USER MOD reduce.3.24.130724 H: found=0, std=0, add=1171, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1171 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 66 TYR OH : rot 180:sc= 1 USER MOD Set 1.2: A 110 SER OG : rot 147:sc= 1.18 USER MOD Set 2.1: A 93 SER OG : rot -153:sc= 1.05 USER MOD Set 2.2: A 95 CYS SG : rot 171:sc= 0.844 USER MOD Set 2.3: A 107 TYR OH : rot -56:sc= 2 USER MOD Set 2.4: A 126 GLN : amide:sc= 0.45 K(o=4.3,f=2.2) USER MOD Set 3.1: A 77 CYS SG : rot 36:sc= 0.47 USER MOD Set 3.2: A 84 SER OG : rot -26:sc= 1.21 USER MOD Set 4.1: A 30 TYR OH : rot 62:sc= 1.34 USER MOD Set 4.2: A 103 LYS NZ :NH3+ -171:sc= 1.25 (180deg=0.998) USER MOD Set 5.1: A 26 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 92 MET CE :methyl -124:sc=-0.00177 (180deg=-2.86!) USER MOD Set 6.1: A 22 LYS NZ :NH3+ -145:sc= 2.25 (180deg=1.17) USER MOD Set 6.2: A 87 GLN : amide:sc= -0.479 K(o=1.8,f=-6.2!) USER MOD Set 7.1: A 15 TYR OH : rot 18:sc= 1.7 USER MOD Set 7.2: A 19 LYS NZ :NH3+ 171:sc= 1.26 (180deg=0.0849) USER MOD Single : A 1 MET CE :methyl 158:sc= -0.137 (180deg=-0.764) USER MOD Single : A 1 MET N :NH3+ 154:sc= 1.36 (180deg=0.575) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 77:sc= 1.2 USER MOD Single : A 11 CYS SG : rot 83:sc= 0.986 USER MOD Single : A 12 LYS NZ :NH3+ -172:sc= 1.18 (180deg=0.971) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.0114 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ -132:sc= 0.301 (180deg=-0.0369) USER MOD Single : A 24 HIS : no HE2:sc= 0.00071 X(o=0.00071,f=-0.035) USER MOD Single : A 35 LYS NZ :NH3+ 175:sc= 2.29 (180deg=2.05) USER MOD Single : A 36 GLN : amide:sc= -1.41! C(o=-1.4!,f=-8.4!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc=-0.00851 X(o=-0.0085,f=-0.0085) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= 0.495 K(o=0.49,f=-4.7!) USER MOD Single : A 57 GLN : amide:sc= -0.687 K(o=-0.69,f=-2.3!) USER MOD Single : A 58 LYS NZ :NH3+ -172:sc= 0.989 (180deg=0.871) USER MOD Single : A 59 CYS SG : rot 73:sc= 0.46 USER MOD Single : A 64 CYS SG : rot 150:sc= -0.331 USER MOD Single : A 73 TYR OH : rot 54:sc= 1.24 USER MOD Single : A 74 MET CE :methyl -105:sc= -0.21 (180deg=-1.7) USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= -1.01 K(o=-1,f=-5.4!) USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 63:sc= 0.388 USER MOD Single : A 85 LYS NZ :NH3+ 171:sc= 0.691 (180deg=0.679) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 162:sc= 0.914 (180deg=-1.12!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0768) USER MOD Single : A 104 LYS NZ :NH3+ 166:sc= 1.11 (180deg=0.961) USER MOD Single : A 105 MET CE :methyl 165:sc= 0 (180deg=-0.498) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 170:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -141:sc= -0.404 (180deg=-1.92!) USER MOD Single : A 116 LYS NZ :NH3+ -166:sc= 0.312 (180deg=0.246) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 LYS NZ :NH3+ 150:sc= 0.015 (180deg=-0.317) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 65:sc= 0.0532 USER MOD Single : A 131 SER OG : rot 87:sc= 1.28 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 157:sc= 1.28 (180deg=1.16) USER MOD Single : A 145 THR OG1 : rot 39:sc= 0.637 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.087 -2.888 -1.113 1.00 50.20 N ATOM 2 CA MET A 1 3.159 -1.878 -2.192 1.00 74.24 C ATOM 3 C MET A 1 4.600 -1.431 -2.404 1.00 63.40 C ATOM 4 O MET A 1 5.119 -0.585 -1.676 1.00 15.52 O ATOM 5 CB MET A 1 2.268 -0.666 -1.872 1.00 22.40 C ATOM 6 CG MET A 1 0.778 -0.975 -1.861 1.00 41.25 C ATOM 7 SD MET A 1 0.265 -1.932 -0.420 1.00 34.04 S ATOM 8 CE MET A 1 0.551 -0.744 0.893 1.00 41.43 C ATOM 0 H1 MET A 1 2.143 -2.865 -0.678 1.00 50.20 H new ATOM 0 H2 MET A 1 3.262 -3.833 -1.510 1.00 50.20 H new ATOM 0 H3 MET A 1 3.806 -2.677 -0.392 1.00 50.20 H new ATOM 0 HA MET A 1 2.793 -2.337 -3.110 1.00 74.24 H new ATOM 0 HB2 MET A 1 2.552 -0.267 -0.898 1.00 22.40 H new ATOM 0 HB3 MET A 1 2.460 0.117 -2.606 1.00 22.40 H new ATOM 0 HG2 MET A 1 0.219 -0.040 -1.887 1.00 41.25 H new ATOM 0 HG3 MET A 1 0.520 -1.525 -2.766 1.00 41.25 H new ATOM 0 HE1 MET A 1 -0.055 -1.007 1.760 1.00 41.43 H new ATOM 0 HE2 MET A 1 1.605 -0.755 1.171 1.00 41.43 H new ATOM 0 HE3 MET A 1 0.277 0.253 0.548 1.00 41.43 H new ATOM 20 N ALA A 2 5.250 -2.032 -3.388 1.00 13.31 N ATOM 21 CA ALA A 2 6.614 -1.676 -3.740 1.00 13.22 C ATOM 22 C ALA A 2 6.687 -1.264 -5.204 1.00 24.04 C ATOM 23 O ALA A 2 5.753 -1.515 -5.973 1.00 53.21 O ATOM 24 CB ALA A 2 7.554 -2.841 -3.456 1.00 44.23 C ATOM 0 H ALA A 2 4.850 -2.775 -3.961 1.00 13.31 H new ATOM 0 HA ALA A 2 6.928 -0.829 -3.130 1.00 13.22 H new ATOM 0 HB1 ALA A 2 8.573 -2.560 -3.724 1.00 44.23 H new ATOM 0 HB2 ALA A 2 7.514 -3.091 -2.396 1.00 44.23 H new ATOM 0 HB3 ALA A 2 7.249 -3.706 -4.044 1.00 44.23 H new ATOM 30 N SER A 3 7.786 -0.626 -5.586 1.00 23.41 N ATOM 31 CA SER A 3 7.974 -0.175 -6.954 1.00 70.41 C ATOM 32 C SER A 3 8.137 -1.369 -7.890 1.00 61.20 C ATOM 33 O SER A 3 9.208 -1.978 -7.968 1.00 42.43 O ATOM 34 CB SER A 3 9.191 0.743 -7.036 1.00 54.23 C ATOM 35 OG SER A 3 9.122 1.759 -6.046 1.00 31.42 O ATOM 0 H SER A 3 8.563 -0.410 -4.962 1.00 23.41 H new ATOM 0 HA SER A 3 7.092 0.385 -7.267 1.00 70.41 H new ATOM 0 HB2 SER A 3 10.102 0.160 -6.903 1.00 54.23 H new ATOM 0 HB3 SER A 3 9.245 1.196 -8.026 1.00 54.23 H new ATOM 0 HG SER A 3 9.911 2.336 -6.114 1.00 31.42 H new ATOM 41 N GLY A 4 7.055 -1.713 -8.566 1.00 53.05 N ATOM 42 CA GLY A 4 7.041 -2.857 -9.452 1.00 24.21 C ATOM 43 C GLY A 4 5.642 -3.412 -9.574 1.00 53.31 C ATOM 44 O GLY A 4 5.382 -4.566 -9.230 1.00 43.54 O ATOM 0 H GLY A 4 6.169 -1.210 -8.515 1.00 53.05 H new ATOM 0 HA2 GLY A 4 7.411 -2.568 -10.436 1.00 24.21 H new ATOM 0 HA3 GLY A 4 7.713 -3.627 -9.072 1.00 24.21 H new ATOM 48 N VAL A 5 4.740 -2.575 -10.057 1.00 12.44 N ATOM 49 CA VAL A 5 3.322 -2.897 -10.098 1.00 53.35 C ATOM 50 C VAL A 5 2.961 -3.668 -11.369 1.00 32.24 C ATOM 51 O VAL A 5 3.541 -3.444 -12.435 1.00 13.02 O ATOM 52 CB VAL A 5 2.484 -1.603 -9.998 1.00 4.34 C ATOM 53 CG1 VAL A 5 0.995 -1.888 -10.087 1.00 1.14 C ATOM 54 CG2 VAL A 5 2.806 -0.868 -8.706 1.00 73.23 C ATOM 0 H VAL A 5 4.968 -1.654 -10.432 1.00 12.44 H new ATOM 0 HA VAL A 5 3.095 -3.538 -9.246 1.00 53.35 H new ATOM 0 HB VAL A 5 2.748 -0.970 -10.845 1.00 4.34 H new ATOM 0 HG11 VAL A 5 0.440 -0.953 -10.013 1.00 1.14 H new ATOM 0 HG12 VAL A 5 0.773 -2.367 -11.041 1.00 1.14 H new ATOM 0 HG13 VAL A 5 0.702 -2.549 -9.272 1.00 1.14 H new ATOM 0 HG21 VAL A 5 2.209 0.042 -8.647 1.00 73.23 H new ATOM 0 HG22 VAL A 5 2.575 -1.509 -7.855 1.00 73.23 H new ATOM 0 HG23 VAL A 5 3.865 -0.610 -8.689 1.00 73.23 H new ATOM 64 N THR A 6 1.989 -4.567 -11.245 1.00 35.55 N ATOM 65 CA THR A 6 1.584 -5.421 -12.349 1.00 44.42 C ATOM 66 C THR A 6 0.335 -4.867 -13.039 1.00 23.52 C ATOM 67 O THR A 6 -0.500 -4.219 -12.406 1.00 14.22 O ATOM 68 CB THR A 6 1.310 -6.848 -11.841 1.00 23.04 C ATOM 69 OG1 THR A 6 2.424 -7.297 -11.053 1.00 63.11 O ATOM 70 CG2 THR A 6 1.085 -7.806 -13.000 1.00 4.12 C ATOM 0 H THR A 6 1.466 -4.721 -10.383 1.00 35.55 H new ATOM 0 HA THR A 6 2.397 -5.447 -13.075 1.00 44.42 H new ATOM 0 HB THR A 6 0.407 -6.830 -11.231 1.00 23.04 H new ATOM 0 HG1 THR A 6 2.250 -8.205 -10.728 1.00 63.11 H new ATOM 0 HG21 THR A 6 0.894 -8.807 -12.613 1.00 4.12 H new ATOM 0 HG22 THR A 6 0.228 -7.474 -13.586 1.00 4.12 H new ATOM 0 HG23 THR A 6 1.972 -7.825 -13.633 1.00 4.12 H new ATOM 78 N VAL A 7 0.221 -5.126 -14.338 1.00 13.55 N ATOM 79 CA VAL A 7 -0.851 -4.568 -15.151 1.00 1.04 C ATOM 80 C VAL A 7 -2.009 -5.555 -15.287 1.00 31.35 C ATOM 81 O VAL A 7 -1.800 -6.732 -15.583 1.00 4.33 O ATOM 82 CB VAL A 7 -0.342 -4.219 -16.567 1.00 61.44 C ATOM 83 CG1 VAL A 7 -1.331 -3.321 -17.288 1.00 34.30 C ATOM 84 CG2 VAL A 7 1.034 -3.576 -16.508 1.00 42.53 C ATOM 0 H VAL A 7 0.866 -5.725 -14.853 1.00 13.55 H new ATOM 0 HA VAL A 7 -1.197 -3.665 -14.648 1.00 1.04 H new ATOM 0 HB VAL A 7 -0.253 -5.147 -17.132 1.00 61.44 H new ATOM 0 HG11 VAL A 7 -0.952 -3.088 -18.283 1.00 34.30 H new ATOM 0 HG12 VAL A 7 -2.290 -3.832 -17.375 1.00 34.30 H new ATOM 0 HG13 VAL A 7 -1.462 -2.397 -16.724 1.00 34.30 H new ATOM 0 HG21 VAL A 7 1.369 -3.340 -17.518 1.00 42.53 H new ATOM 0 HG22 VAL A 7 0.983 -2.660 -15.920 1.00 42.53 H new ATOM 0 HG23 VAL A 7 1.739 -4.266 -16.044 1.00 42.53 H new ATOM 94 N SER A 8 -3.227 -5.076 -15.071 1.00 10.02 N ATOM 95 CA SER A 8 -4.411 -5.899 -15.284 1.00 12.11 C ATOM 96 C SER A 8 -4.855 -5.821 -16.744 1.00 74.51 C ATOM 97 O SER A 8 -4.469 -4.903 -17.473 1.00 43.12 O ATOM 98 CB SER A 8 -5.545 -5.461 -14.357 1.00 34.31 C ATOM 99 OG SER A 8 -5.139 -5.523 -12.999 1.00 73.31 O ATOM 0 H SER A 8 -3.421 -4.127 -14.750 1.00 10.02 H new ATOM 0 HA SER A 8 -4.159 -6.934 -15.051 1.00 12.11 H new ATOM 0 HB2 SER A 8 -5.850 -4.444 -14.604 1.00 34.31 H new ATOM 0 HB3 SER A 8 -6.414 -6.101 -14.511 1.00 34.31 H new ATOM 0 HG SER A 8 -4.562 -4.757 -12.795 1.00 73.31 H new ATOM 105 N ASP A 9 -5.688 -6.770 -17.152 1.00 74.33 N ATOM 106 CA ASP A 9 -6.073 -6.920 -18.554 1.00 35.43 C ATOM 107 C ASP A 9 -6.921 -5.750 -19.039 1.00 52.11 C ATOM 108 O ASP A 9 -6.958 -5.455 -20.235 1.00 61.32 O ATOM 109 CB ASP A 9 -6.827 -8.237 -18.758 1.00 12.33 C ATOM 110 CG ASP A 9 -5.944 -9.443 -18.517 1.00 72.23 C ATOM 111 OD1 ASP A 9 -5.724 -9.804 -17.339 1.00 21.33 O ATOM 112 OD2 ASP A 9 -5.449 -10.027 -19.501 1.00 34.31 O ATOM 0 H ASP A 9 -6.114 -7.454 -16.527 1.00 74.33 H new ATOM 0 HA ASP A 9 -5.158 -6.932 -19.146 1.00 35.43 H new ATOM 0 HB2 ASP A 9 -7.681 -8.273 -18.082 1.00 12.33 H new ATOM 0 HB3 ASP A 9 -7.222 -8.275 -19.773 1.00 12.33 H new ATOM 117 N VAL A 10 -7.586 -5.071 -18.111 1.00 12.31 N ATOM 118 CA VAL A 10 -8.425 -3.931 -18.461 1.00 44.31 C ATOM 119 C VAL A 10 -7.569 -2.784 -19.000 1.00 21.34 C ATOM 120 O VAL A 10 -7.987 -2.049 -19.892 1.00 32.41 O ATOM 121 CB VAL A 10 -9.264 -3.434 -17.255 1.00 62.11 C ATOM 122 CG1 VAL A 10 -10.354 -2.481 -17.719 1.00 23.15 C ATOM 123 CG2 VAL A 10 -9.871 -4.611 -16.506 1.00 53.14 C ATOM 0 H VAL A 10 -7.561 -5.289 -17.115 1.00 12.31 H new ATOM 0 HA VAL A 10 -9.116 -4.267 -19.234 1.00 44.31 H new ATOM 0 HB VAL A 10 -8.603 -2.896 -16.576 1.00 62.11 H new ATOM 0 HG11 VAL A 10 -10.932 -2.143 -16.859 1.00 23.15 H new ATOM 0 HG12 VAL A 10 -9.900 -1.621 -18.212 1.00 23.15 H new ATOM 0 HG13 VAL A 10 -11.012 -2.995 -18.419 1.00 23.15 H new ATOM 0 HG21 VAL A 10 -10.456 -4.243 -15.663 1.00 53.14 H new ATOM 0 HG22 VAL A 10 -10.518 -5.175 -17.178 1.00 53.14 H new ATOM 0 HG23 VAL A 10 -9.075 -5.259 -16.140 1.00 53.14 H new ATOM 133 N CYS A 11 -6.352 -2.672 -18.484 1.00 22.31 N ATOM 134 CA CYS A 11 -5.454 -1.592 -18.868 1.00 63.25 C ATOM 135 C CYS A 11 -4.896 -1.796 -20.273 1.00 4.22 C ATOM 136 O CYS A 11 -4.715 -0.835 -21.022 1.00 73.15 O ATOM 137 CB CYS A 11 -4.308 -1.478 -17.863 1.00 33.21 C ATOM 138 SG CYS A 11 -3.055 -0.253 -18.303 1.00 24.23 S ATOM 0 H CYS A 11 -5.964 -3.318 -17.797 1.00 22.31 H new ATOM 0 HA CYS A 11 -6.030 -0.667 -18.868 1.00 63.25 H new ATOM 0 HB2 CYS A 11 -4.720 -1.225 -16.886 1.00 33.21 H new ATOM 0 HB3 CYS A 11 -3.829 -2.452 -17.764 1.00 33.21 H new ATOM 0 HG CYS A 11 -3.446 0.925 -17.917 1.00 24.23 H new ATOM 144 N LYS A 12 -4.623 -3.045 -20.627 1.00 43.33 N ATOM 145 CA LYS A 12 -4.018 -3.353 -21.917 1.00 35.21 C ATOM 146 C LYS A 12 -4.992 -3.067 -23.055 1.00 43.03 C ATOM 147 O LYS A 12 -4.615 -2.482 -24.069 1.00 31.34 O ATOM 148 CB LYS A 12 -3.570 -4.817 -21.970 1.00 62.02 C ATOM 149 CG LYS A 12 -2.742 -5.160 -23.202 1.00 54.24 C ATOM 150 CD LYS A 12 -2.368 -6.636 -23.238 1.00 1.22 C ATOM 151 CE LYS A 12 -3.566 -7.515 -23.570 1.00 31.45 C ATOM 152 NZ LYS A 12 -3.944 -7.430 -25.009 1.00 31.11 N ATOM 0 H LYS A 12 -4.810 -3.859 -20.042 1.00 43.33 H new ATOM 0 HA LYS A 12 -3.144 -2.713 -22.037 1.00 35.21 H new ATOM 0 HB2 LYS A 12 -2.987 -5.042 -21.077 1.00 62.02 H new ATOM 0 HB3 LYS A 12 -4.451 -5.458 -21.945 1.00 62.02 H new ATOM 0 HG2 LYS A 12 -3.304 -4.905 -24.100 1.00 54.24 H new ATOM 0 HG3 LYS A 12 -1.835 -4.555 -23.211 1.00 54.24 H new ATOM 0 HD2 LYS A 12 -1.584 -6.794 -23.979 1.00 1.22 H new ATOM 0 HD3 LYS A 12 -1.958 -6.931 -22.272 1.00 1.22 H new ATOM 0 HE2 LYS A 12 -3.337 -8.550 -23.317 1.00 31.45 H new ATOM 0 HE3 LYS A 12 -4.415 -7.217 -22.955 1.00 31.45 H new ATOM 0 HZ1 LYS A 12 -4.841 -7.934 -25.163 1.00 31.11 H new ATOM 0 HZ2 LYS A 12 -4.057 -6.432 -25.280 1.00 31.11 H new ATOM 0 HZ3 LYS A 12 -3.199 -7.864 -25.590 1.00 31.11 H new ATOM 166 N THR A 13 -6.245 -3.461 -22.860 1.00 13.20 N ATOM 167 CA THR A 13 -7.267 -3.348 -23.894 1.00 63.03 C ATOM 168 C THR A 13 -7.371 -1.923 -24.443 1.00 41.33 C ATOM 169 O THR A 13 -7.187 -1.696 -25.639 1.00 2.32 O ATOM 170 CB THR A 13 -8.642 -3.782 -23.350 1.00 65.23 C ATOM 171 OG1 THR A 13 -8.508 -5.012 -22.620 1.00 53.41 O ATOM 172 CG2 THR A 13 -9.640 -3.971 -24.483 1.00 5.11 C ATOM 0 H THR A 13 -6.580 -3.866 -21.986 1.00 13.20 H new ATOM 0 HA THR A 13 -6.967 -4.009 -24.707 1.00 63.03 H new ATOM 0 HB THR A 13 -9.012 -2.998 -22.689 1.00 65.23 H new ATOM 0 HG1 THR A 13 -9.384 -5.284 -22.274 1.00 53.41 H new ATOM 0 HG21 THR A 13 -10.602 -4.277 -24.073 1.00 5.11 H new ATOM 0 HG22 THR A 13 -9.758 -3.032 -25.024 1.00 5.11 H new ATOM 0 HG23 THR A 13 -9.275 -4.739 -25.165 1.00 5.11 H new ATOM 180 N THR A 14 -7.636 -0.967 -23.562 1.00 40.24 N ATOM 181 CA THR A 14 -7.864 0.407 -23.979 1.00 0.20 C ATOM 182 C THR A 14 -6.591 1.046 -24.539 1.00 60.40 C ATOM 183 O THR A 14 -6.655 1.876 -25.448 1.00 31.11 O ATOM 184 CB THR A 14 -8.398 1.251 -22.810 1.00 1.11 C ATOM 185 OG1 THR A 14 -9.433 0.527 -22.133 1.00 13.02 O ATOM 186 CG2 THR A 14 -8.950 2.579 -23.310 1.00 71.43 C ATOM 0 H THR A 14 -7.698 -1.119 -22.555 1.00 40.24 H new ATOM 0 HA THR A 14 -8.611 0.382 -24.772 1.00 0.20 H new ATOM 0 HB THR A 14 -7.576 1.454 -22.123 1.00 1.11 H new ATOM 0 HG1 THR A 14 -9.773 1.063 -21.387 1.00 13.02 H new ATOM 0 HG21 THR A 14 -9.322 3.159 -22.466 1.00 71.43 H new ATOM 0 HG22 THR A 14 -8.159 3.136 -23.812 1.00 71.43 H new ATOM 0 HG23 THR A 14 -9.765 2.394 -24.010 1.00 71.43 H new ATOM 194 N TYR A 15 -5.434 0.646 -24.016 1.00 30.30 N ATOM 195 CA TYR A 15 -4.165 1.174 -24.502 1.00 51.10 C ATOM 196 C TYR A 15 -3.941 0.778 -25.959 1.00 61.10 C ATOM 197 O TYR A 15 -3.475 1.582 -26.766 1.00 63.12 O ATOM 198 CB TYR A 15 -2.992 0.701 -23.630 1.00 72.52 C ATOM 199 CG TYR A 15 -1.637 0.931 -24.269 1.00 75.21 C ATOM 200 CD1 TYR A 15 -1.102 2.212 -24.407 1.00 0.41 C ATOM 201 CD2 TYR A 15 -0.903 -0.139 -24.765 1.00 75.05 C ATOM 202 CE1 TYR A 15 0.124 2.411 -25.017 1.00 22.33 C ATOM 203 CE2 TYR A 15 0.318 0.055 -25.380 1.00 20.22 C ATOM 204 CZ TYR A 15 0.828 1.330 -25.503 1.00 55.23 C ATOM 205 OH TYR A 15 2.037 1.524 -26.132 1.00 21.52 O ATOM 0 H TYR A 15 -5.350 -0.036 -23.262 1.00 30.30 H new ATOM 0 HA TYR A 15 -4.212 2.261 -24.439 1.00 51.10 H new ATOM 0 HB2 TYR A 15 -3.027 1.221 -22.673 1.00 72.52 H new ATOM 0 HB3 TYR A 15 -3.111 -0.362 -23.420 1.00 72.52 H new ATOM 0 HD1 TYR A 15 -1.653 3.062 -24.032 1.00 0.41 H new ATOM 0 HD2 TYR A 15 -1.294 -1.141 -24.668 1.00 75.05 H new ATOM 0 HE1 TYR A 15 0.527 3.408 -25.112 1.00 22.33 H new ATOM 0 HE2 TYR A 15 0.872 -0.789 -25.763 1.00 20.22 H new ATOM 0 HH TYR A 15 2.381 2.415 -25.911 1.00 21.52 H new ATOM 215 N GLU A 16 -4.287 -0.455 -26.297 1.00 13.34 N ATOM 216 CA GLU A 16 -4.134 -0.935 -27.662 1.00 24.52 C ATOM 217 C GLU A 16 -5.089 -0.201 -28.599 1.00 31.43 C ATOM 218 O GLU A 16 -4.772 0.039 -29.765 1.00 44.11 O ATOM 219 CB GLU A 16 -4.369 -2.443 -27.728 1.00 41.05 C ATOM 220 CG GLU A 16 -3.382 -3.234 -26.886 1.00 45.40 C ATOM 221 CD GLU A 16 -3.619 -4.726 -26.949 1.00 62.01 C ATOM 222 OE1 GLU A 16 -4.546 -5.214 -26.270 1.00 13.25 O ATOM 223 OE2 GLU A 16 -2.871 -5.421 -27.668 1.00 71.13 O ATOM 0 H GLU A 16 -4.674 -1.139 -25.647 1.00 13.34 H new ATOM 0 HA GLU A 16 -3.113 -0.732 -27.986 1.00 24.52 H new ATOM 0 HB2 GLU A 16 -5.383 -2.662 -27.392 1.00 41.05 H new ATOM 0 HB3 GLU A 16 -4.299 -2.771 -28.765 1.00 41.05 H new ATOM 0 HG2 GLU A 16 -2.369 -3.018 -27.224 1.00 45.40 H new ATOM 0 HG3 GLU A 16 -3.450 -2.904 -25.849 1.00 45.40 H new ATOM 230 N GLU A 17 -6.250 0.173 -28.075 1.00 51.34 N ATOM 231 CA GLU A 17 -7.222 0.931 -28.848 1.00 10.23 C ATOM 232 C GLU A 17 -6.736 2.359 -29.080 1.00 54.02 C ATOM 233 O GLU A 17 -6.781 2.864 -30.200 1.00 55.45 O ATOM 234 CB GLU A 17 -8.575 0.970 -28.136 1.00 65.52 C ATOM 235 CG GLU A 17 -9.176 -0.398 -27.862 1.00 52.41 C ATOM 236 CD GLU A 17 -10.560 -0.309 -27.250 1.00 43.45 C ATOM 237 OE1 GLU A 17 -10.667 -0.217 -26.011 1.00 15.43 O ATOM 238 OE2 GLU A 17 -11.550 -0.320 -28.013 1.00 2.43 O ATOM 0 H GLU A 17 -6.540 -0.036 -27.120 1.00 51.34 H new ATOM 0 HA GLU A 17 -7.338 0.430 -29.809 1.00 10.23 H new ATOM 0 HB2 GLU A 17 -8.460 1.499 -27.190 1.00 65.52 H new ATOM 0 HB3 GLU A 17 -9.274 1.547 -28.741 1.00 65.52 H new ATOM 0 HG2 GLU A 17 -9.229 -0.962 -28.793 1.00 52.41 H new ATOM 0 HG3 GLU A 17 -8.520 -0.952 -27.191 1.00 52.41 H new ATOM 245 N ILE A 18 -6.252 2.998 -28.019 1.00 1.30 N ATOM 246 CA ILE A 18 -5.893 4.411 -28.071 1.00 51.43 C ATOM 247 C ILE A 18 -4.615 4.651 -28.888 1.00 41.52 C ATOM 248 O ILE A 18 -4.408 5.734 -29.420 1.00 44.25 O ATOM 249 CB ILE A 18 -5.736 5.009 -26.649 1.00 41.10 C ATOM 250 CG1 ILE A 18 -5.599 6.533 -26.718 1.00 22.43 C ATOM 251 CG2 ILE A 18 -4.542 4.398 -25.928 1.00 2.33 C ATOM 252 CD1 ILE A 18 -5.364 7.184 -25.372 1.00 3.44 C ATOM 0 H ILE A 18 -6.099 2.558 -27.111 1.00 1.30 H new ATOM 0 HA ILE A 18 -6.715 4.921 -28.574 1.00 51.43 H new ATOM 0 HB ILE A 18 -6.634 4.767 -26.081 1.00 41.10 H new ATOM 0 HG12 ILE A 18 -4.773 6.785 -27.383 1.00 22.43 H new ATOM 0 HG13 ILE A 18 -6.503 6.951 -27.161 1.00 22.43 H new ATOM 0 HG21 ILE A 18 -4.455 4.835 -24.933 1.00 2.33 H new ATOM 0 HG22 ILE A 18 -4.682 3.321 -25.840 1.00 2.33 H new ATOM 0 HG23 ILE A 18 -3.633 4.600 -26.494 1.00 2.33 H new ATOM 0 HD11 ILE A 18 -5.277 8.263 -25.500 1.00 3.44 H new ATOM 0 HD12 ILE A 18 -6.201 6.963 -24.710 1.00 3.44 H new ATOM 0 HD13 ILE A 18 -4.444 6.795 -24.935 1.00 3.44 H new ATOM 264 N LYS A 19 -3.753 3.652 -28.994 1.00 65.43 N ATOM 265 CA LYS A 19 -2.533 3.820 -29.774 1.00 60.41 C ATOM 266 C LYS A 19 -2.798 3.643 -31.272 1.00 13.02 C ATOM 267 O LYS A 19 -2.086 4.202 -32.105 1.00 0.21 O ATOM 268 CB LYS A 19 -1.435 2.865 -29.292 1.00 74.24 C ATOM 269 CG LYS A 19 -1.748 1.389 -29.485 1.00 32.44 C ATOM 270 CD LYS A 19 -0.702 0.515 -28.815 1.00 42.13 C ATOM 271 CE LYS A 19 0.684 0.759 -29.390 1.00 54.15 C ATOM 272 NZ LYS A 19 1.746 0.118 -28.573 1.00 33.24 N ATOM 0 H LYS A 19 -3.869 2.736 -28.561 1.00 65.43 H new ATOM 0 HA LYS A 19 -2.182 4.840 -29.620 1.00 60.41 H new ATOM 0 HB2 LYS A 19 -0.511 3.099 -29.821 1.00 74.24 H new ATOM 0 HB3 LYS A 19 -1.252 3.048 -28.233 1.00 74.24 H new ATOM 0 HG2 LYS A 19 -2.732 1.166 -29.072 1.00 32.44 H new ATOM 0 HG3 LYS A 19 -1.790 1.159 -30.550 1.00 32.44 H new ATOM 0 HD2 LYS A 19 -0.692 0.715 -27.744 1.00 42.13 H new ATOM 0 HD3 LYS A 19 -0.969 -0.534 -28.941 1.00 42.13 H new ATOM 0 HE2 LYS A 19 0.727 0.373 -30.408 1.00 54.15 H new ATOM 0 HE3 LYS A 19 0.869 1.832 -29.448 1.00 54.15 H new ATOM 0 HZ1 LYS A 19 2.654 0.177 -29.076 1.00 33.24 H new ATOM 0 HZ2 LYS A 19 1.824 0.608 -27.659 1.00 33.24 H new ATOM 0 HZ3 LYS A 19 1.504 -0.880 -28.411 1.00 33.24 H new ATOM 286 N LYS A 20 -3.816 2.861 -31.615 1.00 43.55 N ATOM 287 CA LYS A 20 -4.136 2.610 -33.017 1.00 32.13 C ATOM 288 C LYS A 20 -5.265 3.511 -33.518 1.00 11.12 C ATOM 289 O LYS A 20 -5.084 4.294 -34.454 1.00 61.33 O ATOM 290 CB LYS A 20 -4.528 1.147 -33.220 1.00 20.11 C ATOM 291 CG LYS A 20 -3.414 0.159 -32.912 1.00 13.44 C ATOM 292 CD LYS A 20 -3.853 -1.270 -33.194 1.00 42.14 C ATOM 293 CE LYS A 20 -4.217 -1.458 -34.658 1.00 24.41 C ATOM 294 NZ LYS A 20 -4.741 -2.819 -34.932 1.00 61.45 N ATOM 0 H LYS A 20 -4.430 2.393 -30.948 1.00 43.55 H new ATOM 0 HA LYS A 20 -3.240 2.837 -33.595 1.00 32.13 H new ATOM 0 HB2 LYS A 20 -5.386 0.920 -32.587 1.00 20.11 H new ATOM 0 HB3 LYS A 20 -4.848 1.007 -34.253 1.00 20.11 H new ATOM 0 HG2 LYS A 20 -2.536 0.398 -33.512 1.00 13.44 H new ATOM 0 HG3 LYS A 20 -3.120 0.252 -31.867 1.00 13.44 H new ATOM 0 HD2 LYS A 20 -3.052 -1.958 -32.925 1.00 42.14 H new ATOM 0 HD3 LYS A 20 -4.711 -1.519 -32.569 1.00 42.14 H new ATOM 0 HE2 LYS A 20 -4.965 -0.718 -34.943 1.00 24.41 H new ATOM 0 HE3 LYS A 20 -3.338 -1.277 -35.276 1.00 24.41 H new ATOM 0 HZ1 LYS A 20 -4.977 -2.904 -35.941 1.00 61.45 H new ATOM 0 HZ2 LYS A 20 -4.019 -3.525 -34.685 1.00 61.45 H new ATOM 0 HZ3 LYS A 20 -5.595 -2.983 -34.362 1.00 61.45 H new ATOM 308 N ASP A 21 -6.421 3.410 -32.876 1.00 12.22 N ATOM 309 CA ASP A 21 -7.623 4.096 -33.341 1.00 75.11 C ATOM 310 C ASP A 21 -7.873 5.367 -32.536 1.00 60.11 C ATOM 311 O ASP A 21 -8.383 6.354 -33.059 1.00 4.01 O ATOM 312 CB ASP A 21 -8.815 3.141 -33.226 1.00 65.22 C ATOM 313 CG ASP A 21 -10.147 3.812 -33.480 1.00 65.52 C ATOM 314 OD1 ASP A 21 -10.510 4.010 -34.661 1.00 23.14 O ATOM 315 OD2 ASP A 21 -10.847 4.130 -32.498 1.00 74.54 O ATOM 0 H ASP A 21 -6.554 2.858 -32.029 1.00 12.22 H new ATOM 0 HA ASP A 21 -7.489 4.390 -34.382 1.00 75.11 H new ATOM 0 HB2 ASP A 21 -8.687 2.324 -33.936 1.00 65.22 H new ATOM 0 HB3 ASP A 21 -8.823 2.699 -32.230 1.00 65.22 H new ATOM 320 N LYS A 22 -7.456 5.326 -31.276 1.00 13.43 N ATOM 321 CA LYS A 22 -7.539 6.444 -30.328 1.00 55.24 C ATOM 322 C LYS A 22 -8.891 7.165 -30.308 1.00 42.12 C ATOM 323 O LYS A 22 -8.961 8.340 -29.952 1.00 12.11 O ATOM 324 CB LYS A 22 -6.408 7.452 -30.556 1.00 21.45 C ATOM 325 CG LYS A 22 -6.602 8.391 -31.727 1.00 41.11 C ATOM 326 CD LYS A 22 -5.599 9.516 -31.660 1.00 65.42 C ATOM 327 CE LYS A 22 -6.024 10.684 -32.513 1.00 42.30 C ATOM 328 NZ LYS A 22 -5.127 11.848 -32.300 1.00 44.33 N ATOM 0 H LYS A 22 -7.037 4.490 -30.868 1.00 13.43 H new ATOM 0 HA LYS A 22 -7.429 5.983 -29.346 1.00 55.24 H new ATOM 0 HB2 LYS A 22 -6.287 8.047 -29.651 1.00 21.45 H new ATOM 0 HB3 LYS A 22 -5.478 6.902 -30.703 1.00 21.45 H new ATOM 0 HG2 LYS A 22 -6.487 7.846 -32.664 1.00 41.11 H new ATOM 0 HG3 LYS A 22 -7.614 8.795 -31.716 1.00 41.11 H new ATOM 0 HD2 LYS A 22 -5.484 9.842 -30.626 1.00 65.42 H new ATOM 0 HD3 LYS A 22 -4.625 9.157 -31.992 1.00 65.42 H new ATOM 0 HE2 LYS A 22 -6.010 10.396 -33.564 1.00 42.30 H new ATOM 0 HE3 LYS A 22 -7.050 10.961 -32.272 1.00 42.30 H new ATOM 0 HZ1 LYS A 22 -5.678 12.728 -32.366 1.00 44.33 H new ATOM 0 HZ2 LYS A 22 -4.691 11.782 -31.358 1.00 44.33 H new ATOM 0 HZ3 LYS A 22 -4.383 11.851 -33.027 1.00 44.33 H new ATOM 342 N LYS A 23 -9.973 6.487 -30.650 1.00 35.03 N ATOM 343 CA LYS A 23 -11.281 7.071 -30.404 1.00 1.03 C ATOM 344 C LYS A 23 -11.549 7.020 -28.910 1.00 21.41 C ATOM 345 O LYS A 23 -12.206 7.894 -28.353 1.00 14.21 O ATOM 346 CB LYS A 23 -12.381 6.384 -31.213 1.00 30.03 C ATOM 347 CG LYS A 23 -12.982 7.291 -32.283 1.00 63.25 C ATOM 348 CD LYS A 23 -11.903 7.969 -33.123 1.00 70.52 C ATOM 349 CE LYS A 23 -11.174 6.982 -34.016 1.00 34.14 C ATOM 350 NZ LYS A 23 -12.031 6.468 -35.117 1.00 50.43 N ATOM 0 H LYS A 23 -9.977 5.564 -31.084 1.00 35.03 H new ATOM 0 HA LYS A 23 -11.286 8.108 -30.738 1.00 1.03 H new ATOM 0 HB2 LYS A 23 -11.973 5.491 -31.687 1.00 30.03 H new ATOM 0 HB3 LYS A 23 -13.170 6.054 -30.538 1.00 30.03 H new ATOM 0 HG2 LYS A 23 -13.633 6.705 -32.932 1.00 63.25 H new ATOM 0 HG3 LYS A 23 -13.604 8.050 -31.809 1.00 63.25 H new ATOM 0 HD2 LYS A 23 -12.357 8.747 -33.737 1.00 70.52 H new ATOM 0 HD3 LYS A 23 -11.186 8.460 -32.465 1.00 70.52 H new ATOM 0 HE2 LYS A 23 -10.293 7.463 -34.440 1.00 34.14 H new ATOM 0 HE3 LYS A 23 -10.821 6.145 -33.414 1.00 34.14 H new ATOM 0 HZ1 LYS A 23 -11.952 5.432 -35.163 1.00 50.43 H new ATOM 0 HZ2 LYS A 23 -13.021 6.732 -34.939 1.00 50.43 H new ATOM 0 HZ3 LYS A 23 -11.720 6.880 -36.020 1.00 50.43 H new ATOM 364 N HIS A 24 -10.987 6.005 -28.261 1.00 63.53 N ATOM 365 CA HIS A 24 -10.879 5.989 -26.805 1.00 71.50 C ATOM 366 C HIS A 24 -9.628 6.750 -26.396 1.00 34.34 C ATOM 367 O HIS A 24 -8.747 6.214 -25.729 1.00 10.43 O ATOM 368 CB HIS A 24 -10.809 4.562 -26.257 1.00 51.15 C ATOM 369 CG HIS A 24 -12.090 3.799 -26.362 1.00 11.31 C ATOM 370 ND1 HIS A 24 -13.226 4.114 -25.643 1.00 52.41 N ATOM 371 CD2 HIS A 24 -12.409 2.720 -27.108 1.00 1.13 C ATOM 372 CE1 HIS A 24 -14.183 3.257 -25.945 1.00 55.41 C ATOM 373 NE2 HIS A 24 -13.712 2.400 -26.831 1.00 33.22 N ATOM 0 H HIS A 24 -10.599 5.181 -28.721 1.00 63.53 H new ATOM 0 HA HIS A 24 -11.770 6.461 -26.390 1.00 71.50 H new ATOM 0 HB2 HIS A 24 -10.031 4.018 -26.792 1.00 51.15 H new ATOM 0 HB3 HIS A 24 -10.508 4.602 -25.210 1.00 51.15 H new ATOM 0 HD1 HIS A 24 -13.312 4.887 -24.983 1.00 52.41 H new ATOM 0 HD2 HIS A 24 -11.757 2.204 -27.797 1.00 1.13 H new ATOM 0 HE1 HIS A 24 -15.183 3.257 -25.536 1.00 55.41 H new ATOM 382 N ARG A 25 -9.568 8.006 -26.810 1.00 42.20 N ATOM 383 CA ARG A 25 -8.384 8.843 -26.629 1.00 44.15 C ATOM 384 C ARG A 25 -8.199 9.294 -25.185 1.00 3.15 C ATOM 385 O ARG A 25 -7.310 10.088 -24.891 1.00 54.32 O ATOM 386 CB ARG A 25 -8.465 10.057 -27.557 1.00 31.50 C ATOM 387 CG ARG A 25 -9.840 10.697 -27.599 1.00 44.41 C ATOM 388 CD ARG A 25 -10.099 11.582 -26.397 1.00 51.12 C ATOM 389 NE ARG A 25 -9.573 12.925 -26.595 1.00 61.22 N ATOM 390 CZ ARG A 25 -10.324 14.018 -26.522 1.00 2.44 C ATOM 391 NH1 ARG A 25 -11.612 13.911 -26.227 1.00 42.21 N ATOM 392 NH2 ARG A 25 -9.793 15.213 -26.735 1.00 41.33 N ATOM 0 H ARG A 25 -10.339 8.478 -27.283 1.00 42.20 H new ATOM 0 HA ARG A 25 -7.514 8.237 -26.884 1.00 44.15 H new ATOM 0 HB2 ARG A 25 -7.737 10.801 -27.233 1.00 31.50 H new ATOM 0 HB3 ARG A 25 -8.184 9.753 -28.565 1.00 31.50 H new ATOM 0 HG2 ARG A 25 -9.936 11.288 -28.510 1.00 44.41 H new ATOM 0 HG3 ARG A 25 -10.600 9.917 -27.644 1.00 44.41 H new ATOM 0 HD2 ARG A 25 -11.171 11.635 -26.208 1.00 51.12 H new ATOM 0 HD3 ARG A 25 -9.641 11.138 -25.513 1.00 51.12 H new ATOM 0 HE ARG A 25 -8.579 13.032 -26.800 1.00 61.22 H new ATOM 0 HH11 ARG A 25 -12.022 12.992 -26.057 1.00 42.21 H new ATOM 0 HH12 ARG A 25 -12.193 14.747 -26.170 1.00 42.21 H new ATOM 0 HH21 ARG A 25 -8.801 15.298 -26.957 1.00 41.33 H new ATOM 0 HH22 ARG A 25 -10.376 16.048 -26.677 1.00 41.33 H new ATOM 406 N TYR A 26 -9.036 8.808 -24.289 1.00 25.42 N ATOM 407 CA TYR A 26 -8.883 9.122 -22.885 1.00 22.32 C ATOM 408 C TYR A 26 -9.257 7.919 -22.031 1.00 64.24 C ATOM 409 O TYR A 26 -10.394 7.457 -22.054 1.00 41.30 O ATOM 410 CB TYR A 26 -9.717 10.349 -22.498 1.00 72.21 C ATOM 411 CG TYR A 26 -9.465 10.836 -21.085 1.00 75.22 C ATOM 412 CD1 TYR A 26 -8.201 10.739 -20.513 1.00 42.40 C ATOM 413 CD2 TYR A 26 -10.487 11.385 -20.323 1.00 3.53 C ATOM 414 CE1 TYR A 26 -7.963 11.176 -19.226 1.00 43.22 C ATOM 415 CE2 TYR A 26 -10.257 11.825 -19.032 1.00 2.20 C ATOM 416 CZ TYR A 26 -8.994 11.718 -18.488 1.00 15.33 C ATOM 417 OH TYR A 26 -8.759 12.154 -17.204 1.00 73.23 O ATOM 0 H TYR A 26 -9.824 8.198 -24.508 1.00 25.42 H new ATOM 0 HA TYR A 26 -7.836 9.364 -22.702 1.00 22.32 H new ATOM 0 HB2 TYR A 26 -9.502 11.158 -23.196 1.00 72.21 H new ATOM 0 HB3 TYR A 26 -10.774 10.108 -22.606 1.00 72.21 H new ATOM 0 HD1 TYR A 26 -7.391 10.314 -21.087 1.00 42.40 H new ATOM 0 HD2 TYR A 26 -11.478 11.470 -20.745 1.00 3.53 H new ATOM 0 HE1 TYR A 26 -6.974 11.094 -18.799 1.00 43.22 H new ATOM 0 HE2 TYR A 26 -11.063 12.251 -18.452 1.00 2.20 H new ATOM 0 HH TYR A 26 -9.589 12.510 -16.822 1.00 73.23 H new ATOM 427 N VAL A 27 -8.285 7.404 -21.301 1.00 55.41 N ATOM 428 CA VAL A 27 -8.503 6.265 -20.428 1.00 31.33 C ATOM 429 C VAL A 27 -8.046 6.589 -19.008 1.00 33.33 C ATOM 430 O VAL A 27 -6.930 7.068 -18.798 1.00 40.52 O ATOM 431 CB VAL A 27 -7.781 5.005 -20.965 1.00 63.43 C ATOM 432 CG1 VAL A 27 -6.333 5.309 -21.317 1.00 24.12 C ATOM 433 CG2 VAL A 27 -7.857 3.863 -19.963 1.00 30.22 C ATOM 0 H VAL A 27 -7.329 7.760 -21.296 1.00 55.41 H new ATOM 0 HA VAL A 27 -9.572 6.051 -20.407 1.00 31.33 H new ATOM 0 HB VAL A 27 -8.294 4.696 -21.876 1.00 63.43 H new ATOM 0 HG11 VAL A 27 -5.852 4.405 -21.691 1.00 24.12 H new ATOM 0 HG12 VAL A 27 -6.300 6.082 -22.085 1.00 24.12 H new ATOM 0 HG13 VAL A 27 -5.808 5.658 -20.428 1.00 24.12 H new ATOM 0 HG21 VAL A 27 -7.342 2.991 -20.366 1.00 30.22 H new ATOM 0 HG22 VAL A 27 -7.382 4.166 -19.030 1.00 30.22 H new ATOM 0 HG23 VAL A 27 -8.901 3.613 -19.775 1.00 30.22 H new ATOM 443 N ILE A 28 -8.927 6.355 -18.043 1.00 32.32 N ATOM 444 CA ILE A 28 -8.643 6.661 -16.648 1.00 33.43 C ATOM 445 C ILE A 28 -8.276 5.389 -15.889 1.00 65.13 C ATOM 446 O ILE A 28 -9.068 4.444 -15.811 1.00 74.32 O ATOM 447 CB ILE A 28 -9.844 7.352 -15.945 1.00 62.01 C ATOM 448 CG1 ILE A 28 -10.194 8.688 -16.613 1.00 34.03 C ATOM 449 CG2 ILE A 28 -9.550 7.577 -14.466 1.00 43.01 C ATOM 450 CD1 ILE A 28 -10.986 8.557 -17.899 1.00 3.53 C ATOM 0 H ILE A 28 -9.850 5.952 -18.204 1.00 32.32 H new ATOM 0 HA ILE A 28 -7.802 7.354 -16.639 1.00 33.43 H new ATOM 0 HB ILE A 28 -10.701 6.685 -16.041 1.00 62.01 H new ATOM 0 HG12 ILE A 28 -10.765 9.294 -15.909 1.00 34.03 H new ATOM 0 HG13 ILE A 28 -9.271 9.228 -16.823 1.00 34.03 H new ATOM 0 HG21 ILE A 28 -10.405 8.062 -13.995 1.00 43.01 H new ATOM 0 HG22 ILE A 28 -9.364 6.618 -13.982 1.00 43.01 H new ATOM 0 HG23 ILE A 28 -8.670 8.212 -14.362 1.00 43.01 H new ATOM 0 HD11 ILE A 28 -11.190 9.548 -18.303 1.00 3.53 H new ATOM 0 HD12 ILE A 28 -10.411 7.981 -18.624 1.00 3.53 H new ATOM 0 HD13 ILE A 28 -11.928 8.047 -17.696 1.00 3.53 H new ATOM 462 N PHE A 29 -7.074 5.378 -15.336 1.00 3.35 N ATOM 463 CA PHE A 29 -6.561 4.228 -14.610 1.00 73.22 C ATOM 464 C PHE A 29 -6.741 4.422 -13.109 1.00 53.44 C ATOM 465 O PHE A 29 -6.542 5.523 -12.590 1.00 51.34 O ATOM 466 CB PHE A 29 -5.067 4.031 -14.900 1.00 64.30 C ATOM 467 CG PHE A 29 -4.707 4.023 -16.359 1.00 34.22 C ATOM 468 CD1 PHE A 29 -4.421 5.206 -17.021 1.00 14.43 C ATOM 469 CD2 PHE A 29 -4.646 2.836 -17.067 1.00 30.22 C ATOM 470 CE1 PHE A 29 -4.083 5.205 -18.357 1.00 42.11 C ATOM 471 CE2 PHE A 29 -4.307 2.829 -18.407 1.00 23.41 C ATOM 472 CZ PHE A 29 -4.027 4.014 -19.052 1.00 34.54 C ATOM 0 H PHE A 29 -6.427 6.165 -15.378 1.00 3.35 H new ATOM 0 HA PHE A 29 -7.119 3.351 -14.939 1.00 73.22 H new ATOM 0 HB2 PHE A 29 -4.507 4.825 -14.406 1.00 64.30 H new ATOM 0 HB3 PHE A 29 -4.745 3.089 -14.455 1.00 64.30 H new ATOM 0 HD1 PHE A 29 -4.464 6.141 -16.483 1.00 14.43 H new ATOM 0 HD2 PHE A 29 -4.866 1.904 -16.567 1.00 30.22 H new ATOM 0 HE1 PHE A 29 -3.862 6.135 -18.860 1.00 42.11 H new ATOM 0 HE2 PHE A 29 -4.262 1.895 -18.948 1.00 23.41 H new ATOM 0 HZ PHE A 29 -3.764 4.011 -20.100 1.00 34.54 H new ATOM 482 N TYR A 30 -7.112 3.358 -12.420 1.00 24.52 N ATOM 483 CA TYR A 30 -7.167 3.372 -10.969 1.00 2.23 C ATOM 484 C TYR A 30 -6.275 2.264 -10.433 1.00 14.24 C ATOM 485 O TYR A 30 -5.947 1.320 -11.154 1.00 44.44 O ATOM 486 CB TYR A 30 -8.605 3.200 -10.460 1.00 30.40 C ATOM 487 CG TYR A 30 -8.753 3.426 -8.964 1.00 24.21 C ATOM 488 CD1 TYR A 30 -8.734 4.710 -8.431 1.00 61.12 C ATOM 489 CD2 TYR A 30 -8.896 2.357 -8.085 1.00 54.42 C ATOM 490 CE1 TYR A 30 -8.847 4.922 -7.069 1.00 30.20 C ATOM 491 CE2 TYR A 30 -9.016 2.564 -6.721 1.00 14.11 C ATOM 492 CZ TYR A 30 -8.989 3.848 -6.218 1.00 22.24 C ATOM 493 OH TYR A 30 -9.092 4.057 -4.857 1.00 40.10 O ATOM 0 H TYR A 30 -7.381 2.470 -12.844 1.00 24.52 H new ATOM 0 HA TYR A 30 -6.812 4.339 -10.611 1.00 2.23 H new ATOM 0 HB2 TYR A 30 -9.255 3.896 -10.990 1.00 30.40 H new ATOM 0 HB3 TYR A 30 -8.950 2.195 -10.703 1.00 30.40 H new ATOM 0 HD1 TYR A 30 -8.629 5.557 -9.093 1.00 61.12 H new ATOM 0 HD2 TYR A 30 -8.914 1.349 -8.473 1.00 54.42 H new ATOM 0 HE1 TYR A 30 -8.824 5.927 -6.674 1.00 30.20 H new ATOM 0 HE2 TYR A 30 -9.130 1.723 -6.053 1.00 14.11 H new ATOM 0 HH TYR A 30 -9.896 4.584 -4.667 1.00 40.10 H new ATOM 503 N ILE A 31 -5.868 2.382 -9.185 1.00 24.22 N ATOM 504 CA ILE A 31 -5.007 1.391 -8.582 1.00 34.31 C ATOM 505 C ILE A 31 -5.843 0.210 -8.064 1.00 31.43 C ATOM 506 O ILE A 31 -6.492 0.275 -7.018 1.00 73.23 O ATOM 507 CB ILE A 31 -4.139 2.047 -7.479 1.00 60.33 C ATOM 508 CG1 ILE A 31 -3.108 1.070 -6.913 1.00 10.34 C ATOM 509 CG2 ILE A 31 -4.993 2.640 -6.367 1.00 62.14 C ATOM 510 CD1 ILE A 31 -2.088 0.611 -7.929 1.00 44.33 C ATOM 0 H ILE A 31 -6.121 3.156 -8.570 1.00 24.22 H new ATOM 0 HA ILE A 31 -4.322 0.988 -9.328 1.00 34.31 H new ATOM 0 HB ILE A 31 -3.596 2.865 -7.952 1.00 60.33 H new ATOM 0 HG12 ILE A 31 -2.590 1.544 -6.079 1.00 10.34 H new ATOM 0 HG13 ILE A 31 -3.627 0.199 -6.512 1.00 10.34 H new ATOM 0 HG21 ILE A 31 -4.347 3.090 -5.613 1.00 62.14 H new ATOM 0 HG22 ILE A 31 -5.653 3.402 -6.782 1.00 62.14 H new ATOM 0 HG23 ILE A 31 -5.591 1.853 -5.909 1.00 62.14 H new ATOM 0 HD11 ILE A 31 -1.389 -0.080 -7.457 1.00 44.33 H new ATOM 0 HD12 ILE A 31 -2.595 0.108 -8.752 1.00 44.33 H new ATOM 0 HD13 ILE A 31 -1.543 1.473 -8.312 1.00 44.33 H new ATOM 522 N ARG A 32 -5.838 -0.864 -8.839 1.00 61.25 N ATOM 523 CA ARG A 32 -6.653 -2.036 -8.564 1.00 75.31 C ATOM 524 C ARG A 32 -6.170 -2.746 -7.319 1.00 24.04 C ATOM 525 O ARG A 32 -4.982 -3.059 -7.195 1.00 4.55 O ATOM 526 CB ARG A 32 -6.603 -3.003 -9.738 1.00 2.31 C ATOM 527 CG ARG A 32 -7.625 -4.119 -9.652 1.00 53.30 C ATOM 528 CD ARG A 32 -7.530 -5.052 -10.848 1.00 14.14 C ATOM 529 NE ARG A 32 -8.595 -6.061 -10.838 1.00 60.20 N ATOM 530 CZ ARG A 32 -8.666 -7.089 -9.983 1.00 62.10 C ATOM 531 NH1 ARG A 32 -7.690 -7.317 -9.115 1.00 34.53 N ATOM 532 NH2 ARG A 32 -9.709 -7.905 -10.011 1.00 21.33 N ATOM 0 H ARG A 32 -5.266 -0.947 -9.679 1.00 61.25 H new ATOM 0 HA ARG A 32 -7.679 -1.700 -8.410 1.00 75.31 H new ATOM 0 HB2 ARG A 32 -6.762 -2.447 -10.662 1.00 2.31 H new ATOM 0 HB3 ARG A 32 -5.606 -3.439 -9.796 1.00 2.31 H new ATOM 0 HG2 ARG A 32 -7.471 -4.686 -8.734 1.00 53.30 H new ATOM 0 HG3 ARG A 32 -8.627 -3.693 -9.599 1.00 53.30 H new ATOM 0 HD2 ARG A 32 -7.589 -4.471 -11.768 1.00 14.14 H new ATOM 0 HD3 ARG A 32 -6.559 -5.548 -10.846 1.00 14.14 H new ATOM 0 HE ARG A 32 -9.336 -5.973 -11.534 1.00 60.20 H new ATOM 0 HH11 ARG A 32 -6.874 -6.706 -9.094 1.00 34.53 H new ATOM 0 HH12 ARG A 32 -7.756 -8.103 -8.469 1.00 34.53 H new ATOM 0 HH21 ARG A 32 -10.459 -7.751 -10.684 1.00 21.33 H new ATOM 0 HH22 ARG A 32 -9.762 -8.688 -9.359 1.00 21.33 H new ATOM 546 N ASP A 33 -7.093 -2.956 -6.386 1.00 24.24 N ATOM 547 CA ASP A 33 -6.812 -3.667 -5.138 1.00 31.54 C ATOM 548 C ASP A 33 -5.753 -2.914 -4.331 1.00 13.20 C ATOM 549 O ASP A 33 -5.256 -3.401 -3.314 1.00 32.23 O ATOM 550 CB ASP A 33 -6.366 -5.106 -5.434 1.00 42.01 C ATOM 551 CG ASP A 33 -6.603 -6.048 -4.269 1.00 42.03 C ATOM 552 OD1 ASP A 33 -7.775 -6.250 -3.896 1.00 30.45 O ATOM 553 OD2 ASP A 33 -5.623 -6.597 -3.728 1.00 33.04 O ATOM 0 H ASP A 33 -8.059 -2.639 -6.471 1.00 24.24 H new ATOM 0 HA ASP A 33 -7.723 -3.714 -4.541 1.00 31.54 H new ATOM 0 HB2 ASP A 33 -6.903 -5.475 -6.308 1.00 42.01 H new ATOM 0 HB3 ASP A 33 -5.306 -5.108 -5.687 1.00 42.01 H new ATOM 558 N GLU A 34 -5.431 -1.710 -4.810 1.00 2.04 N ATOM 559 CA GLU A 34 -4.489 -0.806 -4.166 1.00 63.22 C ATOM 560 C GLU A 34 -3.048 -1.329 -4.204 1.00 2.14 C ATOM 561 O GLU A 34 -2.249 -1.018 -3.324 1.00 60.33 O ATOM 562 CB GLU A 34 -4.953 -0.504 -2.739 1.00 44.50 C ATOM 563 CG GLU A 34 -6.303 0.194 -2.725 1.00 41.14 C ATOM 564 CD GLU A 34 -6.854 0.434 -1.336 1.00 24.05 C ATOM 565 OE1 GLU A 34 -7.563 -0.455 -0.811 1.00 52.24 O ATOM 566 OE2 GLU A 34 -6.620 1.527 -0.783 1.00 73.24 O ATOM 0 H GLU A 34 -5.827 -1.334 -5.671 1.00 2.04 H new ATOM 0 HA GLU A 34 -4.476 0.125 -4.732 1.00 63.22 H new ATOM 0 HB2 GLU A 34 -5.017 -1.433 -2.173 1.00 44.50 H new ATOM 0 HB3 GLU A 34 -4.214 0.123 -2.240 1.00 44.50 H new ATOM 0 HG2 GLU A 34 -6.212 1.151 -3.240 1.00 41.14 H new ATOM 0 HG3 GLU A 34 -7.017 -0.405 -3.290 1.00 41.14 H new ATOM 573 N LYS A 35 -2.707 -2.100 -5.246 1.00 44.04 N ATOM 574 CA LYS A 35 -1.307 -2.477 -5.479 1.00 2.13 C ATOM 575 C LYS A 35 -1.028 -2.842 -6.943 1.00 43.03 C ATOM 576 O LYS A 35 0.122 -3.085 -7.307 1.00 64.33 O ATOM 577 CB LYS A 35 -0.859 -3.640 -4.580 1.00 33.31 C ATOM 578 CG LYS A 35 -1.466 -4.991 -4.936 1.00 5.23 C ATOM 579 CD LYS A 35 -2.805 -5.200 -4.259 1.00 51.54 C ATOM 580 CE LYS A 35 -2.656 -5.311 -2.749 1.00 52.11 C ATOM 581 NZ LYS A 35 -3.974 -5.437 -2.078 1.00 55.13 N ATOM 0 H LYS A 35 -3.368 -2.469 -5.929 1.00 44.04 H new ATOM 0 HA LYS A 35 -0.729 -1.588 -5.226 1.00 2.13 H new ATOM 0 HB2 LYS A 35 0.227 -3.721 -4.628 1.00 33.31 H new ATOM 0 HB3 LYS A 35 -1.115 -3.403 -3.548 1.00 33.31 H new ATOM 0 HG2 LYS A 35 -1.590 -5.061 -6.017 1.00 5.23 H new ATOM 0 HG3 LYS A 35 -0.781 -5.786 -4.642 1.00 5.23 H new ATOM 0 HD2 LYS A 35 -3.469 -4.370 -4.500 1.00 51.54 H new ATOM 0 HD3 LYS A 35 -3.273 -6.105 -4.647 1.00 51.54 H new ATOM 0 HE2 LYS A 35 -2.039 -6.176 -2.506 1.00 52.11 H new ATOM 0 HE3 LYS A 35 -2.136 -4.432 -2.368 1.00 52.11 H new ATOM 0 HZ1 LYS A 35 -3.832 -5.595 -1.060 1.00 55.13 H new ATOM 0 HZ2 LYS A 35 -4.520 -4.564 -2.219 1.00 55.13 H new ATOM 0 HZ3 LYS A 35 -4.495 -6.241 -2.484 1.00 55.13 H new ATOM 595 N GLN A 36 -2.060 -2.893 -7.782 1.00 60.04 N ATOM 596 CA GLN A 36 -1.865 -3.256 -9.189 1.00 21.32 C ATOM 597 C GLN A 36 -2.634 -2.318 -10.119 1.00 63.54 C ATOM 598 O GLN A 36 -3.556 -1.641 -9.695 1.00 4.31 O ATOM 599 CB GLN A 36 -2.243 -4.718 -9.440 1.00 43.51 C ATOM 600 CG GLN A 36 -3.686 -5.057 -9.121 1.00 0.44 C ATOM 601 CD GLN A 36 -3.990 -6.531 -9.299 1.00 42.24 C ATOM 602 OE1 GLN A 36 -5.105 -6.903 -9.650 1.00 1.43 O ATOM 603 NE2 GLN A 36 -3.006 -7.381 -9.048 1.00 3.10 N ATOM 0 H GLN A 36 -3.025 -2.692 -7.521 1.00 60.04 H new ATOM 0 HA GLN A 36 -0.804 -3.143 -9.414 1.00 21.32 H new ATOM 0 HB2 GLN A 36 -2.050 -4.956 -10.486 1.00 43.51 H new ATOM 0 HB3 GLN A 36 -1.592 -5.356 -8.842 1.00 43.51 H new ATOM 0 HG2 GLN A 36 -3.906 -4.766 -8.094 1.00 0.44 H new ATOM 0 HG3 GLN A 36 -4.344 -4.474 -9.765 1.00 0.44 H new ATOM 0 HE21 GLN A 36 -2.092 -7.032 -8.758 1.00 3.10 H new ATOM 0 HE22 GLN A 36 -3.162 -8.384 -9.145 1.00 3.10 H new ATOM 612 N ILE A 37 -2.226 -2.265 -11.381 1.00 60.31 N ATOM 613 CA ILE A 37 -2.808 -1.338 -12.355 1.00 61.04 C ATOM 614 C ILE A 37 -4.195 -1.795 -12.809 1.00 44.44 C ATOM 615 O ILE A 37 -4.442 -2.994 -12.914 1.00 14.14 O ATOM 616 CB ILE A 37 -1.912 -1.231 -13.602 1.00 40.44 C ATOM 617 CG1 ILE A 37 -0.449 -1.018 -13.194 1.00 25.33 C ATOM 618 CG2 ILE A 37 -2.392 -0.103 -14.506 1.00 5.43 C ATOM 619 CD1 ILE A 37 0.488 -0.800 -14.362 1.00 1.30 C ATOM 0 H ILE A 37 -1.487 -2.857 -11.760 1.00 60.31 H new ATOM 0 HA ILE A 37 -2.889 -0.371 -11.859 1.00 61.04 H new ATOM 0 HB ILE A 37 -1.977 -2.166 -14.159 1.00 40.44 H new ATOM 0 HG12 ILE A 37 -0.390 -0.157 -12.528 1.00 25.33 H new ATOM 0 HG13 ILE A 37 -0.111 -1.885 -12.626 1.00 25.33 H new ATOM 0 HG21 ILE A 37 -1.748 -0.041 -15.383 1.00 5.43 H new ATOM 0 HG22 ILE A 37 -3.417 -0.300 -14.821 1.00 5.43 H new ATOM 0 HG23 ILE A 37 -2.356 0.840 -13.961 1.00 5.43 H new ATOM 0 HD11 ILE A 37 1.503 -0.657 -13.992 1.00 1.30 H new ATOM 0 HD12 ILE A 37 0.460 -1.670 -15.018 1.00 1.30 H new ATOM 0 HD13 ILE A 37 0.177 0.084 -14.918 1.00 1.30 H new ATOM 631 N ASP A 38 -5.088 -0.844 -13.091 1.00 1.21 N ATOM 632 CA ASP A 38 -6.416 -1.169 -13.607 1.00 43.11 C ATOM 633 C ASP A 38 -7.045 0.032 -14.314 1.00 31.41 C ATOM 634 O ASP A 38 -6.567 1.158 -14.180 1.00 4.41 O ATOM 635 CB ASP A 38 -7.319 -1.625 -12.469 1.00 63.32 C ATOM 636 CG ASP A 38 -8.620 -2.226 -12.957 1.00 52.33 C ATOM 637 OD1 ASP A 38 -8.571 -3.139 -13.810 1.00 12.55 O ATOM 638 OD2 ASP A 38 -9.690 -1.800 -12.489 1.00 44.51 O ATOM 0 H ASP A 38 -4.915 0.154 -12.971 1.00 1.21 H new ATOM 0 HA ASP A 38 -6.307 -1.975 -14.333 1.00 43.11 H new ATOM 0 HB2 ASP A 38 -6.789 -2.360 -11.863 1.00 63.32 H new ATOM 0 HB3 ASP A 38 -7.537 -0.776 -11.821 1.00 63.32 H new ATOM 643 N VAL A 39 -8.110 -0.219 -15.069 1.00 42.44 N ATOM 644 CA VAL A 39 -8.857 0.833 -15.752 1.00 25.34 C ATOM 645 C VAL A 39 -10.318 0.785 -15.333 1.00 3.43 C ATOM 646 O VAL A 39 -10.938 -0.277 -15.361 1.00 62.33 O ATOM 647 CB VAL A 39 -8.772 0.693 -17.287 1.00 54.23 C ATOM 648 CG1 VAL A 39 -9.700 1.680 -17.983 1.00 72.43 C ATOM 649 CG2 VAL A 39 -7.346 0.887 -17.761 1.00 1.35 C ATOM 0 H VAL A 39 -8.480 -1.157 -15.225 1.00 42.44 H new ATOM 0 HA VAL A 39 -8.411 1.786 -15.468 1.00 25.34 H new ATOM 0 HB VAL A 39 -9.094 -0.315 -17.548 1.00 54.23 H new ATOM 0 HG11 VAL A 39 -9.618 1.557 -19.063 1.00 72.43 H new ATOM 0 HG12 VAL A 39 -10.728 1.493 -17.674 1.00 72.43 H new ATOM 0 HG13 VAL A 39 -9.419 2.697 -17.711 1.00 72.43 H new ATOM 0 HG21 VAL A 39 -7.306 0.785 -18.845 1.00 1.35 H new ATOM 0 HG22 VAL A 39 -7.000 1.881 -17.477 1.00 1.35 H new ATOM 0 HG23 VAL A 39 -6.704 0.135 -17.302 1.00 1.35 H new ATOM 659 N GLU A 40 -10.868 1.927 -14.950 1.00 40.10 N ATOM 660 CA GLU A 40 -12.254 1.972 -14.508 1.00 12.03 C ATOM 661 C GLU A 40 -13.119 2.825 -15.431 1.00 64.02 C ATOM 662 O GLU A 40 -14.307 2.557 -15.599 1.00 11.22 O ATOM 663 CB GLU A 40 -12.345 2.504 -13.080 1.00 20.45 C ATOM 664 CG GLU A 40 -11.618 1.646 -12.063 1.00 61.41 C ATOM 665 CD GLU A 40 -11.909 2.079 -10.639 1.00 55.21 C ATOM 666 OE1 GLU A 40 -11.783 3.286 -10.341 1.00 71.14 O ATOM 667 OE2 GLU A 40 -12.285 1.214 -9.816 1.00 32.43 O ATOM 0 H GLU A 40 -10.384 2.825 -14.936 1.00 40.10 H new ATOM 0 HA GLU A 40 -12.633 0.951 -14.539 1.00 12.03 H new ATOM 0 HB2 GLU A 40 -11.934 3.513 -13.051 1.00 20.45 H new ATOM 0 HB3 GLU A 40 -13.395 2.579 -12.796 1.00 20.45 H new ATOM 0 HG2 GLU A 40 -11.912 0.604 -12.192 1.00 61.41 H new ATOM 0 HG3 GLU A 40 -10.545 1.699 -12.245 1.00 61.41 H new ATOM 674 N THR A 41 -12.530 3.850 -16.028 1.00 32.03 N ATOM 675 CA THR A 41 -13.289 4.775 -16.858 1.00 63.13 C ATOM 676 C THR A 41 -12.645 4.927 -18.233 1.00 63.44 C ATOM 677 O THR A 41 -11.458 5.236 -18.340 1.00 42.43 O ATOM 678 CB THR A 41 -13.388 6.161 -16.182 1.00 53.44 C ATOM 679 OG1 THR A 41 -13.809 6.008 -14.819 1.00 12.33 O ATOM 680 CG2 THR A 41 -14.370 7.068 -16.915 1.00 14.04 C ATOM 0 H THR A 41 -11.535 4.062 -15.955 1.00 32.03 H new ATOM 0 HA THR A 41 -14.291 4.363 -16.979 1.00 63.13 H new ATOM 0 HB THR A 41 -12.401 6.623 -16.218 1.00 53.44 H new ATOM 0 HG1 THR A 41 -13.869 6.889 -14.394 1.00 12.33 H new ATOM 0 HG21 THR A 41 -14.416 8.035 -16.414 1.00 14.04 H new ATOM 0 HG22 THR A 41 -14.038 7.208 -17.944 1.00 14.04 H new ATOM 0 HG23 THR A 41 -15.359 6.611 -16.912 1.00 14.04 H new ATOM 688 N VAL A 42 -13.424 4.695 -19.282 1.00 12.24 N ATOM 689 CA VAL A 42 -12.941 4.889 -20.642 1.00 20.35 C ATOM 690 C VAL A 42 -13.720 6.005 -21.332 1.00 64.01 C ATOM 691 O VAL A 42 -14.953 5.993 -21.375 1.00 12.11 O ATOM 692 CB VAL A 42 -13.021 3.591 -21.484 1.00 21.41 C ATOM 693 CG1 VAL A 42 -12.045 2.554 -20.953 1.00 50.11 C ATOM 694 CG2 VAL A 42 -14.433 3.024 -21.499 1.00 62.11 C ATOM 0 H VAL A 42 -14.390 4.373 -19.217 1.00 12.24 H new ATOM 0 HA VAL A 42 -11.891 5.171 -20.569 1.00 20.35 H new ATOM 0 HB VAL A 42 -12.749 3.843 -22.509 1.00 21.41 H new ATOM 0 HG11 VAL A 42 -12.113 1.648 -21.555 1.00 50.11 H new ATOM 0 HG12 VAL A 42 -11.030 2.949 -21.005 1.00 50.11 H new ATOM 0 HG13 VAL A 42 -12.290 2.320 -19.917 1.00 50.11 H new ATOM 0 HG21 VAL A 42 -14.453 2.114 -22.099 1.00 62.11 H new ATOM 0 HG22 VAL A 42 -14.744 2.794 -20.480 1.00 62.11 H new ATOM 0 HG23 VAL A 42 -15.115 3.757 -21.929 1.00 62.11 H new ATOM 704 N ALA A 43 -12.997 6.978 -21.855 1.00 3.41 N ATOM 705 CA ALA A 43 -13.611 8.115 -22.520 1.00 34.04 C ATOM 706 C ALA A 43 -13.375 8.057 -24.024 1.00 44.10 C ATOM 707 O ALA A 43 -12.711 7.148 -24.527 1.00 74.13 O ATOM 708 CB ALA A 43 -13.086 9.421 -21.942 1.00 3.13 C ATOM 0 H ALA A 43 -11.978 7.004 -21.832 1.00 3.41 H new ATOM 0 HA ALA A 43 -14.686 8.071 -22.345 1.00 34.04 H new ATOM 0 HB1 ALA A 43 -13.558 10.261 -22.453 1.00 3.13 H new ATOM 0 HB2 ALA A 43 -13.318 9.467 -20.878 1.00 3.13 H new ATOM 0 HB3 ALA A 43 -12.006 9.472 -22.081 1.00 3.13 H new ATOM 714 N ASP A 44 -13.916 9.038 -24.731 1.00 5.33 N ATOM 715 CA ASP A 44 -13.905 9.035 -26.187 1.00 33.12 C ATOM 716 C ASP A 44 -13.466 10.404 -26.725 1.00 72.42 C ATOM 717 O ASP A 44 -13.279 11.344 -25.954 1.00 31.21 O ATOM 718 CB ASP A 44 -15.313 8.654 -26.678 1.00 43.31 C ATOM 719 CG ASP A 44 -15.486 8.706 -28.183 1.00 44.42 C ATOM 720 OD1 ASP A 44 -15.214 7.695 -28.858 1.00 4.20 O ATOM 721 OD2 ASP A 44 -15.925 9.759 -28.692 1.00 32.45 O ATOM 0 H ASP A 44 -14.371 9.852 -24.317 1.00 5.33 H new ATOM 0 HA ASP A 44 -13.186 8.305 -26.560 1.00 33.12 H new ATOM 0 HB2 ASP A 44 -15.545 7.647 -26.332 1.00 43.31 H new ATOM 0 HB3 ASP A 44 -16.039 9.324 -26.218 1.00 43.31 H new ATOM 726 N ARG A 45 -13.281 10.509 -28.041 1.00 22.02 N ATOM 727 CA ARG A 45 -12.838 11.752 -28.676 1.00 21.13 C ATOM 728 C ARG A 45 -13.871 12.864 -28.493 1.00 21.42 C ATOM 729 O ARG A 45 -13.543 14.049 -28.560 1.00 55.14 O ATOM 730 CB ARG A 45 -12.570 11.516 -30.167 1.00 53.25 C ATOM 731 CG ARG A 45 -11.809 12.646 -30.847 1.00 10.14 C ATOM 732 CD ARG A 45 -11.619 12.369 -32.329 1.00 51.41 C ATOM 733 NE ARG A 45 -10.788 13.379 -32.989 1.00 64.33 N ATOM 734 CZ ARG A 45 -10.968 13.783 -34.248 1.00 4.41 C ATOM 735 NH1 ARG A 45 -11.996 13.326 -34.958 1.00 13.52 N ATOM 736 NH2 ARG A 45 -10.125 14.652 -34.790 1.00 61.15 N ATOM 0 H ARG A 45 -13.433 9.740 -28.694 1.00 22.02 H new ATOM 0 HA ARG A 45 -11.913 12.069 -28.194 1.00 21.13 H new ATOM 0 HB2 ARG A 45 -12.005 10.591 -30.282 1.00 53.25 H new ATOM 0 HB3 ARG A 45 -13.522 11.374 -30.678 1.00 53.25 H new ATOM 0 HG2 ARG A 45 -12.351 13.583 -30.716 1.00 10.14 H new ATOM 0 HG3 ARG A 45 -10.837 12.771 -30.370 1.00 10.14 H new ATOM 0 HD2 ARG A 45 -11.161 11.388 -32.456 1.00 51.41 H new ATOM 0 HD3 ARG A 45 -12.594 12.331 -32.816 1.00 51.41 H new ATOM 0 HE ARG A 45 -10.027 13.798 -32.455 1.00 64.33 H new ATOM 0 HH11 ARG A 45 -12.650 12.664 -34.540 1.00 13.52 H new ATOM 0 HH12 ARG A 45 -12.130 13.637 -35.920 1.00 13.52 H new ATOM 0 HH21 ARG A 45 -9.341 15.010 -34.245 1.00 61.15 H new ATOM 0 HH22 ARG A 45 -10.261 14.962 -35.752 1.00 61.15 H new ATOM 750 N ASN A 46 -15.113 12.470 -28.243 1.00 13.12 N ATOM 751 CA ASN A 46 -16.193 13.422 -27.995 1.00 3.41 C ATOM 752 C ASN A 46 -15.961 14.186 -26.689 1.00 53.32 C ATOM 753 O ASN A 46 -16.488 15.284 -26.500 1.00 21.25 O ATOM 754 CB ASN A 46 -17.537 12.685 -27.949 1.00 13.33 C ATOM 755 CG ASN A 46 -18.718 13.607 -27.694 1.00 13.54 C ATOM 756 OD1 ASN A 46 -19.274 14.192 -28.623 1.00 4.23 O ATOM 757 ND2 ASN A 46 -19.136 13.715 -26.440 1.00 53.33 N ATOM 0 H ASN A 46 -15.401 11.492 -28.206 1.00 13.12 H new ATOM 0 HA ASN A 46 -16.209 14.145 -28.810 1.00 3.41 H new ATOM 0 HB2 ASN A 46 -17.690 12.162 -28.893 1.00 13.33 H new ATOM 0 HB3 ASN A 46 -17.501 11.926 -27.167 1.00 13.33 H new ATOM 0 HD21 ASN A 46 -19.944 14.298 -26.220 1.00 53.33 H new ATOM 0 HD22 ASN A 46 -18.650 13.215 -25.696 1.00 53.33 H new ATOM 764 N ALA A 47 -15.151 13.601 -25.808 1.00 55.41 N ATOM 765 CA ALA A 47 -14.863 14.184 -24.500 1.00 34.15 C ATOM 766 C ALA A 47 -14.279 15.589 -24.619 1.00 23.42 C ATOM 767 O ALA A 47 -13.239 15.800 -25.252 1.00 31.15 O ATOM 768 CB ALA A 47 -13.906 13.289 -23.723 1.00 73.45 C ATOM 0 H ALA A 47 -14.678 12.714 -25.980 1.00 55.41 H new ATOM 0 HA ALA A 47 -15.808 14.261 -23.962 1.00 34.15 H new ATOM 0 HB1 ALA A 47 -13.700 13.735 -22.750 1.00 73.45 H new ATOM 0 HB2 ALA A 47 -14.358 12.307 -23.583 1.00 73.45 H new ATOM 0 HB3 ALA A 47 -12.974 13.183 -24.279 1.00 73.45 H new ATOM 774 N GLU A 48 -14.962 16.542 -24.013 1.00 23.10 N ATOM 775 CA GLU A 48 -14.504 17.920 -23.971 1.00 14.40 C ATOM 776 C GLU A 48 -13.755 18.171 -22.662 1.00 61.42 C ATOM 777 O GLU A 48 -13.882 17.387 -21.718 1.00 44.14 O ATOM 778 CB GLU A 48 -15.708 18.847 -24.110 1.00 50.12 C ATOM 779 CG GLU A 48 -15.370 20.318 -24.241 1.00 34.43 C ATOM 780 CD GLU A 48 -16.595 21.143 -24.558 1.00 33.11 C ATOM 781 OE1 GLU A 48 -17.336 21.502 -23.623 1.00 54.02 O ATOM 782 OE2 GLU A 48 -16.834 21.416 -25.751 1.00 31.21 O ATOM 0 H GLU A 48 -15.850 16.384 -23.536 1.00 23.10 H new ATOM 0 HA GLU A 48 -13.817 18.118 -24.794 1.00 14.40 H new ATOM 0 HB2 GLU A 48 -16.283 18.542 -24.984 1.00 50.12 H new ATOM 0 HB3 GLU A 48 -16.353 18.713 -23.241 1.00 50.12 H new ATOM 0 HG2 GLU A 48 -14.921 20.673 -23.313 1.00 34.43 H new ATOM 0 HG3 GLU A 48 -14.626 20.453 -25.027 1.00 34.43 H new ATOM 789 N TYR A 49 -12.985 19.260 -22.606 1.00 32.15 N ATOM 790 CA TYR A 49 -12.146 19.558 -21.450 1.00 61.35 C ATOM 791 C TYR A 49 -12.962 19.623 -20.161 1.00 43.15 C ATOM 792 O TYR A 49 -12.600 19.031 -19.148 1.00 2.50 O ATOM 793 CB TYR A 49 -11.421 20.888 -21.658 1.00 12.11 C ATOM 794 CG TYR A 49 -10.624 20.973 -22.944 1.00 41.14 C ATOM 795 CD1 TYR A 49 -9.334 20.462 -23.022 1.00 13.40 C ATOM 796 CD2 TYR A 49 -11.160 21.573 -24.077 1.00 44.41 C ATOM 797 CE1 TYR A 49 -8.602 20.546 -24.193 1.00 32.43 C ATOM 798 CE2 TYR A 49 -10.436 21.658 -25.251 1.00 22.40 C ATOM 799 CZ TYR A 49 -9.158 21.145 -25.304 1.00 52.01 C ATOM 800 OH TYR A 49 -8.435 21.234 -26.473 1.00 60.11 O ATOM 0 H TYR A 49 -12.927 19.952 -23.354 1.00 32.15 H new ATOM 0 HA TYR A 49 -11.421 18.750 -21.354 1.00 61.35 H new ATOM 0 HB2 TYR A 49 -12.155 21.694 -21.646 1.00 12.11 H new ATOM 0 HB3 TYR A 49 -10.749 21.057 -20.817 1.00 12.11 H new ATOM 0 HD1 TYR A 49 -8.896 19.992 -22.154 1.00 13.40 H new ATOM 0 HD2 TYR A 49 -12.160 21.980 -24.039 1.00 44.41 H new ATOM 0 HE1 TYR A 49 -7.600 20.145 -24.237 1.00 32.43 H new ATOM 0 HE2 TYR A 49 -10.870 22.124 -26.123 1.00 22.40 H new ATOM 0 HH TYR A 49 -8.974 21.683 -27.157 1.00 60.11 H new ATOM 810 N ASP A 50 -14.069 20.337 -20.210 1.00 45.41 N ATOM 811 CA ASP A 50 -14.898 20.542 -19.032 1.00 41.34 C ATOM 812 C ASP A 50 -15.702 19.288 -18.703 1.00 31.12 C ATOM 813 O ASP A 50 -16.099 19.074 -17.560 1.00 12.23 O ATOM 814 CB ASP A 50 -15.837 21.725 -19.262 1.00 3.52 C ATOM 815 CG ASP A 50 -15.092 22.985 -19.663 1.00 1.34 C ATOM 816 OD1 ASP A 50 -14.732 23.114 -20.857 1.00 64.12 O ATOM 817 OD2 ASP A 50 -14.869 23.854 -18.796 1.00 42.34 O ATOM 0 H ASP A 50 -14.419 20.788 -21.055 1.00 45.41 H new ATOM 0 HA ASP A 50 -14.247 20.757 -18.185 1.00 41.34 H new ATOM 0 HB2 ASP A 50 -16.557 21.469 -20.040 1.00 3.52 H new ATOM 0 HB3 ASP A 50 -16.406 21.916 -18.352 1.00 3.52 H new ATOM 822 N GLN A 51 -15.917 18.447 -19.707 1.00 2.10 N ATOM 823 CA GLN A 51 -16.746 17.260 -19.540 1.00 14.11 C ATOM 824 C GLN A 51 -16.032 16.191 -18.721 1.00 23.32 C ATOM 825 O GLN A 51 -16.610 15.636 -17.787 1.00 12.14 O ATOM 826 CB GLN A 51 -17.153 16.691 -20.896 1.00 73.34 C ATOM 827 CG GLN A 51 -18.006 17.636 -21.723 1.00 24.44 C ATOM 828 CD GLN A 51 -18.444 17.023 -23.035 1.00 72.41 C ATOM 829 OE1 GLN A 51 -17.758 16.164 -23.592 1.00 54.41 O ATOM 830 NE2 GLN A 51 -19.573 17.475 -23.548 1.00 11.13 N ATOM 0 H GLN A 51 -15.530 18.564 -20.643 1.00 2.10 H new ATOM 0 HA GLN A 51 -17.642 17.562 -18.998 1.00 14.11 H new ATOM 0 HB2 GLN A 51 -16.254 16.440 -21.459 1.00 73.34 H new ATOM 0 HB3 GLN A 51 -17.702 15.762 -20.740 1.00 73.34 H new ATOM 0 HG2 GLN A 51 -18.886 17.923 -21.148 1.00 24.44 H new ATOM 0 HG3 GLN A 51 -17.444 18.548 -21.922 1.00 24.44 H new ATOM 0 HE21 GLN A 51 -20.109 18.187 -23.052 1.00 11.13 H new ATOM 0 HE22 GLN A 51 -19.909 17.112 -24.440 1.00 11.13 H new ATOM 839 N PHE A 52 -14.775 15.905 -19.055 1.00 41.14 N ATOM 840 CA PHE A 52 -14.041 14.875 -18.330 1.00 44.43 C ATOM 841 C PHE A 52 -13.749 15.352 -16.912 1.00 50.34 C ATOM 842 O PHE A 52 -13.737 14.560 -15.971 1.00 64.54 O ATOM 843 CB PHE A 52 -12.743 14.464 -19.060 1.00 63.12 C ATOM 844 CG PHE A 52 -11.611 15.458 -18.988 1.00 13.32 C ATOM 845 CD1 PHE A 52 -10.774 15.501 -17.882 1.00 33.31 C ATOM 846 CD2 PHE A 52 -11.376 16.338 -20.030 1.00 14.44 C ATOM 847 CE1 PHE A 52 -9.733 16.404 -17.816 1.00 32.20 C ATOM 848 CE2 PHE A 52 -10.332 17.242 -19.969 1.00 14.31 C ATOM 849 CZ PHE A 52 -9.512 17.277 -18.862 1.00 31.12 C ATOM 0 H PHE A 52 -14.255 16.361 -19.805 1.00 41.14 H new ATOM 0 HA PHE A 52 -14.666 13.983 -18.283 1.00 44.43 H new ATOM 0 HB2 PHE A 52 -12.398 13.517 -18.644 1.00 63.12 H new ATOM 0 HB3 PHE A 52 -12.979 14.285 -20.109 1.00 63.12 H new ATOM 0 HD1 PHE A 52 -10.940 14.818 -17.062 1.00 33.31 H new ATOM 0 HD2 PHE A 52 -12.015 16.318 -20.900 1.00 14.44 H new ATOM 0 HE1 PHE A 52 -9.092 16.428 -16.947 1.00 32.20 H new ATOM 0 HE2 PHE A 52 -10.159 17.922 -20.790 1.00 14.31 H new ATOM 0 HZ PHE A 52 -8.699 17.986 -18.813 1.00 31.12 H new ATOM 859 N LEU A 53 -13.548 16.660 -16.774 1.00 21.04 N ATOM 860 CA LEU A 53 -13.298 17.275 -15.479 1.00 51.41 C ATOM 861 C LEU A 53 -14.479 17.031 -14.543 1.00 21.13 C ATOM 862 O LEU A 53 -14.309 16.619 -13.395 1.00 64.10 O ATOM 863 CB LEU A 53 -13.070 18.778 -15.658 1.00 42.53 C ATOM 864 CG LEU A 53 -12.670 19.532 -14.391 1.00 32.21 C ATOM 865 CD1 LEU A 53 -11.331 19.031 -13.875 1.00 71.40 C ATOM 866 CD2 LEU A 53 -12.615 21.029 -14.656 1.00 5.05 C ATOM 0 H LEU A 53 -13.554 17.318 -17.554 1.00 21.04 H new ATOM 0 HA LEU A 53 -12.407 16.828 -15.038 1.00 51.41 H new ATOM 0 HB2 LEU A 53 -12.293 18.924 -16.409 1.00 42.53 H new ATOM 0 HB3 LEU A 53 -13.983 19.223 -16.053 1.00 42.53 H new ATOM 0 HG LEU A 53 -13.424 19.347 -13.626 1.00 32.21 H new ATOM 0 HD11 LEU A 53 -11.061 19.579 -12.972 1.00 71.40 H new ATOM 0 HD12 LEU A 53 -11.404 17.968 -13.646 1.00 71.40 H new ATOM 0 HD13 LEU A 53 -10.566 19.187 -14.636 1.00 71.40 H new ATOM 0 HD21 LEU A 53 -12.329 21.550 -13.742 1.00 5.05 H new ATOM 0 HD22 LEU A 53 -11.881 21.234 -15.436 1.00 5.05 H new ATOM 0 HD23 LEU A 53 -13.596 21.377 -14.980 1.00 5.05 H new ATOM 878 N GLU A 54 -15.676 17.264 -15.066 1.00 31.45 N ATOM 879 CA GLU A 54 -16.907 17.114 -14.301 1.00 43.42 C ATOM 880 C GLU A 54 -17.117 15.665 -13.850 1.00 31.24 C ATOM 881 O GLU A 54 -17.465 15.410 -12.696 1.00 23.11 O ATOM 882 CB GLU A 54 -18.096 17.573 -15.153 1.00 44.02 C ATOM 883 CG GLU A 54 -19.439 17.494 -14.444 1.00 74.13 C ATOM 884 CD GLU A 54 -19.546 18.456 -13.277 1.00 51.11 C ATOM 885 OE1 GLU A 54 -19.952 19.617 -13.496 1.00 5.41 O ATOM 886 OE2 GLU A 54 -19.242 18.052 -12.137 1.00 34.11 O ATOM 0 H GLU A 54 -15.821 17.562 -16.031 1.00 31.45 H new ATOM 0 HA GLU A 54 -16.830 17.732 -13.407 1.00 43.42 H new ATOM 0 HB2 GLU A 54 -17.925 18.602 -15.470 1.00 44.02 H new ATOM 0 HB3 GLU A 54 -18.138 16.964 -16.056 1.00 44.02 H new ATOM 0 HG2 GLU A 54 -20.235 17.707 -15.158 1.00 74.13 H new ATOM 0 HG3 GLU A 54 -19.596 16.477 -14.086 1.00 74.13 H new ATOM 893 N ASP A 55 -16.884 14.717 -14.752 1.00 21.51 N ATOM 894 CA ASP A 55 -17.230 13.326 -14.486 1.00 22.33 C ATOM 895 C ASP A 55 -16.280 12.690 -13.475 1.00 50.22 C ATOM 896 O ASP A 55 -16.708 11.905 -12.631 1.00 31.00 O ATOM 897 CB ASP A 55 -17.248 12.511 -15.782 1.00 65.31 C ATOM 898 CG ASP A 55 -17.947 11.174 -15.608 1.00 10.31 C ATOM 899 OD1 ASP A 55 -19.191 11.165 -15.485 1.00 11.23 O ATOM 900 OD2 ASP A 55 -17.266 10.127 -15.584 1.00 53.11 O ATOM 0 H ASP A 55 -16.461 14.884 -15.665 1.00 21.51 H new ATOM 0 HA ASP A 55 -18.231 13.320 -14.054 1.00 22.33 H new ATOM 0 HB2 ASP A 55 -17.750 13.083 -16.562 1.00 65.31 H new ATOM 0 HB3 ASP A 55 -16.225 12.343 -16.118 1.00 65.31 H new ATOM 905 N ILE A 56 -15.001 13.042 -13.541 1.00 34.20 N ATOM 906 CA ILE A 56 -14.005 12.416 -12.674 1.00 0.23 C ATOM 907 C ILE A 56 -14.040 12.974 -11.251 1.00 2.01 C ATOM 908 O ILE A 56 -13.823 12.234 -10.289 1.00 63.20 O ATOM 909 CB ILE A 56 -12.569 12.552 -13.234 1.00 73.02 C ATOM 910 CG1 ILE A 56 -12.171 14.028 -13.376 1.00 4.52 C ATOM 911 CG2 ILE A 56 -12.454 11.828 -14.568 1.00 45.20 C ATOM 912 CD1 ILE A 56 -10.743 14.238 -13.836 1.00 71.34 C ATOM 0 H ILE A 56 -14.631 13.748 -14.177 1.00 34.20 H new ATOM 0 HA ILE A 56 -14.273 11.360 -12.645 1.00 0.23 H new ATOM 0 HB ILE A 56 -11.879 12.089 -12.528 1.00 73.02 H new ATOM 0 HG12 ILE A 56 -12.845 14.509 -14.085 1.00 4.52 H new ATOM 0 HG13 ILE A 56 -12.310 14.525 -12.416 1.00 4.52 H new ATOM 0 HG21 ILE A 56 -11.439 11.931 -14.952 1.00 45.20 H new ATOM 0 HG22 ILE A 56 -12.684 10.772 -14.430 1.00 45.20 H new ATOM 0 HG23 ILE A 56 -13.157 12.262 -15.279 1.00 45.20 H new ATOM 0 HD11 ILE A 56 -10.539 15.306 -13.912 1.00 71.34 H new ATOM 0 HD12 ILE A 56 -10.059 13.788 -13.116 1.00 71.34 H new ATOM 0 HD13 ILE A 56 -10.602 13.771 -14.811 1.00 71.34 H new ATOM 924 N GLN A 57 -14.330 14.265 -11.107 1.00 2.24 N ATOM 925 CA GLN A 57 -14.249 14.910 -9.800 1.00 23.21 C ATOM 926 C GLN A 57 -15.361 14.432 -8.867 1.00 4.45 C ATOM 927 O GLN A 57 -15.186 14.403 -7.652 1.00 40.41 O ATOM 928 CB GLN A 57 -14.250 16.447 -9.939 1.00 55.00 C ATOM 929 CG GLN A 57 -15.528 17.051 -10.512 1.00 12.42 C ATOM 930 CD GLN A 57 -16.627 17.208 -9.476 1.00 61.11 C ATOM 931 OE1 GLN A 57 -16.358 17.387 -8.288 1.00 11.20 O ATOM 932 NE2 GLN A 57 -17.869 17.151 -9.918 1.00 71.14 N ATOM 0 H GLN A 57 -14.620 14.878 -11.869 1.00 2.24 H new ATOM 0 HA GLN A 57 -13.302 14.618 -9.347 1.00 23.21 H new ATOM 0 HB2 GLN A 57 -14.070 16.884 -8.957 1.00 55.00 H new ATOM 0 HB3 GLN A 57 -13.414 16.738 -10.575 1.00 55.00 H new ATOM 0 HG2 GLN A 57 -15.301 18.026 -10.943 1.00 12.42 H new ATOM 0 HG3 GLN A 57 -15.889 16.420 -11.324 1.00 12.42 H new ATOM 0 HE21 GLN A 57 -18.051 17.001 -10.910 1.00 71.14 H new ATOM 0 HE22 GLN A 57 -18.647 17.257 -9.267 1.00 71.14 H new ATOM 941 N LYS A 58 -16.494 14.031 -9.432 1.00 53.22 N ATOM 942 CA LYS A 58 -17.633 13.625 -8.619 1.00 70.53 C ATOM 943 C LYS A 58 -17.496 12.185 -8.126 1.00 22.32 C ATOM 944 O LYS A 58 -18.254 11.749 -7.259 1.00 23.25 O ATOM 945 CB LYS A 58 -18.947 13.814 -9.386 1.00 32.23 C ATOM 946 CG LYS A 58 -18.985 13.136 -10.745 1.00 54.15 C ATOM 947 CD LYS A 58 -20.279 13.462 -11.477 1.00 14.02 C ATOM 948 CE LYS A 58 -20.285 12.922 -12.897 1.00 41.01 C ATOM 949 NZ LYS A 58 -20.212 11.439 -12.935 1.00 63.21 N ATOM 0 H LYS A 58 -16.648 13.979 -10.439 1.00 53.22 H new ATOM 0 HA LYS A 58 -17.650 14.270 -7.741 1.00 70.53 H new ATOM 0 HB2 LYS A 58 -19.766 13.429 -8.779 1.00 32.23 H new ATOM 0 HB3 LYS A 58 -19.124 14.881 -9.521 1.00 32.23 H new ATOM 0 HG2 LYS A 58 -18.133 13.461 -11.342 1.00 54.15 H new ATOM 0 HG3 LYS A 58 -18.895 12.057 -10.620 1.00 54.15 H new ATOM 0 HD2 LYS A 58 -21.121 13.043 -10.927 1.00 14.02 H new ATOM 0 HD3 LYS A 58 -20.419 14.543 -11.500 1.00 14.02 H new ATOM 0 HE2 LYS A 58 -21.191 13.252 -13.405 1.00 41.01 H new ATOM 0 HE3 LYS A 58 -19.441 13.340 -13.446 1.00 41.01 H new ATOM 0 HZ1 LYS A 58 -20.082 11.123 -13.917 1.00 63.21 H new ATOM 0 HZ2 LYS A 58 -19.409 11.116 -12.358 1.00 63.21 H new ATOM 0 HZ3 LYS A 58 -21.094 11.038 -12.556 1.00 63.21 H new ATOM 963 N CYS A 59 -16.522 11.454 -8.661 1.00 10.22 N ATOM 964 CA CYS A 59 -16.292 10.077 -8.235 1.00 33.41 C ATOM 965 C CYS A 59 -15.506 10.035 -6.930 1.00 55.11 C ATOM 966 O CYS A 59 -15.819 9.256 -6.029 1.00 11.42 O ATOM 967 CB CYS A 59 -15.530 9.302 -9.310 1.00 42.42 C ATOM 968 SG CYS A 59 -16.420 9.114 -10.868 1.00 13.31 S ATOM 0 H CYS A 59 -15.885 11.788 -9.384 1.00 10.22 H new ATOM 0 HA CYS A 59 -17.265 9.612 -8.077 1.00 33.41 H new ATOM 0 HB2 CYS A 59 -14.585 9.809 -9.505 1.00 42.42 H new ATOM 0 HB3 CYS A 59 -15.287 8.312 -8.923 1.00 42.42 H new ATOM 0 HG CYS A 59 -16.441 10.252 -11.496 1.00 13.31 H new ATOM 974 N GLY A 60 -14.490 10.881 -6.830 1.00 44.12 N ATOM 975 CA GLY A 60 -13.667 10.912 -5.641 1.00 42.10 C ATOM 976 C GLY A 60 -12.469 11.824 -5.801 1.00 51.34 C ATOM 977 O GLY A 60 -11.447 11.408 -6.354 1.00 11.53 O ATOM 0 H GLY A 60 -14.222 11.548 -7.554 1.00 44.12 H new ATOM 0 HA2 GLY A 60 -14.266 11.247 -4.794 1.00 42.10 H new ATOM 0 HA3 GLY A 60 -13.326 9.903 -5.411 1.00 42.10 H new ATOM 981 N PRO A 61 -12.568 13.081 -5.335 1.00 73.02 N ATOM 982 CA PRO A 61 -11.480 14.055 -5.435 1.00 33.00 C ATOM 983 C PRO A 61 -10.308 13.722 -4.517 1.00 22.45 C ATOM 984 O PRO A 61 -9.186 14.165 -4.748 1.00 12.20 O ATOM 985 CB PRO A 61 -12.122 15.383 -5.002 1.00 70.11 C ATOM 986 CG PRO A 61 -13.592 15.126 -4.946 1.00 32.52 C ATOM 987 CD PRO A 61 -13.749 13.658 -4.680 1.00 65.33 C ATOM 0 HA PRO A 61 -11.064 14.076 -6.442 1.00 33.00 H new ATOM 0 HB2 PRO A 61 -11.744 15.702 -4.031 1.00 70.11 H new ATOM 0 HB3 PRO A 61 -11.891 16.178 -5.711 1.00 70.11 H new ATOM 0 HG2 PRO A 61 -14.061 15.717 -4.159 1.00 32.52 H new ATOM 0 HG3 PRO A 61 -14.072 15.406 -5.884 1.00 32.52 H new ATOM 0 HD2 PRO A 61 -13.766 13.440 -3.612 1.00 65.33 H new ATOM 0 HD3 PRO A 61 -14.676 13.268 -5.100 1.00 65.33 H new ATOM 995 N GLY A 62 -10.569 12.928 -3.484 1.00 61.21 N ATOM 996 CA GLY A 62 -9.539 12.604 -2.517 1.00 41.13 C ATOM 997 C GLY A 62 -8.928 11.239 -2.757 1.00 35.22 C ATOM 998 O GLY A 62 -8.569 10.538 -1.812 1.00 32.41 O ATOM 0 H GLY A 62 -11.478 12.503 -3.300 1.00 61.21 H new ATOM 0 HA2 GLY A 62 -8.756 13.361 -2.557 1.00 41.13 H new ATOM 0 HA3 GLY A 62 -9.964 12.637 -1.514 1.00 41.13 H new ATOM 1002 N GLU A 63 -8.813 10.861 -4.021 1.00 61.13 N ATOM 1003 CA GLU A 63 -8.223 9.581 -4.397 1.00 62.42 C ATOM 1004 C GLU A 63 -7.198 9.787 -5.497 1.00 33.03 C ATOM 1005 O GLU A 63 -6.968 10.912 -5.933 1.00 72.13 O ATOM 1006 CB GLU A 63 -9.285 8.597 -4.889 1.00 3.24 C ATOM 1007 CG GLU A 63 -10.301 8.187 -3.842 1.00 43.24 C ATOM 1008 CD GLU A 63 -11.212 7.086 -4.341 1.00 31.43 C ATOM 1009 OE1 GLU A 63 -12.260 7.398 -4.945 1.00 4.22 O ATOM 1010 OE2 GLU A 63 -10.876 5.898 -4.146 1.00 50.41 O ATOM 0 H GLU A 63 -9.123 11.427 -4.811 1.00 61.13 H new ATOM 0 HA GLU A 63 -7.746 9.165 -3.509 1.00 62.42 H new ATOM 0 HB2 GLU A 63 -9.812 9.044 -5.732 1.00 3.24 H new ATOM 0 HB3 GLU A 63 -8.787 7.702 -5.262 1.00 3.24 H new ATOM 0 HG2 GLU A 63 -9.782 7.850 -2.945 1.00 43.24 H new ATOM 0 HG3 GLU A 63 -10.899 9.053 -3.558 1.00 43.24 H new ATOM 1017 N CYS A 64 -6.590 8.701 -5.949 1.00 75.12 N ATOM 1018 CA CYS A 64 -5.623 8.778 -7.027 1.00 22.43 C ATOM 1019 C CYS A 64 -6.155 8.101 -8.284 1.00 2.25 C ATOM 1020 O CYS A 64 -6.640 6.972 -8.236 1.00 13.01 O ATOM 1021 CB CYS A 64 -4.299 8.137 -6.596 1.00 42.12 C ATOM 1022 SG CYS A 64 -4.461 6.478 -5.897 1.00 62.21 S ATOM 0 H CYS A 64 -6.750 7.761 -5.586 1.00 75.12 H new ATOM 0 HA CYS A 64 -5.448 9.829 -7.256 1.00 22.43 H new ATOM 0 HB2 CYS A 64 -3.635 8.091 -7.459 1.00 42.12 H new ATOM 0 HB3 CYS A 64 -3.820 8.783 -5.860 1.00 42.12 H new ATOM 0 HG CYS A 64 -3.385 5.794 -6.150 1.00 62.21 H new ATOM 1028 N ARG A 65 -6.071 8.807 -9.403 1.00 42.00 N ATOM 1029 CA ARG A 65 -6.409 8.244 -10.701 1.00 74.34 C ATOM 1030 C ARG A 65 -5.663 8.977 -11.805 1.00 13.43 C ATOM 1031 O ARG A 65 -5.687 10.202 -11.888 1.00 4.34 O ATOM 1032 CB ARG A 65 -7.921 8.258 -10.972 1.00 64.30 C ATOM 1033 CG ARG A 65 -8.658 9.496 -10.482 1.00 32.31 C ATOM 1034 CD ARG A 65 -9.364 9.227 -9.160 1.00 5.53 C ATOM 1035 NE ARG A 65 -10.218 8.036 -9.237 1.00 14.04 N ATOM 1036 CZ ARG A 65 -11.175 7.736 -8.357 1.00 62.40 C ATOM 1037 NH1 ARG A 65 -11.436 8.556 -7.346 1.00 42.24 N ATOM 1038 NH2 ARG A 65 -11.878 6.613 -8.493 1.00 21.24 N ATOM 0 H ARG A 65 -5.768 9.781 -9.436 1.00 42.00 H new ATOM 0 HA ARG A 65 -6.098 7.199 -10.689 1.00 74.34 H new ATOM 0 HB2 ARG A 65 -8.082 8.161 -12.046 1.00 64.30 H new ATOM 0 HB3 ARG A 65 -8.366 7.381 -10.502 1.00 64.30 H new ATOM 0 HG2 ARG A 65 -7.953 10.318 -10.360 1.00 32.31 H new ATOM 0 HG3 ARG A 65 -9.387 9.809 -11.230 1.00 32.31 H new ATOM 0 HD2 ARG A 65 -8.623 9.094 -8.372 1.00 5.53 H new ATOM 0 HD3 ARG A 65 -9.968 10.092 -8.887 1.00 5.53 H new ATOM 0 HE ARG A 65 -10.070 7.394 -10.016 1.00 14.04 H new ATOM 0 HH11 ARG A 65 -10.904 9.420 -7.239 1.00 42.24 H new ATOM 0 HH12 ARG A 65 -12.169 8.322 -6.676 1.00 42.24 H new ATOM 0 HH21 ARG A 65 -11.685 5.981 -9.270 1.00 21.24 H new ATOM 0 HH22 ARG A 65 -12.609 6.384 -7.820 1.00 21.24 H new ATOM 1052 N TYR A 66 -5.002 8.211 -12.645 1.00 12.10 N ATOM 1053 CA TYR A 66 -4.164 8.760 -13.696 1.00 2.21 C ATOM 1054 C TYR A 66 -4.820 8.508 -15.040 1.00 62.50 C ATOM 1055 O TYR A 66 -5.471 7.485 -15.227 1.00 42.31 O ATOM 1056 CB TYR A 66 -2.771 8.118 -13.650 1.00 14.10 C ATOM 1057 CG TYR A 66 -2.618 7.091 -12.544 1.00 23.13 C ATOM 1058 CD1 TYR A 66 -2.262 7.477 -11.257 1.00 14.33 C ATOM 1059 CD2 TYR A 66 -2.849 5.742 -12.784 1.00 71.13 C ATOM 1060 CE1 TYR A 66 -2.139 6.547 -10.243 1.00 63.00 C ATOM 1061 CE2 TYR A 66 -2.732 4.807 -11.772 1.00 62.45 C ATOM 1062 CZ TYR A 66 -2.376 5.215 -10.505 1.00 63.41 C ATOM 1063 OH TYR A 66 -2.267 4.292 -9.491 1.00 34.22 O ATOM 0 H TYR A 66 -5.028 7.192 -12.621 1.00 12.10 H new ATOM 0 HA TYR A 66 -4.050 9.834 -13.548 1.00 2.21 H new ATOM 0 HB2 TYR A 66 -2.567 7.642 -14.609 1.00 14.10 H new ATOM 0 HB3 TYR A 66 -2.023 8.899 -13.516 1.00 14.10 H new ATOM 0 HD1 TYR A 66 -2.079 8.520 -11.047 1.00 14.33 H new ATOM 0 HD2 TYR A 66 -3.124 5.419 -13.777 1.00 71.13 H new ATOM 0 HE1 TYR A 66 -1.858 6.863 -9.249 1.00 63.00 H new ATOM 0 HE2 TYR A 66 -2.919 3.763 -11.974 1.00 62.45 H new ATOM 0 HH TYR A 66 -2.466 3.398 -9.840 1.00 34.22 H new ATOM 1073 N GLY A 67 -4.672 9.433 -15.966 1.00 25.35 N ATOM 1074 CA GLY A 67 -5.327 9.284 -17.244 1.00 51.44 C ATOM 1075 C GLY A 67 -4.385 9.446 -18.413 1.00 1.01 C ATOM 1076 O GLY A 67 -3.507 10.312 -18.396 1.00 72.04 O ATOM 0 H GLY A 67 -4.114 10.280 -15.859 1.00 25.35 H new ATOM 0 HA2 GLY A 67 -5.794 8.300 -17.294 1.00 51.44 H new ATOM 0 HA3 GLY A 67 -6.127 10.020 -17.324 1.00 51.44 H new ATOM 1080 N LEU A 68 -4.571 8.613 -19.428 1.00 61.50 N ATOM 1081 CA LEU A 68 -3.838 8.744 -20.677 1.00 32.33 C ATOM 1082 C LEU A 68 -4.734 9.451 -21.678 1.00 60.11 C ATOM 1083 O LEU A 68 -5.776 8.927 -22.080 1.00 31.34 O ATOM 1084 CB LEU A 68 -3.396 7.374 -21.211 1.00 62.25 C ATOM 1085 CG LEU A 68 -2.744 7.386 -22.596 1.00 53.41 C ATOM 1086 CD1 LEU A 68 -1.486 8.237 -22.591 1.00 31.24 C ATOM 1087 CD2 LEU A 68 -2.433 5.968 -23.049 1.00 13.02 C ATOM 0 H LEU A 68 -5.229 7.834 -19.408 1.00 61.50 H new ATOM 0 HA LEU A 68 -2.931 9.325 -20.510 1.00 32.33 H new ATOM 0 HB2 LEU A 68 -2.694 6.936 -20.502 1.00 62.25 H new ATOM 0 HB3 LEU A 68 -4.266 6.718 -21.244 1.00 62.25 H new ATOM 0 HG LEU A 68 -3.447 7.826 -23.303 1.00 53.41 H new ATOM 0 HD11 LEU A 68 -1.039 8.231 -23.585 1.00 31.24 H new ATOM 0 HD12 LEU A 68 -1.740 9.260 -22.313 1.00 31.24 H new ATOM 0 HD13 LEU A 68 -0.775 7.831 -21.871 1.00 31.24 H new ATOM 0 HD21 LEU A 68 -1.970 5.994 -24.035 1.00 13.02 H new ATOM 0 HD22 LEU A 68 -1.750 5.501 -22.340 1.00 13.02 H new ATOM 0 HD23 LEU A 68 -3.356 5.391 -23.097 1.00 13.02 H new ATOM 1099 N PHE A 69 -4.335 10.651 -22.049 1.00 74.44 N ATOM 1100 CA PHE A 69 -5.207 11.554 -22.772 1.00 44.01 C ATOM 1101 C PHE A 69 -4.564 12.025 -24.065 1.00 32.42 C ATOM 1102 O PHE A 69 -3.646 12.836 -24.041 1.00 64.01 O ATOM 1103 CB PHE A 69 -5.496 12.763 -21.884 1.00 72.14 C ATOM 1104 CG PHE A 69 -6.752 13.516 -22.224 1.00 2.34 C ATOM 1105 CD1 PHE A 69 -7.299 13.469 -23.496 1.00 2.51 C ATOM 1106 CD2 PHE A 69 -7.389 14.271 -21.257 1.00 20.50 C ATOM 1107 CE1 PHE A 69 -8.454 14.163 -23.793 1.00 4.33 C ATOM 1108 CE2 PHE A 69 -8.545 14.966 -21.550 1.00 12.50 C ATOM 1109 CZ PHE A 69 -9.078 14.913 -22.820 1.00 31.21 C ATOM 0 H PHE A 69 -3.405 11.025 -21.860 1.00 74.44 H new ATOM 0 HA PHE A 69 -6.128 11.028 -23.024 1.00 44.01 H new ATOM 0 HB2 PHE A 69 -5.561 12.427 -20.849 1.00 72.14 H new ATOM 0 HB3 PHE A 69 -4.651 13.449 -21.944 1.00 72.14 H new ATOM 0 HD1 PHE A 69 -6.816 12.883 -24.264 1.00 2.51 H new ATOM 0 HD2 PHE A 69 -6.977 14.318 -20.260 1.00 20.50 H new ATOM 0 HE1 PHE A 69 -8.869 14.118 -24.789 1.00 4.33 H new ATOM 0 HE2 PHE A 69 -9.032 15.551 -20.784 1.00 12.50 H new ATOM 0 HZ PHE A 69 -9.982 15.457 -23.052 1.00 31.21 H new ATOM 1119 N ASP A 70 -5.043 11.524 -25.184 1.00 52.00 N ATOM 1120 CA ASP A 70 -4.617 12.037 -26.475 1.00 64.02 C ATOM 1121 C ASP A 70 -5.597 13.093 -26.941 1.00 1.53 C ATOM 1122 O ASP A 70 -6.789 12.814 -27.115 1.00 11.23 O ATOM 1123 CB ASP A 70 -4.528 10.929 -27.529 1.00 1.41 C ATOM 1124 CG ASP A 70 -4.131 11.466 -28.899 1.00 21.34 C ATOM 1125 OD1 ASP A 70 -5.021 11.925 -29.654 1.00 34.21 O ATOM 1126 OD2 ASP A 70 -2.929 11.427 -29.232 1.00 53.13 O ATOM 0 H ASP A 70 -5.724 10.766 -25.229 1.00 52.00 H new ATOM 0 HA ASP A 70 -3.622 12.465 -26.354 1.00 64.02 H new ATOM 0 HB2 ASP A 70 -3.801 10.183 -27.209 1.00 1.41 H new ATOM 0 HB3 ASP A 70 -5.491 10.424 -27.604 1.00 1.41 H new ATOM 1131 N PHE A 71 -5.130 14.314 -27.100 1.00 70.50 N ATOM 1132 CA PHE A 71 -5.972 15.335 -27.683 1.00 1.43 C ATOM 1133 C PHE A 71 -5.207 16.205 -28.657 1.00 41.14 C ATOM 1134 O PHE A 71 -3.982 16.338 -28.585 1.00 1.35 O ATOM 1135 CB PHE A 71 -6.711 16.175 -26.631 1.00 32.00 C ATOM 1136 CG PHE A 71 -5.872 17.050 -25.738 1.00 21.12 C ATOM 1137 CD1 PHE A 71 -5.341 18.245 -26.203 1.00 43.42 C ATOM 1138 CD2 PHE A 71 -5.664 16.702 -24.414 1.00 4.55 C ATOM 1139 CE1 PHE A 71 -4.616 19.069 -25.366 1.00 20.10 C ATOM 1140 CE2 PHE A 71 -4.934 17.520 -23.574 1.00 12.14 C ATOM 1141 CZ PHE A 71 -4.411 18.705 -24.051 1.00 3.00 C ATOM 0 H PHE A 71 -4.192 14.619 -26.840 1.00 70.50 H new ATOM 0 HA PHE A 71 -6.741 14.808 -28.247 1.00 1.43 H new ATOM 0 HB2 PHE A 71 -7.429 16.811 -27.149 1.00 32.00 H new ATOM 0 HB3 PHE A 71 -7.284 15.497 -25.998 1.00 32.00 H new ATOM 0 HD1 PHE A 71 -5.497 18.534 -27.232 1.00 43.42 H new ATOM 0 HD2 PHE A 71 -6.078 15.780 -24.034 1.00 4.55 H new ATOM 0 HE1 PHE A 71 -4.210 19.997 -25.740 1.00 20.10 H new ATOM 0 HE2 PHE A 71 -4.773 17.233 -22.545 1.00 12.14 H new ATOM 0 HZ PHE A 71 -3.842 19.347 -23.395 1.00 3.00 H new ATOM 1151 N GLU A 72 -5.960 16.789 -29.567 1.00 13.14 N ATOM 1152 CA GLU A 72 -5.413 17.571 -30.651 1.00 70.54 C ATOM 1153 C GLU A 72 -5.497 19.054 -30.314 1.00 53.24 C ATOM 1154 O GLU A 72 -6.586 19.624 -30.248 1.00 3.12 O ATOM 1155 CB GLU A 72 -6.208 17.249 -31.913 1.00 34.45 C ATOM 1156 CG GLU A 72 -6.313 15.751 -32.167 1.00 5.42 C ATOM 1157 CD GLU A 72 -7.544 15.368 -32.957 1.00 11.45 C ATOM 1158 OE1 GLU A 72 -8.597 15.120 -32.338 1.00 23.14 O ATOM 1159 OE2 GLU A 72 -7.468 15.314 -34.197 1.00 50.03 O ATOM 0 H GLU A 72 -6.978 16.732 -29.573 1.00 13.14 H new ATOM 0 HA GLU A 72 -4.363 17.328 -30.810 1.00 70.54 H new ATOM 0 HB2 GLU A 72 -7.209 17.671 -31.826 1.00 34.45 H new ATOM 0 HB3 GLU A 72 -5.734 17.728 -32.770 1.00 34.45 H new ATOM 0 HG2 GLU A 72 -5.425 15.417 -32.704 1.00 5.42 H new ATOM 0 HG3 GLU A 72 -6.324 15.226 -31.212 1.00 5.42 H new ATOM 1166 N TYR A 73 -4.349 19.664 -30.078 1.00 62.20 N ATOM 1167 CA TYR A 73 -4.290 21.069 -29.705 1.00 34.53 C ATOM 1168 C TYR A 73 -3.631 21.860 -30.828 1.00 12.30 C ATOM 1169 O TYR A 73 -2.565 21.482 -31.311 1.00 54.14 O ATOM 1170 CB TYR A 73 -3.504 21.211 -28.393 1.00 45.21 C ATOM 1171 CG TYR A 73 -3.570 22.580 -27.751 1.00 43.43 C ATOM 1172 CD1 TYR A 73 -4.789 23.198 -27.493 1.00 30.00 C ATOM 1173 CD2 TYR A 73 -2.409 23.245 -27.382 1.00 50.03 C ATOM 1174 CE1 TYR A 73 -4.845 24.442 -26.892 1.00 21.54 C ATOM 1175 CE2 TYR A 73 -2.458 24.486 -26.778 1.00 21.34 C ATOM 1176 CZ TYR A 73 -3.677 25.080 -26.536 1.00 2.43 C ATOM 1177 OH TYR A 73 -3.725 26.316 -25.932 1.00 44.45 O ATOM 0 H TYR A 73 -3.439 19.207 -30.138 1.00 62.20 H new ATOM 0 HA TYR A 73 -5.295 21.463 -29.550 1.00 34.53 H new ATOM 0 HB2 TYR A 73 -3.878 20.475 -27.682 1.00 45.21 H new ATOM 0 HB3 TYR A 73 -2.459 20.967 -28.585 1.00 45.21 H new ATOM 0 HD1 TYR A 73 -5.707 22.698 -27.766 1.00 30.00 H new ATOM 0 HD2 TYR A 73 -1.451 22.784 -27.570 1.00 50.03 H new ATOM 0 HE1 TYR A 73 -5.799 24.911 -26.703 1.00 21.54 H new ATOM 0 HE2 TYR A 73 -1.544 24.989 -26.497 1.00 21.34 H new ATOM 0 HH TYR A 73 -4.304 26.272 -25.143 1.00 44.45 H new ATOM 1187 N MET A 74 -4.269 22.936 -31.262 1.00 1.23 N ATOM 1188 CA MET A 74 -3.740 23.726 -32.367 1.00 31.40 C ATOM 1189 C MET A 74 -3.436 25.146 -31.917 1.00 75.12 C ATOM 1190 O MET A 74 -4.219 25.760 -31.191 1.00 24.22 O ATOM 1191 CB MET A 74 -4.709 23.732 -33.557 1.00 33.23 C ATOM 1192 CG MET A 74 -6.050 24.394 -33.280 1.00 20.01 C ATOM 1193 SD MET A 74 -7.174 24.285 -34.689 1.00 72.11 S ATOM 1194 CE MET A 74 -7.405 22.511 -34.790 1.00 4.34 C ATOM 0 H MET A 74 -5.146 23.281 -30.871 1.00 1.23 H new ATOM 0 HA MET A 74 -2.809 23.262 -32.693 1.00 31.40 H new ATOM 0 HB2 MET A 74 -4.233 24.243 -34.394 1.00 33.23 H new ATOM 0 HB3 MET A 74 -4.885 22.703 -33.870 1.00 33.23 H new ATOM 0 HG2 MET A 74 -6.512 23.923 -32.412 1.00 20.01 H new ATOM 0 HG3 MET A 74 -5.890 25.442 -33.027 1.00 20.01 H new ATOM 0 HE1 MET A 74 -6.837 22.118 -35.633 1.00 4.34 H new ATOM 0 HE2 MET A 74 -7.056 22.046 -33.868 1.00 4.34 H new ATOM 0 HE3 MET A 74 -8.463 22.289 -34.930 1.00 4.34 H new ATOM 1204 N HIS A 75 -2.281 25.651 -32.323 1.00 65.51 N ATOM 1205 CA HIS A 75 -1.876 27.000 -31.962 1.00 53.40 C ATOM 1206 C HIS A 75 -1.298 27.722 -33.173 1.00 41.44 C ATOM 1207 O HIS A 75 -0.537 27.139 -33.947 1.00 62.21 O ATOM 1208 CB HIS A 75 -0.839 26.956 -30.836 1.00 64.42 C ATOM 1209 CG HIS A 75 -1.020 28.031 -29.812 1.00 72.01 C ATOM 1210 ND1 HIS A 75 -0.128 29.063 -29.624 1.00 53.33 N ATOM 1211 CD2 HIS A 75 -1.998 28.210 -28.896 1.00 15.12 C ATOM 1212 CE1 HIS A 75 -0.552 29.829 -28.636 1.00 64.13 C ATOM 1213 NE2 HIS A 75 -1.685 29.333 -28.174 1.00 22.15 N ATOM 0 H HIS A 75 -1.609 25.147 -32.902 1.00 65.51 H new ATOM 0 HA HIS A 75 -2.754 27.545 -31.615 1.00 53.40 H new ATOM 0 HB2 HIS A 75 -0.891 25.985 -30.344 1.00 64.42 H new ATOM 0 HB3 HIS A 75 0.158 27.042 -31.268 1.00 64.42 H new ATOM 0 HD2 HIS A 75 -2.867 27.583 -28.758 1.00 15.12 H new ATOM 0 HE1 HIS A 75 -0.055 30.714 -28.267 1.00 64.13 H new ATOM 0 HE2 HIS A 75 -2.236 29.721 -27.408 1.00 22.15 H new ATOM 1222 N GLN A 76 -1.664 28.983 -33.343 1.00 4.31 N ATOM 1223 CA GLN A 76 -1.116 29.791 -34.420 1.00 73.32 C ATOM 1224 C GLN A 76 0.274 30.271 -34.027 1.00 35.13 C ATOM 1225 O GLN A 76 0.429 31.043 -33.082 1.00 31.45 O ATOM 1226 CB GLN A 76 -2.026 30.989 -34.731 1.00 32.40 C ATOM 1227 CG GLN A 76 -3.364 30.619 -35.367 1.00 31.44 C ATOM 1228 CD GLN A 76 -4.305 29.884 -34.427 1.00 64.41 C ATOM 1229 OE1 GLN A 76 -4.303 28.656 -34.360 1.00 4.53 O ATOM 1230 NE2 GLN A 76 -5.109 30.632 -33.692 1.00 72.40 N ATOM 0 H GLN A 76 -2.337 29.468 -32.750 1.00 4.31 H new ATOM 0 HA GLN A 76 -1.052 29.181 -35.321 1.00 73.32 H new ATOM 0 HB2 GLN A 76 -2.216 31.535 -33.807 1.00 32.40 H new ATOM 0 HB3 GLN A 76 -1.496 31.668 -35.399 1.00 32.40 H new ATOM 0 HG2 GLN A 76 -3.853 31.528 -35.719 1.00 31.44 H new ATOM 0 HG3 GLN A 76 -3.180 29.997 -36.243 1.00 31.44 H new ATOM 0 HE21 GLN A 76 -5.080 31.648 -33.777 1.00 72.40 H new ATOM 0 HE22 GLN A 76 -5.759 30.193 -33.039 1.00 72.40 H new ATOM 1239 N CYS A 77 1.277 29.806 -34.751 1.00 51.32 N ATOM 1240 CA CYS A 77 2.662 30.064 -34.387 1.00 4.11 C ATOM 1241 C CYS A 77 3.243 31.205 -35.213 1.00 13.41 C ATOM 1242 O CYS A 77 3.042 31.259 -36.424 1.00 43.35 O ATOM 1243 CB CYS A 77 3.493 28.798 -34.597 1.00 31.51 C ATOM 1244 SG CYS A 77 2.772 27.316 -33.855 1.00 43.32 S ATOM 0 H CYS A 77 1.159 29.247 -35.596 1.00 51.32 H new ATOM 0 HA CYS A 77 2.692 30.354 -33.337 1.00 4.11 H new ATOM 0 HB2 CYS A 77 3.620 28.632 -35.667 1.00 31.51 H new ATOM 0 HB3 CYS A 77 4.487 28.955 -34.179 1.00 31.51 H new ATOM 0 HG CYS A 77 1.477 27.368 -33.953 1.00 43.32 H new ATOM 1250 N GLN A 78 3.941 32.124 -34.539 1.00 33.23 N ATOM 1251 CA GLN A 78 4.642 33.237 -35.197 1.00 42.33 C ATOM 1252 C GLN A 78 3.679 34.174 -35.927 1.00 12.22 C ATOM 1253 O GLN A 78 4.101 35.007 -36.735 1.00 64.31 O ATOM 1254 CB GLN A 78 5.684 32.700 -36.182 1.00 40.21 C ATOM 1255 CG GLN A 78 6.781 31.880 -35.523 1.00 52.04 C ATOM 1256 CD GLN A 78 7.672 31.179 -36.530 1.00 55.22 C ATOM 1257 OE1 GLN A 78 7.869 31.659 -37.647 1.00 52.04 O ATOM 1258 NE2 GLN A 78 8.220 30.040 -36.139 1.00 12.24 N ATOM 0 H GLN A 78 4.038 32.120 -33.524 1.00 33.23 H new ATOM 0 HA GLN A 78 5.137 33.812 -34.414 1.00 42.33 H new ATOM 0 HB2 GLN A 78 5.182 32.085 -36.929 1.00 40.21 H new ATOM 0 HB3 GLN A 78 6.137 33.538 -36.711 1.00 40.21 H new ATOM 0 HG2 GLN A 78 7.390 32.532 -34.897 1.00 52.04 H new ATOM 0 HG3 GLN A 78 6.329 31.138 -34.865 1.00 52.04 H new ATOM 0 HE21 GLN A 78 8.031 29.677 -35.205 1.00 12.24 H new ATOM 0 HE22 GLN A 78 8.832 29.525 -36.772 1.00 12.24 H new ATOM 1267 N GLY A 79 2.395 34.047 -35.632 1.00 44.32 N ATOM 1268 CA GLY A 79 1.396 34.843 -36.316 1.00 51.32 C ATOM 1269 C GLY A 79 0.824 34.117 -37.515 1.00 24.21 C ATOM 1270 O GLY A 79 -0.167 34.549 -38.100 1.00 35.24 O ATOM 0 H GLY A 79 2.025 33.406 -34.930 1.00 44.32 H new ATOM 0 HA2 GLY A 79 0.592 35.091 -35.623 1.00 51.32 H new ATOM 0 HA3 GLY A 79 1.840 35.785 -36.639 1.00 51.32 H new ATOM 1274 N THR A 80 1.454 33.012 -37.884 1.00 34.32 N ATOM 1275 CA THR A 80 0.991 32.200 -38.991 1.00 10.20 C ATOM 1276 C THR A 80 -0.288 31.465 -38.600 1.00 21.00 C ATOM 1277 O THR A 80 -0.282 30.618 -37.701 1.00 52.23 O ATOM 1278 CB THR A 80 2.071 31.183 -39.410 1.00 21.14 C ATOM 1279 OG1 THR A 80 3.320 31.857 -39.614 1.00 62.32 O ATOM 1280 CG2 THR A 80 1.674 30.450 -40.685 1.00 20.32 C ATOM 0 H THR A 80 2.294 32.658 -37.426 1.00 34.32 H new ATOM 0 HA THR A 80 0.785 32.856 -39.837 1.00 10.20 H new ATOM 0 HB THR A 80 2.173 30.450 -38.610 1.00 21.14 H new ATOM 0 HG1 THR A 80 4.003 31.206 -39.878 1.00 62.32 H new ATOM 0 HG21 THR A 80 2.456 29.740 -40.955 1.00 20.32 H new ATOM 0 HG22 THR A 80 0.739 29.915 -40.521 1.00 20.32 H new ATOM 0 HG23 THR A 80 1.543 31.170 -41.493 1.00 20.32 H new ATOM 1288 N SER A 81 -1.382 31.787 -39.280 1.00 1.43 N ATOM 1289 CA SER A 81 -2.685 31.213 -38.964 1.00 70.15 C ATOM 1290 C SER A 81 -2.828 29.802 -39.529 1.00 1.31 C ATOM 1291 O SER A 81 -3.939 29.328 -39.773 1.00 70.43 O ATOM 1292 CB SER A 81 -3.796 32.123 -39.486 1.00 22.41 C ATOM 1293 OG SER A 81 -3.740 33.388 -38.848 1.00 40.42 O ATOM 0 H SER A 81 -1.392 32.446 -40.058 1.00 1.43 H new ATOM 0 HA SER A 81 -2.770 31.137 -37.880 1.00 70.15 H new ATOM 0 HB2 SER A 81 -3.696 32.248 -40.564 1.00 22.41 H new ATOM 0 HB3 SER A 81 -4.767 31.661 -39.307 1.00 22.41 H new ATOM 0 HG SER A 81 -4.456 33.961 -39.194 1.00 40.42 H new ATOM 1299 N GLU A 82 -1.693 29.127 -39.698 1.00 40.41 N ATOM 1300 CA GLU A 82 -1.671 27.724 -40.087 1.00 21.14 C ATOM 1301 C GLU A 82 -2.468 26.924 -39.065 1.00 55.33 C ATOM 1302 O GLU A 82 -3.132 25.946 -39.401 1.00 43.32 O ATOM 1303 CB GLU A 82 -0.214 27.234 -40.154 1.00 1.31 C ATOM 1304 CG GLU A 82 0.008 25.943 -40.940 1.00 24.41 C ATOM 1305 CD GLU A 82 -0.399 24.688 -40.192 1.00 14.14 C ATOM 1306 OE1 GLU A 82 0.295 24.314 -39.219 1.00 53.42 O ATOM 1307 OE2 GLU A 82 -1.402 24.057 -40.587 1.00 5.21 O ATOM 0 H GLU A 82 -0.768 29.537 -39.569 1.00 40.41 H new ATOM 0 HA GLU A 82 -2.120 27.592 -41.071 1.00 21.14 H new ATOM 0 HB2 GLU A 82 0.396 28.020 -40.600 1.00 1.31 H new ATOM 0 HB3 GLU A 82 0.149 27.087 -39.137 1.00 1.31 H new ATOM 0 HG2 GLU A 82 -0.554 25.996 -41.872 1.00 24.41 H new ATOM 0 HG3 GLU A 82 1.062 25.869 -41.207 1.00 24.41 H new ATOM 1314 N SER A 83 -2.429 27.401 -37.819 1.00 45.54 N ATOM 1315 CA SER A 83 -3.116 26.754 -36.712 1.00 14.35 C ATOM 1316 C SER A 83 -2.579 25.343 -36.539 1.00 35.43 C ATOM 1317 O SER A 83 -3.318 24.367 -36.661 1.00 43.41 O ATOM 1318 CB SER A 83 -4.628 26.728 -36.954 1.00 54.21 C ATOM 1319 OG SER A 83 -5.090 27.983 -37.434 1.00 31.24 O ATOM 0 H SER A 83 -1.920 28.245 -37.555 1.00 45.54 H new ATOM 0 HA SER A 83 -2.933 27.321 -35.800 1.00 14.35 H new ATOM 0 HB2 SER A 83 -4.871 25.947 -37.675 1.00 54.21 H new ATOM 0 HB3 SER A 83 -5.144 26.477 -36.027 1.00 54.21 H new ATOM 0 HG SER A 83 -4.681 28.171 -38.304 1.00 31.24 H new ATOM 1325 N SER A 84 -1.281 25.260 -36.273 1.00 22.34 N ATOM 1326 CA SER A 84 -0.591 23.988 -36.177 1.00 73.33 C ATOM 1327 C SER A 84 -1.255 23.081 -35.156 1.00 61.24 C ATOM 1328 O SER A 84 -1.135 23.280 -33.944 1.00 40.13 O ATOM 1329 CB SER A 84 0.878 24.219 -35.837 1.00 12.34 C ATOM 1330 OG SER A 84 1.495 25.010 -36.839 1.00 21.13 O ATOM 0 H SER A 84 -0.683 26.072 -36.119 1.00 22.34 H new ATOM 0 HA SER A 84 -0.649 23.486 -37.143 1.00 73.33 H new ATOM 0 HB2 SER A 84 0.961 24.715 -34.870 1.00 12.34 H new ATOM 0 HB3 SER A 84 1.393 23.262 -35.750 1.00 12.34 H new ATOM 0 HG SER A 84 1.019 24.893 -37.687 1.00 21.13 H new ATOM 1336 N LYS A 85 -1.984 22.111 -35.673 1.00 21.33 N ATOM 1337 CA LYS A 85 -2.693 21.155 -34.860 1.00 62.13 C ATOM 1338 C LYS A 85 -1.767 20.006 -34.513 1.00 4.11 C ATOM 1339 O LYS A 85 -1.318 19.264 -35.387 1.00 14.13 O ATOM 1340 CB LYS A 85 -3.947 20.685 -35.614 1.00 41.21 C ATOM 1341 CG LYS A 85 -4.678 19.503 -34.995 1.00 53.03 C ATOM 1342 CD LYS A 85 -4.177 18.191 -35.576 1.00 3.52 C ATOM 1343 CE LYS A 85 -5.078 17.027 -35.213 1.00 43.13 C ATOM 1344 NZ LYS A 85 -6.460 17.198 -35.740 1.00 72.03 N ATOM 0 H LYS A 85 -2.099 21.967 -36.676 1.00 21.33 H new ATOM 0 HA LYS A 85 -3.018 21.609 -33.924 1.00 62.13 H new ATOM 0 HB2 LYS A 85 -4.641 21.522 -35.686 1.00 41.21 H new ATOM 0 HB3 LYS A 85 -3.660 20.420 -36.632 1.00 41.21 H new ATOM 0 HG2 LYS A 85 -4.533 19.506 -33.915 1.00 53.03 H new ATOM 0 HG3 LYS A 85 -5.749 19.599 -35.173 1.00 53.03 H new ATOM 0 HD2 LYS A 85 -4.114 18.276 -36.661 1.00 3.52 H new ATOM 0 HD3 LYS A 85 -3.168 17.995 -35.212 1.00 3.52 H new ATOM 0 HE2 LYS A 85 -4.653 16.104 -35.607 1.00 43.13 H new ATOM 0 HE3 LYS A 85 -5.115 16.923 -34.129 1.00 43.13 H new ATOM 0 HZ1 LYS A 85 -6.996 16.317 -35.602 1.00 72.03 H new ATOM 0 HZ2 LYS A 85 -6.932 17.974 -35.232 1.00 72.03 H new ATOM 0 HZ3 LYS A 85 -6.419 17.423 -36.755 1.00 72.03 H new ATOM 1358 N LYS A 86 -1.457 19.887 -33.240 1.00 2.23 N ATOM 1359 CA LYS A 86 -0.550 18.864 -32.774 1.00 20.32 C ATOM 1360 C LYS A 86 -1.288 17.919 -31.833 1.00 22.32 C ATOM 1361 O LYS A 86 -1.787 18.335 -30.784 1.00 31.05 O ATOM 1362 CB LYS A 86 0.644 19.516 -32.068 1.00 24.42 C ATOM 1363 CG LYS A 86 1.866 18.618 -31.954 1.00 60.24 C ATOM 1364 CD LYS A 86 2.497 18.343 -33.311 1.00 41.15 C ATOM 1365 CE LYS A 86 2.980 19.625 -33.973 1.00 55.41 C ATOM 1366 NZ LYS A 86 3.716 19.352 -35.234 1.00 23.12 N ATOM 0 H LYS A 86 -1.824 20.492 -32.505 1.00 2.23 H new ATOM 0 HA LYS A 86 -0.177 18.288 -33.621 1.00 20.32 H new ATOM 0 HB2 LYS A 86 0.921 20.421 -32.608 1.00 24.42 H new ATOM 0 HB3 LYS A 86 0.338 19.823 -31.068 1.00 24.42 H new ATOM 0 HG2 LYS A 86 2.601 19.087 -31.300 1.00 60.24 H new ATOM 0 HG3 LYS A 86 1.581 17.675 -31.488 1.00 60.24 H new ATOM 0 HD2 LYS A 86 3.335 17.656 -33.191 1.00 41.15 H new ATOM 0 HD3 LYS A 86 1.771 17.850 -33.957 1.00 41.15 H new ATOM 0 HE2 LYS A 86 2.126 20.270 -34.183 1.00 55.41 H new ATOM 0 HE3 LYS A 86 3.628 20.168 -33.284 1.00 55.41 H new ATOM 0 HZ1 LYS A 86 4.029 20.250 -35.655 1.00 23.12 H new ATOM 0 HZ2 LYS A 86 4.545 18.758 -35.030 1.00 23.12 H new ATOM 0 HZ3 LYS A 86 3.090 18.857 -35.901 1.00 23.12 H new ATOM 1380 N GLN A 87 -1.393 16.660 -32.228 1.00 63.04 N ATOM 1381 CA GLN A 87 -2.060 15.654 -31.413 1.00 1.25 C ATOM 1382 C GLN A 87 -1.035 14.855 -30.611 1.00 20.12 C ATOM 1383 O GLN A 87 -0.085 14.302 -31.169 1.00 25.41 O ATOM 1384 CB GLN A 87 -2.909 14.737 -32.303 1.00 44.14 C ATOM 1385 CG GLN A 87 -2.122 14.015 -33.387 1.00 51.30 C ATOM 1386 CD GLN A 87 -3.004 13.551 -34.528 1.00 65.42 C ATOM 1387 OE1 GLN A 87 -3.566 12.458 -34.497 1.00 24.33 O ATOM 1388 NE2 GLN A 87 -3.120 14.379 -35.553 1.00 63.41 N ATOM 0 H GLN A 87 -1.024 16.308 -33.111 1.00 63.04 H new ATOM 0 HA GLN A 87 -2.724 16.150 -30.705 1.00 1.25 H new ATOM 0 HB2 GLN A 87 -3.404 13.996 -31.675 1.00 44.14 H new ATOM 0 HB3 GLN A 87 -3.693 15.331 -32.773 1.00 44.14 H new ATOM 0 HG2 GLN A 87 -1.350 14.679 -33.775 1.00 51.30 H new ATOM 0 HG3 GLN A 87 -1.613 13.155 -32.951 1.00 51.30 H new ATOM 0 HE21 GLN A 87 -2.637 15.277 -35.540 1.00 63.41 H new ATOM 0 HE22 GLN A 87 -3.692 14.119 -36.356 1.00 63.41 H new ATOM 1397 N LYS A 88 -1.203 14.836 -29.295 1.00 72.20 N ATOM 1398 CA LYS A 88 -0.256 14.160 -28.416 1.00 20.15 C ATOM 1399 C LYS A 88 -0.989 13.424 -27.311 1.00 41.32 C ATOM 1400 O LYS A 88 -2.080 13.826 -26.909 1.00 44.43 O ATOM 1401 CB LYS A 88 0.727 15.148 -27.763 1.00 2.33 C ATOM 1402 CG LYS A 88 1.519 16.008 -28.735 1.00 11.41 C ATOM 1403 CD LYS A 88 0.737 17.238 -29.170 1.00 73.22 C ATOM 1404 CE LYS A 88 0.570 18.238 -28.039 1.00 15.34 C ATOM 1405 NZ LYS A 88 1.873 18.618 -27.444 1.00 51.21 N ATOM 0 H LYS A 88 -1.985 15.280 -28.813 1.00 72.20 H new ATOM 0 HA LYS A 88 0.302 13.460 -29.037 1.00 20.15 H new ATOM 0 HB2 LYS A 88 0.169 15.803 -27.094 1.00 2.33 H new ATOM 0 HB3 LYS A 88 1.428 14.585 -27.146 1.00 2.33 H new ATOM 0 HG2 LYS A 88 2.453 16.318 -28.267 1.00 11.41 H new ATOM 0 HG3 LYS A 88 1.783 15.416 -29.612 1.00 11.41 H new ATOM 0 HD2 LYS A 88 1.250 17.717 -30.004 1.00 73.22 H new ATOM 0 HD3 LYS A 88 -0.245 16.933 -29.532 1.00 73.22 H new ATOM 0 HE2 LYS A 88 0.067 19.130 -28.413 1.00 15.34 H new ATOM 0 HE3 LYS A 88 -0.071 17.811 -27.268 1.00 15.34 H new ATOM 0 HZ1 LYS A 88 1.764 19.501 -26.905 1.00 51.21 H new ATOM 0 HZ2 LYS A 88 2.198 17.862 -26.809 1.00 51.21 H new ATOM 0 HZ3 LYS A 88 2.572 18.759 -28.201 1.00 51.21 H new ATOM 1419 N LEU A 89 -0.380 12.357 -26.819 1.00 34.41 N ATOM 1420 CA LEU A 89 -0.895 11.660 -25.657 1.00 51.35 C ATOM 1421 C LEU A 89 -0.253 12.237 -24.405 1.00 20.55 C ATOM 1422 O LEU A 89 0.977 12.272 -24.281 1.00 62.15 O ATOM 1423 CB LEU A 89 -0.615 10.155 -25.715 1.00 62.51 C ATOM 1424 CG LEU A 89 -1.154 9.399 -26.937 1.00 32.44 C ATOM 1425 CD1 LEU A 89 -0.306 9.670 -28.173 1.00 32.52 C ATOM 1426 CD2 LEU A 89 -1.197 7.907 -26.650 1.00 2.10 C ATOM 0 H LEU A 89 0.473 11.956 -27.209 1.00 34.41 H new ATOM 0 HA LEU A 89 -1.976 11.798 -25.639 1.00 51.35 H new ATOM 0 HB2 LEU A 89 0.464 10.008 -25.673 1.00 62.51 H new ATOM 0 HB3 LEU A 89 -1.034 9.696 -24.819 1.00 62.51 H new ATOM 0 HG LEU A 89 -2.164 9.756 -27.136 1.00 32.44 H new ATOM 0 HD11 LEU A 89 -0.713 9.120 -29.021 1.00 32.52 H new ATOM 0 HD12 LEU A 89 -0.315 10.737 -28.394 1.00 32.52 H new ATOM 0 HD13 LEU A 89 0.719 9.346 -27.989 1.00 32.52 H new ATOM 0 HD21 LEU A 89 -1.581 7.379 -27.523 1.00 2.10 H new ATOM 0 HD22 LEU A 89 -0.192 7.551 -26.424 1.00 2.10 H new ATOM 0 HD23 LEU A 89 -1.849 7.719 -25.797 1.00 2.10 H new ATOM 1438 N PHE A 90 -1.082 12.704 -23.499 1.00 31.04 N ATOM 1439 CA PHE A 90 -0.624 13.283 -22.252 1.00 4.44 C ATOM 1440 C PHE A 90 -0.959 12.345 -21.104 1.00 61.14 C ATOM 1441 O PHE A 90 -1.904 11.564 -21.192 1.00 4.54 O ATOM 1442 CB PHE A 90 -1.299 14.635 -22.032 1.00 51.24 C ATOM 1443 CG PHE A 90 -1.214 15.528 -23.232 1.00 3.32 C ATOM 1444 CD1 PHE A 90 -0.076 16.273 -23.477 1.00 60.33 C ATOM 1445 CD2 PHE A 90 -2.268 15.612 -24.121 1.00 54.32 C ATOM 1446 CE1 PHE A 90 0.007 17.087 -24.587 1.00 53.35 C ATOM 1447 CE2 PHE A 90 -2.191 16.426 -25.232 1.00 71.24 C ATOM 1448 CZ PHE A 90 -1.053 17.163 -25.465 1.00 43.44 C ATOM 0 H PHE A 90 -2.096 12.694 -23.605 1.00 31.04 H new ATOM 0 HA PHE A 90 0.455 13.428 -22.295 1.00 4.44 H new ATOM 0 HB2 PHE A 90 -2.347 14.476 -21.777 1.00 51.24 H new ATOM 0 HB3 PHE A 90 -0.836 15.133 -21.180 1.00 51.24 H new ATOM 0 HD1 PHE A 90 0.757 16.217 -22.792 1.00 60.33 H new ATOM 0 HD2 PHE A 90 -3.163 15.034 -23.944 1.00 54.32 H new ATOM 0 HE1 PHE A 90 0.902 17.664 -24.768 1.00 53.35 H new ATOM 0 HE2 PHE A 90 -3.023 16.485 -25.918 1.00 71.24 H new ATOM 0 HZ PHE A 90 -0.990 17.800 -26.335 1.00 43.44 H new ATOM 1458 N LEU A 91 -0.182 12.411 -20.044 1.00 70.41 N ATOM 1459 CA LEU A 91 -0.442 11.622 -18.856 1.00 42.34 C ATOM 1460 C LEU A 91 -0.511 12.535 -17.650 1.00 14.33 C ATOM 1461 O LEU A 91 0.462 13.207 -17.312 1.00 21.21 O ATOM 1462 CB LEU A 91 0.652 10.569 -18.655 1.00 10.41 C ATOM 1463 CG LEU A 91 0.521 9.711 -17.392 1.00 33.42 C ATOM 1464 CD1 LEU A 91 -0.754 8.886 -17.434 1.00 54.44 C ATOM 1465 CD2 LEU A 91 1.736 8.809 -17.235 1.00 34.22 C ATOM 0 H LEU A 91 0.642 13.008 -19.980 1.00 70.41 H new ATOM 0 HA LEU A 91 -1.394 11.106 -18.977 1.00 42.34 H new ATOM 0 HB2 LEU A 91 0.659 9.909 -19.522 1.00 10.41 H new ATOM 0 HB3 LEU A 91 1.618 11.074 -18.631 1.00 10.41 H new ATOM 0 HG LEU A 91 0.469 10.375 -16.529 1.00 33.42 H new ATOM 0 HD11 LEU A 91 -0.828 8.284 -16.528 1.00 54.44 H new ATOM 0 HD12 LEU A 91 -1.615 9.551 -17.499 1.00 54.44 H new ATOM 0 HD13 LEU A 91 -0.735 8.231 -18.305 1.00 54.44 H new ATOM 0 HD21 LEU A 91 1.628 8.206 -16.333 1.00 34.22 H new ATOM 0 HD22 LEU A 91 1.817 8.154 -18.102 1.00 34.22 H new ATOM 0 HD23 LEU A 91 2.635 9.420 -17.157 1.00 34.22 H new ATOM 1477 N MET A 92 -1.660 12.573 -17.011 1.00 5.42 N ATOM 1478 CA MET A 92 -1.820 13.384 -15.824 1.00 72.14 C ATOM 1479 C MET A 92 -2.298 12.522 -14.669 1.00 12.21 C ATOM 1480 O MET A 92 -3.244 11.744 -14.807 1.00 1.31 O ATOM 1481 CB MET A 92 -2.774 14.559 -16.072 1.00 33.00 C ATOM 1482 CG MET A 92 -4.182 14.153 -16.471 1.00 53.40 C ATOM 1483 SD MET A 92 -5.252 15.574 -16.757 1.00 25.43 S ATOM 1484 CE MET A 92 -6.791 14.748 -17.146 1.00 74.02 C ATOM 0 H MET A 92 -2.493 12.055 -17.291 1.00 5.42 H new ATOM 0 HA MET A 92 -0.851 13.809 -15.564 1.00 72.14 H new ATOM 0 HB2 MET A 92 -2.827 15.165 -15.168 1.00 33.00 H new ATOM 0 HB3 MET A 92 -2.356 15.191 -16.855 1.00 33.00 H new ATOM 0 HG2 MET A 92 -4.140 13.546 -17.375 1.00 53.40 H new ATOM 0 HG3 MET A 92 -4.613 13.529 -15.688 1.00 53.40 H new ATOM 0 HE1 MET A 92 -7.148 15.083 -18.120 1.00 74.02 H new ATOM 0 HE2 MET A 92 -6.630 13.670 -17.170 1.00 74.02 H new ATOM 0 HE3 MET A 92 -7.534 14.987 -16.385 1.00 74.02 H new ATOM 1494 N SER A 93 -1.612 12.633 -13.547 1.00 42.53 N ATOM 1495 CA SER A 93 -1.931 11.831 -12.385 1.00 43.30 C ATOM 1496 C SER A 93 -2.783 12.625 -11.400 1.00 53.33 C ATOM 1497 O SER A 93 -2.256 13.352 -10.563 1.00 62.54 O ATOM 1498 CB SER A 93 -0.642 11.352 -11.720 1.00 1.41 C ATOM 1499 OG SER A 93 -0.915 10.434 -10.686 1.00 73.24 O ATOM 0 H SER A 93 -0.829 13.273 -13.417 1.00 42.53 H new ATOM 0 HA SER A 93 -2.508 10.963 -12.703 1.00 43.30 H new ATOM 0 HB2 SER A 93 0.003 10.885 -12.464 1.00 1.41 H new ATOM 0 HB3 SER A 93 -0.098 12.206 -11.318 1.00 1.41 H new ATOM 0 HG SER A 93 -0.194 10.464 -10.023 1.00 73.24 H new ATOM 1505 N TRP A 94 -4.097 12.481 -11.497 1.00 45.44 N ATOM 1506 CA TRP A 94 -5.006 13.259 -10.667 1.00 62.40 C ATOM 1507 C TRP A 94 -5.129 12.627 -9.285 1.00 33.41 C ATOM 1508 O TRP A 94 -5.762 11.580 -9.122 1.00 2.44 O ATOM 1509 CB TRP A 94 -6.381 13.364 -11.333 1.00 23.03 C ATOM 1510 CG TRP A 94 -7.220 14.477 -10.785 1.00 64.33 C ATOM 1511 CD1 TRP A 94 -6.940 15.812 -10.844 1.00 5.41 C ATOM 1512 CD2 TRP A 94 -8.480 14.360 -10.108 1.00 14.43 C ATOM 1513 NE1 TRP A 94 -7.942 16.532 -10.242 1.00 21.14 N ATOM 1514 CE2 TRP A 94 -8.900 15.664 -9.783 1.00 22.21 C ATOM 1515 CE3 TRP A 94 -9.290 13.282 -9.746 1.00 31.55 C ATOM 1516 CZ2 TRP A 94 -10.094 15.917 -9.113 1.00 24.24 C ATOM 1517 CZ3 TRP A 94 -10.475 13.534 -9.082 1.00 71.32 C ATOM 1518 CH2 TRP A 94 -10.868 14.842 -8.772 1.00 71.01 C ATOM 0 H TRP A 94 -4.556 11.835 -12.139 1.00 45.44 H new ATOM 0 HA TRP A 94 -4.601 14.265 -10.555 1.00 62.40 H new ATOM 0 HB2 TRP A 94 -6.248 13.512 -12.405 1.00 23.03 H new ATOM 0 HB3 TRP A 94 -6.912 12.421 -11.205 1.00 23.03 H new ATOM 0 HD1 TRP A 94 -6.058 16.240 -11.298 1.00 5.41 H new ATOM 0 HE1 TRP A 94 -7.970 17.548 -10.151 1.00 21.14 H new ATOM 0 HE3 TRP A 94 -8.996 12.270 -9.981 1.00 31.55 H new ATOM 0 HZ2 TRP A 94 -10.398 16.925 -8.871 1.00 24.24 H new ATOM 0 HZ3 TRP A 94 -11.109 12.708 -8.797 1.00 71.32 H new ATOM 0 HH2 TRP A 94 -11.801 15.005 -8.253 1.00 71.01 H new ATOM 1529 N CYS A 95 -4.501 13.258 -8.303 1.00 40.41 N ATOM 1530 CA CYS A 95 -4.457 12.731 -6.949 1.00 45.45 C ATOM 1531 C CYS A 95 -3.809 13.725 -5.995 1.00 41.22 C ATOM 1532 O CYS A 95 -2.714 14.226 -6.262 1.00 3.12 O ATOM 1533 CB CYS A 95 -3.666 11.426 -6.929 1.00 71.50 C ATOM 1534 SG CYS A 95 -2.067 11.528 -7.770 1.00 15.23 S ATOM 0 H CYS A 95 -4.011 14.144 -8.422 1.00 40.41 H new ATOM 0 HA CYS A 95 -5.481 12.551 -6.622 1.00 45.45 H new ATOM 0 HB2 CYS A 95 -3.503 11.127 -5.894 1.00 71.50 H new ATOM 0 HB3 CYS A 95 -4.263 10.643 -7.397 1.00 71.50 H new ATOM 0 HG CYS A 95 -1.383 10.448 -7.534 1.00 15.23 H new ATOM 1540 N PRO A 96 -4.480 14.041 -4.880 1.00 12.25 N ATOM 1541 CA PRO A 96 -3.900 14.869 -3.825 1.00 64.55 C ATOM 1542 C PRO A 96 -2.704 14.184 -3.181 1.00 13.25 C ATOM 1543 O PRO A 96 -2.850 13.244 -2.394 1.00 72.01 O ATOM 1544 CB PRO A 96 -5.044 15.043 -2.820 1.00 21.13 C ATOM 1545 CG PRO A 96 -6.273 14.708 -3.587 1.00 30.04 C ATOM 1546 CD PRO A 96 -5.860 13.652 -4.571 1.00 3.25 C ATOM 0 HA PRO A 96 -3.524 15.820 -4.201 1.00 64.55 H new ATOM 0 HB2 PRO A 96 -4.921 14.383 -1.961 1.00 21.13 H new ATOM 0 HB3 PRO A 96 -5.082 16.062 -2.436 1.00 21.13 H new ATOM 0 HG2 PRO A 96 -7.059 14.342 -2.927 1.00 30.04 H new ATOM 0 HG3 PRO A 96 -6.668 15.586 -4.097 1.00 30.04 H new ATOM 0 HD2 PRO A 96 -5.915 12.652 -4.142 1.00 3.25 H new ATOM 0 HD3 PRO A 96 -6.492 13.653 -5.459 1.00 3.25 H new ATOM 1554 N ASP A 97 -1.523 14.662 -3.532 1.00 72.32 N ATOM 1555 CA ASP A 97 -0.271 14.045 -3.115 1.00 1.23 C ATOM 1556 C ASP A 97 -0.074 14.158 -1.604 1.00 32.43 C ATOM 1557 O ASP A 97 0.621 13.350 -0.992 1.00 52.40 O ATOM 1558 CB ASP A 97 0.888 14.717 -3.856 1.00 64.11 C ATOM 1559 CG ASP A 97 2.191 13.962 -3.727 1.00 61.10 C ATOM 1560 OD1 ASP A 97 2.437 13.056 -4.552 1.00 52.02 O ATOM 1561 OD2 ASP A 97 2.986 14.283 -2.822 1.00 25.31 O ATOM 0 H ASP A 97 -1.402 15.490 -4.115 1.00 72.32 H new ATOM 0 HA ASP A 97 -0.301 12.984 -3.363 1.00 1.23 H new ATOM 0 HB2 ASP A 97 0.632 14.810 -4.911 1.00 64.11 H new ATOM 0 HB3 ASP A 97 1.021 15.728 -3.470 1.00 64.11 H new ATOM 1566 N THR A 98 -0.718 15.149 -1.006 1.00 53.22 N ATOM 1567 CA THR A 98 -0.561 15.414 0.415 1.00 4.31 C ATOM 1568 C THR A 98 -1.755 14.905 1.224 1.00 52.23 C ATOM 1569 O THR A 98 -1.931 15.288 2.380 1.00 54.24 O ATOM 1570 CB THR A 98 -0.385 16.925 0.671 1.00 32.30 C ATOM 1571 OG1 THR A 98 -1.496 17.649 0.120 1.00 33.12 O ATOM 1572 CG2 THR A 98 0.910 17.434 0.053 1.00 34.51 C ATOM 0 H THR A 98 -1.356 15.784 -1.485 1.00 53.22 H new ATOM 0 HA THR A 98 0.331 14.879 0.740 1.00 4.31 H new ATOM 0 HB THR A 98 -0.343 17.084 1.749 1.00 32.30 H new ATOM 0 HG1 THR A 98 -1.378 18.607 0.288 1.00 33.12 H new ATOM 0 HG21 THR A 98 1.011 18.502 0.247 1.00 34.51 H new ATOM 0 HG22 THR A 98 1.755 16.904 0.492 1.00 34.51 H new ATOM 0 HG23 THR A 98 0.892 17.261 -1.023 1.00 34.51 H new ATOM 1580 N ALA A 99 -2.567 14.035 0.631 1.00 35.30 N ATOM 1581 CA ALA A 99 -3.798 13.602 1.286 1.00 4.31 C ATOM 1582 C ALA A 99 -3.584 12.330 2.102 1.00 10.52 C ATOM 1583 O ALA A 99 -2.901 12.349 3.127 1.00 35.32 O ATOM 1584 CB ALA A 99 -4.915 13.410 0.270 1.00 54.41 C ATOM 0 H ALA A 99 -2.400 13.621 -0.286 1.00 35.30 H new ATOM 0 HA ALA A 99 -4.095 14.391 1.978 1.00 4.31 H new ATOM 0 HB1 ALA A 99 -5.821 13.087 0.782 1.00 54.41 H new ATOM 0 HB2 ALA A 99 -5.105 14.352 -0.245 1.00 54.41 H new ATOM 0 HB3 ALA A 99 -4.620 12.653 -0.456 1.00 54.41 H new ATOM 1590 N LYS A 100 -4.162 11.226 1.643 1.00 64.40 N ATOM 1591 CA LYS A 100 -4.047 9.953 2.340 1.00 10.31 C ATOM 1592 C LYS A 100 -2.671 9.349 2.103 1.00 62.23 C ATOM 1593 O LYS A 100 -2.340 8.959 0.985 1.00 61.52 O ATOM 1594 CB LYS A 100 -5.150 8.991 1.881 1.00 24.41 C ATOM 1595 CG LYS A 100 -5.057 7.594 2.485 1.00 3.24 C ATOM 1596 CD LYS A 100 -5.205 7.602 3.999 1.00 11.14 C ATOM 1597 CE LYS A 100 -6.568 8.115 4.434 1.00 40.34 C ATOM 1598 NZ LYS A 100 -6.773 7.955 5.896 1.00 52.21 N ATOM 0 H LYS A 100 -4.717 11.188 0.788 1.00 64.40 H new ATOM 0 HA LYS A 100 -4.169 10.125 3.409 1.00 10.31 H new ATOM 0 HB2 LYS A 100 -6.119 9.420 2.136 1.00 24.41 H new ATOM 0 HB3 LYS A 100 -5.114 8.907 0.795 1.00 24.41 H new ATOM 0 HG2 LYS A 100 -5.832 6.962 2.051 1.00 3.24 H new ATOM 0 HG3 LYS A 100 -4.098 7.150 2.219 1.00 3.24 H new ATOM 0 HD2 LYS A 100 -5.058 6.593 4.383 1.00 11.14 H new ATOM 0 HD3 LYS A 100 -4.426 8.226 4.436 1.00 11.14 H new ATOM 0 HE2 LYS A 100 -6.664 9.167 4.166 1.00 40.34 H new ATOM 0 HE3 LYS A 100 -7.348 7.577 3.896 1.00 40.34 H new ATOM 0 HZ1 LYS A 100 -7.713 8.316 6.156 1.00 52.21 H new ATOM 0 HZ2 LYS A 100 -6.707 6.948 6.148 1.00 52.21 H new ATOM 0 HZ3 LYS A 100 -6.043 8.489 6.409 1.00 52.21 H new ATOM 1612 N VAL A 101 -1.884 9.267 3.166 1.00 24.42 N ATOM 1613 CA VAL A 101 -0.499 8.820 3.074 1.00 53.32 C ATOM 1614 C VAL A 101 -0.389 7.378 2.582 1.00 3.41 C ATOM 1615 O VAL A 101 0.590 7.019 1.936 1.00 44.12 O ATOM 1616 CB VAL A 101 0.239 8.966 4.423 1.00 52.45 C ATOM 1617 CG1 VAL A 101 0.324 10.430 4.822 1.00 22.22 C ATOM 1618 CG2 VAL A 101 -0.441 8.153 5.517 1.00 62.23 C ATOM 0 H VAL A 101 -2.183 9.506 4.111 1.00 24.42 H new ATOM 0 HA VAL A 101 -0.021 9.469 2.340 1.00 53.32 H new ATOM 0 HB VAL A 101 1.249 8.576 4.298 1.00 52.45 H new ATOM 0 HG11 VAL A 101 0.847 10.518 5.775 1.00 22.22 H new ATOM 0 HG12 VAL A 101 0.868 10.985 4.057 1.00 22.22 H new ATOM 0 HG13 VAL A 101 -0.681 10.839 4.921 1.00 22.22 H new ATOM 0 HG21 VAL A 101 0.103 8.277 6.454 1.00 62.23 H new ATOM 0 HG22 VAL A 101 -1.467 8.500 5.644 1.00 62.23 H new ATOM 0 HG23 VAL A 101 -0.446 7.099 5.237 1.00 62.23 H new ATOM 1628 N LYS A 102 -1.390 6.555 2.875 1.00 42.23 N ATOM 1629 CA LYS A 102 -1.386 5.172 2.406 1.00 34.25 C ATOM 1630 C LYS A 102 -1.763 5.096 0.933 1.00 74.02 C ATOM 1631 O LYS A 102 -1.155 4.345 0.172 1.00 55.22 O ATOM 1632 CB LYS A 102 -2.315 4.292 3.243 1.00 33.32 C ATOM 1633 CG LYS A 102 -1.592 3.543 4.353 1.00 55.24 C ATOM 1634 CD LYS A 102 -1.033 4.484 5.404 1.00 54.22 C ATOM 1635 CE LYS A 102 -0.007 3.793 6.287 1.00 33.44 C ATOM 1636 NZ LYS A 102 -0.539 2.552 6.907 1.00 12.52 N ATOM 0 H LYS A 102 -2.206 6.816 3.428 1.00 42.23 H new ATOM 0 HA LYS A 102 -0.371 4.792 2.523 1.00 34.25 H new ATOM 0 HB2 LYS A 102 -3.096 4.913 3.682 1.00 33.32 H new ATOM 0 HB3 LYS A 102 -2.809 3.573 2.590 1.00 33.32 H new ATOM 0 HG2 LYS A 102 -2.280 2.841 4.824 1.00 55.24 H new ATOM 0 HG3 LYS A 102 -0.780 2.955 3.924 1.00 55.24 H new ATOM 0 HD2 LYS A 102 -0.573 5.343 4.916 1.00 54.22 H new ATOM 0 HD3 LYS A 102 -1.847 4.865 6.021 1.00 54.22 H new ATOM 0 HE2 LYS A 102 0.875 3.551 5.694 1.00 33.44 H new ATOM 0 HE3 LYS A 102 0.315 4.479 7.071 1.00 33.44 H new ATOM 0 HZ1 LYS A 102 0.145 2.191 7.602 1.00 12.52 H new ATOM 0 HZ2 LYS A 102 -1.440 2.760 7.383 1.00 12.52 H new ATOM 0 HZ3 LYS A 102 -0.695 1.835 6.170 1.00 12.52 H new ATOM 1650 N LYS A 103 -2.747 5.892 0.527 1.00 74.31 N ATOM 1651 CA LYS A 103 -3.140 5.962 -0.876 1.00 3.11 C ATOM 1652 C LYS A 103 -1.993 6.549 -1.695 1.00 0.24 C ATOM 1653 O LYS A 103 -1.738 6.129 -2.819 1.00 12.11 O ATOM 1654 CB LYS A 103 -4.405 6.815 -1.041 1.00 71.53 C ATOM 1655 CG LYS A 103 -5.018 6.759 -2.435 1.00 21.24 C ATOM 1656 CD LYS A 103 -6.328 5.976 -2.456 1.00 3.31 C ATOM 1657 CE LYS A 103 -6.138 4.523 -2.042 1.00 32.14 C ATOM 1658 NZ LYS A 103 -7.414 3.754 -2.088 1.00 3.41 N ATOM 0 H LYS A 103 -3.286 6.496 1.148 1.00 74.31 H new ATOM 0 HA LYS A 103 -3.361 4.957 -1.234 1.00 3.11 H new ATOM 0 HB2 LYS A 103 -5.149 6.486 -0.316 1.00 71.53 H new ATOM 0 HB3 LYS A 103 -4.165 7.851 -0.803 1.00 71.53 H new ATOM 0 HG2 LYS A 103 -5.197 7.773 -2.793 1.00 21.24 H new ATOM 0 HG3 LYS A 103 -4.310 6.298 -3.124 1.00 21.24 H new ATOM 0 HD2 LYS A 103 -7.044 6.452 -1.786 1.00 3.31 H new ATOM 0 HD3 LYS A 103 -6.755 6.013 -3.458 1.00 3.31 H new ATOM 0 HE2 LYS A 103 -5.408 4.052 -2.700 1.00 32.14 H new ATOM 0 HE3 LYS A 103 -5.729 4.485 -1.032 1.00 32.14 H new ATOM 0 HZ1 LYS A 103 -7.271 2.819 -1.656 1.00 3.41 H new ATOM 0 HZ2 LYS A 103 -8.149 4.269 -1.563 1.00 3.41 H new ATOM 0 HZ3 LYS A 103 -7.713 3.637 -3.077 1.00 3.41 H new ATOM 1672 N LYS A 104 -1.304 7.518 -1.102 1.00 22.01 N ATOM 1673 CA LYS A 104 -0.113 8.117 -1.689 1.00 25.51 C ATOM 1674 C LYS A 104 1.043 7.112 -1.720 1.00 31.03 C ATOM 1675 O LYS A 104 1.841 7.099 -2.658 1.00 25.41 O ATOM 1676 CB LYS A 104 0.250 9.373 -0.874 1.00 0.14 C ATOM 1677 CG LYS A 104 1.700 9.819 -0.972 1.00 62.33 C ATOM 1678 CD LYS A 104 2.090 10.242 -2.375 1.00 72.02 C ATOM 1679 CE LYS A 104 3.558 10.623 -2.423 1.00 41.01 C ATOM 1680 NZ LYS A 104 3.969 11.105 -3.766 1.00 23.41 N ATOM 0 H LYS A 104 -1.558 7.911 -0.196 1.00 22.01 H new ATOM 0 HA LYS A 104 -0.309 8.403 -2.723 1.00 25.51 H new ATOM 0 HB2 LYS A 104 -0.388 10.194 -1.201 1.00 0.14 H new ATOM 0 HB3 LYS A 104 0.016 9.185 0.174 1.00 0.14 H new ATOM 0 HG2 LYS A 104 1.867 10.650 -0.287 1.00 62.33 H new ATOM 0 HG3 LYS A 104 2.349 9.005 -0.649 1.00 62.33 H new ATOM 0 HD2 LYS A 104 1.896 9.429 -3.074 1.00 72.02 H new ATOM 0 HD3 LYS A 104 1.478 11.087 -2.691 1.00 72.02 H new ATOM 0 HE2 LYS A 104 3.754 11.400 -1.684 1.00 41.01 H new ATOM 0 HE3 LYS A 104 4.165 9.760 -2.147 1.00 41.01 H new ATOM 0 HZ1 LYS A 104 4.896 11.572 -3.699 1.00 23.41 H new ATOM 0 HZ2 LYS A 104 4.034 10.299 -4.419 1.00 23.41 H new ATOM 0 HZ3 LYS A 104 3.265 11.783 -4.122 1.00 23.41 H new ATOM 1694 N MET A 105 1.114 6.264 -0.702 1.00 21.43 N ATOM 1695 CA MET A 105 2.159 5.246 -0.608 1.00 65.20 C ATOM 1696 C MET A 105 2.068 4.270 -1.779 1.00 62.50 C ATOM 1697 O MET A 105 3.027 4.105 -2.534 1.00 14.14 O ATOM 1698 CB MET A 105 2.042 4.505 0.731 1.00 30.30 C ATOM 1699 CG MET A 105 3.177 3.534 1.029 1.00 14.30 C ATOM 1700 SD MET A 105 2.987 1.949 0.195 1.00 32.11 S ATOM 1701 CE MET A 105 4.376 1.047 0.874 1.00 14.12 C ATOM 0 H MET A 105 0.456 6.260 0.077 1.00 21.43 H new ATOM 0 HA MET A 105 3.133 5.733 -0.655 1.00 65.20 H new ATOM 0 HB2 MET A 105 1.993 5.241 1.534 1.00 30.30 H new ATOM 0 HB3 MET A 105 1.101 3.956 0.744 1.00 30.30 H new ATOM 0 HG2 MET A 105 4.122 3.986 0.728 1.00 14.30 H new ATOM 0 HG3 MET A 105 3.232 3.368 2.105 1.00 14.30 H new ATOM 0 HE1 MET A 105 4.253 -0.017 0.672 1.00 14.12 H new ATOM 0 HE2 MET A 105 5.299 1.399 0.413 1.00 14.12 H new ATOM 0 HE3 MET A 105 4.424 1.209 1.951 1.00 14.12 H new ATOM 1711 N LEU A 106 0.906 3.644 -1.939 1.00 11.22 N ATOM 1712 CA LEU A 106 0.694 2.687 -3.021 1.00 13.44 C ATOM 1713 C LEU A 106 0.760 3.377 -4.381 1.00 60.55 C ATOM 1714 O LEU A 106 1.235 2.802 -5.362 1.00 20.30 O ATOM 1715 CB LEU A 106 -0.642 1.952 -2.831 1.00 14.44 C ATOM 1716 CG LEU A 106 -1.872 2.836 -2.595 1.00 73.44 C ATOM 1717 CD1 LEU A 106 -2.544 3.202 -3.909 1.00 35.12 C ATOM 1718 CD2 LEU A 106 -2.854 2.145 -1.662 1.00 64.25 C ATOM 0 H LEU A 106 0.097 3.782 -1.334 1.00 11.22 H new ATOM 0 HA LEU A 106 1.494 1.948 -2.990 1.00 13.44 H new ATOM 0 HB2 LEU A 106 -0.825 1.339 -3.714 1.00 14.44 H new ATOM 0 HB3 LEU A 106 -0.542 1.271 -1.986 1.00 14.44 H new ATOM 0 HG LEU A 106 -1.538 3.760 -2.122 1.00 73.44 H new ATOM 0 HD11 LEU A 106 -3.413 3.829 -3.711 1.00 35.12 H new ATOM 0 HD12 LEU A 106 -1.840 3.746 -4.539 1.00 35.12 H new ATOM 0 HD13 LEU A 106 -2.861 2.293 -4.421 1.00 35.12 H new ATOM 0 HD21 LEU A 106 -3.721 2.787 -1.506 1.00 64.25 H new ATOM 0 HD22 LEU A 106 -3.176 1.203 -2.105 1.00 64.25 H new ATOM 0 HD23 LEU A 106 -2.370 1.949 -0.705 1.00 64.25 H new ATOM 1730 N TYR A 107 0.302 4.621 -4.417 1.00 34.31 N ATOM 1731 CA TYR A 107 0.354 5.437 -5.622 1.00 50.32 C ATOM 1732 C TYR A 107 1.796 5.685 -6.053 1.00 63.41 C ATOM 1733 O TYR A 107 2.105 5.711 -7.244 1.00 41.41 O ATOM 1734 CB TYR A 107 -0.357 6.768 -5.371 1.00 14.24 C ATOM 1735 CG TYR A 107 0.065 7.870 -6.307 1.00 43.21 C ATOM 1736 CD1 TYR A 107 -0.267 7.829 -7.651 1.00 62.13 C ATOM 1737 CD2 TYR A 107 0.815 8.943 -5.845 1.00 24.21 C ATOM 1738 CE1 TYR A 107 0.131 8.829 -8.508 1.00 63.11 C ATOM 1739 CE2 TYR A 107 1.218 9.947 -6.699 1.00 13.25 C ATOM 1740 CZ TYR A 107 0.872 9.885 -8.030 1.00 3.54 C ATOM 1741 OH TYR A 107 1.269 10.884 -8.889 1.00 74.12 O ATOM 0 H TYR A 107 -0.115 5.092 -3.614 1.00 34.31 H new ATOM 0 HA TYR A 107 -0.151 4.901 -6.426 1.00 50.32 H new ATOM 0 HB2 TYR A 107 -1.433 6.618 -5.464 1.00 14.24 H new ATOM 0 HB3 TYR A 107 -0.167 7.083 -4.345 1.00 14.24 H new ATOM 0 HD1 TYR A 107 -0.846 7.001 -8.031 1.00 62.13 H new ATOM 0 HD2 TYR A 107 1.087 8.992 -4.801 1.00 24.21 H new ATOM 0 HE1 TYR A 107 -0.138 8.785 -9.553 1.00 63.11 H new ATOM 0 HE2 TYR A 107 1.801 10.776 -6.327 1.00 13.25 H new ATOM 0 HH TYR A 107 1.769 10.494 -9.636 1.00 74.12 H new ATOM 1751 N SER A 108 2.674 5.849 -5.074 1.00 34.04 N ATOM 1752 CA SER A 108 4.077 6.130 -5.339 1.00 10.22 C ATOM 1753 C SER A 108 4.714 4.971 -6.106 1.00 23.20 C ATOM 1754 O SER A 108 5.715 5.142 -6.806 1.00 22.00 O ATOM 1755 CB SER A 108 4.820 6.378 -4.019 1.00 35.42 C ATOM 1756 OG SER A 108 6.080 6.994 -4.235 1.00 11.02 O ATOM 0 H SER A 108 2.437 5.792 -4.084 1.00 34.04 H new ATOM 0 HA SER A 108 4.149 7.028 -5.953 1.00 10.22 H new ATOM 0 HB2 SER A 108 4.212 7.010 -3.372 1.00 35.42 H new ATOM 0 HB3 SER A 108 4.962 5.431 -3.498 1.00 35.42 H new ATOM 0 HG SER A 108 6.525 7.139 -3.374 1.00 11.02 H new ATOM 1762 N SER A 109 4.110 3.797 -5.986 1.00 24.34 N ATOM 1763 CA SER A 109 4.596 2.614 -6.671 1.00 14.42 C ATOM 1764 C SER A 109 4.044 2.541 -8.097 1.00 44.02 C ATOM 1765 O SER A 109 4.779 2.252 -9.042 1.00 51.14 O ATOM 1766 CB SER A 109 4.197 1.364 -5.887 1.00 31.25 C ATOM 1767 OG SER A 109 4.618 1.458 -4.536 1.00 53.15 O ATOM 0 H SER A 109 3.278 3.641 -5.417 1.00 24.34 H new ATOM 0 HA SER A 109 5.683 2.671 -6.732 1.00 14.42 H new ATOM 0 HB2 SER A 109 3.115 1.235 -5.927 1.00 31.25 H new ATOM 0 HB3 SER A 109 4.641 0.483 -6.350 1.00 31.25 H new ATOM 0 HG SER A 109 4.217 0.730 -4.017 1.00 53.15 H new ATOM 1773 N SER A 110 2.751 2.814 -8.247 1.00 75.12 N ATOM 1774 CA SER A 110 2.082 2.658 -9.531 1.00 12.40 C ATOM 1775 C SER A 110 2.342 3.823 -10.490 1.00 31.43 C ATOM 1776 O SER A 110 2.192 3.659 -11.699 1.00 13.11 O ATOM 1777 CB SER A 110 0.583 2.482 -9.305 1.00 71.43 C ATOM 1778 OG SER A 110 0.080 3.483 -8.437 1.00 2.35 O ATOM 0 H SER A 110 2.147 3.144 -7.494 1.00 75.12 H new ATOM 0 HA SER A 110 2.498 1.770 -10.007 1.00 12.40 H new ATOM 0 HB2 SER A 110 0.060 2.527 -10.260 1.00 71.43 H new ATOM 0 HB3 SER A 110 0.389 1.497 -8.881 1.00 71.43 H new ATOM 0 HG SER A 110 -0.837 3.710 -8.696 1.00 2.35 H new ATOM 1784 N PHE A 111 2.744 4.979 -9.958 1.00 25.44 N ATOM 1785 CA PHE A 111 2.955 6.184 -10.776 1.00 11.00 C ATOM 1786 C PHE A 111 3.882 5.916 -11.968 1.00 52.03 C ATOM 1787 O PHE A 111 3.561 6.261 -13.103 1.00 11.43 O ATOM 1788 CB PHE A 111 3.519 7.327 -9.918 1.00 12.10 C ATOM 1789 CG PHE A 111 3.849 8.570 -10.703 1.00 12.12 C ATOM 1790 CD1 PHE A 111 2.849 9.443 -11.109 1.00 32.25 C ATOM 1791 CD2 PHE A 111 5.163 8.862 -11.043 1.00 11.25 C ATOM 1792 CE1 PHE A 111 3.153 10.578 -11.835 1.00 71.42 C ATOM 1793 CE2 PHE A 111 5.471 9.995 -11.772 1.00 52.54 C ATOM 1794 CZ PHE A 111 4.464 10.853 -12.169 1.00 3.54 C ATOM 0 H PHE A 111 2.931 5.110 -8.964 1.00 25.44 H new ATOM 0 HA PHE A 111 1.983 6.477 -11.172 1.00 11.00 H new ATOM 0 HB2 PHE A 111 2.795 7.579 -9.144 1.00 12.10 H new ATOM 0 HB3 PHE A 111 4.419 6.979 -9.411 1.00 12.10 H new ATOM 0 HD1 PHE A 111 1.821 9.232 -10.854 1.00 32.25 H new ATOM 0 HD2 PHE A 111 5.954 8.195 -10.734 1.00 11.25 H new ATOM 0 HE1 PHE A 111 2.365 11.250 -12.141 1.00 71.42 H new ATOM 0 HE2 PHE A 111 6.497 10.209 -12.031 1.00 52.54 H new ATOM 0 HZ PHE A 111 4.702 11.738 -12.740 1.00 3.54 H new ATOM 1804 N ASP A 112 5.038 5.319 -11.715 1.00 2.24 N ATOM 1805 CA ASP A 112 5.962 4.991 -12.797 1.00 44.35 C ATOM 1806 C ASP A 112 5.577 3.663 -13.438 1.00 71.11 C ATOM 1807 O ASP A 112 5.958 3.367 -14.572 1.00 40.14 O ATOM 1808 CB ASP A 112 7.406 4.936 -12.293 1.00 62.33 C ATOM 1809 CG ASP A 112 8.413 4.802 -13.425 1.00 62.30 C ATOM 1810 OD1 ASP A 112 8.737 5.828 -14.065 1.00 1.11 O ATOM 1811 OD2 ASP A 112 8.876 3.671 -13.687 1.00 3.24 O ATOM 0 H ASP A 112 5.358 5.054 -10.783 1.00 2.24 H new ATOM 0 HA ASP A 112 5.895 5.779 -13.547 1.00 44.35 H new ATOM 0 HB2 ASP A 112 7.623 5.839 -11.723 1.00 62.33 H new ATOM 0 HB3 ASP A 112 7.517 4.094 -11.610 1.00 62.33 H new ATOM 1816 N ALA A 113 4.796 2.879 -12.709 1.00 43.33 N ATOM 1817 CA ALA A 113 4.417 1.544 -13.144 1.00 3.45 C ATOM 1818 C ALA A 113 3.531 1.576 -14.386 1.00 12.52 C ATOM 1819 O ALA A 113 3.686 0.741 -15.272 1.00 11.31 O ATOM 1820 CB ALA A 113 3.721 0.795 -12.021 1.00 70.44 C ATOM 0 H ALA A 113 4.409 3.149 -11.804 1.00 43.33 H new ATOM 0 HA ALA A 113 5.335 1.019 -13.409 1.00 3.45 H new ATOM 0 HB1 ALA A 113 3.445 -0.202 -12.365 1.00 70.44 H new ATOM 0 HB2 ALA A 113 4.394 0.711 -11.168 1.00 70.44 H new ATOM 0 HB3 ALA A 113 2.824 1.338 -11.723 1.00 70.44 H new ATOM 1826 N LEU A 114 2.598 2.525 -14.469 1.00 15.51 N ATOM 1827 CA LEU A 114 1.755 2.606 -15.659 1.00 12.04 C ATOM 1828 C LEU A 114 2.533 3.238 -16.806 1.00 22.14 C ATOM 1829 O LEU A 114 2.215 3.019 -17.972 1.00 0.34 O ATOM 1830 CB LEU A 114 0.432 3.354 -15.419 1.00 2.54 C ATOM 1831 CG LEU A 114 0.516 4.874 -15.265 1.00 1.31 C ATOM 1832 CD1 LEU A 114 -0.795 5.510 -15.689 1.00 1.10 C ATOM 1833 CD2 LEU A 114 0.820 5.251 -13.831 1.00 61.14 C ATOM 0 H LEU A 114 2.411 3.226 -13.752 1.00 15.51 H new ATOM 0 HA LEU A 114 1.480 1.585 -15.922 1.00 12.04 H new ATOM 0 HB2 LEU A 114 -0.238 3.133 -16.250 1.00 2.54 H new ATOM 0 HB3 LEU A 114 -0.030 2.947 -14.520 1.00 2.54 H new ATOM 0 HG LEU A 114 1.322 5.239 -15.902 1.00 1.31 H new ATOM 0 HD11 LEU A 114 -0.728 6.592 -15.577 1.00 1.10 H new ATOM 0 HD12 LEU A 114 -0.998 5.265 -16.732 1.00 1.10 H new ATOM 0 HD13 LEU A 114 -1.603 5.130 -15.064 1.00 1.10 H new ATOM 0 HD21 LEU A 114 0.875 6.336 -13.744 1.00 61.14 H new ATOM 0 HD22 LEU A 114 0.030 4.875 -13.181 1.00 61.14 H new ATOM 0 HD23 LEU A 114 1.774 4.814 -13.534 1.00 61.14 H new ATOM 1845 N LYS A 115 3.578 3.991 -16.466 1.00 12.41 N ATOM 1846 CA LYS A 115 4.492 4.548 -17.464 1.00 43.10 C ATOM 1847 C LYS A 115 5.211 3.418 -18.191 1.00 2.15 C ATOM 1848 O LYS A 115 5.691 3.578 -19.315 1.00 41.43 O ATOM 1849 CB LYS A 115 5.527 5.457 -16.797 1.00 42.11 C ATOM 1850 CG LYS A 115 4.944 6.699 -16.148 1.00 13.33 C ATOM 1851 CD LYS A 115 5.997 7.496 -15.377 1.00 50.51 C ATOM 1852 CE LYS A 115 7.154 7.967 -16.259 1.00 23.21 C ATOM 1853 NZ LYS A 115 8.162 6.896 -16.505 1.00 21.01 N ATOM 0 H LYS A 115 3.814 4.231 -15.503 1.00 12.41 H new ATOM 0 HA LYS A 115 3.911 5.135 -18.175 1.00 43.10 H new ATOM 0 HB2 LYS A 115 6.062 4.884 -16.040 1.00 42.11 H new ATOM 0 HB3 LYS A 115 6.260 5.762 -17.544 1.00 42.11 H new ATOM 0 HG2 LYS A 115 4.500 7.334 -16.915 1.00 13.33 H new ATOM 0 HG3 LYS A 115 4.141 6.410 -15.470 1.00 13.33 H new ATOM 0 HD2 LYS A 115 5.523 8.362 -14.916 1.00 50.51 H new ATOM 0 HD3 LYS A 115 6.391 6.880 -14.569 1.00 50.51 H new ATOM 0 HE2 LYS A 115 6.760 8.315 -17.214 1.00 23.21 H new ATOM 0 HE3 LYS A 115 7.643 8.819 -15.786 1.00 23.21 H new ATOM 0 HZ1 LYS A 115 9.117 7.307 -16.483 1.00 21.01 H new ATOM 0 HZ2 LYS A 115 8.082 6.167 -15.767 1.00 21.01 H new ATOM 0 HZ3 LYS A 115 7.991 6.466 -17.436 1.00 21.01 H new ATOM 1867 N LYS A 116 5.285 2.280 -17.517 1.00 22.34 N ATOM 1868 CA LYS A 116 5.863 1.067 -18.070 1.00 24.14 C ATOM 1869 C LYS A 116 4.911 0.442 -19.095 1.00 72.42 C ATOM 1870 O LYS A 116 5.328 -0.325 -19.966 1.00 12.13 O ATOM 1871 CB LYS A 116 6.175 0.108 -16.902 1.00 33.41 C ATOM 1872 CG LYS A 116 6.564 -1.315 -17.282 1.00 4.41 C ATOM 1873 CD LYS A 116 5.348 -2.232 -17.383 1.00 42.43 C ATOM 1874 CE LYS A 116 4.535 -2.250 -16.090 1.00 23.33 C ATOM 1875 NZ LYS A 116 5.305 -2.789 -14.933 1.00 40.34 N ATOM 0 H LYS A 116 4.942 2.173 -16.562 1.00 22.34 H new ATOM 0 HA LYS A 116 6.789 1.288 -18.601 1.00 24.14 H new ATOM 0 HB2 LYS A 116 6.985 0.538 -16.313 1.00 33.41 H new ATOM 0 HB3 LYS A 116 5.300 0.062 -16.254 1.00 33.41 H new ATOM 0 HG2 LYS A 116 7.090 -1.304 -18.236 1.00 4.41 H new ATOM 0 HG3 LYS A 116 7.257 -1.712 -16.540 1.00 4.41 H new ATOM 0 HD2 LYS A 116 4.713 -1.903 -18.206 1.00 42.43 H new ATOM 0 HD3 LYS A 116 5.676 -3.244 -17.619 1.00 42.43 H new ATOM 0 HE2 LYS A 116 4.203 -1.237 -15.860 1.00 23.33 H new ATOM 0 HE3 LYS A 116 3.639 -2.853 -16.237 1.00 23.33 H new ATOM 0 HZ1 LYS A 116 4.653 -3.001 -14.151 1.00 40.34 H new ATOM 0 HZ2 LYS A 116 5.798 -3.659 -15.219 1.00 40.34 H new ATOM 0 HZ3 LYS A 116 6.002 -2.083 -14.621 1.00 40.34 H new ATOM 1889 N SER A 117 3.638 0.805 -19.004 1.00 73.03 N ATOM 1890 CA SER A 117 2.611 0.236 -19.865 1.00 41.41 C ATOM 1891 C SER A 117 2.256 1.175 -21.021 1.00 13.21 C ATOM 1892 O SER A 117 2.404 0.816 -22.190 1.00 43.44 O ATOM 1893 CB SER A 117 1.360 -0.063 -19.039 1.00 13.23 C ATOM 1894 OG SER A 117 1.690 -0.768 -17.855 1.00 51.24 O ATOM 0 H SER A 117 3.291 1.495 -18.338 1.00 73.03 H new ATOM 0 HA SER A 117 3.004 -0.686 -20.294 1.00 41.41 H new ATOM 0 HB2 SER A 117 0.857 0.870 -18.783 1.00 13.23 H new ATOM 0 HB3 SER A 117 0.659 -0.650 -19.633 1.00 13.23 H new ATOM 0 HG SER A 117 0.874 -0.946 -17.342 1.00 51.24 H new ATOM 1900 N LEU A 118 1.806 2.386 -20.694 1.00 51.24 N ATOM 1901 CA LEU A 118 1.302 3.316 -21.705 1.00 50.22 C ATOM 1902 C LEU A 118 2.426 4.104 -22.383 1.00 41.02 C ATOM 1903 O LEU A 118 2.359 5.328 -22.504 1.00 73.52 O ATOM 1904 CB LEU A 118 0.249 4.265 -21.101 1.00 33.24 C ATOM 1905 CG LEU A 118 0.510 4.780 -19.677 1.00 54.41 C ATOM 1906 CD1 LEU A 118 1.735 5.679 -19.607 1.00 33.12 C ATOM 1907 CD2 LEU A 118 -0.709 5.523 -19.169 1.00 34.15 C ATOM 0 H LEU A 118 1.780 2.746 -19.740 1.00 51.24 H new ATOM 0 HA LEU A 118 0.824 2.717 -22.480 1.00 50.22 H new ATOM 0 HB2 LEU A 118 0.152 5.127 -21.761 1.00 33.24 H new ATOM 0 HB3 LEU A 118 -0.712 3.751 -21.105 1.00 33.24 H new ATOM 0 HG LEU A 118 0.706 3.914 -19.044 1.00 54.41 H new ATOM 0 HD11 LEU A 118 1.879 6.018 -18.581 1.00 33.12 H new ATOM 0 HD12 LEU A 118 2.614 5.122 -19.932 1.00 33.12 H new ATOM 0 HD13 LEU A 118 1.591 6.542 -20.258 1.00 33.12 H new ATOM 0 HD21 LEU A 118 -0.519 5.886 -18.159 1.00 34.15 H new ATOM 0 HD22 LEU A 118 -0.920 6.368 -19.825 1.00 34.15 H new ATOM 0 HD23 LEU A 118 -1.566 4.850 -19.157 1.00 34.15 H new ATOM 1919 N VAL A 119 3.449 3.395 -22.842 1.00 12.12 N ATOM 1920 CA VAL A 119 4.536 4.026 -23.578 1.00 63.13 C ATOM 1921 C VAL A 119 3.989 4.714 -24.830 1.00 43.42 C ATOM 1922 O VAL A 119 3.272 4.105 -25.630 1.00 53.24 O ATOM 1923 CB VAL A 119 5.644 3.006 -23.947 1.00 40.50 C ATOM 1924 CG1 VAL A 119 5.084 1.838 -24.749 1.00 50.22 C ATOM 1925 CG2 VAL A 119 6.772 3.686 -24.706 1.00 53.51 C ATOM 0 H VAL A 119 3.549 2.387 -22.718 1.00 12.12 H new ATOM 0 HA VAL A 119 4.992 4.777 -22.933 1.00 63.13 H new ATOM 0 HB VAL A 119 6.046 2.606 -23.016 1.00 40.50 H new ATOM 0 HG11 VAL A 119 5.889 1.143 -24.990 1.00 50.22 H new ATOM 0 HG12 VAL A 119 4.324 1.324 -24.160 1.00 50.22 H new ATOM 0 HG13 VAL A 119 4.638 2.210 -25.671 1.00 50.22 H new ATOM 0 HG21 VAL A 119 7.538 2.951 -24.954 1.00 53.51 H new ATOM 0 HG22 VAL A 119 6.380 4.126 -25.623 1.00 53.51 H new ATOM 0 HG23 VAL A 119 7.208 4.469 -24.085 1.00 53.51 H new ATOM 1935 N GLY A 120 4.302 5.995 -24.972 1.00 71.24 N ATOM 1936 CA GLY A 120 3.732 6.791 -26.041 1.00 14.54 C ATOM 1937 C GLY A 120 3.425 8.197 -25.572 1.00 31.43 C ATOM 1938 O GLY A 120 3.355 9.130 -26.373 1.00 12.02 O ATOM 0 H GLY A 120 4.945 6.500 -24.362 1.00 71.24 H new ATOM 0 HA2 GLY A 120 4.426 6.828 -26.880 1.00 14.54 H new ATOM 0 HA3 GLY A 120 2.819 6.318 -26.403 1.00 14.54 H new ATOM 1942 N VAL A 121 3.223 8.330 -24.263 1.00 3.31 N ATOM 1943 CA VAL A 121 3.020 9.632 -23.623 1.00 75.31 C ATOM 1944 C VAL A 121 4.133 10.616 -23.990 1.00 21.40 C ATOM 1945 O VAL A 121 5.316 10.271 -23.965 1.00 20.15 O ATOM 1946 CB VAL A 121 2.969 9.489 -22.086 1.00 2.25 C ATOM 1947 CG1 VAL A 121 2.776 10.840 -21.420 1.00 25.35 C ATOM 1948 CG2 VAL A 121 1.867 8.533 -21.673 1.00 64.33 C ATOM 0 H VAL A 121 3.195 7.542 -23.616 1.00 3.31 H new ATOM 0 HA VAL A 121 2.068 10.019 -23.987 1.00 75.31 H new ATOM 0 HB VAL A 121 3.924 9.080 -21.755 1.00 2.25 H new ATOM 0 HG11 VAL A 121 2.744 10.711 -20.338 1.00 25.35 H new ATOM 0 HG12 VAL A 121 3.605 11.497 -21.682 1.00 25.35 H new ATOM 0 HG13 VAL A 121 1.840 11.283 -21.761 1.00 25.35 H new ATOM 0 HG21 VAL A 121 1.848 8.447 -20.587 1.00 64.33 H new ATOM 0 HG22 VAL A 121 0.907 8.911 -22.023 1.00 64.33 H new ATOM 0 HG23 VAL A 121 2.052 7.553 -22.112 1.00 64.33 H new ATOM 1958 N GLN A 122 3.745 11.840 -24.328 1.00 53.34 N ATOM 1959 CA GLN A 122 4.704 12.869 -24.716 1.00 12.14 C ATOM 1960 C GLN A 122 4.708 14.026 -23.713 1.00 75.40 C ATOM 1961 O GLN A 122 5.416 15.015 -23.897 1.00 42.34 O ATOM 1962 CB GLN A 122 4.383 13.382 -26.123 1.00 4.51 C ATOM 1963 CG GLN A 122 4.483 12.306 -27.195 1.00 24.41 C ATOM 1964 CD GLN A 122 4.196 12.832 -28.588 1.00 21.15 C ATOM 1965 OE1 GLN A 122 5.094 13.304 -29.282 1.00 44.32 O ATOM 1966 NE2 GLN A 122 2.948 12.729 -29.016 1.00 64.11 N ATOM 0 H GLN A 122 2.772 12.145 -24.341 1.00 53.34 H new ATOM 0 HA GLN A 122 5.700 12.425 -24.719 1.00 12.14 H new ATOM 0 HB2 GLN A 122 3.376 13.798 -26.129 1.00 4.51 H new ATOM 0 HB3 GLN A 122 5.065 14.195 -26.370 1.00 4.51 H new ATOM 0 HG2 GLN A 122 5.483 11.872 -27.175 1.00 24.41 H new ATOM 0 HG3 GLN A 122 3.782 11.504 -26.964 1.00 24.41 H new ATOM 0 HE21 GLN A 122 2.232 12.331 -28.409 1.00 64.11 H new ATOM 0 HE22 GLN A 122 2.702 13.047 -29.953 1.00 64.11 H new ATOM 1975 N LYS A 123 3.914 13.886 -22.657 1.00 60.23 N ATOM 1976 CA LYS A 123 3.810 14.901 -21.610 1.00 52.33 C ATOM 1977 C LYS A 123 3.111 14.313 -20.395 1.00 50.32 C ATOM 1978 O LYS A 123 1.931 13.980 -20.448 1.00 5.34 O ATOM 1979 CB LYS A 123 3.065 16.138 -22.144 1.00 33.43 C ATOM 1980 CG LYS A 123 2.463 17.076 -21.088 1.00 34.52 C ATOM 1981 CD LYS A 123 3.474 17.588 -20.065 1.00 60.55 C ATOM 1982 CE LYS A 123 4.806 17.964 -20.690 1.00 52.10 C ATOM 1983 NZ LYS A 123 5.797 18.355 -19.657 1.00 61.42 N ATOM 0 H LYS A 123 3.325 13.068 -22.501 1.00 60.23 H new ATOM 0 HA LYS A 123 4.808 15.219 -21.308 1.00 52.33 H new ATOM 0 HB2 LYS A 123 3.755 16.714 -22.760 1.00 33.43 H new ATOM 0 HB3 LYS A 123 2.262 15.798 -22.798 1.00 33.43 H new ATOM 0 HG2 LYS A 123 2.007 17.929 -21.591 1.00 34.52 H new ATOM 0 HG3 LYS A 123 1.664 16.551 -20.563 1.00 34.52 H new ATOM 0 HD2 LYS A 123 3.059 18.457 -19.555 1.00 60.55 H new ATOM 0 HD3 LYS A 123 3.637 16.822 -19.307 1.00 60.55 H new ATOM 0 HE2 LYS A 123 5.191 17.122 -21.265 1.00 52.10 H new ATOM 0 HE3 LYS A 123 4.662 18.788 -21.389 1.00 52.10 H new ATOM 0 HZ1 LYS A 123 6.754 18.119 -19.987 1.00 61.42 H new ATOM 0 HZ2 LYS A 123 5.733 19.379 -19.485 1.00 61.42 H new ATOM 0 HZ3 LYS A 123 5.599 17.842 -18.774 1.00 61.42 H new ATOM 1997 N TYR A 124 3.852 14.172 -19.308 1.00 25.11 N ATOM 1998 CA TYR A 124 3.327 13.550 -18.103 1.00 20.00 C ATOM 1999 C TYR A 124 3.551 14.443 -16.888 1.00 21.32 C ATOM 2000 O TYR A 124 4.669 14.898 -16.633 1.00 23.33 O ATOM 2001 CB TYR A 124 3.968 12.169 -17.888 1.00 22.23 C ATOM 2002 CG TYR A 124 5.485 12.174 -17.881 1.00 42.10 C ATOM 2003 CD1 TYR A 124 6.205 12.156 -19.071 1.00 63.12 C ATOM 2004 CD2 TYR A 124 6.196 12.190 -16.687 1.00 22.13 C ATOM 2005 CE1 TYR A 124 7.586 12.156 -19.070 1.00 2.43 C ATOM 2006 CE2 TYR A 124 7.578 12.191 -16.679 1.00 14.41 C ATOM 2007 CZ TYR A 124 8.268 12.175 -17.873 1.00 33.21 C ATOM 2008 OH TYR A 124 9.645 12.173 -17.867 1.00 43.45 O ATOM 0 H TYR A 124 4.821 14.481 -19.235 1.00 25.11 H new ATOM 0 HA TYR A 124 2.253 13.416 -18.229 1.00 20.00 H new ATOM 0 HB2 TYR A 124 3.614 11.762 -16.941 1.00 22.23 H new ATOM 0 HB3 TYR A 124 3.623 11.496 -18.673 1.00 22.23 H new ATOM 0 HD1 TYR A 124 5.675 12.142 -20.012 1.00 63.12 H new ATOM 0 HD2 TYR A 124 5.660 12.202 -15.750 1.00 22.13 H new ATOM 0 HE1 TYR A 124 8.129 12.141 -20.003 1.00 2.43 H new ATOM 0 HE2 TYR A 124 8.115 12.204 -15.742 1.00 14.41 H new ATOM 0 HH TYR A 124 9.968 12.189 -16.942 1.00 43.45 H new ATOM 2018 N ILE A 125 2.477 14.724 -16.168 1.00 72.31 N ATOM 2019 CA ILE A 125 2.563 15.496 -14.941 1.00 74.33 C ATOM 2020 C ILE A 125 1.452 15.088 -13.971 1.00 63.13 C ATOM 2021 O ILE A 125 0.341 14.763 -14.387 1.00 33.34 O ATOM 2022 CB ILE A 125 2.504 17.015 -15.212 1.00 35.24 C ATOM 2023 CG1 ILE A 125 2.759 17.793 -13.913 1.00 41.24 C ATOM 2024 CG2 ILE A 125 1.163 17.396 -15.821 1.00 31.24 C ATOM 2025 CD1 ILE A 125 3.063 19.258 -14.122 1.00 11.12 C ATOM 0 H ILE A 125 1.533 14.427 -16.414 1.00 72.31 H new ATOM 0 HA ILE A 125 3.530 15.278 -14.487 1.00 74.33 H new ATOM 0 HB ILE A 125 3.284 17.276 -15.927 1.00 35.24 H new ATOM 0 HG12 ILE A 125 1.884 17.703 -13.270 1.00 41.24 H new ATOM 0 HG13 ILE A 125 3.593 17.332 -13.383 1.00 41.24 H new ATOM 0 HG21 ILE A 125 1.139 18.470 -16.005 1.00 31.24 H new ATOM 0 HG22 ILE A 125 1.026 16.863 -16.762 1.00 31.24 H new ATOM 0 HG23 ILE A 125 0.361 17.128 -15.133 1.00 31.24 H new ATOM 0 HD11 ILE A 125 3.231 19.736 -13.157 1.00 11.12 H new ATOM 0 HD12 ILE A 125 3.957 19.360 -14.738 1.00 11.12 H new ATOM 0 HD13 ILE A 125 2.221 19.736 -14.622 1.00 11.12 H new ATOM 2037 N GLN A 126 1.757 15.075 -12.686 1.00 42.14 N ATOM 2038 CA GLN A 126 0.763 14.767 -11.666 1.00 1.32 C ATOM 2039 C GLN A 126 -0.102 15.992 -11.361 1.00 10.15 C ATOM 2040 O GLN A 126 0.375 17.128 -11.372 1.00 54.44 O ATOM 2041 CB GLN A 126 1.454 14.258 -10.397 1.00 64.33 C ATOM 2042 CG GLN A 126 0.581 14.268 -9.149 1.00 13.43 C ATOM 2043 CD GLN A 126 1.371 13.947 -7.897 1.00 11.14 C ATOM 2044 OE1 GLN A 126 2.568 14.231 -7.815 1.00 50.34 O ATOM 2045 NE2 GLN A 126 0.714 13.348 -6.916 1.00 53.13 N ATOM 0 H GLN A 126 2.688 15.275 -12.320 1.00 42.14 H new ATOM 0 HA GLN A 126 0.107 13.983 -12.044 1.00 1.32 H new ATOM 0 HB2 GLN A 126 1.802 13.240 -10.572 1.00 64.33 H new ATOM 0 HB3 GLN A 126 2.337 14.869 -10.211 1.00 64.33 H new ATOM 0 HG2 GLN A 126 0.115 15.247 -9.041 1.00 13.43 H new ATOM 0 HG3 GLN A 126 -0.224 13.542 -9.265 1.00 13.43 H new ATOM 0 HE21 GLN A 126 -0.277 13.130 -7.024 1.00 53.13 H new ATOM 0 HE22 GLN A 126 1.198 13.104 -6.052 1.00 53.13 H new ATOM 2054 N ALA A 127 -1.374 15.746 -11.106 1.00 63.30 N ATOM 2055 CA ALA A 127 -2.316 16.799 -10.758 1.00 41.24 C ATOM 2056 C ALA A 127 -2.802 16.593 -9.330 1.00 74.20 C ATOM 2057 O ALA A 127 -3.501 15.628 -9.044 1.00 63.11 O ATOM 2058 CB ALA A 127 -3.489 16.805 -11.735 1.00 0.02 C ATOM 0 H ALA A 127 -1.785 14.813 -11.134 1.00 63.30 H new ATOM 0 HA ALA A 127 -1.818 17.766 -10.825 1.00 41.24 H new ATOM 0 HB1 ALA A 127 -4.186 17.598 -11.462 1.00 0.02 H new ATOM 0 HB2 ALA A 127 -3.120 16.978 -12.746 1.00 0.02 H new ATOM 0 HB3 ALA A 127 -4.000 15.843 -11.695 1.00 0.02 H new ATOM 2064 N THR A 128 -2.433 17.497 -8.441 1.00 20.51 N ATOM 2065 CA THR A 128 -2.701 17.323 -7.022 1.00 30.10 C ATOM 2066 C THR A 128 -4.157 17.585 -6.657 1.00 44.50 C ATOM 2067 O THR A 128 -4.648 17.080 -5.651 1.00 5.30 O ATOM 2068 CB THR A 128 -1.815 18.247 -6.182 1.00 0.54 C ATOM 2069 OG1 THR A 128 -1.904 19.587 -6.684 1.00 22.11 O ATOM 2070 CG2 THR A 128 -0.367 17.789 -6.211 1.00 43.35 C ATOM 0 H THR A 128 -1.946 18.362 -8.676 1.00 20.51 H new ATOM 0 HA THR A 128 -2.476 16.279 -6.803 1.00 30.10 H new ATOM 0 HB THR A 128 -2.166 18.214 -5.151 1.00 0.54 H new ATOM 0 HG1 THR A 128 -2.818 19.920 -6.567 1.00 22.11 H new ATOM 0 HG21 THR A 128 0.240 18.463 -5.606 1.00 43.35 H new ATOM 0 HG22 THR A 128 -0.297 16.778 -5.809 1.00 43.35 H new ATOM 0 HG23 THR A 128 -0.003 17.797 -7.239 1.00 43.35 H new ATOM 2078 N ASP A 129 -4.842 18.384 -7.456 1.00 21.02 N ATOM 2079 CA ASP A 129 -6.212 18.757 -7.140 1.00 54.33 C ATOM 2080 C ASP A 129 -6.918 19.297 -8.372 1.00 44.23 C ATOM 2081 O ASP A 129 -6.378 19.252 -9.480 1.00 44.32 O ATOM 2082 CB ASP A 129 -6.239 19.798 -6.013 1.00 71.02 C ATOM 2083 CG ASP A 129 -5.793 21.172 -6.470 1.00 44.31 C ATOM 2084 OD1 ASP A 129 -4.570 21.393 -6.612 1.00 63.11 O ATOM 2085 OD2 ASP A 129 -6.669 22.032 -6.694 1.00 30.42 O ATOM 0 H ASP A 129 -4.478 18.784 -8.321 1.00 21.02 H new ATOM 0 HA ASP A 129 -6.739 17.865 -6.803 1.00 54.33 H new ATOM 0 HB2 ASP A 129 -7.250 19.865 -5.611 1.00 71.02 H new ATOM 0 HB3 ASP A 129 -5.594 19.464 -5.200 1.00 71.02 H new ATOM 2090 N LEU A 130 -8.124 19.812 -8.165 1.00 35.23 N ATOM 2091 CA LEU A 130 -8.963 20.309 -9.251 1.00 64.52 C ATOM 2092 C LEU A 130 -8.262 21.419 -10.039 1.00 0.51 C ATOM 2093 O LEU A 130 -8.404 21.509 -11.259 1.00 10.35 O ATOM 2094 CB LEU A 130 -10.289 20.824 -8.683 1.00 13.41 C ATOM 2095 CG LEU A 130 -11.369 21.142 -9.718 1.00 70.21 C ATOM 2096 CD1 LEU A 130 -11.793 19.881 -10.453 1.00 53.11 C ATOM 2097 CD2 LEU A 130 -12.570 21.792 -9.051 1.00 22.41 C ATOM 0 H LEU A 130 -8.548 19.897 -7.241 1.00 35.23 H new ATOM 0 HA LEU A 130 -9.154 19.484 -9.938 1.00 64.52 H new ATOM 0 HB2 LEU A 130 -10.682 20.079 -7.991 1.00 13.41 H new ATOM 0 HB3 LEU A 130 -10.090 21.725 -8.102 1.00 13.41 H new ATOM 0 HG LEU A 130 -10.953 21.841 -10.443 1.00 70.21 H new ATOM 0 HD11 LEU A 130 -12.562 20.128 -11.185 1.00 53.11 H new ATOM 0 HD12 LEU A 130 -10.931 19.450 -10.963 1.00 53.11 H new ATOM 0 HD13 LEU A 130 -12.190 19.160 -9.739 1.00 53.11 H new ATOM 0 HD21 LEU A 130 -13.329 22.012 -9.802 1.00 22.41 H new ATOM 0 HD22 LEU A 130 -12.984 21.113 -8.305 1.00 22.41 H new ATOM 0 HD23 LEU A 130 -12.260 22.718 -8.567 1.00 22.41 H new ATOM 2109 N SER A 131 -7.483 22.238 -9.340 1.00 52.34 N ATOM 2110 CA SER A 131 -6.807 23.378 -9.951 1.00 14.44 C ATOM 2111 C SER A 131 -5.788 22.929 -10.999 1.00 33.00 C ATOM 2112 O SER A 131 -5.474 23.668 -11.932 1.00 43.53 O ATOM 2113 CB SER A 131 -6.105 24.196 -8.868 1.00 34.31 C ATOM 2114 OG SER A 131 -6.966 24.411 -7.763 1.00 32.44 O ATOM 0 H SER A 131 -7.303 22.132 -8.342 1.00 52.34 H new ATOM 0 HA SER A 131 -7.558 23.989 -10.452 1.00 14.44 H new ATOM 0 HB2 SER A 131 -5.206 23.676 -8.538 1.00 34.31 H new ATOM 0 HB3 SER A 131 -5.786 25.154 -9.279 1.00 34.31 H new ATOM 0 HG SER A 131 -6.900 23.653 -7.145 1.00 32.44 H new ATOM 2120 N GLU A 132 -5.284 21.710 -10.847 1.00 35.54 N ATOM 2121 CA GLU A 132 -4.256 21.195 -11.743 1.00 63.12 C ATOM 2122 C GLU A 132 -4.863 20.482 -12.943 1.00 21.20 C ATOM 2123 O GLU A 132 -4.148 20.100 -13.871 1.00 40.20 O ATOM 2124 CB GLU A 132 -3.323 20.240 -10.995 1.00 43.44 C ATOM 2125 CG GLU A 132 -2.478 20.924 -9.939 1.00 62.22 C ATOM 2126 CD GLU A 132 -1.702 22.090 -10.504 1.00 64.12 C ATOM 2127 OE1 GLU A 132 -0.879 21.877 -11.419 1.00 73.12 O ATOM 2128 OE2 GLU A 132 -1.936 23.230 -10.057 1.00 61.14 O ATOM 0 H GLU A 132 -5.570 21.061 -10.114 1.00 35.54 H new ATOM 0 HA GLU A 132 -3.685 22.049 -12.107 1.00 63.12 H new ATOM 0 HB2 GLU A 132 -3.918 19.459 -10.523 1.00 43.44 H new ATOM 0 HB3 GLU A 132 -2.666 19.750 -11.713 1.00 43.44 H new ATOM 0 HG2 GLU A 132 -3.120 21.273 -9.131 1.00 62.22 H new ATOM 0 HG3 GLU A 132 -1.785 20.203 -9.506 1.00 62.22 H new ATOM 2135 N ALA A 133 -6.176 20.312 -12.925 1.00 74.20 N ATOM 2136 CA ALA A 133 -6.861 19.593 -13.988 1.00 2.12 C ATOM 2137 C ALA A 133 -7.675 20.540 -14.860 1.00 35.44 C ATOM 2138 O ALA A 133 -8.432 20.107 -15.727 1.00 45.32 O ATOM 2139 CB ALA A 133 -7.754 18.513 -13.401 1.00 41.22 C ATOM 0 H ALA A 133 -6.788 20.661 -12.187 1.00 74.20 H new ATOM 0 HA ALA A 133 -6.106 19.124 -14.619 1.00 2.12 H new ATOM 0 HB1 ALA A 133 -8.261 17.982 -14.207 1.00 41.22 H new ATOM 0 HB2 ALA A 133 -7.148 17.811 -12.829 1.00 41.22 H new ATOM 0 HB3 ALA A 133 -8.495 18.970 -12.745 1.00 41.22 H new ATOM 2145 N SER A 134 -7.521 21.837 -14.627 1.00 23.33 N ATOM 2146 CA SER A 134 -8.206 22.830 -15.436 1.00 31.34 C ATOM 2147 C SER A 134 -7.661 22.813 -16.859 1.00 74.24 C ATOM 2148 O SER A 134 -6.458 22.646 -17.070 1.00 22.23 O ATOM 2149 CB SER A 134 -8.053 24.228 -14.827 1.00 42.41 C ATOM 2150 OG SER A 134 -8.633 25.212 -15.670 1.00 4.34 O ATOM 0 H SER A 134 -6.931 22.222 -13.889 1.00 23.33 H new ATOM 0 HA SER A 134 -9.267 22.582 -15.459 1.00 31.34 H new ATOM 0 HB2 SER A 134 -8.529 24.256 -13.847 1.00 42.41 H new ATOM 0 HB3 SER A 134 -6.997 24.450 -14.675 1.00 42.41 H new ATOM 0 HG SER A 134 -8.526 26.097 -15.262 1.00 4.34 H new ATOM 2156 N ARG A 135 -8.548 23.014 -17.828 1.00 32.43 N ATOM 2157 CA ARG A 135 -8.189 22.939 -19.241 1.00 21.31 C ATOM 2158 C ARG A 135 -7.147 24.004 -19.596 1.00 73.53 C ATOM 2159 O ARG A 135 -6.402 23.862 -20.566 1.00 72.10 O ATOM 2160 CB ARG A 135 -9.450 23.097 -20.105 1.00 32.44 C ATOM 2161 CG ARG A 135 -9.887 24.537 -20.313 1.00 4.35 C ATOM 2162 CD ARG A 135 -11.361 24.648 -20.664 1.00 24.41 C ATOM 2163 NE ARG A 135 -11.737 26.029 -20.960 1.00 64.21 N ATOM 2164 CZ ARG A 135 -12.885 26.387 -21.532 1.00 54.43 C ATOM 2165 NH1 ARG A 135 -13.830 25.488 -21.767 1.00 30.45 N ATOM 2166 NH2 ARG A 135 -13.113 27.655 -21.839 1.00 24.04 N ATOM 0 H ARG A 135 -9.530 23.232 -17.659 1.00 32.43 H new ATOM 0 HA ARG A 135 -7.746 21.964 -19.441 1.00 21.31 H new ATOM 0 HB2 ARG A 135 -9.270 22.640 -21.078 1.00 32.44 H new ATOM 0 HB3 ARG A 135 -10.267 22.545 -19.640 1.00 32.44 H new ATOM 0 HG2 ARG A 135 -9.688 25.109 -19.407 1.00 4.35 H new ATOM 0 HG3 ARG A 135 -9.292 24.983 -21.109 1.00 4.35 H new ATOM 0 HD2 ARG A 135 -11.580 24.017 -21.526 1.00 24.41 H new ATOM 0 HD3 ARG A 135 -11.963 24.275 -19.835 1.00 24.41 H new ATOM 0 HE ARG A 135 -11.077 26.766 -20.712 1.00 64.21 H new ATOM 0 HH11 ARG A 135 -13.681 24.512 -21.509 1.00 30.45 H new ATOM 0 HH12 ARG A 135 -14.706 25.772 -22.206 1.00 30.45 H new ATOM 0 HH21 ARG A 135 -12.407 28.363 -21.637 1.00 24.04 H new ATOM 0 HH22 ARG A 135 -13.994 27.923 -22.277 1.00 24.04 H new ATOM 2180 N GLU A 136 -7.095 25.061 -18.789 1.00 3.13 N ATOM 2181 CA GLU A 136 -6.138 26.142 -18.988 1.00 14.00 C ATOM 2182 C GLU A 136 -4.771 25.774 -18.408 1.00 72.24 C ATOM 2183 O GLU A 136 -3.733 26.194 -18.916 1.00 71.34 O ATOM 2184 CB GLU A 136 -6.658 27.421 -18.329 1.00 55.31 C ATOM 2185 CG GLU A 136 -5.762 28.630 -18.534 1.00 74.11 C ATOM 2186 CD GLU A 136 -6.231 29.839 -17.755 1.00 24.41 C ATOM 2187 OE1 GLU A 136 -7.145 30.542 -18.232 1.00 53.41 O ATOM 2188 OE2 GLU A 136 -5.696 30.089 -16.655 1.00 32.11 O ATOM 0 H GLU A 136 -7.710 25.190 -17.986 1.00 3.13 H new ATOM 0 HA GLU A 136 -6.021 26.308 -20.059 1.00 14.00 H new ATOM 0 HB2 GLU A 136 -7.649 27.645 -18.725 1.00 55.31 H new ATOM 0 HB3 GLU A 136 -6.774 27.245 -17.260 1.00 55.31 H new ATOM 0 HG2 GLU A 136 -4.745 28.380 -18.232 1.00 74.11 H new ATOM 0 HG3 GLU A 136 -5.728 28.877 -19.595 1.00 74.11 H new ATOM 2195 N ALA A 137 -4.784 24.969 -17.354 1.00 65.44 N ATOM 2196 CA ALA A 137 -3.563 24.619 -16.638 1.00 55.20 C ATOM 2197 C ALA A 137 -2.850 23.435 -17.283 1.00 14.32 C ATOM 2198 O ALA A 137 -1.660 23.228 -17.068 1.00 42.53 O ATOM 2199 CB ALA A 137 -3.879 24.313 -15.181 1.00 20.35 C ATOM 0 H ALA A 137 -5.630 24.544 -16.974 1.00 65.44 H new ATOM 0 HA ALA A 137 -2.892 25.476 -16.688 1.00 55.20 H new ATOM 0 HB1 ALA A 137 -2.960 24.053 -14.656 1.00 20.35 H new ATOM 0 HB2 ALA A 137 -4.328 25.190 -14.714 1.00 20.35 H new ATOM 0 HB3 ALA A 137 -4.576 23.477 -15.128 1.00 20.35 H new ATOM 2205 N VAL A 138 -3.579 22.652 -18.064 1.00 71.13 N ATOM 2206 CA VAL A 138 -2.998 21.483 -18.713 1.00 12.51 C ATOM 2207 C VAL A 138 -2.097 21.885 -19.884 1.00 43.12 C ATOM 2208 O VAL A 138 -0.999 21.344 -20.050 1.00 64.12 O ATOM 2209 CB VAL A 138 -4.089 20.506 -19.208 1.00 55.01 C ATOM 2210 CG1 VAL A 138 -3.472 19.326 -19.947 1.00 64.24 C ATOM 2211 CG2 VAL A 138 -4.933 20.013 -18.043 1.00 44.12 C ATOM 0 H VAL A 138 -4.568 22.802 -18.264 1.00 71.13 H new ATOM 0 HA VAL A 138 -2.393 20.975 -17.962 1.00 12.51 H new ATOM 0 HB VAL A 138 -4.732 21.046 -19.903 1.00 55.01 H new ATOM 0 HG11 VAL A 138 -4.262 18.655 -20.284 1.00 64.24 H new ATOM 0 HG12 VAL A 138 -2.912 19.689 -20.809 1.00 64.24 H new ATOM 0 HG13 VAL A 138 -2.800 18.789 -19.278 1.00 64.24 H new ATOM 0 HG21 VAL A 138 -5.695 19.326 -18.411 1.00 44.12 H new ATOM 0 HG22 VAL A 138 -4.296 19.497 -17.325 1.00 44.12 H new ATOM 0 HG23 VAL A 138 -5.413 20.862 -17.557 1.00 44.12 H new ATOM 2221 N GLU A 139 -2.547 22.860 -20.669 1.00 44.44 N ATOM 2222 CA GLU A 139 -1.837 23.260 -21.879 1.00 72.44 C ATOM 2223 C GLU A 139 -0.457 23.841 -21.578 1.00 22.32 C ATOM 2224 O GLU A 139 0.471 23.661 -22.360 1.00 51.14 O ATOM 2225 CB GLU A 139 -2.664 24.260 -22.688 1.00 11.14 C ATOM 2226 CG GLU A 139 -3.176 25.430 -21.870 1.00 1.21 C ATOM 2227 CD GLU A 139 -3.781 26.518 -22.728 1.00 55.42 C ATOM 2228 OE1 GLU A 139 -4.763 26.244 -23.447 1.00 75.33 O ATOM 2229 OE2 GLU A 139 -3.273 27.657 -22.684 1.00 72.35 O ATOM 0 H GLU A 139 -3.401 23.388 -20.488 1.00 44.44 H new ATOM 0 HA GLU A 139 -1.690 22.356 -22.470 1.00 72.44 H new ATOM 0 HB2 GLU A 139 -2.056 24.640 -23.509 1.00 11.14 H new ATOM 0 HB3 GLU A 139 -3.512 23.740 -23.133 1.00 11.14 H new ATOM 0 HG2 GLU A 139 -3.923 25.074 -21.161 1.00 1.21 H new ATOM 0 HG3 GLU A 139 -2.356 25.847 -21.286 1.00 1.21 H new ATOM 2236 N GLU A 140 -0.304 24.513 -20.445 1.00 34.30 N ATOM 2237 CA GLU A 140 0.965 25.164 -20.139 1.00 14.20 C ATOM 2238 C GLU A 140 2.061 24.151 -19.820 1.00 34.45 C ATOM 2239 O GLU A 140 3.245 24.433 -19.997 1.00 44.44 O ATOM 2240 CB GLU A 140 0.826 26.165 -18.995 1.00 52.45 C ATOM 2241 CG GLU A 140 0.297 25.576 -17.702 1.00 33.43 C ATOM 2242 CD GLU A 140 0.428 26.542 -16.545 1.00 14.34 C ATOM 2243 OE1 GLU A 140 -0.367 27.502 -16.472 1.00 12.11 O ATOM 2244 OE2 GLU A 140 1.341 26.351 -15.714 1.00 33.43 O ATOM 0 H GLU A 140 -1.027 24.622 -19.734 1.00 34.30 H new ATOM 0 HA GLU A 140 1.256 25.709 -21.037 1.00 14.20 H new ATOM 0 HB2 GLU A 140 1.800 26.614 -18.802 1.00 52.45 H new ATOM 0 HB3 GLU A 140 0.161 26.969 -19.312 1.00 52.45 H new ATOM 0 HG2 GLU A 140 -0.750 25.303 -17.830 1.00 33.43 H new ATOM 0 HG3 GLU A 140 0.840 24.659 -17.472 1.00 33.43 H new ATOM 2251 N LYS A 141 1.674 22.964 -19.380 1.00 52.04 N ATOM 2252 CA LYS A 141 2.651 21.949 -19.048 1.00 73.15 C ATOM 2253 C LYS A 141 3.078 21.229 -20.315 1.00 50.31 C ATOM 2254 O LYS A 141 4.242 20.870 -20.475 1.00 0.12 O ATOM 2255 CB LYS A 141 2.081 20.971 -18.018 1.00 42.44 C ATOM 2256 CG LYS A 141 1.220 21.668 -16.981 1.00 62.31 C ATOM 2257 CD LYS A 141 0.659 20.701 -15.964 1.00 12.23 C ATOM 2258 CE LYS A 141 -0.140 21.438 -14.905 1.00 23.32 C ATOM 2259 NZ LYS A 141 -0.469 20.572 -13.739 1.00 45.02 N ATOM 0 H LYS A 141 0.702 22.685 -19.247 1.00 52.04 H new ATOM 0 HA LYS A 141 3.527 22.420 -18.601 1.00 73.15 H new ATOM 0 HB2 LYS A 141 1.488 20.212 -18.529 1.00 42.44 H new ATOM 0 HB3 LYS A 141 2.900 20.453 -17.519 1.00 42.44 H new ATOM 0 HG2 LYS A 141 1.812 22.427 -16.470 1.00 62.31 H new ATOM 0 HG3 LYS A 141 0.400 22.185 -17.480 1.00 62.31 H new ATOM 0 HD2 LYS A 141 0.023 19.970 -16.463 1.00 12.23 H new ATOM 0 HD3 LYS A 141 1.472 20.148 -15.494 1.00 12.23 H new ATOM 0 HE2 LYS A 141 0.427 22.304 -14.563 1.00 23.32 H new ATOM 0 HE3 LYS A 141 -1.063 21.815 -15.346 1.00 23.32 H new ATOM 0 HZ1 LYS A 141 -0.652 21.167 -12.906 1.00 45.02 H new ATOM 0 HZ2 LYS A 141 -1.315 20.007 -13.954 1.00 45.02 H new ATOM 0 HZ3 LYS A 141 0.330 19.936 -13.542 1.00 45.02 H new ATOM 2273 N LEU A 142 2.134 21.053 -21.234 1.00 24.13 N ATOM 2274 CA LEU A 142 2.431 20.403 -22.506 1.00 64.33 C ATOM 2275 C LEU A 142 3.221 21.338 -23.430 1.00 10.33 C ATOM 2276 O LEU A 142 4.126 20.896 -24.136 1.00 12.11 O ATOM 2277 CB LEU A 142 1.146 19.889 -23.184 1.00 35.44 C ATOM 2278 CG LEU A 142 0.078 20.928 -23.534 1.00 32.24 C ATOM 2279 CD1 LEU A 142 0.316 21.521 -24.918 1.00 65.32 C ATOM 2280 CD2 LEU A 142 -1.304 20.303 -23.454 1.00 5.13 C ATOM 0 H LEU A 142 1.164 21.349 -21.124 1.00 24.13 H new ATOM 0 HA LEU A 142 3.059 19.536 -22.301 1.00 64.33 H new ATOM 0 HB2 LEU A 142 1.431 19.374 -24.102 1.00 35.44 H new ATOM 0 HB3 LEU A 142 0.692 19.145 -22.529 1.00 35.44 H new ATOM 0 HG LEU A 142 0.143 21.739 -22.809 1.00 32.24 H new ATOM 0 HD11 LEU A 142 -0.459 22.255 -25.137 1.00 65.32 H new ATOM 0 HD12 LEU A 142 1.292 22.005 -24.943 1.00 65.32 H new ATOM 0 HD13 LEU A 142 0.285 20.727 -25.664 1.00 65.32 H new ATOM 0 HD21 LEU A 142 -2.057 21.051 -23.705 1.00 5.13 H new ATOM 0 HD22 LEU A 142 -1.369 19.473 -24.157 1.00 5.13 H new ATOM 0 HD23 LEU A 142 -1.480 19.937 -22.443 1.00 5.13 H new ATOM 2292 N ARG A 143 2.913 22.638 -23.392 1.00 11.54 N ATOM 2293 CA ARG A 143 3.613 23.610 -24.242 1.00 42.51 C ATOM 2294 C ARG A 143 5.072 23.753 -23.816 1.00 33.31 C ATOM 2295 O ARG A 143 5.904 24.257 -24.569 1.00 52.04 O ATOM 2296 CB ARG A 143 2.900 24.980 -24.251 1.00 34.34 C ATOM 2297 CG ARG A 143 2.769 25.659 -22.890 1.00 74.34 C ATOM 2298 CD ARG A 143 4.035 26.399 -22.475 1.00 43.23 C ATOM 2299 NE ARG A 143 4.281 27.583 -23.298 1.00 31.14 N ATOM 2300 CZ ARG A 143 5.482 27.939 -23.750 1.00 44.22 C ATOM 2301 NH1 ARG A 143 6.543 27.178 -23.499 1.00 14.33 N ATOM 2302 NH2 ARG A 143 5.620 29.051 -24.463 1.00 30.52 N ATOM 0 H ARG A 143 2.193 23.039 -22.791 1.00 11.54 H new ATOM 0 HA ARG A 143 3.592 23.228 -25.263 1.00 42.51 H new ATOM 0 HB2 ARG A 143 3.442 25.648 -24.921 1.00 34.34 H new ATOM 0 HB3 ARG A 143 1.902 24.849 -24.670 1.00 34.34 H new ATOM 0 HG2 ARG A 143 1.936 26.361 -22.918 1.00 74.34 H new ATOM 0 HG3 ARG A 143 2.528 24.909 -22.137 1.00 74.34 H new ATOM 0 HD2 ARG A 143 3.953 26.697 -21.430 1.00 43.23 H new ATOM 0 HD3 ARG A 143 4.888 25.724 -22.549 1.00 43.23 H new ATOM 0 HE ARG A 143 3.484 28.172 -23.540 1.00 31.14 H new ATOM 0 HH11 ARG A 143 6.438 26.319 -22.959 1.00 14.33 H new ATOM 0 HH12 ARG A 143 7.462 27.453 -23.846 1.00 14.33 H new ATOM 0 HH21 ARG A 143 4.806 29.632 -24.664 1.00 30.52 H new ATOM 0 HH22 ARG A 143 6.540 29.324 -24.809 1.00 30.52 H new ATOM 2316 N ALA A 144 5.371 23.326 -22.593 1.00 63.43 N ATOM 2317 CA ALA A 144 6.740 23.323 -22.093 1.00 51.44 C ATOM 2318 C ALA A 144 7.582 22.271 -22.814 1.00 50.43 C ATOM 2319 O ALA A 144 8.811 22.349 -22.830 1.00 73.13 O ATOM 2320 CB ALA A 144 6.752 23.082 -20.589 1.00 63.31 C ATOM 0 H ALA A 144 4.680 22.977 -21.929 1.00 63.43 H new ATOM 0 HA ALA A 144 7.180 24.300 -22.293 1.00 51.44 H new ATOM 0 HB1 ALA A 144 7.781 23.082 -20.229 1.00 63.31 H new ATOM 0 HB2 ALA A 144 6.192 23.873 -20.089 1.00 63.31 H new ATOM 0 HB3 ALA A 144 6.292 22.118 -20.371 1.00 63.31 H new ATOM 2326 N THR A 145 6.916 21.291 -23.411 1.00 15.53 N ATOM 2327 CA THR A 145 7.607 20.248 -24.152 1.00 13.21 C ATOM 2328 C THR A 145 7.511 20.467 -25.663 1.00 33.13 C ATOM 2329 O THR A 145 8.404 20.058 -26.410 1.00 60.21 O ATOM 2330 CB THR A 145 7.074 18.849 -23.784 1.00 55.03 C ATOM 2331 OG1 THR A 145 5.680 18.920 -23.462 1.00 44.40 O ATOM 2332 CG2 THR A 145 7.851 18.265 -22.611 1.00 5.21 C ATOM 0 H THR A 145 5.900 21.198 -23.396 1.00 15.53 H new ATOM 0 HA THR A 145 8.658 20.304 -23.867 1.00 13.21 H new ATOM 0 HB THR A 145 7.208 18.195 -24.646 1.00 55.03 H new ATOM 0 HG1 THR A 145 5.235 19.545 -24.072 1.00 44.40 H new ATOM 0 HG21 THR A 145 7.457 17.278 -22.369 1.00 5.21 H new ATOM 0 HG22 THR A 145 8.904 18.180 -22.878 1.00 5.21 H new ATOM 0 HG23 THR A 145 7.748 18.919 -21.745 1.00 5.21 H new ATOM 2340 N ASP A 146 6.440 21.121 -26.109 1.00 10.24 N ATOM 2341 CA ASP A 146 6.270 21.422 -27.530 1.00 62.54 C ATOM 2342 C ASP A 146 7.278 22.470 -27.978 1.00 70.52 C ATOM 2343 O ASP A 146 7.642 23.362 -27.210 1.00 50.53 O ATOM 2344 CB ASP A 146 4.854 21.922 -27.833 1.00 4.22 C ATOM 2345 CG ASP A 146 3.808 20.833 -27.731 1.00 45.54 C ATOM 2346 OD1 ASP A 146 3.752 19.961 -28.628 1.00 30.33 O ATOM 2347 OD2 ASP A 146 3.024 20.842 -26.758 1.00 21.55 O ATOM 0 H ASP A 146 5.682 21.451 -25.512 1.00 10.24 H new ATOM 0 HA ASP A 146 6.437 20.495 -28.079 1.00 62.54 H new ATOM 0 HB2 ASP A 146 4.603 22.726 -27.141 1.00 4.22 H new ATOM 0 HB3 ASP A 146 4.832 22.347 -28.837 1.00 4.22 H new