASP A 34 119.419 -15.256 21.366 1.00 0.00 H new ATOM 0 HB3 ASP A 34 119.155 -16.797 20.574 1.00 0.00 H new ATOM 587 N ASP A 35 117.053 -16.059 18.791 1.00 0.00 N ATOM 588 CA ASP A 35 115.598 -16.036 18.698 1.00 0.00 C ATOM 589 C ASP A 35 114.970 -16.078 20.088 1.00 0.00 C ATOM 590 O ASP A 35 115.141 -17.045 20.830 1.00 0.00 O ATOM 591 CB ASP A 35 115.108 -17.231 17.879 1.00 0.00 C ATOM 592 CG ASP A 35 113.600 -17.139 17.673 1.00 0.00 C ATOM 593 OD1 ASP A 35 113.188 -16.456 16.749 1.00 0.00 O ATOM 594 OD2 ASP A 35 112.879 -17.754 18.441 1.00 0.00 O ATOM 0 H ASP A 35 117.483 -16.944 18.523 1.00 0.00 H new ATOM 0 HA ASP A 35 115.300 -15.111 18.205 1.00 0.00 H new ATOM 0 HB2 ASP A 35 115.614 -17.253 16.914 1.00 0.00 H new ATOM 0 HB3 ASP A 35 115.357 -18.160 18.391 1.00 0.00 H new ATOM 599 N LYS A 36 114.243 -15.019 20.430 1.00 0.00 N ATOM 600 CA LYS A 36 113.599 -14.927 21.735 1.00 0.00 C ATOM 601 C LYS A 36 112.117 -15.269 21.630 1.00 0.00 C ATOM 602 O LYS A 36 111.579 -15.415 20.531 1.00 0.00 O ATOM 603 CB LYS A 36 113.758 -13.512 22.296 1.00 0.00 C ATOM 604 CG LYS A 36 115.241 -13.222 22.538 1.00 0.00 C ATOM 605 CD LYS A 36 115.392 -11.850 23.198 1.00 0.00 C ATOM 606 CE LYS A 36 116.876 -11.506 23.330 1.00 0.00 C ATOM 607 NZ LYS A 36 117.029 -10.257 24.128 1.00 0.00 N ATOM 0 H LYS A 36 114.085 -14.215 19.823 1.00 0.00 H new ATOM 0 HA LYS A 36 114.077 -15.642 22.405 1.00 0.00 H new ATOM 0 HB2 LYS A 36 113.343 -12.784 21.598 1.00 0.00 H new ATOM 0 HB3 LYS A 36 113.201 -13.414 23.228 1.00 0.00 H new ATOM 0 HG2 LYS A 36 115.674 -13.993 23.175 1.00 0.00 H new ATOM 0 HG3 LYS A 36 115.786 -13.245 21.594 1.00 0.00 H new ATOM 0 HD2 LYS A 36 114.884 -11.091 22.603 1.00 0.00 H new ATOM 0 HD3 LYS A 36 114.920 -11.854 24.181 1.00 0.00 H new ATOM 0 HE2 LYS A 36 117.408 -12.326 23.813 1.00 0.00 H new ATOM 0 HE3 LYS A 36 117.319 -11.376 22.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 118.039 -10.024 24.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 116.534 -9.477 23.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 116.621 -10.397 25.074 1.00 0.00 H new ATOM 621 N THR A 37 111.462 -15.397 22.779 1.00 0.00 N ATOM 622 CA THR A 37 110.039 -15.714 22.808 1.00 0.00 C ATOM 623 C THR A 37 109.235 -14.607 22.135 1.00 0.00 C ATOM 624 O THR A 37 109.575 -13.428 22.240 1.00 0.00 O ATOM 625 CB THR A 37 109.571 -15.884 24.255 1.00 0.00 C ATOM 626 OG1 THR A 37 110.394 -16.840 24.908 1.00 0.00 O ATOM 627 CG2 THR A 37 108.119 -16.364 24.270 1.00 0.00 C ATOM 0 H THR A 37 111.891 -15.287 23.698 1.00 0.00 H new ATOM 0 HA THR A 37 109.879 -16.646 22.266 1.00 0.00 H new ATOM 0 HB THR A 37 109.641 -14.928 24.774 1.00 0.00 H new ATOM 0 HG1 THR A 37 110.097 -16.949 25.835 1.00 0.00 H new ATOM 0 HG21 THR A 37 107.786 -16.485 25.301 1.00 0.00 H new ATOM 0 HG22 THR A 37 107.488 -15.630 23.769 1.00 0.00 H new ATOM 0 HG23 THR A 37 108.046 -17.320 23.751 1.00 0.00 H new ATOM 635 N GLY A 38 108.167 -14.993 21.445 1.00 0.00 N ATOM 636 CA GLY A 38 107.349 -14.027 20.721 1.00 0.00 C ATOM 637 C GLY A 38 106.667 -13.056 21.678 1.00 0.00 C ATOM 638 O GLY A 38 106.614 -13.292 22.886 1.00 0.00 O ATOM 0 H GLY A 38 107.850 -15.960 21.372 1.00 0.00 H new ATOM 0 HA2 GLY A 38 107.972 -13.473 20.019 1.00 0.00 H new ATOM 0 HA3 GLY A 38 106.596 -14.552 20.133 1.00 0.00 H new ATOM 642 N GLY A 39 106.147 -11.963 21.129 1.00 0.00 N ATOM 643 CA GLY A 39 105.497 -10.943 21.941 1.00 0.00 C ATOM 644 C GLY A 39 104.042 -11.305 22.222 1.00 0.00 C ATOM 645 O GLY A 39 103.600 -12.417 21.931 1.00 0.00 O ATOM 0 H GLY A 39 106.163 -11.762 20.129 1.00 0.00 H new ATOM 0 HA2 GLY A 39 106.034 -10.827 22.883 1.00 0.00 H new ATOM 0 HA3 GLY A 39 105.543 -9.982 21.428 1.00 0.00 H new ATOM 649 N GLY A 40 103.305 -10.356 22.789 1.00 0.00 N ATOM 650 CA GLY A 40 101.902 -10.581 23.118 1.00 0.00 C ATOM 651 C GLY A 40 101.024 -10.472 21.876 1.00 0.00 C ATOM 652 O GLY A 40 101.519 -10.510 20.750 1.00 0.00 O ATOM 0 H GLY A 40 103.653 -9.428 23.029 1.00 0.00 H new ATOM 0 HA2 GLY A 40 101.784 -11.568 23.566 1.00 0.00 H new ATOM 0 HA3 GLY A 40 101.578 -9.853 23.862 1.00 0.00 H new ATOM 656 N ARG A 41 99.719 -10.338 22.092 1.00 0.00 N ATOM 657 CA ARG A 41 98.774 -10.254 20.983 1.00 0.00 C ATOM 658 C ARG A 41 99.135 -9.093 20.061 1.00 0.00 C ATOM 659 O ARG A 41 99.529 -8.021 20.520 1.00 0.00 O ATOM 660 CB ARG A 41 97.357 -10.053 21.531 1.00 0.00 C ATOM 661 CG ARG A 41 96.333 -10.116 20.394 1.00 0.00 C ATOM 662 CD ARG A 41 96.102 -11.571 19.979 1.00 0.00 C ATOM 663 NE ARG A 41 95.160 -11.634 18.857 1.00 0.00 N ATOM 664 CZ ARG A 41 95.533 -11.586 17.569 1.00 0.00 C ATOM 665 NH1 ARG A 41 96.787 -11.478 17.206 1.00 0.00 N ATOM 666 NH2 ARG A 41 94.613 -11.647 16.646 1.00 0.00 N ATOM 0 H ARG A 41 99.294 -10.286 23.018 1.00 0.00 H new ATOM 0 HA ARG A 41 98.819 -11.182 20.412 1.00 0.00 H new ATOM 0 HB2 ARG A 41 97.135 -10.820 22.273 1.00 0.00 H new ATOM 0 HB3 ARG A 41 97.289 -9.090 22.038 1.00 0.00 H new ATOM 0 HG2 ARG A 41 95.393 -9.667 20.715 1.00 0.00 H new ATOM 0 HG3 ARG A 41 96.688 -9.538 19.541 1.00 0.00 H new ATOM 0 HD2 ARG A 41 97.049 -12.030 19.695 1.00 0.00 H new ATOM 0 HD3 ARG A 41 95.712 -12.140 20.823 1.00 0.00 H new ATOM 0 HE ARG A 41 94.166 -11.719 19.067 1.00 0.00 H new ATOM 0 HH11 ARG A 41 97.520 -11.427 17.913 1.00 0.00 H new ATOM 0 HH12 ARG A 41 97.030 -11.445 16.216 1.00 0.00 H new ATOM 0 HH21 ARG A 41 93.631 -11.730 16.909 1.00 0.00 H new ATOM 0 HH22 ARG A 41 94.876 -11.612 15.661 1.00 0.00 H new ATOM 680 N ALA A 42 98.998 -9.316 18.757 1.00 0.00 N ATOM 681 CA ALA A 42 99.323 -8.290 17.774 1.00 0.00 C ATOM 682 C ALA A 42 98.491 -7.034 18.007 1.00 0.00 C ATOM 683 O ALA A 42 97.366 -7.103 18.500 1.00 0.00 O ATOM 684 CB ALA A 42 99.064 -8.821 16.363 1.00 0.00 C ATOM 0 H ALA A 42 98.666 -10.194 18.359 1.00 0.00 H new ATOM 0 HA ALA A 42 100.377 -8.035 17.881 1.00 0.00 H new ATOM 0 HB1 ALA A 42 99.309 -8.049 15.633 1.00 0.00 H new ATOM 0 HB2 ALA A 42 99.685 -9.699 16.185 1.00 0.00 H new ATOM 0 HB3 ALA A 42 98.013 -9.094 16.264 1.00 0.00 H new ATOM 690 N ASP A 43 99.057 -5.885 17.649 1.00 0.00 N ATOM 691 CA ASP A 43 98.363 -4.613 17.823 1.00 0.00 C ATOM 692 C ASP A 43 97.019 -4.628 17.090 1.00 0.00 C ATOM 693 O ASP A 43 96.852 -5.389 16.137 1.00 0.00 O ATOM 694 CB ASP A 43 99.226 -3.466 17.291 1.00 0.00 C ATOM 695 CG ASP A 43 99.619 -3.729 15.840 1.00 0.00 C ATOM 696 OD1 ASP A 43 98.736 -4.013 15.048 1.00 0.00 O ATOM 697 OD2 ASP A 43 100.798 -3.641 15.542 1.00 0.00 O ATOM 0 H ASP A 43 99.988 -5.808 17.239 1.00 0.00 H new ATOM 0 HA ASP A 43 98.181 -4.464 18.887 1.00 0.00 H new ATOM 0 HB2 ASP A 43 98.678 -2.526 17.362 1.00 0.00 H new ATOM 0 HB3 ASP A 43 100.121 -3.360 17.904 1.00 0.00 H new ATOM 702 N PRO A 44 96.064 -3.818 17.500 1.00 0.00 N ATOM 703 CA PRO A 44 94.723 -3.801 16.840 1.00 0.00 C ATOM 704 C PRO A 44 94.760 -3.131 15.470 1.00 0.00 C ATOM 705 O PRO A 44 95.831 -2.840 14.938 1.00 0.00 O ATOM 706 CB PRO A 44 93.839 -3.011 17.807 1.00 0.00 C ATOM 707 CG PRO A 44 94.772 -2.108 18.540 1.00 0.00 C ATOM 708 CD PRO A 44 96.118 -2.832 18.603 1.00 0.00 C ATOM 0 HA PRO A 44 94.356 -4.810 16.652 1.00 0.00 H new ATOM 0 HB2 PRO A 44 93.080 -2.442 17.271 1.00 0.00 H new ATOM 0 HB3 PRO A 44 93.314 -3.676 18.493 1.00 0.00 H new ATOM 0 HG2 PRO A 44 94.870 -1.152 18.026 1.00 0.00 H new ATOM 0 HG3 PRO A 44 94.399 -1.895 19.542 1.00 0.00 H new ATOM 0 HD2 PRO A 44 96.948 -2.137 18.474 1.00 0.00 H new ATOM 0 HD3 PRO A 44 96.260 -3.322 19.566 1.00 0.00 H new ATOM 716 N ALA A 45 93.581 -2.889 14.906 1.00 0.00 N ATOM 717 CA ALA A 45 93.482 -2.265 13.592 1.00 0.00 C ATOM 718 C ALA A 45 94.072 -0.858 13.615 1.00 0.00 C ATOM 719 O ALA A 45 94.060 -0.185 14.645 1.00 0.00 O ATOM 720 CB ALA A 45 92.017 -2.198 13.156 1.00 0.00 C ATOM 0 H ALA A 45 92.684 -3.115 15.337 1.00 0.00 H new ATOM 0 HA ALA A 45 94.047 -2.869 12.883 1.00 0.00 H new ATOM 0 HB1 ALA A 45 91.951 -1.731 12.174 1.00 0.00 H new ATOM 0 HB2 ALA A 45 91.606 -3.206 13.107 1.00 0.00 H new ATOM 0 HB3 ALA A 45 91.449 -1.609 13.877 1.00 0.00 H new ATOM 726 N HIS A 46 94.587 -0.421 12.469 1.00 0.00 N ATOM 727 CA HIS A 46 95.178 0.910 12.352 1.00 0.00 C ATOM 728 C HIS A 46 94.538 1.677 11.200 1.00 0.00 C ATOM 729 O HIS A 46 93.806 1.105 10.392 1.00 0.00 O ATOM 730 CB HIS A 46 96.684 0.791 12.111 1.00 0.00 C ATOM 731 CG HIS A 46 97.409 0.041 13.194 1.00 0.00 C ATOM 732 ND1 HIS A 46 97.591 0.569 14.463 1.00 0.00 N ATOM 733 CD2 HIS A 46 98.003 -1.197 13.214 1.00 0.00 C ATOM 734 CE1 HIS A 46 98.269 -0.340 15.186 1.00 0.00 C ATOM 735 NE2 HIS A 46 98.546 -1.434 14.474 1.00 0.00 N ATOM 0 H HIS A 46 94.607 -0.968 11.608 1.00 0.00 H new ATOM 0 HA HIS A 46 94.999 1.452 13.281 1.00 0.00 H new ATOM 0 HB2 HIS A 46 96.853 0.290 11.158 1.00 0.00 H new ATOM 0 HB3 HIS A 46 97.110 1.791 12.025 1.00 0.00 H new ATOM 0 HD1 HIS A 46 97.269 1.480 14.789 1.00 0.00 H new ATOM 0 HD2 HIS A 46 98.043 -1.882 12.380 1.00 0.00 H new ATOM 0 HE1 HIS A 46 98.555 -0.201 16.218 1.00 0.00 H new ATOM 743 N ARG A 47 94.818 2.974 11.131 1.00 0.00 N ATOM 744 CA ARG A 47 94.252 3.812 10.080 1.00 0.00 C ATOM 745 C ARG A 47 94.782 3.390 8.713 1.00 0.00 C ATOM 746 O ARG A 47 95.950 3.025 8.575 1.00 0.00 O ATOM 747 CB ARG A 47 94.603 5.279 10.334 1.00 0.00 C ATOM 748 CG ARG A 47 93.862 6.164 9.331 1.00 0.00 C ATOM 749 CD ARG A 47 94.150 7.636 9.636 1.00 0.00 C ATOM 750 NE ARG A 47 95.549 7.952 9.331 1.00 0.00 N ATOM 751 CZ ARG A 47 96.203 8.997 9.860 1.00 0.00 C ATOM 752 NH1 ARG A 47 95.634 9.824 10.702 1.00 0.00 N ATOM 753 NH2 ARG A 47 97.449 9.195 9.524 1.00 0.00 N ATOM 0 H ARG A 47 95.428 3.465 11.784 1.00 0.00 H new ATOM 0 HA ARG A 47 93.169 3.691 10.090 1.00 0.00 H new ATOM 0 HB2 ARG A 47 94.330 5.558 11.352 1.00 0.00 H new ATOM 0 HB3 ARG A 47 95.679 5.428 10.240 1.00 0.00 H new ATOM 0 HG2 ARG A 47 94.178 5.924 8.316 1.00 0.00 H new ATOM 0 HG3 ARG A 47 92.790 5.974 9.385 1.00 0.00 H new ATOM 0 HD2 ARG A 47 93.489 8.273 9.048 1.00 0.00 H new ATOM 0 HD3 ARG A 47 93.943 7.845 10.686 1.00 0.00 H new ATOM 0 HE ARG A 47 96.051 7.345 8.683 1.00 0.00 H new ATOM 0 HH11 ARG A 47 94.661 9.684 10.976 1.00 0.00 H new ATOM 0 HH12 ARG A 47 96.164 10.608 11.084 1.00 0.00 H new ATOM 0 HH21 ARG A 47 97.908 8.561 8.870 1.00 0.00 H new ATOM 0 HH22 ARG A 47 97.964 9.984 9.915 1.00 0.00 H new ATOM 767 N SER A 48 93.917 3.445 7.706 1.00 0.00 N ATOM 768 CA SER A 48 94.306 3.059 6.355 1.00 0.00 C ATOM 769 C SER A 48 95.342 4.037 5.792 1.00 0.00 C ATOM 770 O SER A 48 95.375 5.196 6.210 1.00 0.00 O ATOM 771 CB SER A 48 93.078 3.036 5.444 1.00 0.00 C ATOM 772 OG SER A 48 92.132 2.109 5.958 1.00 0.00 O ATOM 0 H SER A 48 92.948 3.751 7.798 1.00 0.00 H new ATOM 0 HA SER A 48 94.747 2.063 6.396 1.00 0.00 H new ATOM 0 HB2 SER A 48 92.635 4.030 5.385 1.00 0.00 H new ATOM 0 HB3 SER A 48 93.367 2.755 4.431 1.00 0.00 H new ATOM 0 HG SER A 48 91.342 2.092 5.378 1.00 0.00 H new ATOM 778 N PRO A 49 96.183 3.614 4.870 1.00 0.00 N ATOM 779 CA PRO A 49 97.219 4.522 4.287 1.00 0.00 C ATOM 780 C PRO A 49 96.603 5.798 3.719 1.00 0.00 C ATOM 781 O PRO A 49 95.487 5.781 3.201 1.00 0.00 O ATOM 782 CB PRO A 49 97.881 3.696 3.180 1.00 0.00 C ATOM 783 CG PRO A 49 97.598 2.273 3.520 1.00 0.00 C ATOM 784 CD PRO A 49 96.268 2.266 4.268 1.00 0.00 C ATOM 0 HA PRO A 49 97.931 4.855 5.043 1.00 0.00 H new ATOM 0 HB2 PRO A 49 97.475 3.954 2.202 1.00 0.00 H new ATOM 0 HB3 PRO A 49 98.954 3.884 3.139 1.00 0.00 H new ATOM 0 HG2 PRO A 49 97.540 1.662 2.619 1.00 0.00 H new ATOM 0 HG3 PRO A 49 98.393 1.856 4.138 1.00 0.00 H new ATOM 0 HD2 PRO A 49 95.433 2.078 3.593 1.00 0.00 H new ATOM 0 HD3 PRO A 49 96.244 1.487 5.030 1.00 0.00 H new ATOM 792 N VAL A 50 97.337 6.902 3.819 1.00 0.00 N ATOM 793 CA VAL A 50 96.828 8.186 3.346 1.00 0.00 C ATOM 794 C VAL A 50 97.221 8.382 1.877 1.00 0.00 C ATOM 795 O VAL A 50 98.347 8.034 1.516 1.00 0.00 O ATOM 796 CB VAL A 50 97.414 9.319 4.199 1.00 0.00 C ATOM 797 CG1 VAL A 50 96.851 10.668 3.746 1.00 0.00 C ATOM 798 CG2 VAL A 50 97.049 9.097 5.670 1.00 0.00 C ATOM 0 H VAL A 50 98.275 6.935 4.218 1.00 0.00 H new ATOM 0 HA VAL A 50 95.742 8.201 3.432 1.00 0.00 H new ATOM 0 HB VAL A 50 98.497 9.321 4.080 1.00 0.00 H new ATOM 0 HG11 VAL A 50 97.275 11.463 4.359 1.00 0.00 H new ATOM 0 HG12 VAL A 50 97.110 10.838 2.701 1.00 0.00 H new ATOM 0 HG13 VAL A 50 95.766 10.665 3.855 1.00 0.00 H new ATOM 0 HG21 VAL A 50 97.466 9.903 6.274 1.00 0.00 H new ATOM 0 HG22 VAL A 50 95.964 9.087 5.778 1.00 0.00 H new ATOM 0 HG23 VAL A 50 97.456 8.143 6.006 1.00 0.00 H new ATOM 808 N PRO A 51 96.376 8.946 1.038 1.00 0.00 N ATOM 809 CA PRO A 51 96.746 9.177 -0.393 1.00 0.00 C ATOM 810 C PRO A 51 98.073 9.920 -0.514 1.00 0.00 C ATOM 811 O PRO A 51 98.527 10.554 0.439 1.00 0.00 O ATOM 812 CB PRO A 51 95.599 10.019 -0.955 1.00 0.00 C ATOM 813 CG PRO A 51 94.432 9.733 -0.075 1.00 0.00 C ATOM 814 CD PRO A 51 95.002 9.413 1.306 1.00 0.00 C ATOM 0 HA PRO A 51 96.881 8.240 -0.934 1.00 0.00 H new ATOM 0 HB2 PRO A 51 95.848 11.080 -0.945 1.00 0.00 H new ATOM 0 HB3 PRO A 51 95.386 9.752 -1.990 1.00 0.00 H new ATOM 0 HG2 PRO A 51 93.761 10.591 -0.029 1.00 0.00 H new ATOM 0 HG3 PRO A 51 93.852 8.894 -0.460 1.00 0.00 H new ATOM 0 HD2 PRO A 51 95.000 10.292 1.950 1.00 0.00 H new ATOM 0 HD3 PRO A 51 94.413 8.647 1.811 1.00 0.00 H new ATOM 822 N LEU A 52 98.693 9.840 -1.687 1.00 0.00 N ATOM 823 CA LEU A 52 99.987 10.479 -1.897 1.00 0.00 C ATOM 824 C LEU A 52 99.860 11.998 -1.770 1.00 0.00 C ATOM 825 O LEU A 52 98.778 12.540 -2.006 1.00 0.00 O ATOM 826 CB LEU A 52 100.526 10.136 -3.288 1.00 0.00 C ATOM 827 CG LEU A 52 101.201 8.763 -3.266 1.00 0.00 C ATOM 828 CD1 LEU A 52 101.470 8.311 -4.702 1.00 0.00 C ATOM 829 CD2 LEU A 52 102.529 8.854 -2.509 1.00 0.00 C ATOM 0 H LEU A 52 98.325 9.344 -2.499 1.00 0.00 H new ATOM 0 HA LEU A 52 100.676 10.110 -1.137 1.00 0.00 H new ATOM 0 HB2 LEU A 52 99.712 10.138 -4.013 1.00 0.00 H new ATOM 0 HB3 LEU A 52 101.239 10.896 -3.608 1.00 0.00 H new ATOM 0 HG LEU A 52 100.548 8.046 -2.768 1.00 0.00 H new ATOM 0 HD11 LEU A 52 101.951 7.333 -4.692 1.00 0.00 H new ATOM 0 HD12 LEU A 52 100.527 8.246 -5.246 1.00 0.00 H new ATOM 0 HD13 LEU A 52 102.124 9.031 -5.194 1.00 0.00 H new ATOM 0 HD21 LEU A 52 103.008 7.875 -2.495 1.00 0.00 H new ATOM 0 HD22 LEU A 52 103.183 9.570 -3.006 1.00 0.00 H new ATOM 0 HD23 LEU A 52 102.343 9.182 -1.486 1.00 0.00 H new ATOM 841 N PRO A 53 100.918 12.698 -1.409 1.00 0.00 N ATOM 842 CA PRO A 53 100.865 14.187 -1.314 1.00 0.00 C ATOM 843 C PRO A 53 100.837 14.834 -2.695 1.00 0.00 C ATOM 844 O PRO A 53 101.433 14.317 -3.645 1.00 0.00 O ATOM 845 CB PRO A 53 102.142 14.562 -0.561 1.00 0.00 C ATOM 846 CG PRO A 53 103.102 13.458 -0.839 1.00 0.00 C ATOM 847 CD PRO A 53 102.265 12.197 -1.058 1.00 0.00 C ATOM 0 HA PRO A 53 99.963 14.534 -0.810 1.00 0.00 H new ATOM 0 HB2 PRO A 53 102.534 15.519 -0.904 1.00 0.00 H new ATOM 0 HB3 PRO A 53 101.954 14.659 0.508 1.00 0.00 H new ATOM 0 HG2 PRO A 53 103.705 13.681 -1.719 1.00 0.00 H new ATOM 0 HG3 PRO A 53 103.792 13.325 -0.006 1.00 0.00 H new ATOM 0 HD2 PRO A 53 102.679 11.580 -1.856 1.00 0.00 H new ATOM 0 HD3 PRO A 53 102.237 11.579 -0.160 1.00 0.00 H new ATOM 855 N SER A 54 100.173 15.985 -2.793 1.00 0.00 N ATOM 856 CA SER A 54 100.012 16.658 -4.079 1.00 0.00 C ATOM 857 C SER A 54 101.384 16.913 -4.714 1.00 0.00 C ATOM 858 O SER A 54 102.266 17.453 -4.044 1.00 0.00 O ATOM 859 CB SER A 54 99.291 17.992 -3.878 1.00 0.00 C ATOM 860 OG SER A 54 100.078 18.826 -3.037 1.00 0.00 O ATOM 0 H SER A 54 99.742 16.467 -2.004 1.00 0.00 H new ATOM 0 HA SER A 54 99.423 16.021 -4.739 1.00 0.00 H new ATOM 0 HB2 SER A 54 99.125 18.478 -4.839 1.00 0.00 H new ATOM 0 HB3 SER A 54 98.311 17.826 -3.431 1.00 0.00 H new ATOM 0 HG SER A 54 101.028 18.628 -3.176 1.00 0.00 H new ATOM 866 N PRO A 55 101.595 16.556 -5.963 1.00 0.00 N ATOM 867 CA PRO A 55 102.964 16.579 -6.550 1.00 0.00 C ATOM 868 C PRO A 55 103.414 17.968 -6.985 1.00 0.00 C ATOM 869 O PRO A 55 102.785 18.598 -7.836 1.00 0.00 O ATOM 870 CB PRO A 55 102.853 15.643 -7.752 1.00 0.00 C ATOM 871 CG PRO A 55 101.437 15.761 -8.207 1.00 0.00 C ATOM 872 CD PRO A 55 100.606 16.168 -6.989 1.00 0.00 C ATOM 0 HA PRO A 55 103.713 16.274 -5.820 1.00 0.00 H new ATOM 0 HB2 PRO A 55 103.546 15.932 -8.542 1.00 0.00 H new ATOM 0 HB3 PRO A 55 103.094 14.616 -7.476 1.00 0.00 H new ATOM 0 HG2 PRO A 55 101.348 16.504 -9.000 1.00 0.00 H new ATOM 0 HG3 PRO A 55 101.084 14.814 -8.616 1.00 0.00 H new ATOM 0 HD2 PRO A 55 99.938 16.996 -7.226 1.00 0.00 H new ATOM 0 HD3 PRO A 55 99.982 15.344 -6.644 1.00 0.00 H new ATOM 880 N THR A 56 104.505 18.441 -6.395 1.00 0.00 N ATOM 881 CA THR A 56 105.180 19.622 -6.915 1.00 0.00 C ATOM 882 C THR A 56 105.963 19.203 -8.153 1.00 0.00 C ATOM 883 O THR A 56 106.276 18.021 -8.310 1.00 0.00 O ATOM 884 CB THR A 56 106.131 20.211 -5.869 1.00 0.00 C ATOM 885 OG1 THR A 56 107.171 19.282 -5.602 1.00 0.00 O ATOM 886 CG2 THR A 56 105.367 20.512 -4.578 1.00 0.00 C ATOM 0 H THR A 56 104.936 18.031 -5.567 1.00 0.00 H new ATOM 0 HA THR A 56 104.446 20.389 -7.164 1.00 0.00 H new ATOM 0 HB THR A 56 106.558 21.138 -6.253 1.00 0.00 H new ATOM 0 HG1 THR A 56 107.782 19.658 -4.934 1.00 0.00 H new ATOM 0 HG21 THR A 56 106.051 20.931 -3.840 1.00 0.00 H new ATOM 0 HG22 THR A 56 104.572 21.229 -4.784 1.00 0.00 H new ATOM 0 HG23 THR A 56 104.933 19.591 -4.189 1.00 0.00 H new ATOM 894 N SER A 57 106.313 20.154 -9.018 1.00 0.00 N ATOM 895 CA SER A 57 106.924 19.795 -10.297 1.00 0.00 C ATOM 896 C SER A 57 108.178 18.946 -10.089 1.00 0.00 C ATOM 897 O SER A 57 109.097 19.334 -9.369 1.00 0.00 O ATOM 898 CB SER A 57 107.287 21.062 -11.072 1.00 0.00 C ATOM 899 OG SER A 57 108.457 21.637 -10.509 1.00 0.00 O ATOM 0 H SER A 57 106.188 21.154 -8.863 1.00 0.00 H new ATOM 0 HA SER A 57 106.202 19.209 -10.866 1.00 0.00 H new ATOM 0 HB2 SER A 57 107.454 20.824 -12.123 1.00 0.00 H new ATOM 0 HB3 SER A 57 106.463 21.774 -11.033 1.00 0.00 H new ATOM 0 HG SER A 57 108.768 21.082 -9.763 1.00 0.00 H new ATOM 905 N ASN A 58 108.196 17.782 -10.735 1.00 0.00 N ATOM 906 CA ASN A 58 109.375 16.918 -10.747 1.00 0.00 C ATOM 907 C ASN A 58 109.752 16.391 -9.358 1.00 0.00 C ATOM 908 O ASN A 58 110.859 15.880 -9.191 1.00 0.00 O ATOM 909 CB ASN A 58 110.567 17.676 -11.335 1.00 0.00 C ATOM 910 CG ASN A 58 110.223 18.195 -12.727 1.00 0.00 C ATOM 911 OD1 ASN A 58 110.490 19.355 -13.041 1.00 0.00 O ATOM 912 ND2 ASN A 58 109.644 17.400 -13.585 1.00 0.00 N ATOM 0 H ASN A 58 107.403 17.414 -11.260 1.00 0.00 H new ATOM 0 HA ASN A 58 109.121 16.055 -11.363 1.00 0.00 H new ATOM 0 HB2 ASN A 58 110.836 18.508 -10.684 1.00 0.00 H new ATOM 0 HB3 ASN A 58 111.435 17.019 -11.388 1.00 0.00 H new ATOM 0 HD21 ASN A 58 109.412 17.739 -14.518 1.00 0.00 H new ATOM 0 HD22 ASN A 58 109.424 16.439 -13.322 1.00 0.00 H new ATOM 919 N LYS A 59 108.862 16.503 -8.368 1.00 0.00 N ATOM 920 CA LYS A 59 109.203 16.086 -7.007 1.00 0.00 C ATOM 921 C LYS A 59 107.978 15.617 -6.221 1.00 0.00 C ATOM 922 O LYS A 59 106.862 16.084 -6.450 1.00 0.00 O ATOM 923 CB LYS A 59 109.851 17.250 -6.249 1.00 0.00 C ATOM 924 CG LYS A 59 111.163 17.658 -6.925 1.00 0.00 C ATOM 925 CD LYS A 59 111.860 18.724 -6.078 1.00 0.00 C ATOM 926 CE LYS A 59 113.107 19.226 -6.809 1.00 0.00 C ATOM 927 NZ LYS A 59 113.443 20.596 -6.334 1.00 0.00 N ATOM 0 H LYS A 59 107.918 16.872 -8.480 1.00 0.00 H new ATOM 0 HA LYS A 59 109.896 15.250 -7.096 1.00 0.00 H new ATOM 0 HB2 LYS A 59 109.169 18.100 -6.221 1.00 0.00 H new ATOM 0 HB3 LYS A 59 110.041 16.959 -5.216 1.00 0.00 H new ATOM 0 HG2 LYS A 59 111.811 16.789 -7.041 1.00 0.00 H new ATOM 0 HG3 LYS A 59 110.965 18.044 -7.925 1.00 0.00 H new ATOM 0 HD2 LYS A 59 111.179 19.554 -5.887 1.00 0.00 H new ATOM 0 HD3 LYS A 59 112.137 18.309 -5.109 1.00 0.00 H new ATOM 0 HE2 LYS A 59 113.944 18.551 -6.628 1.00 0.00 H new ATOM 0 HE3 LYS A 59 112.932 19.235 -7.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 114.291 20.938 -6.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 112.646 21.236 -6.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 113.627 20.573 -5.311 1.00 0.00 H new ATOM 941 N GLN A 60 108.203 14.687 -5.293 1.00 0.00 N ATOM 942 CA GLN A 60 107.171 14.289 -4.335 1.00 0.00 C ATOM 943 C GLN A 60 107.794 13.868 -3.009 1.00 0.00 C ATOM 944 O GLN A 60 108.917 13.369 -2.971 1.00 0.00 O ATOM 945 CB GLN A 60 106.327 13.122 -4.855 1.00 0.00 C ATOM 946 CG GLN A 60 105.432 13.587 -6.001 1.00 0.00 C ATOM 947 CD GLN A 60 104.453 12.478 -6.378 1.00 0.00 C ATOM 948 OE1 GLN A 60 104.805 11.574 -7.137 1.00 0.00 O ATOM 949 NE2 GLN A 60 103.242 12.477 -5.882 1.00 0.00 N ATOM 0 H GLN A 60 109.090 14.195 -5.184 1.00 0.00 H new ATOM 0 HA GLN A 60 106.531 15.160 -4.194 1.00 0.00 H new ATOM 0 HB2 GLN A 60 106.978 12.317 -5.196 1.00 0.00 H new ATOM 0 HB3 GLN A 60 105.716 12.718 -4.048 1.00 0.00 H new ATOM 0 HG2 GLN A 60 104.885 14.482 -5.706 1.00 0.00 H new ATOM 0 HG3 GLN A 60 106.041 13.855 -6.864 1.00 0.00 H new ATOM 0 HE21 GLN A 60 102.948 13.224 -5.253 1.00 0.00 H new ATOM 0 HE22 GLN A 60 102.592 11.729 -6.124 1.00 0.00 H new ATOM 958 N ASP A 61 107.051 14.061 -1.925 1.00 0.00 N ATOM 959 CA ASP A 61 107.471 13.552 -0.625 1.00 0.00 C ATOM 960 C ASP A 61 106.836 12.186 -0.389 1.00 0.00 C ATOM 961 O ASP A 61 105.617 12.040 -0.487 1.00 0.00 O ATOM 962 CB ASP A 61 107.047 14.519 0.484 1.00 0.00 C ATOM 963 CG ASP A 61 107.742 15.868 0.314 1.00 0.00 C ATOM 964 OD1 ASP A 61 108.853 15.890 -0.192 1.00 0.00 O ATOM 965 OD2 ASP A 61 107.149 16.865 0.694 1.00 0.00 O ATOM 0 H ASP A 61 106.162 14.562 -1.920 1.00 0.00 H new ATOM 0 HA ASP A 61 108.557 13.458 -0.611 1.00 0.00 H new ATOM 0 HB2 ASP A 61 105.966 14.655 0.462 1.00 0.00 H new ATOM 0 HB3 ASP A 61 107.295 14.096 1.457 1.00 0.00 H new ATOM 970 N ILE A 62 107.656 11.183 -0.083 1.00 0.00 N ATOM 971 CA ILE A 62 107.155 9.817 0.082 1.00 0.00 C ATOM 972 C ILE A 62 107.569 9.256 1.445 1.00 0.00 C ATOM 973 O ILE A 62 108.667 9.541 1.923 1.00 0.00 O ATOM 974 CB ILE A 62 107.676 8.955 -1.079 1.00 0.00 C ATOM 975 CG1 ILE A 62 106.945 7.611 -1.088 1.00 0.00 C ATOM 976 CG2 ILE A 62 109.189 8.722 -0.972 1.00 0.00 C ATOM 977 CD1 ILE A 62 105.582 7.775 -1.769 1.00 0.00 C ATOM 0 H ILE A 62 108.661 11.287 0.055 1.00 0.00 H new ATOM 0 HA ILE A 62 106.065 9.811 0.057 1.00 0.00 H new ATOM 0 HB ILE A 62 107.484 9.488 -2.010 1.00 0.00 H new ATOM 0 HG12 ILE A 62 107.540 6.865 -1.616 1.00 0.00 H new ATOM 0 HG13 ILE A 62 106.813 7.250 -0.068 1.00 0.00 H new ATOM 0 HG21 ILE A 62 109.523 8.109 -1.809 1.00 0.00 H new ATOM 0 HG22 ILE A 62 109.707 9.681 -0.995 1.00 0.00 H new ATOM 0 HG23 ILE A 62 109.413 8.211 -0.036 1.00 0.00 H new ATOM 0 HD11 ILE A 62 105.061 6.818 -1.776 1.00 0.00 H new ATOM 0 HD12 ILE A 62 104.988 8.508 -1.223 1.00 0.00 H new ATOM 0 HD13 ILE A 62 105.726 8.117 -2.794 1.00 0.00 H new ATOM 989 N SER A 63 106.704 8.451 2.062 1.00 0.00 N ATOM 990 CA SER A 63 106.969 7.982 3.421 1.00 0.00 C ATOM 991 C SER A 63 106.377 6.599 3.684 1.00 0.00 C ATOM 992 O SER A 63 105.461 6.144 2.995 1.00 0.00 O ATOM 993 CB SER A 63 106.399 8.977 4.432 1.00 0.00 C ATOM 994 OG SER A 63 104.979 8.904 4.412 1.00 0.00 O ATOM 0 H SER A 63 105.832 8.116 1.653 1.00 0.00 H new ATOM 0 HA SER A 63 108.051 7.906 3.531 1.00 0.00 H new ATOM 0 HB2 SER A 63 106.772 8.752 5.431 1.00 0.00 H new ATOM 0 HB3 SER A 63 106.726 9.988 4.189 1.00 0.00 H new ATOM 0 HG SER A 63 104.652 9.135 3.518 1.00 0.00 H new ATOM 1000 N GLU A 64 106.903 5.945 4.716 1.00 0.00 N ATOM 1001 CA GLU A 64 106.445 4.614 5.091 1.00 0.00 C ATOM 1002 C GLU A 64 104.939 4.590 5.343 1.00 0.00 C ATOM 1003 O GLU A 64 104.272 3.609 5.023 1.00 0.00 O ATOM 1004 CB GLU A 64 107.187 4.150 6.349 1.00 0.00 C ATOM 1005 CG GLU A 64 106.908 5.108 7.514 1.00 0.00 C ATOM 1006 CD GLU A 64 107.712 4.738 8.765 1.00 0.00 C ATOM 1007 OE1 GLU A 64 108.372 3.708 8.770 1.00 0.00 O ATOM 1008 OE2 GLU A 64 107.651 5.500 9.716 1.00 0.00 O ATOM 0 H GLU A 64 107.647 6.317 5.307 1.00 0.00 H new ATOM 0 HA GLU A 64 106.658 3.938 4.263 1.00 0.00 H new ATOM 0 HB2 GLU A 64 106.871 3.141 6.615 1.00 0.00 H new ATOM 0 HB3 GLU A 64 108.258 4.107 6.153 1.00 0.00 H new ATOM 0 HG2 GLU A 64 107.154 6.126 7.213 1.00 0.00 H new ATOM 0 HG3 GLU A 64 105.844 5.093 7.749 1.00 0.00 H new ATOM 1015 N ALA A 65 104.399 5.677 5.887 1.00 0.00 N ATOM 1016 CA ALA A 65 102.984 5.715 6.241 1.00 0.00 C ATOM 1017 C ALA A 65 102.105 5.462 5.020 1.00 0.00 C ATOM 1018 O ALA A 65 101.132 4.711 5.093 1.00 0.00 O ATOM 1019 CB ALA A 65 102.632 7.075 6.846 1.00 0.00 C ATOM 0 H ALA A 65 104.913 6.534 6.090 1.00 0.00 H new ATOM 0 HA ALA A 65 102.799 4.928 6.972 1.00 0.00 H new ATOM 0 HB1 ALA A 65 101.574 7.094 7.107 1.00 0.00 H new ATOM 0 HB2 ALA A 65 103.230 7.240 7.742 1.00 0.00 H new ATOM 0 HB3 ALA A 65 102.841 7.861 6.120 1.00 0.00 H new ATOM 1025 N ASN A 66 102.448 6.092 3.902 1.00 0.00 N ATOM 1026 CA ASN A 66 101.628 5.981 2.698 1.00 0.00 C ATOM 1027 C ASN A 66 101.729 4.585 2.089 1.00 0.00 C ATOM 1028 O ASN A 66 100.721 3.985 1.717 1.00 0.00 O ATOM 1029 CB ASN A 66 102.063 7.009 1.647 1.00 0.00 C ATOM 1030 CG ASN A 66 102.147 8.409 2.248 1.00 0.00 C ATOM 1031 OD1 ASN A 66 103.228 8.860 2.626 1.00 0.00 O ATOM 1032 ND2 ASN A 66 101.067 9.131 2.348 1.00 0.00 N ATOM 0 H ASN A 66 103.277 6.678 3.802 1.00 0.00 H new ATOM 0 HA ASN A 66 100.596 6.171 2.993 1.00 0.00 H new ATOM 0 HB2 ASN A 66 103.033 6.727 1.238 1.00 0.00 H new ATOM 0 HB3 ASN A 66 101.355 7.008 0.818 1.00 0.00 H new ATOM 0 HD21 ASN A 66 101.117 10.071 2.740 1.00 0.00 H new ATOM 0 HD22 ASN A 66 100.172 8.756 2.034 1.00 0.00 H new ATOM 1039 N LEU A 67 102.952 4.079 1.970 1.00 0.00 N ATOM 1040 CA LEU A 67 103.170 2.778 1.339 1.00 0.00 C ATOM 1041 C LEU A 67 102.706 1.609 2.210 1.00 0.00 C ATOM 1042 O LEU A 67 102.398 0.537 1.686 1.00 0.00 O ATOM 1043 CB LEU A 67 104.648 2.608 0.980 1.00 0.00 C ATOM 1044 CG LEU A 67 104.948 3.388 -0.303 1.00 0.00 C ATOM 1045 CD1 LEU A 67 105.032 4.881 0.018 1.00 0.00 C ATOM 1046 CD2 LEU A 67 106.273 2.913 -0.912 1.00 0.00 C ATOM 0 H LEU A 67 103.800 4.542 2.297 1.00 0.00 H new ATOM 0 HA LEU A 67 102.563 2.761 0.434 1.00 0.00 H new ATOM 0 HB2 LEU A 67 105.276 2.969 1.794 1.00 0.00 H new ATOM 0 HB3 LEU A 67 104.882 1.552 0.841 1.00 0.00 H new ATOM 0 HG LEU A 67 104.148 3.214 -1.023 1.00 0.00 H new ATOM 0 HD11 LEU A 67 105.246 5.438 -0.894 1.00 0.00 H new ATOM 0 HD12 LEU A 67 104.083 5.218 0.435 1.00 0.00 H new ATOM 0 HD13 LEU A 67 105.828 5.053 0.743 1.00 0.00 H new ATOM 0 HD21 LEU A 67 106.476 3.474 -1.824 1.00 0.00 H new ATOM 0 HD22 LEU A 67 107.081 3.076 -0.198 1.00 0.00 H new ATOM 0 HD23 LEU A 67 106.205 1.851 -1.147 1.00 0.00 H new ATOM 1058 N ALA A 68 102.662 1.799 3.529 1.00 0.00 N ATOM 1059 CA ALA A 68 102.286 0.728 4.454 1.00 0.00 C ATOM 1060 C ALA A 68 103.406 -0.325 4.481 1.00 0.00 C ATOM 1061 O ALA A 68 104.567 0.033 4.287 1.00 0.00 O ATOM 1062 CB ALA A 68 100.919 0.138 4.060 1.00 0.00 C ATOM 0 H ALA A 68 102.882 2.686 3.982 1.00 0.00 H new ATOM 0 HA ALA A 68 102.173 1.119 5.465 1.00 0.00 H new ATOM 0 HB1 ALA A 68 100.652 -0.657 4.756 1.00 0.00 H new ATOM 0 HB2 ALA A 68 100.161 0.921 4.095 1.00 0.00 H new ATOM 0 HB3 ALA A 68 100.975 -0.268 3.050 1.00 0.00 H new ATOM 1068 N TYR A 69 103.093 -1.606 4.693 1.00 0.00 N ATOM 1069 CA TYR A 69 104.131 -2.637 4.775 1.00 0.00 C ATOM 1070 C TYR A 69 105.028 -2.664 3.528 1.00 0.00 C ATOM 1071 O TYR A 69 106.144 -3.181 3.578 1.00 0.00 O ATOM 1072 CB TYR A 69 103.480 -4.009 4.958 1.00 0.00 C ATOM 1073 CG TYR A 69 102.681 -4.128 6.236 1.00 0.00 C ATOM 1074 CD1 TYR A 69 103.331 -4.403 7.445 1.00 0.00 C ATOM 1075 CD2 TYR A 69 101.292 -3.962 6.209 1.00 0.00 C ATOM 1076 CE1 TYR A 69 102.591 -4.513 8.628 1.00 0.00 C ATOM 1077 CE2 TYR A 69 100.552 -4.072 7.393 1.00 0.00 C ATOM 1078 CZ TYR A 69 101.201 -4.348 8.602 1.00 0.00 C ATOM 1079 OH TYR A 69 100.472 -4.456 9.768 1.00 0.00 O ATOM 0 H TYR A 69 102.140 -1.952 4.810 1.00 0.00 H new ATOM 0 HA TYR A 69 104.761 -2.396 5.631 1.00 0.00 H new ATOM 0 HB2 TYR A 69 102.826 -4.209 4.109 1.00 0.00 H new ATOM 0 HB3 TYR A 69 104.255 -4.775 4.950 1.00 0.00 H new ATOM 0 HD1 TYR A 69 104.403 -4.530 7.465 1.00 0.00 H new ATOM 0 HD2 TYR A 69 100.791 -3.749 5.276 1.00 0.00 H new ATOM 0 HE1 TYR A 69 103.092 -4.725 9.561 1.00 0.00 H new ATOM 0 HE2 TYR A 69 99.480 -3.944 7.373 1.00 0.00 H new ATOM 0 HH TYR A 69 99.522 -4.313 9.574 1.00 0.00 H new ATOM 1089 N LEU A 70 104.544 -2.111 2.418 1.00 0.00 N ATOM 1090 CA LEU A 70 105.308 -2.088 1.170 1.00 0.00 C ATOM 1091 C LEU A 70 106.642 -1.346 1.317 1.00 0.00 C ATOM 1092 O LEU A 70 107.577 -1.597 0.556 1.00 0.00 O ATOM 1093 CB LEU A 70 104.479 -1.421 0.068 1.00 0.00 C ATOM 1094 CG LEU A 70 103.152 -2.162 -0.114 1.00 0.00 C ATOM 1095 CD1 LEU A 70 102.294 -1.422 -1.140 1.00 0.00 C ATOM 1096 CD2 LEU A 70 103.418 -3.584 -0.616 1.00 0.00 C ATOM 0 H LEU A 70 103.625 -1.672 2.356 1.00 0.00 H new ATOM 0 HA LEU A 70 105.529 -3.123 0.908 1.00 0.00 H new ATOM 0 HB2 LEU A 70 104.290 -0.379 0.325 1.00 0.00 H new ATOM 0 HB3 LEU A 70 105.037 -1.422 -0.869 1.00 0.00 H new ATOM 0 HG LEU A 70 102.631 -2.205 0.843 1.00 0.00 H new ATOM 0 HD11 LEU A 70 101.349 -1.948 -1.271 1.00 0.00 H new ATOM 0 HD12 LEU A 70 102.100 -0.409 -0.789 1.00 0.00 H new ATOM 0 HD13 LEU A 70 102.821 -1.381 -2.093 1.00 0.00 H new ATOM 0 HD21 LEU A 70 102.471 -4.108 -0.744 1.00 0.00 H new ATOM 0 HD22 LEU A 70 103.941 -3.541 -1.571 1.00 0.00 H new ATOM 0 HD23 LEU A 70 104.032 -4.117 0.110 1.00 0.00 H new ATOM 1108 N TRP A 71 106.734 -0.437 2.286 1.00 0.00 N ATOM 1109 CA TRP A 71 107.935 0.374 2.464 1.00 0.00 C ATOM 1110 C TRP A 71 109.167 -0.529 2.631 1.00 0.00 C ATOM 1111 O TRP A 71 109.264 -1.227 3.643 1.00 0.00 O ATOM 1112 CB TRP A 71 107.772 1.231 3.720 1.00 0.00 C ATOM 1113 CG TRP A 71 108.753 2.356 3.817 1.00 0.00 C ATOM 1114 CD1 TRP A 71 109.707 2.469 4.766 1.00 0.00 C ATOM 1115 CD2 TRP A 71 108.893 3.525 2.954 1.00 0.00 C ATOM 1116 NE1 TRP A 71 110.410 3.641 4.556 1.00 0.00 N ATOM 1117 CE2 TRP A 71 109.955 4.322 3.446 1.00 0.00 C ATOM 1118 CE3 TRP A 71 108.212 3.967 1.809 1.00 0.00 C ATOM 1119 CZ2 TRP A 71 110.325 5.517 2.821 1.00 0.00 C ATOM 1120 CZ3 TRP A 71 108.580 5.165 1.178 1.00 0.00 C ATOM 1121 CH2 TRP A 71 109.634 5.938 1.682 1.00 0.00 C ATOM 0 H TRP A 71 105.992 -0.244 2.959 1.00 0.00 H new ATOM 0 HA TRP A 71 108.073 1.006 1.587 1.00 0.00 H new ATOM 0 HB2 TRP A 71 106.762 1.640 3.740 1.00 0.00 H new ATOM 0 HB3 TRP A 71 107.876 0.594 4.599 1.00 0.00 H new ATOM 0 HD1 TRP A 71 109.891 1.760 5.559 1.00 0.00 H new ATOM 0 HE1 TRP A 71 111.174 3.963 5.151 1.00 0.00 H new ATOM 0 HE3 TRP A 71 107.398 3.380 1.410 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 111.138 6.109 3.215 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 108.047 5.493 0.298 1.00 0.00 H new ATOM 0 HH2 TRP A 71 109.912 6.859 1.191 1.00 0.00 H new ATOM 1132 N PRO A 72 110.105 -0.551 1.703 1.00 0.00 N ATOM 1133 CA PRO A 72 111.268 -1.485 1.781 1.00 0.00 C ATOM 1134 C PRO A 72 112.475 -0.920 2.532 1.00 0.00 C ATOM 1135 O PRO A 72 113.410 -1.658 2.840 1.00 0.00 O ATOM 1136 CB PRO A 72 111.615 -1.707 0.311 1.00 0.00 C ATOM 1137 CG PRO A 72 111.311 -0.406 -0.349 1.00 0.00 C ATOM 1138 CD PRO A 72 110.207 0.263 0.474 1.00 0.00 C ATOM 0 HA PRO A 72 111.015 -2.387 2.338 1.00 0.00 H new ATOM 0 HB2 PRO A 72 112.664 -1.978 0.188 1.00 0.00 H new ATOM 0 HB3 PRO A 72 111.024 -2.516 -0.118 1.00 0.00 H new ATOM 0 HG2 PRO A 72 112.199 0.224 -0.388 1.00 0.00 H new ATOM 0 HG3 PRO A 72 110.985 -0.562 -1.378 1.00 0.00 H new ATOM 0 HD2 PRO A 72 110.458 1.298 0.705 1.00 0.00 H new ATOM 0 HD3 PRO A 72 109.262 0.278 -0.070 1.00 0.00 H new ATOM 1146 N LEU A 73 112.480 0.386 2.790 1.00 0.00 N ATOM 1147 CA LEU A 73 113.642 1.029 3.402 1.00 0.00 C ATOM 1148 C LEU A 73 113.530 1.064 4.923 1.00 0.00 C ATOM 1149 O LEU A 73 112.441 1.217 5.478 1.00 0.00 O ATOM 1150 CB LEU A 73 113.787 2.464 2.892 1.00 0.00 C ATOM 1151 CG LEU A 73 113.837 2.494 1.362 1.00 0.00 C ATOM 1152 CD1 LEU A 73 113.918 3.951 0.906 1.00 0.00 C ATOM 1153 CD2 LEU A 73 115.068 1.732 0.862 1.00 0.00 C ATOM 0 H LEU A 73 111.702 1.014 2.588 1.00 0.00 H new ATOM 0 HA LEU A 73 114.516 0.440 3.125 1.00 0.00 H new ATOM 0 HB2 LEU A 73 112.950 3.067 3.245 1.00 0.00 H new ATOM 0 HB3 LEU A 73 114.695 2.910 3.299 1.00 0.00 H new ATOM 0 HG LEU A 73 112.943 2.021 0.956 1.00 0.00 H new ATOM 0 HD11 LEU A 73 113.954 3.990 -0.183 1.00 0.00 H new ATOM 0 HD12 LEU A 73 113.040 4.492 1.259 1.00 0.00 H new ATOM 0 HD13 LEU A 73 114.817 4.411 1.316 1.00 0.00 H new ATOM 0 HD21 LEU A 73 115.095 1.759 -0.227 1.00 0.00 H new ATOM 0 HD22 LEU A 73 115.970 2.198 1.259 1.00 0.00 H new ATOM 0 HD23 LEU A 73 115.016 0.696 1.198 1.00 0.00 H new ATOM 1165 N THR A 74 114.674 0.921 5.582 1.00 0.00 N ATOM 1166 CA THR A 74 114.746 1.044 7.033 1.00 0.00 C ATOM 1167 C THR A 74 114.505 2.490 7.462 1.00 0.00 C ATOM 1168 O THR A 74 113.868 2.731 8.489 1.00 0.00 O ATOM 1169 CB THR A 74 116.118 0.583 7.532 1.00 0.00 C ATOM 1170 OG1 THR A 74 117.125 1.422 6.983 1.00 0.00 O ATOM 1171 CG2 THR A 74 116.364 -0.864 7.101 1.00 0.00 C ATOM 0 H THR A 74 115.567 0.719 5.133 1.00 0.00 H new ATOM 0 HA THR A 74 113.972 0.413 7.470 1.00 0.00 H new ATOM 0 HB THR A 74 116.147 0.643 8.620 1.00 0.00 H new ATOM 0 HG1 THR A 74 117.259 1.197 6.039 1.00 0.00 H new ATOM 0 HG21 THR A 74 117.341 -1.189 7.458 1.00 0.00 H new ATOM 0 HG22 THR A 74 115.591 -1.506 7.524 1.00 0.00 H new ATOM 0 HG23 THR A 74 116.335 -0.930 6.013 1.00 0.00 H new ATOM 1179 N VAL A 75 115.012 3.448 6.682 1.00 0.00 N ATOM 1180 CA VAL A 75 114.734 4.852 6.965 1.00 0.00 C ATOM 1181 C VAL A 75 113.241 5.085 6.796 1.00 0.00 C ATOM 1182 O VAL A 75 112.661 4.692 5.789 1.00 0.00 O ATOM 1183 CB VAL A 75 115.529 5.784 6.043 1.00 0.00 C ATOM 1184 CG1 VAL A 75 117.019 5.660 6.363 1.00 0.00 C ATOM 1185 CG2 VAL A 75 115.296 5.420 4.574 1.00 0.00 C ATOM 0 H VAL A 75 115.604 3.280 5.868 1.00 0.00 H new ATOM 0 HA VAL A 75 115.041 5.079 7.986 1.00 0.00 H new ATOM 0 HB VAL A 75 115.193 6.808 6.207 1.00 0.00 H new ATOM 0 HG11 VAL A 75 117.588 6.321 5.709 1.00 0.00 H new ATOM 0 HG12 VAL A 75 117.192 5.940 7.402 1.00 0.00 H new ATOM 0 HG13 VAL A 75 117.340 4.630 6.206 1.00 0.00 H new ATOM 0 HG21 VAL A 75 115.869 6.094 3.937 1.00 0.00 H new ATOM 0 HG22 VAL A 75 115.617 4.393 4.398 1.00 0.00 H new ATOM 0 HG23 VAL A 75 114.236 5.514 4.340 1.00 0.00 H new ATOM 1195 N ASP A 76 112.617 5.703 7.790 1.00 0.00 N ATOM 1196 CA ASP A 76 111.161 5.761 7.833 1.00 0.00 C ATOM 1197 C ASP A 76 110.580 6.506 6.639 1.00 0.00 C ATOM 1198 O ASP A 76 109.484 6.175 6.185 1.00 0.00 O ATOM 1199 CB ASP A 76 110.696 6.420 9.134 1.00 0.00 C ATOM 1200 CG ASP A 76 111.089 5.570 10.340 1.00 0.00 C ATOM 1201 OD1 ASP A 76 111.170 4.360 10.197 1.00 0.00 O ATOM 1202 OD2 ASP A 76 111.304 6.144 11.396 1.00 0.00 O ATOM 0 H ASP A 76 113.088 6.166 8.568 1.00 0.00 H new ATOM 0 HA ASP A 76 110.796 4.735 7.791 1.00 0.00 H new ATOM 0 HB2 ASP A 76 111.138 7.412 9.223 1.00 0.00 H new ATOM 0 HB3 ASP A 76 109.614 6.553 9.114 1.00 0.00 H new ATOM 1207 N HIS A 77 111.287 7.520 6.148 1.00 0.00 N ATOM 1208 CA HIS A 77 110.786 8.285 5.015 1.00 0.00 C ATOM 1209 C HIS A 77 111.931 8.783 4.149 1.00 0.00 C ATOM 1210 O HIS A 77 113.099 8.564 4.463 1.00 0.00 O ATOM 1211 CB HIS A 77 109.943 9.466 5.505 1.00 0.00 C ATOM 1212 CG HIS A 77 110.649 10.344 6.502 1.00 0.00 C ATOM 1213 ND1 HIS A 77 111.111 9.863 7.716 1.00 0.00 N ATOM 1214 CD2 HIS A 77 110.961 11.682 6.486 1.00 0.00 C ATOM 1215 CE1 HIS A 77 111.671 10.893 8.374 1.00 0.00 C ATOM 1216 NE2 HIS A 77 111.608 12.026 7.670 1.00 0.00 N ATOM 0 H HIS A 77 112.191 7.825 6.509 1.00 0.00 H new ATOM 0 HA HIS A 77 110.160 7.629 4.411 1.00 0.00 H new ATOM 0 HB2 HIS A 77 109.648 10.071 4.647 1.00 0.00 H new ATOM 0 HB3 HIS A 77 109.027 9.084 5.956 1.00 0.00 H new ATOM 0 HD2 HIS A 77 110.738 12.363 5.678 1.00 0.00 H new ATOM 0 HE1 HIS A 77 112.118 10.814 9.354 1.00 0.00 H new ATOM 0 HE2 HIS A 77 111.958 12.945 7.941 1.00 0.00 H new ATOM 1224 N GLY A 78 111.576 9.397 3.029 1.00 0.00 N ATOM 1225 CA GLY A 78 112.554 10.015 2.151 1.00 0.00 C ATOM 1226 C GLY A 78 111.842 10.810 1.064 1.00 0.00 C ATOM 1227 O GLY A 78 110.647 10.632 0.824 1.00 0.00 O ATOM 0 H GLY A 78 110.612 9.479 2.707 1.00 0.00 H new ATOM 0 HA2 GLY A 78 113.208 10.671 2.725 1.00 0.00 H new ATOM 0 HA3 GLY A 78 113.186 9.250 1.700 1.00 0.00 H new ATOM 1231 N THR A 79 112.572 11.712 0.426 1.00 0.00 N ATOM 1232 CA THR A 79 112.006 12.523 -0.645 1.00 0.00 C ATOM 1233 C THR A 79 112.553 12.064 -1.991 1.00 0.00 C ATOM 1234 O THR A 79 113.731 11.746 -2.110 1.00 0.00 O ATOM 1235 CB THR A 79 112.352 13.996 -0.420 1.00 0.00 C ATOM 1236 OG1 THR A 79 112.185 14.312 0.954 1.00 0.00 O ATOM 1237 CG2 THR A 79 111.404 14.855 -1.258 1.00 0.00 C ATOM 0 H THR A 79 113.553 11.902 0.629 1.00 0.00 H new ATOM 0 HA THR A 79 110.922 12.406 -0.643 1.00 0.00 H new ATOM 0 HB THR A 79 113.385 14.187 -0.712 1.00 0.00 H new ATOM 0 HG1 THR A 79 112.408 15.255 1.102 1.00 0.00 H new ATOM 0 HG21 THR A 79 111.639 15.909 -1.108 1.00 0.00 H new ATOM 0 HG22 THR A 79 111.521 14.604 -2.312 1.00 0.00 H new ATOM 0 HG23 THR A 79 110.375 14.665 -0.952 1.00 0.00 H new ATOM 1245 N ILE A 80 111.696 12.028 -3.007 1.00 0.00 N ATOM 1246 CA ILE A 80 112.113 11.590 -4.335 1.00 0.00 C ATOM 1247 C ILE A 80 112.139 12.778 -5.288 1.00 0.00 C ATOM 1248 O ILE A 80 111.251 13.632 -5.247 1.00 0.00 O ATOM 1249 CB ILE A 80 111.150 10.515 -4.853 1.00 0.00 C ATOM 1250 CG1 ILE A 80 109.722 11.073 -4.895 1.00 0.00 C ATOM 1251 CG2 ILE A 80 111.204 9.304 -3.919 1.00 0.00 C ATOM 1252 CD1 ILE A 80 108.774 10.038 -5.506 1.00 0.00 C ATOM 0 H ILE A 80 110.714 12.295 -2.937 1.00 0.00 H new ATOM 0 HA ILE A 80 113.115 11.166 -4.275 1.00 0.00 H new ATOM 0 HB ILE A 80 111.443 10.216 -5.859 1.00 0.00 H new ATOM 0 HG12 ILE A 80 109.393 11.330 -3.888 1.00 0.00 H new ATOM 0 HG13 ILE A 80 109.699 11.991 -5.482 1.00 0.00 H new ATOM 0 HG21 ILE A 80 110.522 8.535 -4.281 1.00 0.00 H new ATOM 0 HG22 ILE A 80 112.219 8.907 -3.896 1.00 0.00 H new ATOM 0 HG23 ILE A 80 110.910 9.606 -2.914 1.00 0.00 H new ATOM 0 HD11 ILE A 80 107.762 10.442 -5.532 1.00 0.00 H new ATOM 0 HD12 ILE A 80 109.097 9.803 -6.520 1.00 0.00 H new ATOM 0 HD13 ILE A 80 108.787 9.131 -4.901 1.00 0.00 H new ATOM 1264 N GLU A 81 113.171 12.844 -6.127 1.00 0.00 N ATOM 1265 CA GLU A 81 113.312 13.973 -7.040 1.00 0.00 C ATOM 1266 C GLU A 81 113.908 13.552 -8.377 1.00 0.00 C ATOM 1267 O GLU A 81 114.739 12.645 -8.449 1.00 0.00 O ATOM 1268 CB GLU A 81 114.204 15.041 -6.403 1.00 0.00 C ATOM 1269 CG GLU A 81 113.568 15.531 -5.095 1.00 0.00 C ATOM 1270 CD GLU A 81 114.373 16.671 -4.464 1.00 0.00 C ATOM 1271 OE1 GLU A 81 115.481 16.937 -4.907 1.00 0.00 O ATOM 1272 OE2 GLU A 81 113.861 17.271 -3.534 1.00 0.00 O ATOM 0 H GLU A 81 113.909 12.142 -6.193 1.00 0.00 H new ATOM 0 HA GLU A 81 112.315 14.373 -7.227 1.00 0.00 H new ATOM 0 HB2 GLU A 81 115.195 14.631 -6.206 1.00 0.00 H new ATOM 0 HB3 GLU A 81 114.335 15.877 -7.090 1.00 0.00 H new ATOM 0 HG2 GLU A 81 112.550 15.869 -5.290 1.00 0.00 H new ATOM 0 HG3 GLU A 81 113.499 14.702 -4.391 1.00 0.00 H new ATOM 1279 N CYS A 82 113.458 14.220 -9.435 1.00 0.00 N ATOM 1280 CA CYS A 82 114.022 14.029 -10.765 1.00 0.00 C ATOM 1281 C CYS A 82 114.830 15.261 -11.165 1.00 0.00 C ATOM 1282 O CYS A 82 114.294 16.367 -11.237 1.00 0.00 O ATOM 1283 CB CYS A 82 112.900 13.799 -11.780 1.00 0.00 C ATOM 1284 SG CYS A 82 112.479 12.038 -11.822 1.00 0.00 S ATOM 0 H CYS A 82 112.700 14.902 -9.395 1.00 0.00 H new ATOM 0 HA CYS A 82 114.676 13.157 -10.751 1.00 0.00 H new ATOM 0 HB2 CYS A 82 112.023 14.387 -11.509 1.00 0.00 H new ATOM 0 HB3 CYS A 82 113.215 14.133 -12.769 1.00 0.00 H new ATOM 1289 N LEU A 83 116.118 15.064 -11.425 1.00 0.00 N ATOM 1290 CA LEU A 83 116.995 16.176 -11.776 1.00 0.00 C ATOM 1291 C LEU A 83 116.854 16.536 -13.258 1.00 0.00 C ATOM 1292 O LEU A 83 116.467 15.685 -14.057 1.00 0.00 O ATOM 1293 CB LEU A 83 118.449 15.807 -11.476 1.00 0.00 C ATOM 1294 CG LEU A 83 118.710 15.938 -9.974 1.00 0.00 C ATOM 1295 CD1 LEU A 83 119.926 15.093 -9.590 1.00 0.00 C ATOM 1296 CD2 LEU A 83 118.980 17.404 -9.631 1.00 0.00 C ATOM 0 H LEU A 83 116.575 14.153 -11.400 1.00 0.00 H new ATOM 0 HA LEU A 83 116.705 17.040 -11.179 1.00 0.00 H new ATOM 0 HB2 LEU A 83 118.651 14.787 -11.803 1.00 0.00 H new ATOM 0 HB3 LEU A 83 119.123 16.460 -12.031 1.00 0.00 H new ATOM 0 HG LEU A 83 117.837 15.589 -9.422 1.00 0.00 H new ATOM 0 HD11 LEU A 83 120.111 15.187 -8.520 1.00 0.00 H new ATOM 0 HD12 LEU A 83 119.735 14.048 -9.835 1.00 0.00 H new ATOM 0 HD13 LEU A 83 120.800 15.441 -10.141 1.00 0.00 H new ATOM 0 HD21 LEU A 83 119.166 17.499 -8.561 1.00 0.00 H new ATOM 0 HD22 LEU A 83 119.853 17.752 -10.184 1.00 0.00 H new ATOM 0 HD23 LEU A 83 118.114 18.007 -9.904 1.00 0.00 H new ATOM 1308 N PRO A 84 117.161 17.756 -13.651 1.00 0.00 N ATOM 1309 CA PRO A 84 117.065 18.159 -15.091 1.00 0.00 C ATOM 1310 C PRO A 84 117.801 17.205 -16.037 1.00 0.00 C ATOM 1311 O PRO A 84 117.521 17.176 -17.235 1.00 0.00 O ATOM 1312 CB PRO A 84 117.699 19.552 -15.137 1.00 0.00 C ATOM 1313 CG PRO A 84 117.568 20.092 -13.756 1.00 0.00 C ATOM 1314 CD PRO A 84 117.618 18.888 -12.817 1.00 0.00 C ATOM 0 HA PRO A 84 116.029 18.139 -15.430 1.00 0.00 H new ATOM 0 HB2 PRO A 84 118.745 19.498 -15.440 1.00 0.00 H new ATOM 0 HB3 PRO A 84 117.191 20.191 -15.859 1.00 0.00 H new ATOM 0 HG2 PRO A 84 118.374 20.792 -13.534 1.00 0.00 H new ATOM 0 HG3 PRO A 84 116.631 20.637 -13.639 1.00 0.00 H new ATOM 0 HD2 PRO A 84 118.626 18.721 -12.437 1.00 0.00 H new ATOM 0 HD3 PRO A 84 116.971 19.031 -11.951 1.00 0.00 H new ATOM 1322 N SER A 85 118.739 16.428 -15.499 1.00 0.00 N ATOM 1323 CA SER A 85 119.533 15.509 -16.318 1.00 0.00 C ATOM 1324 C SER A 85 118.807 14.192 -16.634 1.00 0.00 C ATOM 1325 O SER A 85 119.392 13.308 -17.258 1.00 0.00 O ATOM 1326 CB SER A 85 120.846 15.194 -15.599 1.00 0.00 C ATOM 1327 OG SER A 85 121.619 16.382 -15.501 1.00 0.00 O ATOM 0 H SER A 85 118.968 16.415 -14.505 1.00 0.00 H new ATOM 0 HA SER A 85 119.713 16.012 -17.268 1.00 0.00 H new ATOM 0 HB2 SER A 85 120.644 14.794 -14.605 1.00 0.00 H new ATOM 0 HB3 SER A 85 121.399 14.429 -16.144 1.00 0.00 H new ATOM 0 HG SER A 85 122.461 16.187 -15.039 1.00 0.00 H new ATOM 1333 N ASP A 86 117.552 14.051 -16.201 1.00 0.00 N ATOM 1334 CA ASP A 86 116.794 12.812 -16.383 1.00 0.00 C ATOM 1335 C ASP A 86 117.368 11.690 -15.517 1.00 0.00 C ATOM 1336 O ASP A 86 117.399 10.528 -15.922 1.00 0.00 O ATOM 1337 CB ASP A 86 116.787 12.386 -17.857 1.00 0.00 C ATOM 1338 CG ASP A 86 115.679 11.368 -18.109 1.00 0.00 C ATOM 1339 OD1 ASP A 86 114.654 11.455 -17.454 1.00 0.00 O ATOM 1340 OD2 ASP A 86 115.873 10.512 -18.956 1.00 0.00 O ATOM 0 H ASP A 86 117.036 14.787 -15.718 1.00 0.00 H new ATOM 0 HA ASP A 86 115.767 13.003 -16.071 1.00 0.00 H new ATOM 0 HB2 ASP A 86 116.640 13.258 -18.494 1.00 0.00 H new ATOM 0 HB3 ASP A 86 117.753 11.956 -18.123 1.00 0.00 H new ATOM 1345 N ASN A 87 117.812 12.042 -14.312 1.00 0.00 N ATOM 1346 CA ASN A 87 118.316 11.057 -13.360 1.00 0.00 C ATOM 1347 C ASN A 87 117.395 10.995 -12.148 1.00 0.00 C ATOM 1348 O ASN A 87 117.075 12.025 -11.553 1.00 0.00 O ATOM 1349 CB ASN A 87 119.728 11.439 -12.912 1.00 0.00 C ATOM 1350 CG ASN A 87 120.691 11.392 -14.095 1.00 0.00 C ATOM 1351 OD1 ASN A 87 120.432 10.708 -15.087 1.00 0.00 O ATOM 1352 ND2 ASN A 87 121.798 12.083 -14.051 1.00 0.00 N ATOM 0 H ASN A 87 117.833 13.004 -13.972 1.00 0.00 H new ATOM 0 HA ASN A 87 118.346 10.080 -13.842 1.00 0.00 H new ATOM 0 HB2 ASN A 87 119.721 12.440 -12.480 1.00 0.00 H new ATOM 0 HB3 ASN A 87 120.066 10.757 -12.132 1.00 0.00 H new ATOM 0 HD21 ASN A 87 122.447 12.056 -14.837 1.00 0.00 H new ATOM 0 HD22 ASN A 87 122.013 12.649 -13.231 1.00 0.00 H new ATOM 1359 N ALA A 88 116.956 9.791 -11.800 1.00 0.00 N ATOM 1360 CA ALA A 88 116.067 9.614 -10.659 1.00 0.00 C ATOM 1361 C ALA A 88 116.872 9.255 -9.415 1.00 0.00 C ATOM 1362 O ALA A 88 117.580 8.247 -9.395 1.00 0.00 O ATOM 1363 CB ALA A 88 115.058 8.504 -10.954 1.00 0.00 C ATOM 0 H ALA A 88 117.199 8.929 -12.288 1.00 0.00 H new ATOM 0 HA ALA A 88 115.535 10.549 -10.481 1.00 0.00 H new ATOM 0 HB1 ALA A 88 114.396 8.377 -10.097 1.00 0.00 H new ATOM 0 HB2 ALA A 88 114.469 8.772 -11.831 1.00 0.00 H new ATOM 0 HB3 ALA A 88 115.589 7.571 -11.144 1.00 0.00 H new ATOM 1369 N VAL A 89 116.742 10.068 -8.368 1.00 0.00 N ATOM 1370 CA VAL A 89 117.481 9.829 -7.130 1.00 0.00 C ATOM 1371 C VAL A 89 116.565 9.904 -5.911 1.00 0.00 C ATOM 1372 O VAL A 89 115.522 10.561 -5.931 1.00 0.00 O ATOM 1373 CB VAL A 89 118.603 10.859 -6.979 1.00 0.00 C ATOM 1374 CG1 VAL A 89 119.596 10.709 -8.132 1.00 0.00 C ATOM 1375 CG2 VAL A 89 118.012 12.272 -6.998 1.00 0.00 C ATOM 0 H VAL A 89 116.138 10.890 -8.351 1.00 0.00 H new ATOM 0 HA VAL A 89 117.903 8.826 -7.187 1.00 0.00 H new ATOM 0 HB VAL A 89 119.117 10.693 -6.032 1.00 0.00 H new ATOM 0 HG11 VAL A 89 120.394 11.443 -8.023 1.00 0.00 H new ATOM 0 HG12 VAL A 89 120.022 9.706 -8.117 1.00 0.00 H new ATOM 0 HG13 VAL A 89 119.081 10.871 -9.079 1.00 0.00 H new ATOM 0 HG21 VAL A 89 118.813 13.003 -6.890 1.00 0.00 H new ATOM 0 HG22 VAL A 89 117.495 12.437 -7.943 1.00 0.00 H new ATOM 0 HG23 VAL A 89 117.307 12.383 -6.174 1.00 0.00 H new ATOM 1385 N PHE A 90 116.991 9.230 -4.848 1.00 0.00 N ATOM 1386 CA PHE A 90 116.254 9.187 -3.589 1.00 0.00 C ATOM 1387 C PHE A 90 117.049 9.890 -2.490 1.00 0.00 C ATOM 1388 O PHE A 90 118.216 9.581 -2.271 1.00 0.00 O ATOM 1389 CB PHE A 90 116.031 7.722 -3.205 1.00 0.00 C ATOM 1390 CG PHE A 90 115.331 7.511 -1.882 1.00 0.00 C ATOM 1391 CD1 PHE A 90 113.943 7.671 -1.783 1.00 0.00 C ATOM 1392 CD2 PHE A 90 116.075 7.137 -0.757 1.00 0.00 C ATOM 1393 CE1 PHE A 90 113.301 7.457 -0.556 1.00 0.00 C ATOM 1394 CE2 PHE A 90 115.434 6.923 0.469 1.00 0.00 C ATOM 1395 CZ PHE A 90 114.047 7.081 0.569 1.00 0.00 C ATOM 0 H PHE A 90 117.860 8.696 -4.835 1.00 0.00 H new ATOM 0 HA PHE A 90 115.297 9.695 -3.706 1.00 0.00 H new ATOM 0 HB2 PHE A 90 115.447 7.241 -3.989 1.00 0.00 H new ATOM 0 HB3 PHE A 90 116.997 7.219 -3.173 1.00 0.00 H new ATOM 0 HD1 PHE A 90 113.368 7.959 -2.651 1.00 0.00 H new ATOM 0 HD2 PHE A 90 117.145 7.013 -0.835 1.00 0.00 H new ATOM 0 HE1 PHE A 90 112.231 7.582 -0.477 1.00 0.00 H new ATOM 0 HE2 PHE A 90 116.009 6.636 1.337 1.00 0.00 H new ATOM 0 HZ PHE A 90 113.551 6.913 1.514 1.00 0.00 H new ATOM 1405 N VAL A 91 116.417 10.834 -1.803 1.00 0.00 N ATOM 1406 CA VAL A 91 117.073 11.557 -0.715 1.00 0.00 C ATOM 1407 C VAL A 91 116.487 11.103 0.616 1.00 0.00 C ATOM 1408 O VAL A 91 115.271 11.076 0.781 1.00 0.00 O ATOM 1409 CB VAL A 91 116.852 13.067 -0.885 1.00 0.00 C ATOM 1410 CG1 VAL A 91 117.565 13.863 0.219 1.00 0.00 C ATOM 1411 CG2 VAL A 91 117.389 13.513 -2.249 1.00 0.00 C ATOM 0 H VAL A 91 115.453 11.118 -1.978 1.00 0.00 H new ATOM 0 HA VAL A 91 118.143 11.348 -0.735 1.00 0.00 H new ATOM 0 HB VAL A 91 115.782 13.262 -0.817 1.00 0.00 H new ATOM 0 HG11 VAL A 91 117.389 14.928 0.071 1.00 0.00 H new ATOM 0 HG12 VAL A 91 117.177 13.563 1.192 1.00 0.00 H new ATOM 0 HG13 VAL A 91 118.636 13.663 0.178 1.00 0.00 H new ATOM 0 HG21 VAL A 91 117.232 14.585 -2.369 1.00 0.00 H new ATOM 0 HG22 VAL A 91 118.455 13.293 -2.310 1.00 0.00 H new ATOM 0 HG23 VAL A 91 116.863 12.978 -3.040 1.00 0.00 H new ATOM 1421 N ALA A 92 117.353 10.768 1.568 1.00 0.00 N ATOM 1422 CA ALA A 92 116.885 10.338 2.885 1.00 0.00 C ATOM 1423 C ALA A 92 116.981 11.483 3.898 1.00 0.00 C ATOM 1424 O ALA A 92 117.780 12.397 3.706 1.00 0.00 O ATOM 1425 CB ALA A 92 117.723 9.156 3.373 1.00 0.00 C ATOM 0 H ALA A 92 118.367 10.785 1.457 1.00 0.00 H new ATOM 0 HA ALA A 92 115.841 10.037 2.795 1.00 0.00 H new ATOM 0 HB1 ALA A 92 117.370 8.840 4.355 1.00 0.00 H new ATOM 0 HB2 ALA A 92 117.629 8.328 2.670 1.00 0.00 H new ATOM 0 HB3 ALA A 92 118.769 9.456 3.443 1.00 0.00 H new ATOM 1431 N PRO A 93 116.200 11.467 4.959 1.00 0.00 N ATOM 1432 CA PRO A 93 116.272 12.543 5.999 1.00 0.00 C ATOM 1433 C PRO A 93 117.697 12.839 6.458 1.00 0.00 C ATOM 1434 O PRO A 93 117.992 13.945 6.913 1.00 0.00 O ATOM 1435 CB PRO A 93 115.440 12.003 7.165 1.00 0.00 C ATOM 1436 CG PRO A 93 114.497 11.014 6.568 1.00 0.00 C ATOM 1437 CD PRO A 93 115.154 10.479 5.296 1.00 0.00 C ATOM 0 HA PRO A 93 115.903 13.489 5.602 1.00 0.00 H new ATOM 0 HB2 PRO A 93 116.076 11.533 7.915 1.00 0.00 H new ATOM 0 HB3 PRO A 93 114.899 12.807 7.665 1.00 0.00 H new ATOM 0 HG2 PRO A 93 114.295 10.203 7.268 1.00 0.00 H new ATOM 0 HG3 PRO A 93 113.540 11.483 6.339 1.00 0.00 H new ATOM 0 HD2 PRO A 93 115.583 9.491 5.460 1.00 0.00 H new ATOM 0 HD3 PRO A 93 114.429 10.382 4.488 1.00 0.00 H new ATOM 1445 N ASP A 94 118.578 11.853 6.340 1.00 0.00 N ATOM 1446 CA ASP A 94 119.961 12.020 6.784 1.00 0.00 C ATOM 1447 C ASP A 94 120.727 13.072 5.967 1.00 0.00 C ATOM 1448 O ASP A 94 121.823 13.476 6.357 1.00 0.00 O ATOM 1449 CB ASP A 94 120.686 10.667 6.714 1.00 0.00 C ATOM 1450 CG ASP A 94 120.575 10.029 5.325 1.00 0.00 C ATOM 1451 OD1 ASP A 94 120.160 10.703 4.397 1.00 0.00 O ATOM 1452 OD2 ASP A 94 120.919 8.863 5.204 1.00 0.00 O ATOM 0 H ASP A 94 118.365 10.937 5.945 1.00 0.00 H new ATOM 0 HA ASP A 94 119.932 12.382 7.812 1.00 0.00 H new ATOM 0 HB2 ASP A 94 121.737 10.805 6.967 1.00 0.00 H new ATOM 0 HB3 ASP A 94 120.265 9.991 7.458 1.00 0.00 H new ATOM 1457 N GLY A 95 120.167 13.519 4.841 1.00 0.00 N ATOM 1458 CA GLY A 95 120.851 14.481 3.974 1.00 0.00 C ATOM 1459 C GLY A 95 121.733 13.808 2.910 1.00 0.00 C ATOM 1460 O GLY A 95 122.491 14.486 2.216 1.00 0.00 O ATOM 0 H GLY A 95 119.246 13.232 4.509 1.00 0.00 H new ATOM 0 HA2 GLY A 95 120.109 15.108 3.480 1.00 0.00 H new ATOM 0 HA3 GLY A 95 121.468 15.139 4.586 1.00 0.00 H new ATOM 1464 N THR A 96 121.636 12.486 2.781 1.00 0.00 N ATOM 1465 CA THR A 96 122.425 11.739 1.816 1.00 0.00 C ATOM 1466 C THR A 96 121.575 11.448 0.589 1.00 0.00 C ATOM 1467 O THR A 96 120.393 11.127 0.711 1.00 0.00 O ATOM 1468 CB THR A 96 122.879 10.419 2.443 1.00 0.00 C ATOM 1469 OG1 THR A 96 123.593 10.688 3.641 1.00 0.00 O ATOM 1470 CG2 THR A 96 123.779 9.652 1.470 1.00 0.00 C ATOM 0 H THR A 96 121.010 11.909 3.342 1.00 0.00 H new ATOM 0 HA THR A 96 123.298 12.324 1.527 1.00 0.00 H new ATOM 0 HB THR A 96 122.003 9.810 2.666 1.00 0.00 H new ATOM 0 HG1 THR A 96 123.883 9.844 4.045 1.00 0.00 H new ATOM 0 HG21 THR A 96 124.095 8.715 1.928 1.00 0.00 H new ATOM 0 HG22 THR A 96 123.227 9.440 0.554 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.656 10.254 1.234 1.00 0.00 H new ATOM 1478 N THR A 97 122.174 11.567 -0.590 1.00 0.00 N ATOM 1479 CA THR A 97 121.462 11.263 -1.825 1.00 0.00 C ATOM 1480 C THR A 97 121.917 9.913 -2.367 1.00 0.00 C ATOM 1481 O THR A 97 123.111 9.627 -2.438 1.00 0.00 O ATOM 1482 CB THR A 97 121.727 12.353 -2.865 1.00 0.00 C ATOM 1483 OG1 THR A 97 121.398 13.621 -2.313 1.00 0.00 O ATOM 1484 CG2 THR A 97 120.871 12.098 -4.106 1.00 0.00 C ATOM 0 H THR A 97 123.140 11.868 -0.717 1.00 0.00 H new ATOM 0 HA THR A 97 120.393 11.224 -1.616 1.00 0.00 H new ATOM 0 HB THR A 97 122.780 12.339 -3.145 1.00 0.00 H new ATOM 0 HG1 THR A 97 121.569 14.321 -2.977 1.00 0.00 H new ATOM 0 HG21 THR A 97 121.061 12.876 -4.845 1.00 0.00 H new ATOM 0 HG22 THR A 97 121.124 11.126 -4.529 1.00 0.00 H new ATOM 0 HG23 THR A 97 119.817 12.111 -3.830 1.00 0.00 H new ATOM 1492 N TYR A 98 120.946 9.091 -2.738 1.00 0.00 N ATOM 1493 CA TYR A 98 121.213 7.772 -3.291 1.00 0.00 C ATOM 1494 C TYR A 98 120.662 7.701 -4.713 1.00 0.00 C ATOM 1495 O TYR A 98 119.690 8.380 -5.031 1.00 0.00 O ATOM 1496 CB TYR A 98 120.525 6.705 -2.438 1.00 0.00 C ATOM 1497 CG TYR A 98 120.924 6.701 -0.976 1.00 0.00 C ATOM 1498 CD1 TYR A 98 120.209 7.474 -0.051 1.00 0.00 C ATOM 1499 CD2 TYR A 98 121.997 5.914 -0.542 1.00 0.00 C ATOM 1500 CE1 TYR A 98 120.568 7.461 1.303 1.00 0.00 C ATOM 1501 CE2 TYR A 98 122.354 5.899 0.814 1.00 0.00 C ATOM 1502 CZ TYR A 98 121.640 6.673 1.737 1.00 0.00 C ATOM 1503 OH TYR A 98 121.994 6.658 3.072 1.00 0.00 O ATOM 0 H TYR A 98 119.954 9.319 -2.664 1.00 0.00 H new ATOM 0 HA TYR A 98 122.289 7.596 -3.298 1.00 0.00 H new ATOM 0 HB2 TYR A 98 119.446 6.847 -2.505 1.00 0.00 H new ATOM 0 HB3 TYR A 98 120.744 5.725 -2.862 1.00 0.00 H new ATOM 0 HD1 TYR A 98 119.380 8.081 -0.383 1.00 0.00 H new ATOM 0 HD2 TYR A 98 122.551 5.318 -1.252 1.00 0.00 H new ATOM 0 HE1 TYR A 98 120.017 8.060 2.013 1.00 0.00 H new ATOM 0 HE2 TYR A 98 123.181 5.289 1.147 1.00 0.00 H new ATOM 0 HH TYR A 98 121.562 7.407 3.533 1.00 0.00 H new ATOM 1513 N ALA A 99 121.271 6.881 -5.561 1.00 0.00 N ATOM 1514 CA ALA A 99 120.801 6.735 -6.935 1.00 0.00 C ATOM 1515 C ALA A 99 119.721 5.660 -7.023 1.00 0.00 C ATOM 1516 O ALA A 99 119.932 4.522 -6.605 1.00 0.00 O ATOM 1517 CB ALA A 99 121.970 6.361 -7.852 1.00 0.00 C ATOM 0 H ALA A 99 122.084 6.311 -5.326 1.00 0.00 H new ATOM 0 HA ALA A 99 120.377 7.687 -7.255 1.00 0.00 H new ATOM 0 HB1 ALA A 99 121.610 6.254 -8.875 1.00 0.00 H new ATOM 0 HB2 ALA A 99 122.727 7.144 -7.814 1.00 0.00 H new ATOM 0 HB3 ALA A 99 122.405 5.418 -7.520 1.00 0.00 H new ATOM 1523 N LEU A 100 118.562 6.026 -7.568 1.00 0.00 N ATOM 1524 CA LEU A 100 117.477 5.067 -7.735 1.00 0.00 C ATOM 1525 C LEU A 100 117.682 4.270 -9.015 1.00 0.00 C ATOM 1526 O LEU A 100 117.626 3.041 -9.011 1.00 0.00 O ATOM 1527 CB LEU A 100 116.127 5.783 -7.818 1.00 0.00 C ATOM 1528 CG LEU A 100 115.676 6.244 -6.433 1.00 0.00 C ATOM 1529 CD1 LEU A 100 114.615 7.335 -6.597 1.00 0.00 C ATOM 1530 CD2 LEU A 100 115.067 5.062 -5.677 1.00 0.00 C ATOM 0 H LEU A 100 118.353 6.969 -7.897 1.00 0.00 H new ATOM 0 HA LEU A 100 117.480 4.401 -6.872 1.00 0.00 H new ATOM 0 HB2 LEU A 100 116.205 6.641 -8.485 1.00 0.00 H new ATOM 0 HB3 LEU A 100 115.380 5.114 -8.245 1.00 0.00 H new ATOM 0 HG LEU A 100 116.529 6.632 -5.876 1.00 0.00 H new ATOM 0 HD11 LEU A 100 114.285 7.672 -5.614 1.00 0.00 H new ATOM 0 HD12 LEU A 100 115.039 8.176 -7.146 1.00 0.00 H new ATOM 0 HD13 LEU A 100 113.764 6.935 -7.148 1.00 0.00 H new ATOM 0 HD21 LEU A 100 114.745 5.389 -4.689 1.00 0.00 H new ATOM 0 HD22 LEU A 100 114.209 4.679 -6.230 1.00 0.00 H new ATOM 0 HD23 LEU A 100 115.813 4.274 -5.573 1.00 0.00 H new ATOM 1542 N ASN A 101 117.919 4.986 -10.112 1.00 0.00 N ATOM 1543 CA ASN A 101 118.069 4.339 -11.417 1.00 0.00 C ATOM 1544 C ASN A 101 119.535 4.263 -11.839 1.00 0.00 C ATOM 1545 O ASN A 101 120.409 4.907 -11.255 1.00 0.00 O ATOM 1546 CB ASN A 101 117.227 5.069 -12.473 1.00 0.00 C ATOM 1547 CG ASN A 101 117.793 6.449 -12.800 1.00 0.00 C ATOM 1548 OD1 ASN A 101 118.799 6.868 -12.230 1.00 0.00 O ATOM 1549 ND2 ASN A 101 117.200 7.185 -13.699 1.00 0.00 N ATOM 0 H ASN A 101 118.011 6.002 -10.126 1.00 0.00 H new ATOM 0 HA ASN A 101 117.705 3.315 -11.331 1.00 0.00 H new ATOM 0 HB2 ASN A 101 117.186 4.469 -13.382 1.00 0.00 H new ATOM 0 HB3 ASN A 101 116.204 5.173 -12.113 1.00 0.00 H new ATOM 0 HD21 ASN A 101 117.571 8.107 -13.929 1.00 0.00 H new ATOM 0 HD22 ASN A 101 116.366 6.838 -14.172 1.00 0.00 H new ATOM 1556 N ASP A 102 119.795 3.473 -12.874 1.00 0.00 N ATOM 1557 CA ASP A 102 121.166 3.185 -13.280 1.00 0.00 C ATOM 1558 C ASP A 102 121.947 4.458 -13.596 1.00 0.00 C ATOM 1559 O ASP A 102 123.122 4.563 -13.253 1.00 0.00 O ATOM 1560 CB ASP A 102 121.162 2.263 -14.503 1.00 0.00 C ATOM 1561 CG ASP A 102 120.517 2.953 -15.705 1.00 0.00 C ATOM 1562 OD1 ASP A 102 119.651 3.788 -15.498 1.00 0.00 O ATOM 1563 OD2 ASP A 102 120.900 2.634 -16.818 1.00 0.00 O ATOM 0 H ASP A 102 119.080 3.023 -13.445 1.00 0.00 H new ATOM 0 HA ASP A 102 121.661 2.691 -12.444 1.00 0.00 H new ATOM 0 HB2 ASP A 102 122.184 1.975 -14.749 1.00 0.00 H new ATOM 0 HB3 ASP A 102 120.620 1.347 -14.271 1.00 0.00 H new ATOM 1568 N ARG A 103 121.297 5.430 -14.229 1.00 0.00 N ATOM 1569 CA ARG A 103 121.994 6.639 -14.659 1.00 0.00 C ATOM 1570 C ARG A 103 122.528 7.430 -13.466 1.00 0.00 C ATOM 1571 O ARG A 103 123.674 7.882 -13.476 1.00 0.00 O ATOM 1572 CB ARG A 103 121.061 7.497 -15.515 1.00 0.00 C ATOM 1573 CG ARG A 103 120.787 6.758 -16.827 1.00 0.00 C ATOM 1574 CD ARG A 103 119.947 7.630 -17.761 1.00 0.00 C ATOM 1575 NE ARG A 103 118.676 7.979 -17.123 1.00 0.00 N ATOM 1576 CZ ARG A 103 117.671 7.109 -16.952 1.00 0.00 C ATOM 1577 NH1 ARG A 103 117.755 5.855 -17.326 1.00 0.00 N ATOM 1578 NH2 ARG A 103 116.575 7.534 -16.388 1.00 0.00 N ATOM 0 H ARG A 103 120.302 5.407 -14.454 1.00 0.00 H new ATOM 0 HA ARG A 103 122.855 6.346 -15.261 1.00 0.00 H new ATOM 0 HB2 ARG A 103 120.128 7.686 -14.985 1.00 0.00 H new ATOM 0 HB3 ARG A 103 121.516 8.467 -15.715 1.00 0.00 H new ATOM 0 HG2 ARG A 103 121.729 6.499 -17.310 1.00 0.00 H new ATOM 0 HG3 ARG A 103 120.265 5.823 -16.624 1.00 0.00 H new ATOM 0 HD2 ARG A 103 120.496 8.537 -18.014 1.00 0.00 H new ATOM 0 HD3 ARG A 103 119.760 7.099 -18.695 1.00 0.00 H new ATOM 0 HE ARG A 103 118.549 8.935 -16.791 1.00 0.00 H new ATOM 0 HH11 ARG A 103 118.608 5.510 -17.765 1.00 0.00 H new ATOM 0 HH12 ARG A 103 116.967 5.225 -17.178 1.00 0.00 H new ATOM 0 HH21 ARG A 103 116.499 8.506 -16.090 1.00 0.00 H new ATOM 0 HH22 ARG A 103 115.794 6.894 -16.245 1.00 0.00 H new ATOM 1592 N ALA A 104 121.719 7.561 -12.418 1.00 0.00 N ATOM 1593 CA ALA A 104 122.171 8.238 -11.203 1.00 0.00 C ATOM 1594 C ALA A 104 123.387 7.526 -10.607 1.00 0.00 C ATOM 1595 O ALA A 104 124.296 8.163 -10.068 1.00 0.00 O ATOM 1596 CB ALA A 104 121.039 8.270 -10.174 1.00 0.00 C ATOM 0 H ALA A 104 120.761 7.213 -12.383 1.00 0.00 H new ATOM 0 HA ALA A 104 122.456 9.257 -11.463 1.00 0.00 H new ATOM 0 HB1 ALA A 104 121.382 8.776 -9.271 1.00 0.00 H new ATOM 0 HB2 ALA A 104 120.186 8.807 -10.588 1.00 0.00 H new ATOM 0 HB3 ALA A 104 120.742 7.251 -9.928 1.00 0.00 H new ATOM 1602 N GLU A 105 123.387 6.197 -10.677 1.00 0.00 N ATOM 1603 CA GLU A 105 124.524 5.422 -10.196 1.00 0.00 C ATOM 1604 C GLU A 105 125.772 5.746 -11.018 1.00 0.00 C ATOM 1605 O GLU A 105 126.860 5.914 -10.470 1.00 0.00 O ATOM 1606 CB GLU A 105 124.211 3.929 -10.284 1.00 0.00 C ATOM 1607 CG GLU A 105 125.252 3.148 -9.476 1.00 0.00 C ATOM 1608 CD GLU A 105 125.056 1.632 -9.597 1.00 0.00 C ATOM 1609 OE1 GLU A 105 124.158 1.198 -10.306 1.00 0.00 O ATOM 1610 OE2 GLU A 105 125.819 0.917 -8.970 1.00 0.00 O ATOM 0 H GLU A 105 122.621 5.641 -11.058 1.00 0.00 H new ATOM 0 HA GLU A 105 124.714 5.685 -9.155 1.00 0.00 H new ATOM 0 HB2 GLU A 105 123.211 3.732 -9.898 1.00 0.00 H new ATOM 0 HB3 GLU A 105 124.222 3.604 -11.324 1.00 0.00 H new ATOM 0 HG2 GLU A 105 126.251 3.413 -9.821 1.00 0.00 H new ATOM 0 HG3 GLU A 105 125.189 3.439 -8.427 1.00 0.00 H new ATOM 1617 N LYS A 106 125.605 5.870 -12.331 1.00 0.00 N ATOM 1618 CA LYS A 106 126.712 6.264 -13.205 1.00 0.00 C ATOM 1619 C LYS A 106 127.288 7.625 -12.803 1.00 0.00 C ATOM 1620 O LYS A 106 128.486 7.867 -12.949 1.00 0.00 O ATOM 1621 CB LYS A 106 126.242 6.326 -14.661 1.00 0.00 C ATOM 1622 CG LYS A 106 125.858 4.925 -15.140 1.00 0.00 C ATOM 1623 CD LYS A 106 125.494 4.978 -16.625 1.00 0.00 C ATOM 1624 CE LYS A 106 125.000 3.604 -17.081 1.00 0.00 C ATOM 1625 NZ LYS A 106 123.644 3.350 -16.517 1.00 0.00 N ATOM 0 H LYS A 106 124.722 5.705 -12.814 1.00 0.00 H new ATOM 0 HA LYS A 106 127.494 5.512 -13.101 1.00 0.00 H new ATOM 0 HB2 LYS A 106 125.388 6.997 -14.749 1.00 0.00 H new ATOM 0 HB3 LYS A 106 127.033 6.732 -15.291 1.00 0.00 H new ATOM 0 HG2 LYS A 106 126.687 4.235 -14.982 1.00 0.00 H new ATOM 0 HG3 LYS A 106 125.015 4.549 -14.561 1.00 0.00 H new ATOM 0 HD2 LYS A 106 124.721 5.728 -16.794 1.00 0.00 H new ATOM 0 HD3 LYS A 106 126.362 5.277 -17.212 1.00 0.00 H new ATOM 0 HE2 LYS A 106 124.966 3.561 -18.170 1.00 0.00 H new ATOM 0 HE3 LYS A 106 125.693 2.829 -16.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 123.184 2.585 -17.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 123.730 3.073 -15.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 123.071 4.215 -16.588 1.00 0.00 H new ATOM 1639 N ALA A 107 126.429 8.506 -12.297 1.00 0.00 N ATOM 1640 CA ALA A 107 126.856 9.825 -11.823 1.00 0.00 C ATOM 1641 C ALA A 107 127.640 9.767 -10.502 1.00 0.00 C ATOM 1642 O ALA A 107 128.021 10.808 -9.967 1.00 0.00 O ATOM 1643 CB ALA A 107 125.632 10.722 -11.639 1.00 0.00 C ATOM 0 H ALA A 107 125.428 8.332 -12.203 1.00 0.00 H new ATOM 0 HA ALA A 107 127.528 10.230 -12.580 1.00 0.00 H new ATOM 0 HB1 ALA A 107 125.950 11.703 -11.286 1.00 0.00 H new ATOM 0 HB2 ALA A 107 125.113 10.829 -12.592 1.00 0.00 H new ATOM 0 HB3 ALA A 107 124.959 10.274 -10.908 1.00 0.00 H new ATOM 1649 N GLY A 108 127.882 8.567 -9.975 1.00 0.00 N ATOM 1650 CA GLY A 108 128.674 8.408 -8.761 1.00 0.00 C ATOM 1651 C GLY A 108 127.888 8.709 -7.487 1.00 0.00 C ATOM 1652 O GLY A 108 128.485 9.043 -6.462 1.00 0.00 O ATOM 0 H GLY A 108 127.540 7.692 -10.372 1.00 0.00 H new ATOM 0 HA2 GLY A 108 129.054 7.387 -8.714 1.00 0.00 H new ATOM 0 HA3 GLY A 108 129.540 9.068 -8.811 1.00 0.00 H new ATOM 1656 N HIS A 109 126.560 8.599 -7.541 1.00 0.00 N ATOM 1657 CA HIS A 109 125.762 8.683 -6.325 1.00 0.00 C ATOM 1658 C HIS A 109 125.750 7.313 -5.637 1.00 0.00 C ATOM 1659 O HIS A 109 125.701 6.295 -6.332 1.00 0.00 O ATOM 1660 CB HIS A 109 124.331 9.108 -6.661 1.00 0.00 C ATOM 1661 CG HIS A 109 124.157 10.600 -6.747 1.00 0.00 C ATOM 1662 ND1 HIS A 109 124.683 11.461 -5.797 1.00 0.00 N ATOM 1663 CD2 HIS A 109 123.517 11.399 -7.664 1.00 0.00 C ATOM 1664 CE1 HIS A 109 124.354 12.714 -6.158 1.00 0.00 C ATOM 1665 NE2 HIS A 109 123.644 12.735 -7.289 1.00 0.00 N ATOM 0 H HIS A 109 126.026 8.454 -8.398 1.00 0.00 H new ATOM 0 HA HIS A 109 126.198 9.426 -5.657 1.00 0.00 H new ATOM 0 HB2 HIS A 109 124.040 8.660 -7.611 1.00 0.00 H new ATOM 0 HB3 HIS A 109 123.655 8.714 -5.902 1.00 0.00 H new ATOM 0 HD2 HIS A 109 122.995 11.045 -8.541 1.00 0.00 H new ATOM 0 HE1 HIS A 109 124.631 13.597 -5.601 1.00 0.00 H new ATOM 0 HE2 HIS A 109 123.274 13.553 -7.774 1.00 0.00 H new ATOM 1673 N PRO A 110 125.792 7.239 -4.321 1.00 0.00 N ATOM 1674 CA PRO A 110 125.813 5.918 -3.616 1.00 0.00 C ATOM 1675 C PRO A 110 124.498 5.154 -3.803 1.00 0.00 C ATOM 1676 O PRO A 110 123.471 5.778 -4.057 1.00 0.00 O ATOM 1677 CB PRO A 110 126.033 6.274 -2.143 1.00 0.00 C ATOM 1678 CG PRO A 110 125.554 7.678 -2.004 1.00 0.00 C ATOM 1679 CD PRO A 110 125.814 8.351 -3.351 1.00 0.00 C ATOM 0 HA PRO A 110 126.589 5.262 -4.009 1.00 0.00 H new ATOM 0 HB2 PRO A 110 125.478 5.602 -1.488 1.00 0.00 H new ATOM 0 HB3 PRO A 110 127.085 6.188 -1.870 1.00 0.00 H new ATOM 0 HG2 PRO A 110 124.494 7.705 -1.753 1.00 0.00 H new ATOM 0 HG3 PRO A 110 126.084 8.193 -1.203 1.00 0.00 H new ATOM 0 HD2 PRO A 110 125.050 9.094 -3.579 1.00 0.00 H new ATOM 0 HD3 PRO A 110 126.774 8.868 -3.359 1.00 0.00 H new ATOM 1687 N PRO A 111 124.498 3.840 -3.726 1.00 0.00 N ATOM 1688 CA PRO A 111 123.231 3.052 -3.849 1.00 0.00 C ATOM 1689 C PRO A 111 122.402 3.072 -2.564 1.00 0.00 C ATOM 1690 O PRO A 111 122.949 3.212 -1.471 1.00 0.00 O ATOM 1691 CB PRO A 111 123.708 1.637 -4.179 1.00 0.00 C ATOM 1692 CG PRO A 111 125.088 1.531 -3.619 1.00 0.00 C ATOM 1693 CD PRO A 111 125.660 2.946 -3.545 1.00 0.00 C ATOM 0 HA PRO A 111 122.569 3.467 -4.609 1.00 0.00 H new ATOM 0 HB2 PRO A 111 123.049 0.889 -3.738 1.00 0.00 H new ATOM 0 HB3 PRO A 111 123.709 1.466 -5.255 1.00 0.00 H new ATOM 0 HG2 PRO A 111 125.067 1.073 -2.630 1.00 0.00 H new ATOM 0 HG3 PRO A 111 125.711 0.897 -4.250 1.00 0.00 H new ATOM 0 HD2 PRO A 111 126.149 3.124 -2.587 1.00 0.00 H new ATOM 0 HD3 PRO A 111 126.408 3.110 -4.320 1.00 0.00 H new ATOM 1701 N ILE A 112 121.082 2.941 -2.700 1.00 0.00 N ATOM 1702 CA ILE A 112 120.197 2.900 -1.531 1.00 0.00 C ATOM 1703 C ILE A 112 120.468 1.669 -0.650 1.00 0.00 C ATOM 1704 O ILE A 112 120.081 1.669 0.516 1.00 0.00 O ATOM 1705 CB ILE A 112 118.716 2.954 -1.973 1.00 0.00 C ATOM 1706 CG1 ILE A 112 118.449 4.302 -2.651 1.00 0.00 C ATOM 1707 CG2 ILE A 112 117.765 2.825 -0.770 1.00 0.00 C ATOM 1708 CD1 ILE A 112 117.037 4.344 -3.247 1.00 0.00 C ATOM 0 H ILE A 112 120.604 2.862 -3.598 1.00 0.00 H new ATOM 0 HA ILE A 112 120.409 3.779 -0.923 1.00 0.00 H new ATOM 0 HB ILE A 112 118.535 2.123 -2.655 1.00 0.00 H new ATOM 0 HG12 ILE A 112 118.566 5.108 -1.926 1.00 0.00 H new ATOM 0 HG13 ILE A 112 119.185 4.470 -3.437 1.00 0.00 H new ATOM 0 HG21 ILE A 112 116.732 2.867 -1.116 1.00 0.00 H new ATOM 0 HG22 ILE A 112 117.941 1.874 -0.268 1.00 0.00 H new ATOM 0 HG23 ILE A 112 117.947 3.643 -0.073 1.00 0.00 H new ATOM 0 HD11 ILE A 112 116.871 5.311 -3.723 1.00 0.00 H new ATOM 0 HD12 ILE A 112 116.931 3.552 -3.988 1.00 0.00 H new ATOM 0 HD13 ILE A 112 116.303 4.199 -2.454 1.00 0.00 H new ATOM 1720 N THR A 113 121.166 0.653 -1.162 1.00 0.00 N ATOM 1721 CA THR A 113 121.299 -0.612 -0.439 1.00 0.00 C ATOM 1722 C THR A 113 121.666 -0.489 1.051 1.00 0.00 C ATOM 1723 O THR A 113 121.137 -1.297 1.820 1.00 0.00 O ATOM 1724 CB THR A 113 122.245 -1.590 -1.154 1.00 0.00 C ATOM 1725 OG1 THR A 113 122.462 -2.720 -0.322 1.00 0.00 O ATOM 1726 CG2 THR A 113 123.590 -0.943 -1.477 1.00 0.00 C ATOM 0 H THR A 113 121.642 0.680 -2.064 1.00 0.00 H new ATOM 0 HA THR A 113 120.288 -1.020 -0.450 1.00 0.00 H new ATOM 0 HB THR A 113 121.777 -1.885 -2.093 1.00 0.00 H new ATOM 0 HG1 THR A 113 123.064 -3.348 -0.774 1.00 0.00 H new ATOM 0 HG21 THR A 113 124.230 -1.667 -1.982 1.00 0.00 H new ATOM 0 HG22 THR A 113 123.433 -0.082 -2.127 1.00 0.00 H new ATOM 0 HG23 THR A 113 124.068 -0.618 -0.553 1.00 0.00 H new ATOM 1734 N PRO A 114 122.475 0.453 1.525 1.00 0.00 N ATOM 1735 CA PRO A 114 122.820 0.501 2.987 1.00 0.00 C ATOM 1736 C PRO A 114 121.574 0.637 3.864 1.00 0.00 C ATOM 1737 O PRO A 114 121.534 0.124 4.982 1.00 0.00 O ATOM 1738 CB PRO A 114 123.737 1.717 3.141 1.00 0.00 C ATOM 1739 CG PRO A 114 124.260 1.978 1.772 1.00 0.00 C ATOM 1740 CD PRO A 114 123.129 1.582 0.829 1.00 0.00 C ATOM 0 HA PRO A 114 123.302 -0.421 3.311 1.00 0.00 H new ATOM 0 HB2 PRO A 114 123.190 2.578 3.526 1.00 0.00 H new ATOM 0 HB3 PRO A 114 124.547 1.515 3.842 1.00 0.00 H new ATOM 0 HG2 PRO A 114 124.528 3.027 1.646 1.00 0.00 H new ATOM 0 HG3 PRO A 114 125.159 1.394 1.576 1.00 0.00 H new ATOM 0 HD2 PRO A 114 122.436 2.407 0.665 1.00 0.00 H new ATOM 0 HD3 PRO A 114 123.508 1.285 -0.149 1.00 0.00 H new ATOM 1748 N ILE A 115 120.562 1.331 3.350 1.00 0.00 N ATOM 1749 CA ILE A 115 119.292 1.485 4.069 1.00 0.00 C ATOM 1750 C ILE A 115 118.205 0.509 3.596 1.00 0.00 C ATOM 1751 O ILE A 115 117.063 0.613 4.032 1.00 0.00 O ATOM 1752 CB ILE A 115 118.763 2.923 3.944 1.00 0.00 C ATOM 1753 CG1 ILE A 115 118.726 3.362 2.470 1.00 0.00 C ATOM 1754 CG2 ILE A 115 119.658 3.869 4.744 1.00 0.00 C ATOM 1755 CD1 ILE A 115 117.986 4.698 2.318 1.00 0.00 C ATOM 0 H ILE A 115 120.592 1.795 2.442 1.00 0.00 H new ATOM 0 HA ILE A 115 119.513 1.254 5.111 1.00 0.00 H new ATOM 0 HB ILE A 115 117.748 2.958 4.340 1.00 0.00 H new ATOM 0 HG12 ILE A 115 119.743 3.459 2.089 1.00 0.00 H new ATOM 0 HG13 ILE A 115 118.232 2.597 1.870 1.00 0.00 H new ATOM 0 HG21 ILE A 115 119.282 4.888 4.655 1.00 0.00 H new ATOM 0 HG22 ILE A 115 119.656 3.572 5.793 1.00 0.00 H new ATOM 0 HG23 ILE A 115 120.676 3.822 4.356 1.00 0.00 H new ATOM 0 HD11 ILE A 115 117.972 4.989 1.268 1.00 0.00 H new ATOM 0 HD12 ILE A 115 116.963 4.590 2.678 1.00 0.00 H new ATOM 0 HD13 ILE A 115 118.497 5.465 2.900 1.00 0.00 H new ATOM 1767 N ARG A 116 118.541 -0.432 2.717 1.00 0.00 N ATOM 1768 CA ARG A 116 117.567 -1.394 2.211 1.00 0.00 C ATOM 1769 C ARG A 116 117.313 -2.496 3.236 1.00 0.00 C ATOM 1770 O ARG A 116 118.242 -2.983 3.879 1.00 0.00 O ATOM 1771 CB ARG A 116 118.109 -1.999 0.915 1.00 0.00 C ATOM 1772 CG ARG A 116 117.076 -2.934 0.285 1.00 0.00 C ATOM 1773 CD ARG A 116 117.673 -3.540 -0.988 1.00 0.00 C ATOM 1774 NE ARG A 116 116.680 -4.369 -1.675 1.00 0.00 N ATOM 1775 CZ ARG A 116 116.687 -4.589 -3.000 1.00 0.00 C ATOM 1776 NH1 ARG A 116 117.591 -4.065 -3.792 1.00 0.00 N ATOM 1777 NH2 ARG A 116 115.765 -5.354 -3.517 1.00 0.00 N ATOM 0 H ARG A 116 119.482 -0.548 2.340 1.00 0.00 H new ATOM 0 HA ARG A 116 116.621 -0.887 2.022 1.00 0.00 H new ATOM 0 HB2 ARG A 116 118.363 -1.204 0.214 1.00 0.00 H new ATOM 0 HB3 ARG A 116 119.028 -2.548 1.120 1.00 0.00 H new ATOM 0 HG2 ARG A 116 116.803 -3.722 0.986 1.00 0.00 H new ATOM 0 HG3 ARG A 116 116.164 -2.386 0.050 1.00 0.00 H new ATOM 0 HD2 ARG A 116 118.014 -2.745 -1.651 1.00 0.00 H new ATOM 0 HD3 ARG A 116 118.547 -4.141 -0.737 1.00 0.00 H new ATOM 0 HE ARG A 116 115.944 -4.802 -1.118 1.00 0.00 H new ATOM 0 HH11 ARG A 116 118.322 -3.467 -3.406 1.00 0.00 H new ATOM 0 HH12 ARG A 116 117.563 -4.255 -4.794 1.00 0.00 H new ATOM 0 HH21 ARG A 116 115.055 -5.774 -2.917 1.00 0.00 H new ATOM 0 HH22 ARG A 116 115.754 -5.532 -4.521 1.00 0.00 H new ATOM 1791 N ALA A 117 116.049 -2.886 3.386 1.00 0.00 N ATOM 1792 CA ALA A 117 115.675 -3.889 4.376 1.00 0.00 C ATOM 1793 C ALA A 117 115.874 -5.306 3.847 1.00 0.00 C ATOM 1794 O ALA A 117 115.545 -5.610 2.700 1.00 0.00 O ATOM 1795 CB ALA A 117 114.207 -3.703 4.763 1.00 0.00 C ATOM 0 H ALA A 117 115.270 -2.523 2.836 1.00 0.00 H new ATOM 0 HA ALA A 117 116.319 -3.755 5.245 1.00 0.00 H new ATOM 0 HB1 ALA A 117 113.928 -4.453 5.503 1.00 0.00 H new ATOM 0 HB2 ALA A 117 114.065 -2.708 5.184 1.00 0.00 H new ATOM 0 HB3 ALA A 117 113.580 -3.816 3.878 1.00 0.00 H new ATOM 1801 N LYS A 118 116.405 -6.171 4.705 1.00 0.00 N ATOM 1802 CA LYS A 118 116.563 -7.579 4.364 1.00 0.00 C ATOM 1803 C LYS A 118 115.414 -8.394 4.949 1.00 0.00 C ATOM 1804 O LYS A 118 114.983 -8.150 6.075 1.00 0.00 O ATOM 1805 CB LYS A 118 117.891 -8.105 4.912 1.00 0.00 C ATOM 1806 CG LYS A 118 118.202 -9.462 4.279 1.00 0.00 C ATOM 1807 CD LYS A 118 119.270 -10.180 5.107 1.00 0.00 C ATOM 1808 CE LYS A 118 120.616 -9.476 4.926 1.00 0.00 C ATOM 1809 NZ LYS A 118 121.596 -10.019 5.907 1.00 0.00 N ATOM 0 H LYS A 118 116.732 -5.922 5.639 1.00 0.00 H new ATOM 0 HA LYS A 118 116.556 -7.677 3.278 1.00 0.00 H new ATOM 0 HB2 LYS A 118 118.692 -7.398 4.695 1.00 0.00 H new ATOM 0 HB3 LYS A 118 117.837 -8.201 5.996 1.00 0.00 H new ATOM 0 HG2 LYS A 118 117.297 -10.068 4.229 1.00 0.00 H new ATOM 0 HG3 LYS A 118 118.551 -9.326 3.255 1.00 0.00 H new ATOM 0 HD2 LYS A 118 118.988 -10.183 6.160 1.00 0.00 H new ATOM 0 HD3 LYS A 118 119.348 -11.222 4.795 1.00 0.00 H new ATOM 0 HE2 LYS A 118 120.982 -9.624 3.910 1.00 0.00 H new ATOM 0 HE3 LYS A 118 120.499 -8.402 5.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 122.511 -9.541 5.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 121.247 -9.856 6.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 121.715 -11.040 5.750 1.00 0.00 H new ATOM 1823 N GLY A 119 114.919 -9.361 4.182 1.00 0.00 N ATOM 1824 CA GLY A 119 113.826 -10.206 4.650 1.00 0.00 C ATOM 1825 C GLY A 119 114.344 -11.551 5.148 1.00 0.00 C ATOM 1826 O GLY A 119 115.302 -12.096 4.601 1.00 0.00 O ATOM 0 H GLY A 119 115.253 -9.577 3.243 1.00 0.00 H new ATOM 0 HA2 GLY A 119 113.290 -9.700 5.453 1.00 0.00 H new ATOM 0 HA3 GLY A 119 113.113 -10.365 3.841 1.00 0.00 H new ATOM 1830 N SER A 120 113.707 -12.082 6.188 1.00 0.00 N ATOM 1831 CA SER A 120 114.126 -13.361 6.750 1.00 0.00 C ATOM 1832 C SER A 120 114.103 -14.454 5.684 1.00 0.00 C ATOM 1833 O SER A 120 114.994 -15.302 5.633 1.00 0.00 O ATOM 1834 CB SER A 120 113.200 -13.754 7.902 1.00 0.00 C ATOM 1835 OG SER A 120 113.175 -12.702 8.858 1.00 0.00 O ATOM 0 H SER A 120 112.908 -11.652 6.654 1.00 0.00 H new ATOM 0 HA SER A 120 115.145 -13.253 7.121 1.00 0.00 H new ATOM 0 HB2 SER A 120 112.194 -13.946 7.528 1.00 0.00 H new ATOM 0 HB3 SER A 120 113.548 -14.676 8.367 1.00 0.00 H new ATOM 0 HG SER A 120 112.582 -12.947 9.599 1.00 0.00 H new ATOM 1841 N GLY A 121 113.081 -14.427 4.834 1.00 0.00 N ATOM 1842 CA GLY A 121 112.983 -15.384 3.737 1.00 0.00 C ATOM 1843 C GLY A 121 113.383 -14.731 2.420 1.00 0.00 C ATOM 1844 O GLY A 121 113.539 -13.511 2.345 1.00 0.00 O ATOM 0 H GLY A 121 112.313 -13.757 4.883 1.00 0.00 H new ATOM 0 HA2 GLY A 121 113.628 -16.240 3.935 1.00 0.00 H new ATOM 0 HA3 GLY A 121 111.963 -15.762 3.667 1.00 0.00 H new ATOM 1848 N GLY A 122 113.546 -15.544 1.383 1.00 0.00 N ATOM 1849 CA GLY A 122 113.904 -15.023 0.069 1.00 0.00 C ATOM 1850 C GLY A 122 115.238 -14.287 0.117 1.00 0.00 C ATOM 1851 O GLY A 122 116.267 -14.867 0.463 1.00 0.00 O ATOM 0 H GLY A 122 113.437 -16.557 1.425 1.00 0.00 H new ATOM 0 HA2 GLY A 122 113.963 -15.843 -0.647 1.00 0.00 H new ATOM 0 HA3 GLY A 122 113.124 -14.347 -0.283 1.00 0.00 H new ATOM 1855 N GLY A 123 115.211 -13.005 -0.232 1.00 0.00 N ATOM 1856 CA GLY A 123 116.427 -12.199 -0.255 1.00 0.00 C ATOM 1857 C GLY A 123 116.168 -10.800 0.292 1.00 0.00 C ATOM 1858 O GLY A 123 115.778 -10.629 1.447 1.00 0.00 O ATOM 0 H GLY A 123 114.365 -12.503 -0.502 1.00 0.00 H new ATOM 0 HA2 GLY A 123 117.202 -12.687 0.337 1.00 0.00 H new ATOM 0 HA3 GLY A 123 116.802 -12.130 -1.276 1.00 0.00 H new ATOM 1862 N TYR A 124 116.404 -9.793 -0.542 1.00 0.00 N ATOM 1863 CA TYR A 124 116.205 -8.406 -0.135 1.00 0.00 C ATOM 1864 C TYR A 124 114.902 -7.867 -0.715 1.00 0.00 C ATOM 1865 O TYR A 124 114.461 -8.296 -1.781 1.00 0.00 O ATOM 1866 CB TYR A 124 117.383 -7.554 -0.610 1.00 0.00 C ATOM 1867 CG TYR A 124 118.627 -7.726 0.230 1.00 0.00 C ATOM 1868 CD1 TYR A 124 119.107 -9.010 0.521 1.00 0.00 C ATOM 1869 CD2 TYR A 124 119.312 -6.601 0.704 1.00 0.00 C ATOM 1870 CE1 TYR A 124 120.268 -9.166 1.287 1.00 0.00 C ATOM 1871 CE2 TYR A 124 120.471 -6.759 1.473 1.00 0.00 C ATOM 1872 CZ TYR A 124 120.950 -8.041 1.764 1.00 0.00 C ATOM 1873 OH TYR A 124 122.095 -8.196 2.519 1.00 0.00 O ATOM 0 H TYR A 124 116.732 -9.910 -1.501 1.00 0.00 H new ATOM 0 HA TYR A 124 116.147 -8.361 0.953 1.00 0.00 H new ATOM 0 HB2 TYR A 124 117.614 -7.811 -1.644 1.00 0.00 H new ATOM 0 HB3 TYR A 124 117.090 -6.504 -0.600 1.00 0.00 H new ATOM 0 HD1 TYR A 124 118.581 -9.879 0.154 1.00 0.00 H new ATOM 0 HD2 TYR A 124 118.946 -5.611 0.476 1.00 0.00 H new ATOM 0 HE1 TYR A 124 120.638 -10.156 1.510 1.00 0.00 H new ATOM 0 HE2 TYR A 124 120.996 -5.890 1.842 1.00 0.00 H new ATOM 0 HH TYR A 124 122.444 -7.315 2.769 1.00 0.00 H new ATOM 1883 N ILE A 125 114.289 -6.923 -0.007 1.00 0.00 N ATOM 1884 CA ILE A 125 112.981 -6.412 -0.401 1.00 0.00 C ATOM 1885 C ILE A 125 113.121 -5.469 -1.596 1.00 0.00 C ATOM 1886 O ILE A 125 113.891 -4.510 -1.562 1.00 0.00 O ATOM 1887 CB ILE A 125 112.336 -5.706 0.801 1.00 0.00 C ATOM 1888 CG1 ILE A 125 112.143 -6.718 1.939 1.00 0.00 C ATOM 1889 CG2 ILE A 125 110.965 -5.136 0.421 1.00 0.00 C ATOM 1890 CD1 ILE A 125 111.999 -5.990 3.277 1.00 0.00 C ATOM 0 H ILE A 125 114.674 -6.499 0.837 1.00 0.00 H new ATOM 0 HA ILE A 125 112.336 -7.235 -0.708 1.00 0.00 H new ATOM 0 HB ILE A 125 112.990 -4.893 1.116 1.00 0.00 H new ATOM 0 HG12 ILE A 125 111.257 -7.324 1.750 1.00 0.00 H new ATOM 0 HG13 ILE A 125 112.993 -7.399 1.977 1.00 0.00 H new ATOM 0 HG21 ILE A 125 110.525 -4.640 1.286 1.00 0.00 H new ATOM 0 HG22 ILE A 125 111.082 -4.416 -0.389 1.00 0.00 H new ATOM 0 HG23 ILE A 125 110.312 -5.946 0.096 1.00 0.00 H new ATOM 0 HD11 ILE A 125 111.863 -6.720 4.075 1.00 0.00 H new ATOM 0 HD12 ILE A 125 112.897 -5.404 3.471 1.00 0.00 H new ATOM 0 HD13 ILE A 125 111.134 -5.327 3.240 1.00 0.00 H new ATOM 1902 N SER A 126 112.352 -5.747 -2.645 1.00 0.00 N ATOM 1903 CA SER A 126 112.462 -5.006 -3.898 1.00 0.00 C ATOM 1904 C SER A 126 112.176 -3.522 -3.710 1.00 0.00 C ATOM 1905 O SER A 126 111.257 -3.134 -2.989 1.00 0.00 O ATOM 1906 CB SER A 126 111.481 -5.581 -4.920 1.00 0.00 C ATOM 1907 OG SER A 126 111.783 -6.953 -5.137 1.00 0.00 O ATOM 0 H SER A 126 111.644 -6.482 -2.652 1.00 0.00 H new ATOM 0 HA SER A 126 113.487 -5.109 -4.253 1.00 0.00 H new ATOM 0 HB2 SER A 126 110.458 -5.474 -4.560 1.00 0.00 H new ATOM 0 HB3 SER A 126 111.548 -5.029 -5.857 1.00 0.00 H new ATOM 0 HG SER A 126 111.155 -7.327 -5.790 1.00 0.00 H new ATOM 1913 N LEU A 127 112.985 -2.702 -4.374 1.00 0.00 N ATOM 1914 CA LEU A 127 112.743 -1.259 -4.428 1.00 0.00 C ATOM 1915 C LEU A 127 111.970 -0.844 -5.693 1.00 0.00 C ATOM 1916 O LEU A 127 111.809 0.347 -5.957 1.00 0.00 O ATOM 1917 CB LEU A 127 114.078 -0.504 -4.404 1.00 0.00 C ATOM 1918 CG LEU A 127 114.912 -0.917 -3.186 1.00 0.00 C ATOM 1919 CD1 LEU A 127 116.259 -0.194 -3.226 1.00 0.00 C ATOM 1920 CD2 LEU A 127 114.176 -0.534 -1.900 1.00 0.00 C ATOM 0 H LEU A 127 113.814 -3.009 -4.883 1.00 0.00 H new ATOM 0 HA LEU A 127 112.139 -1.006 -3.557 1.00 0.00 H new ATOM 0 HB2 LEU A 127 114.634 -0.710 -5.319 1.00 0.00 H new ATOM 0 HB3 LEU A 127 113.894 0.570 -4.378 1.00 0.00 H new ATOM 0 HG LEU A 127 115.069 -1.995 -3.207 1.00 0.00 H new ATOM 0 HD11 LEU A 127 116.854 -0.486 -2.361 1.00 0.00 H new ATOM 0 HD12 LEU A 127 116.790 -0.463 -4.139 1.00 0.00 H new ATOM 0 HD13 LEU A 127 116.094 0.883 -3.206 1.00 0.00 H new ATOM 0 HD21 LEU A 127 114.773 -0.830 -1.037 1.00 0.00 H new ATOM 0 HD22 LEU A 127 114.017 0.544 -1.879 1.00 0.00 H new ATOM 0 HD23 LEU A 127 113.213 -1.043 -1.867 1.00 0.00 H new ATOM 1932 N GLY A 128 111.493 -1.810 -6.483 1.00 0.00 N ATOM 1933 CA GLY A 128 110.852 -1.508 -7.760 1.00 0.00 C ATOM 1934 C GLY A 128 109.779 -0.429 -7.638 1.00 0.00 C ATOM 1935 O GLY A 128 109.712 0.478 -8.467 1.00 0.00 O ATOM 0 H GLY A 128 111.540 -2.804 -6.259 1.00 0.00 H new ATOM 0 HA2 GLY A 128 111.609 -1.183 -8.474 1.00 0.00 H new ATOM 0 HA3 GLY A 128 110.404 -2.417 -8.161 1.00 0.00 H new ATOM 1939 N ALA A 129 108.955 -0.510 -6.597 1.00 0.00 N ATOM 1940 CA ALA A 129 107.855 0.439 -6.440 1.00 0.00 C ATOM 1941 C ALA A 129 108.381 1.869 -6.360 1.00 0.00 C ATOM 1942 O ALA A 129 107.911 2.759 -7.072 1.00 0.00 O ATOM 1943 CB ALA A 129 107.062 0.114 -5.173 1.00 0.00 C ATOM 0 H ALA A 129 109.025 -1.211 -5.860 1.00 0.00 H new ATOM 0 HA ALA A 129 107.204 0.354 -7.310 1.00 0.00 H new ATOM 0 HB1 ALA A 129 106.244 0.826 -5.063 1.00 0.00 H new ATOM 0 HB2 ALA A 129 106.657 -0.895 -5.246 1.00 0.00 H new ATOM 0 HB3 ALA A 129 107.719 0.180 -4.306 1.00 0.00 H new ATOM 1949 N LEU A 130 109.384 2.080 -5.516 1.00 0.00 N ATOM 1950 CA LEU A 130 109.943 3.413 -5.334 1.00 0.00 C ATOM 1951 C LEU A 130 110.491 3.948 -6.654 1.00 0.00 C ATOM 1952 O LEU A 130 110.273 5.107 -7.007 1.00 0.00 O ATOM 1953 CB LEU A 130 111.059 3.359 -4.288 1.00 0.00 C ATOM 1954 CG LEU A 130 111.572 4.771 -4.002 1.00 0.00 C ATOM 1955 CD1 LEU A 130 110.496 5.566 -3.260 1.00 0.00 C ATOM 1956 CD2 LEU A 130 112.828 4.683 -3.133 1.00 0.00 C ATOM 0 H LEU A 130 109.823 1.352 -4.952 1.00 0.00 H new ATOM 0 HA LEU A 130 109.155 4.084 -4.991 1.00 0.00 H new ATOM 0 HB2 LEU A 130 110.687 2.905 -3.370 1.00 0.00 H new ATOM 0 HB3 LEU A 130 111.875 2.732 -4.646 1.00 0.00 H new ATOM 0 HG LEU A 130 111.808 5.271 -4.941 1.00 0.00 H new ATOM 0 HD11 LEU A 130 110.862 6.572 -3.057 1.00 0.00 H new ATOM 0 HD12 LEU A 130 109.598 5.624 -3.875 1.00 0.00 H new ATOM 0 HD13 LEU A 130 110.260 5.069 -2.319 1.00 0.00 H new ATOM 0 HD21 LEU A 130 113.198 5.687 -2.926 1.00 0.00 H new ATOM 0 HD22 LEU A 130 112.587 4.184 -2.194 1.00 0.00 H new ATOM 0 HD23 LEU A 130 113.595 4.115 -3.659 1.00 0.00 H new ATOM 1968 N LEU A 131 111.178 3.086 -7.396 1.00 0.00 N ATOM 1969 CA LEU A 131 111.768 3.496 -8.666 1.00 0.00 C ATOM 1970 C LEU A 131 110.686 3.977 -9.626 1.00 0.00 C ATOM 1971 O LEU A 131 110.842 5.005 -10.282 1.00 0.00 O ATOM 1972 CB LEU A 131 112.531 2.323 -9.287 1.00 0.00 C ATOM 1973 CG LEU A 131 113.245 2.776 -10.565 1.00 0.00 C ATOM 1974 CD1 LEU A 131 114.411 3.696 -10.202 1.00 0.00 C ATOM 1975 CD2 LEU A 131 113.779 1.550 -11.308 1.00 0.00 C ATOM 0 H LEU A 131 111.339 2.111 -7.145 1.00 0.00 H new ATOM 0 HA LEU A 131 112.460 4.318 -8.481 1.00 0.00 H new ATOM 0 HB2 LEU A 131 113.258 1.934 -8.574 1.00 0.00 H new ATOM 0 HB3 LEU A 131 111.841 1.510 -9.515 1.00 0.00 H new ATOM 0 HG LEU A 131 112.543 3.314 -11.202 1.00 0.00 H new ATOM 0 HD11 LEU A 131 114.918 4.017 -11.112 1.00 0.00 H new ATOM 0 HD12 LEU A 131 114.034 4.569 -9.669 1.00 0.00 H new ATOM 0 HD13 LEU A 131 115.114 3.159 -9.566 1.00 0.00 H new ATOM 0 HD21 LEU A 131 114.288 1.869 -12.218 1.00 0.00 H new ATOM 0 HD22 LEU A 131 114.481 1.014 -10.669 1.00 0.00 H new ATOM 0 HD23 LEU A 131 112.950 0.892 -11.568 1.00 0.00 H new ATOM 1987 N SER A 132 109.576 3.249 -9.682 1.00 0.00 N ATOM 1988 CA SER A 132 108.504 3.590 -10.608 1.00 0.00 C ATOM 1989 C SER A 132 107.988 4.998 -10.334 1.00 0.00 C ATOM 1990 O SER A 132 107.796 5.787 -11.259 1.00 0.00 O ATOM 1991 CB SER A 132 107.356 2.588 -10.471 1.00 0.00 C ATOM 1992 OG SER A 132 106.406 2.824 -11.501 1.00 0.00 O ATOM 0 H SER A 132 109.396 2.428 -9.104 1.00 0.00 H new ATOM 0 HA SER A 132 108.900 3.551 -11.623 1.00 0.00 H new ATOM 0 HB2 SER A 132 107.737 1.569 -10.537 1.00 0.00 H new ATOM 0 HB3 SER A 132 106.884 2.689 -9.494 1.00 0.00 H new ATOM 0 HG SER A 132 105.669 2.184 -11.419 1.00 0.00 H new ATOM 1998 N THR A 133 107.798 5.319 -9.059 1.00 0.00 N ATOM 1999 CA THR A 133 107.263 6.627 -8.694 1.00 0.00 C ATOM 2000 C THR A 133 108.178 7.739 -9.195 1.00 0.00 C ATOM 2001 O THR A 133 107.726 8.698 -9.825 1.00 0.00 O ATOM 2002 CB THR A 133 107.114 6.727 -7.175 1.00 0.00 C ATOM 2003 OG1 THR A 133 106.343 5.630 -6.704 1.00 0.00 O ATOM 2004 CG2 THR A 133 106.413 8.037 -6.812 1.00 0.00 C ATOM 0 H THR A 133 108.002 4.703 -8.272 1.00 0.00 H new ATOM 0 HA THR A 133 106.285 6.741 -9.161 1.00 0.00 H new ATOM 0 HB THR A 133 108.100 6.706 -6.712 1.00 0.00 H new ATOM 0 HG1 THR A 133 106.248 5.691 -5.731 1.00 0.00 H new ATOM 0 HG21 THR A 133 106.308 8.106 -5.729 1.00 0.00 H new ATOM 0 HG22 THR A 133 107.004 8.878 -7.173 1.00 0.00 H new ATOM 0 HG23 THR A 133 105.426 8.062 -7.274 1.00 0.00 H new ATOM 2012 N THR A 134 109.475 7.588 -8.944 1.00 0.00 N ATOM 2013 CA THR A 134 110.430 8.620 -9.334 1.00 0.00 C ATOM 2014 C THR A 134 110.448 8.798 -10.850 1.00 0.00 C ATOM 2015 O THR A 134 110.496 9.922 -11.347 1.00 0.00 O ATOM 2016 CB THR A 134 111.832 8.269 -8.831 1.00 0.00 C ATOM 2017 OG1 THR A 134 111.761 7.941 -7.451 1.00 0.00 O ATOM 2018 CG2 THR A 134 112.755 9.475 -9.022 1.00 0.00 C ATOM 0 H THR A 134 109.884 6.776 -8.481 1.00 0.00 H new ATOM 0 HA THR A 134 110.117 9.560 -8.879 1.00 0.00 H new ATOM 0 HB THR A 134 112.224 7.420 -9.391 1.00 0.00 H new ATOM 0 HG1 THR A 134 111.028 8.440 -7.033 1.00 0.00 H new ATOM 0 HG21 THR A 134 113.755 9.228 -8.665 1.00 0.00 H new ATOM 0 HG22 THR A 134 112.801 9.734 -10.080 1.00 0.00 H new ATOM 0 HG23 THR A 134 112.367 10.323 -8.458 1.00 0.00 H new ATOM 2026 N LEU A 135 110.390 7.692 -11.584 1.00 0.00 N ATOM 2027 CA LEU A 135 110.400 7.754 -13.043 1.00 0.00 C ATOM 2028 C LEU A 135 109.198 8.534 -13.568 1.00 0.00 C ATOM 2029 O LEU A 135 109.311 9.281 -14.540 1.00 0.00 O ATOM 2030 CB LEU A 135 110.391 6.342 -13.633 1.00 0.00 C ATOM 2031 CG LEU A 135 111.697 5.625 -13.277 1.00 0.00 C ATOM 2032 CD1 LEU A 135 111.589 4.148 -13.662 1.00 0.00 C ATOM 2033 CD2 LEU A 135 112.855 6.262 -14.046 1.00 0.00 C ATOM 0 H LEU A 135 110.336 6.749 -11.198 1.00 0.00 H new ATOM 0 HA LEU A 135 111.310 8.270 -13.349 1.00 0.00 H new ATOM 0 HB2 LEU A 135 109.540 5.781 -13.246 1.00 0.00 H new ATOM 0 HB3 LEU A 135 110.275 6.391 -14.716 1.00 0.00 H new ATOM 0 HG LEU A 135 111.877 5.712 -12.206 1.00 0.00 H new ATOM 0 HD11 LEU A 135 112.518 3.637 -13.409 1.00 0.00 H new ATOM 0 HD12 LEU A 135 110.763 3.690 -13.118 1.00 0.00 H new ATOM 0 HD13 LEU A 135 111.409 4.064 -14.734 1.00 0.00 H new ATOM 0 HD21 LEU A 135 113.784 5.752 -13.793 1.00 0.00 H new ATOM 0 HD22 LEU A 135 112.673 6.174 -15.117 1.00 0.00 H new ATOM 0 HD23 LEU A 135 112.934 7.315 -13.777 1.00 0.00 H new ATOM 2045 N ASN A 136 108.045 8.356 -12.927 1.00 0.00 N ATOM 2046 CA ASN A 136 106.841 9.072 -13.337 1.00 0.00 C ATOM 2047 C ASN A 136 107.075 10.577 -13.270 1.00 0.00 C ATOM 2048 O ASN A 136 106.690 11.317 -14.174 1.00 0.00 O ATOM 2049 CB ASN A 136 105.672 8.692 -12.427 1.00 0.00 C ATOM 2050 CG ASN A 136 104.381 9.307 -12.955 1.00 0.00 C ATOM 2051 OD1 ASN A 136 103.886 10.289 -12.398 1.00 0.00 O ATOM 2052 ND2 ASN A 136 103.800 8.788 -14.002 1.00 0.00 N ATOM 0 H ASN A 136 107.920 7.730 -12.131 1.00 0.00 H new ATOM 0 HA ASN A 136 106.602 8.795 -14.364 1.00 0.00 H new ATOM 0 HB2 ASN A 136 105.575 7.607 -12.379 1.00 0.00 H new ATOM 0 HB3 ASN A 136 105.862 9.040 -11.412 1.00 0.00 H new ATOM 0 HD21 ASN A 136 102.936 9.195 -14.360 1.00 0.00 H new ATOM 0 HD22 ASN A 136 104.210 7.975 -14.462 1.00 0.00 H new ATOM 2059 N LEU A 137 107.709 11.018 -12.190 1.00 0.00 N ATOM 2060 CA LEU A 137 108.045 12.431 -12.040 1.00 0.00 C ATOM 2061 C LEU A 137 109.014 12.880 -13.133 1.00 0.00 C ATOM 2062 O LEU A 137 108.897 13.986 -13.662 1.00 0.00 O ATOM 2063 CB LEU A 137 108.668 12.682 -10.665 1.00 0.00 C ATOM 2064 CG LEU A 137 107.704 12.232 -9.562 1.00 0.00 C ATOM 2065 CD1 LEU A 137 108.375 12.408 -8.199 1.00 0.00 C ATOM 2066 CD2 LEU A 137 106.429 13.080 -9.605 1.00 0.00 C ATOM 0 H LEU A 137 107.999 10.426 -11.412 1.00 0.00 H new ATOM 0 HA LEU A 137 107.125 13.009 -12.131 1.00 0.00 H new ATOM 0 HB2 LEU A 137 109.610 12.140 -10.579 1.00 0.00 H new ATOM 0 HB3 LEU A 137 108.898 13.741 -10.549 1.00 0.00 H new ATOM 0 HG LEU A 137 107.448 11.184 -9.718 1.00 0.00 H new ATOM 0 HD11 LEU A 137 107.691 12.089 -7.413 1.00 0.00 H new ATOM 0 HD12 LEU A 137 109.281 11.804 -8.159 1.00 0.00 H new ATOM 0 HD13 LEU A 137 108.631 13.457 -8.052 1.00 0.00 H new ATOM 0 HD21 LEU A 137 105.749 12.754 -8.818 1.00 0.00 H new ATOM 0 HD22 LEU A 137 106.684 14.129 -9.453 1.00 0.00 H new ATOM 0 HD23 LEU A 137 105.946 12.961 -10.575 1.00 0.00 H new ATOM 2078 N CYS A 138 109.967 12.016 -13.467 1.00 0.00 N ATOM 2079 CA CYS A 138 110.907 12.304 -14.550 1.00 0.00 C ATOM 2080 C CYS A 138 110.188 12.509 -15.891 1.00 0.00 C ATOM 2081 O CYS A 138 110.712 13.188 -16.775 1.00 0.00 O ATOM 2082 CB CYS A 138 111.910 11.151 -14.686 1.00 0.00 C ATOM 2083 SG CYS A 138 113.299 11.378 -13.546 1.00 0.00 S ATOM 0 H CYS A 138 110.110 11.116 -13.008 1.00 0.00 H new ATOM 0 HA CYS A 138 111.426 13.229 -14.298 1.00 0.00 H new ATOM 0 HB2 CYS A 138 111.413 10.203 -14.479 1.00 0.00 H new ATOM 0 HB3 CYS A 138 112.278 11.101 -15.711 1.00 0.00 H new ATOM 2088 N GLY A 139 108.998 11.930 -16.046 1.00 0.00 N ATOM 2089 CA GLY A 139 108.248 12.054 -17.296 1.00 0.00 C ATOM 2090 C GLY A 139 108.293 10.779 -18.146 1.00 0.00 C ATOM 2091 O GLY A 139 107.460 10.604 -19.037 1.00 0.00 O ATOM 0 H GLY A 139 108.535 11.374 -15.327 1.00 0.00 H new ATOM 0 HA2 GLY A 139 107.210 12.297 -17.069 1.00 0.00 H new ATOM 0 HA3 GLY A 139 108.651 12.885 -17.875 1.00 0.00 H new ATOM 2095 N LYS A 140 109.253 9.893 -17.884 1.00 0.00 N ATOM 2096 CA LYS A 140 109.362 8.650 -18.639 1.00 0.00 C ATOM 2097 C LYS A 140 108.643 7.517 -17.914 1.00 0.00 C ATOM 2098 O LYS A 140 108.629 7.463 -16.685 1.00 0.00 O ATOM 2099 CB LYS A 140 110.835 8.283 -18.832 1.00 0.00 C ATOM 2100 CG LYS A 140 111.518 9.352 -19.686 1.00 0.00 C ATOM 2101 CD LYS A 140 112.962 8.935 -19.970 1.00 0.00 C ATOM 2102 CE LYS A 140 113.680 10.056 -20.721 1.00 0.00 C ATOM 2103 NZ LYS A 140 114.972 9.545 -21.262 1.00 0.00 N ATOM 0 H LYS A 140 109.961 10.013 -17.160 1.00 0.00 H new ATOM 0 HA LYS A 140 108.894 8.796 -19.613 1.00 0.00 H new ATOM 0 HB2 LYS A 140 111.331 8.203 -17.865 1.00 0.00 H new ATOM 0 HB3 LYS A 140 110.918 7.309 -19.314 1.00 0.00 H new ATOM 0 HG2 LYS A 140 110.976 9.485 -20.622 1.00 0.00 H new ATOM 0 HG3 LYS A 140 111.501 10.311 -19.169 1.00 0.00 H new ATOM 0 HD2 LYS A 140 113.480 8.720 -19.035 1.00 0.00 H new ATOM 0 HD3 LYS A 140 112.977 8.019 -20.561 1.00 0.00 H new ATOM 0 HE2 LYS A 140 113.053 10.423 -21.534 1.00 0.00 H new ATOM 0 HE3 LYS A 140 113.861 10.898 -20.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 115.184 10.021 -22.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 115.734 9.737 -20.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 114.901 8.520 -21.421 1.00 0.00 H new ATOM 2117 N GLY A 141 108.047 6.613 -18.686 1.00 0.00 N ATOM 2118 CA GLY A 141 107.328 5.484 -18.107 1.00 0.00 C ATOM 2119 C GLY A 141 106.348 4.888 -19.111 1.00 0.00 C ATOM 2120 O GLY A 141 106.229 3.674 -19.145 1.00 0.00 O ATOM 2121 OXT GLY A 141 105.729 5.654 -19.832 1.00 0.00 O ATOM 0 H GLY A 141 108.047 6.640 -19.706 1.00 0.00 H new ATOM 0 HA2 GLY A 141 108.038 4.720 -17.789 1.00 0.00 H new ATOM 0 HA3 GLY A 141 106.790 5.809 -17.217 1.00 0.00 H new TER 2125 GLY A 141