USER MOD reduce.3.24.130724 H: found=0, std=0, add=1171, rem=0, adj=48 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 104 LYS NZ :NH3+ -158:sc= -2.81! (180deg=-3.66!) USER MOD Set 1.2: A 107 TYR OH : rot 67:sc= 1.29 USER MOD Set 1.3: A 126 GLN : amide:sc= -0.375! K(o=-1.9!,f=-2.8) USER MOD Set 2.1: A 76 GLN : amide:sc= 0.621 K(o=1.2,f=0.16) USER MOD Set 2.2: A 83 SER OG : rot -89:sc= 0.557 USER MOD Set 3.1: A 66 TYR OH : rot 15:sc= -0.706 USER MOD Set 3.2: A 110 SER OG : rot 148:sc= -1.67! USER MOD Set 4.1: A 26 TYR OH : rot 165:sc= 0 USER MOD Set 4.2: A 92 MET CE :methyl -169:sc= 0 (180deg=0) USER MOD Set 5.1: A 15 TYR OH : rot 35:sc= 1.29 USER MOD Set 5.2: A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 1 MET CE :methyl -117:sc= -1.6 (180deg=-4.07!) USER MOD Set 6.2: A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.3: A 109 SER OG : rot -90:sc= -0.0797 USER MOD Single : A 1 MET N :NH3+ -166:sc= 1.24 (180deg=1.12) USER MOD Single : A 3 SER OG : rot 50:sc= 0.0378 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 95:sc= 0.203 USER MOD Single : A 11 CYS SG : rot 53:sc= 1.32 USER MOD Single : A 12 LYS NZ :NH3+ -127:sc= 1.24 (180deg=-0.607) USER MOD Single : A 13 THR OG1 : rot 72:sc= 0.388 USER MOD Single : A 14 THR OG1 : rot 73:sc= 0.0608 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ -135:sc= 1.23 (180deg=0.76) USER MOD Single : A 23 LYS NZ :NH3+ 135:sc= 0.772 (180deg=-0.0862) USER MOD Single : A 24 HIS : no HD1:sc= 0.739 K(o=0.74,f=-3.5!) USER MOD Single : A 30 TYR OH : rot 32:sc= 1.25 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 GLN : amide:sc= 1.2 K(o=1.2,f=-1.5!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc=-0.00737 X(o=-0.0074,f=0) USER MOD Single : A 49 TYR OH : rot -37:sc= 0.0363 USER MOD Single : A 51 GLN : amide:sc= -0.695 K(o=-0.7,f=-1.9) USER MOD Single : A 57 GLN : amide:sc= -0.792 K(o=-0.79,f=-2.4!) USER MOD Single : A 58 LYS NZ :NH3+ 158:sc= 0.699 (180deg=-0.0271) USER MOD Single : A 59 CYS SG : rot 180:sc= 0 USER MOD Single : A 64 CYS SG : rot -129:sc= 1.38 USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 MET CE :methyl 160:sc= -0.0929 (180deg=-0.575) USER MOD Single : A 75 HIS : no HD1:sc= -0.478 K(o=-0.48,f=-2.3!) USER MOD Single : A 77 CYS SG : rot 180:sc= -0.182 USER MOD Single : A 78 GLN : amide:sc= 0 K(o=0,f=-0.65) 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 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -165:sc= 1.3 (180deg=1.18) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= 0.204 K(o=0.2,f=-4.1!) USER MOD Single : A 88 LYS NZ :NH3+ 156:sc= 1.54 (180deg=-0.784!) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 CYS SG : rot -170:sc= -4.26! USER MOD Single : A 98 THR OG1 : rot 180:sc=0.000604 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 169:sc= 1.27 (180deg=1.23) USER MOD Single : A 108 SER OG : rot 96:sc= 0.819 USER MOD Single : A 115 LYS NZ :NH3+ -152:sc= 1.22 (180deg=1.01) USER MOD Single : A 116 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0308) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= -0.0905 X(o=-0.09,f=-0.2) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc=0.000681 USER MOD Single : A 131 SER OG : rot -87:sc= 1.18 USER MOD Single : A 134 SER OG : rot -83:sc= 0.0411 USER MOD Single : A 141 LYS NZ :NH3+ -169:sc= 0.784 (180deg=0.32) USER MOD Single : A 145 THR OG1 : rot 120:sc= -0.0511 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.298 -0.639 -1.005 1.00 1.04 N ATOM 2 CA MET A 1 0.920 -0.674 -1.845 1.00 12.51 C ATOM 3 C MET A 1 2.155 -0.677 -0.947 1.00 51.11 C ATOM 4 O MET A 1 2.167 -0.013 0.088 1.00 41.34 O ATOM 5 CB MET A 1 0.939 0.547 -2.777 1.00 62.23 C ATOM 6 CG MET A 1 1.646 0.313 -4.107 1.00 23.25 C ATOM 7 SD MET A 1 3.437 0.174 -3.952 1.00 53.33 S ATOM 8 CE MET A 1 3.853 1.813 -3.360 1.00 25.12 C ATOM 0 H1 MET A 1 -1.128 -0.874 -1.587 1.00 1.04 H new ATOM 0 H2 MET A 1 -0.208 -1.331 -0.234 1.00 1.04 H new ATOM 0 H3 MET A 1 -0.415 0.313 -0.603 1.00 1.04 H new ATOM 0 HA MET A 1 0.922 -1.579 -2.453 1.00 12.51 H new ATOM 0 HB2 MET A 1 -0.088 0.854 -2.974 1.00 62.23 H new ATOM 0 HB3 MET A 1 1.426 1.375 -2.261 1.00 62.23 H new ATOM 0 HG2 MET A 1 1.256 -0.598 -4.562 1.00 23.25 H new ATOM 0 HG3 MET A 1 1.410 1.134 -4.785 1.00 23.25 H new ATOM 0 HE1 MET A 1 4.485 2.315 -4.092 1.00 25.12 H new ATOM 0 HE2 MET A 1 2.940 2.390 -3.214 1.00 25.12 H new ATOM 0 HE3 MET A 1 4.387 1.733 -2.413 1.00 25.12 H new ATOM 20 N ALA A 2 3.183 -1.423 -1.331 1.00 23.04 N ATOM 21 CA ALA A 2 4.398 -1.510 -0.533 1.00 42.13 C ATOM 22 C ALA A 2 5.626 -1.155 -1.364 1.00 34.40 C ATOM 23 O ALA A 2 6.387 -0.251 -1.015 1.00 11.52 O ATOM 24 CB ALA A 2 4.541 -2.905 0.050 1.00 61.32 C ATOM 0 H ALA A 2 3.199 -1.975 -2.188 1.00 23.04 H new ATOM 0 HA ALA A 2 4.323 -0.790 0.282 1.00 42.13 H new ATOM 0 HB1 ALA A 2 5.453 -2.959 0.645 1.00 61.32 H new ATOM 0 HB2 ALA A 2 3.681 -3.125 0.683 1.00 61.32 H new ATOM 0 HB3 ALA A 2 4.592 -3.634 -0.759 1.00 61.32 H new ATOM 30 N SER A 3 5.807 -1.872 -2.462 1.00 44.33 N ATOM 31 CA SER A 3 6.938 -1.660 -3.352 1.00 22.31 C ATOM 32 C SER A 3 6.717 -2.401 -4.666 1.00 2.44 C ATOM 33 O SER A 3 7.015 -3.591 -4.779 1.00 3.03 O ATOM 34 CB SER A 3 8.241 -2.121 -2.682 1.00 74.51 C ATOM 35 OG SER A 3 8.064 -3.357 -2.004 1.00 4.43 O ATOM 0 H SER A 3 5.176 -2.615 -2.761 1.00 44.33 H new ATOM 0 HA SER A 3 7.023 -0.594 -3.565 1.00 22.31 H new ATOM 0 HB2 SER A 3 9.022 -2.225 -3.435 1.00 74.51 H new ATOM 0 HB3 SER A 3 8.578 -1.362 -1.976 1.00 74.51 H new ATOM 0 HG SER A 3 7.636 -4.002 -2.605 1.00 4.43 H new ATOM 41 N GLY A 4 6.164 -1.704 -5.648 1.00 62.42 N ATOM 42 CA GLY A 4 5.856 -2.331 -6.918 1.00 45.53 C ATOM 43 C GLY A 4 4.362 -2.471 -7.123 1.00 62.33 C ATOM 44 O GLY A 4 3.608 -2.557 -6.151 1.00 22.41 O ATOM 0 H GLY A 4 5.923 -0.715 -5.588 1.00 62.42 H new ATOM 0 HA2 GLY A 4 6.281 -1.740 -7.729 1.00 45.53 H new ATOM 0 HA3 GLY A 4 6.324 -3.315 -6.962 1.00 45.53 H new ATOM 48 N VAL A 5 3.928 -2.501 -8.375 1.00 73.33 N ATOM 49 CA VAL A 5 2.509 -2.539 -8.682 1.00 24.52 C ATOM 50 C VAL A 5 2.224 -3.512 -9.827 1.00 30.43 C ATOM 51 O VAL A 5 3.050 -3.696 -10.725 1.00 42.42 O ATOM 52 CB VAL A 5 1.992 -1.127 -9.044 1.00 63.14 C ATOM 53 CG1 VAL A 5 2.619 -0.636 -10.338 1.00 53.40 C ATOM 54 CG2 VAL A 5 0.476 -1.107 -9.141 1.00 34.44 C ATOM 0 H VAL A 5 4.539 -2.500 -9.192 1.00 73.33 H new ATOM 0 HA VAL A 5 1.983 -2.888 -7.793 1.00 24.52 H new ATOM 0 HB VAL A 5 2.287 -0.449 -8.243 1.00 63.14 H new ATOM 0 HG11 VAL A 5 2.240 0.359 -10.571 1.00 53.40 H new ATOM 0 HG12 VAL A 5 3.702 -0.594 -10.224 1.00 53.40 H new ATOM 0 HG13 VAL A 5 2.365 -1.320 -11.148 1.00 53.40 H new ATOM 0 HG21 VAL A 5 0.141 -0.102 -9.397 1.00 34.44 H new ATOM 0 HG22 VAL A 5 0.152 -1.805 -9.913 1.00 34.44 H new ATOM 0 HG23 VAL A 5 0.046 -1.400 -8.183 1.00 34.44 H new ATOM 64 N THR A 6 1.058 -4.133 -9.783 1.00 55.25 N ATOM 65 CA THR A 6 0.644 -5.076 -10.806 1.00 11.42 C ATOM 66 C THR A 6 -0.304 -4.407 -11.799 1.00 5.25 C ATOM 67 O THR A 6 -1.178 -3.646 -11.408 1.00 33.33 O ATOM 68 CB THR A 6 -0.054 -6.285 -10.156 1.00 65.30 C ATOM 69 OG1 THR A 6 0.860 -6.958 -9.278 1.00 34.44 O ATOM 70 CG2 THR A 6 -0.572 -7.254 -11.203 1.00 52.23 C ATOM 0 H THR A 6 0.374 -3.998 -9.039 1.00 55.25 H new ATOM 0 HA THR A 6 1.530 -5.416 -11.342 1.00 11.42 H new ATOM 0 HB THR A 6 -0.907 -5.918 -9.586 1.00 65.30 H new ATOM 0 HG1 THR A 6 0.412 -7.725 -8.865 1.00 34.44 H new ATOM 0 HG21 THR A 6 -1.059 -8.096 -10.711 1.00 52.23 H new ATOM 0 HG22 THR A 6 -1.290 -6.745 -11.846 1.00 52.23 H new ATOM 0 HG23 THR A 6 0.260 -7.618 -11.805 1.00 52.23 H new ATOM 78 N VAL A 7 -0.125 -4.675 -13.082 1.00 2.42 N ATOM 79 CA VAL A 7 -0.990 -4.098 -14.102 1.00 72.10 C ATOM 80 C VAL A 7 -2.071 -5.097 -14.508 1.00 72.50 C ATOM 81 O VAL A 7 -1.763 -6.223 -14.895 1.00 3.23 O ATOM 82 CB VAL A 7 -0.184 -3.680 -15.352 1.00 45.00 C ATOM 83 CG1 VAL A 7 -1.080 -2.992 -16.372 1.00 3.32 C ATOM 84 CG2 VAL A 7 0.981 -2.779 -14.968 1.00 15.00 C ATOM 0 H VAL A 7 0.608 -5.286 -13.443 1.00 2.42 H new ATOM 0 HA VAL A 7 -1.455 -3.209 -13.675 1.00 72.10 H new ATOM 0 HB VAL A 7 0.219 -4.584 -15.809 1.00 45.00 H new ATOM 0 HG11 VAL A 7 -0.489 -2.708 -17.242 1.00 3.32 H new ATOM 0 HG12 VAL A 7 -1.873 -3.674 -16.679 1.00 3.32 H new ATOM 0 HG13 VAL A 7 -1.521 -2.101 -15.926 1.00 3.32 H new ATOM 0 HG21 VAL A 7 1.534 -2.497 -15.864 1.00 15.00 H new ATOM 0 HG22 VAL A 7 0.601 -1.882 -14.479 1.00 15.00 H new ATOM 0 HG23 VAL A 7 1.643 -3.312 -14.285 1.00 15.00 H new ATOM 94 N SER A 8 -3.333 -4.696 -14.395 1.00 3.32 N ATOM 95 CA SER A 8 -4.439 -5.548 -14.811 1.00 42.23 C ATOM 96 C SER A 8 -4.811 -5.275 -16.273 1.00 41.00 C ATOM 97 O SER A 8 -4.510 -4.204 -16.807 1.00 54.20 O ATOM 98 CB SER A 8 -5.643 -5.341 -13.892 1.00 54.41 C ATOM 99 OG SER A 8 -5.327 -5.690 -12.552 1.00 63.20 O ATOM 0 H SER A 8 -3.614 -3.790 -14.020 1.00 3.32 H new ATOM 0 HA SER A 8 -4.125 -6.589 -14.733 1.00 42.23 H new ATOM 0 HB2 SER A 8 -5.963 -4.300 -13.935 1.00 54.41 H new ATOM 0 HB3 SER A 8 -6.480 -5.946 -14.241 1.00 54.41 H new ATOM 0 HG SER A 8 -5.063 -4.886 -12.058 1.00 63.20 H new ATOM 105 N ASP A 9 -5.481 -6.243 -16.900 1.00 12.14 N ATOM 106 CA ASP A 9 -5.743 -6.223 -18.346 1.00 70.44 C ATOM 107 C ASP A 9 -6.498 -4.986 -18.822 1.00 12.44 C ATOM 108 O ASP A 9 -6.268 -4.526 -19.939 1.00 32.45 O ATOM 109 CB ASP A 9 -6.514 -7.474 -18.775 1.00 24.35 C ATOM 110 CG ASP A 9 -5.620 -8.685 -18.933 1.00 52.44 C ATOM 111 OD1 ASP A 9 -4.995 -8.831 -20.006 1.00 43.22 O ATOM 112 OD2 ASP A 9 -5.540 -9.497 -17.991 1.00 14.05 O ATOM 0 H ASP A 9 -5.858 -7.063 -16.424 1.00 12.14 H new ATOM 0 HA ASP A 9 -4.760 -6.199 -18.815 1.00 70.44 H new ATOM 0 HB2 ASP A 9 -7.286 -7.691 -18.037 1.00 24.35 H new ATOM 0 HB3 ASP A 9 -7.022 -7.277 -19.719 1.00 24.35 H new ATOM 117 N VAL A 10 -7.387 -4.442 -17.990 1.00 41.30 N ATOM 118 CA VAL A 10 -8.224 -3.314 -18.410 1.00 1.51 C ATOM 119 C VAL A 10 -7.361 -2.132 -18.860 1.00 50.45 C ATOM 120 O VAL A 10 -7.727 -1.397 -19.778 1.00 1.24 O ATOM 121 CB VAL A 10 -9.214 -2.862 -17.301 1.00 10.04 C ATOM 122 CG1 VAL A 10 -10.265 -1.928 -17.882 1.00 34.44 C ATOM 123 CG2 VAL A 10 -9.878 -4.068 -16.654 1.00 64.11 C ATOM 0 H VAL A 10 -7.546 -4.758 -17.033 1.00 41.30 H new ATOM 0 HA VAL A 10 -8.818 -3.665 -19.254 1.00 1.51 H new ATOM 0 HB VAL A 10 -8.654 -2.325 -16.535 1.00 10.04 H new ATOM 0 HG11 VAL A 10 -10.952 -1.619 -17.094 1.00 34.44 H new ATOM 0 HG12 VAL A 10 -9.777 -1.049 -18.304 1.00 34.44 H new ATOM 0 HG13 VAL A 10 -10.819 -2.446 -18.665 1.00 34.44 H new ATOM 0 HG21 VAL A 10 -10.568 -3.732 -15.880 1.00 64.11 H new ATOM 0 HG22 VAL A 10 -10.427 -4.630 -17.410 1.00 64.11 H new ATOM 0 HG23 VAL A 10 -9.116 -4.707 -16.208 1.00 64.11 H new ATOM 133 N CYS A 11 -6.192 -1.988 -18.243 1.00 55.34 N ATOM 134 CA CYS A 11 -5.253 -0.933 -18.609 1.00 25.41 C ATOM 135 C CYS A 11 -4.746 -1.125 -20.040 1.00 14.42 C ATOM 136 O CYS A 11 -4.611 -0.164 -20.801 1.00 44.40 O ATOM 137 CB CYS A 11 -4.075 -0.919 -17.631 1.00 72.23 C ATOM 138 SG CYS A 11 -2.803 0.309 -18.013 1.00 20.13 S ATOM 0 H CYS A 11 -5.872 -2.591 -17.485 1.00 55.34 H new ATOM 0 HA CYS A 11 -5.774 0.023 -18.557 1.00 25.41 H new ATOM 0 HB2 CYS A 11 -4.454 -0.731 -16.627 1.00 72.23 H new ATOM 0 HB3 CYS A 11 -3.617 -1.908 -17.619 1.00 72.23 H new ATOM 0 HG CYS A 11 -3.354 1.480 -18.137 1.00 20.13 H new ATOM 144 N LYS A 12 -4.487 -2.374 -20.401 1.00 42.35 N ATOM 145 CA LYS A 12 -3.964 -2.702 -21.720 1.00 1.15 C ATOM 146 C LYS A 12 -5.052 -2.575 -22.778 1.00 32.45 C ATOM 147 O LYS A 12 -4.806 -2.083 -23.876 1.00 72.05 O ATOM 148 CB LYS A 12 -3.409 -4.128 -21.729 1.00 62.02 C ATOM 149 CG LYS A 12 -2.775 -4.531 -23.053 1.00 44.42 C ATOM 150 CD LYS A 12 -2.591 -6.036 -23.143 1.00 64.13 C ATOM 151 CE LYS A 12 -3.933 -6.754 -23.200 1.00 74.41 C ATOM 152 NZ LYS A 12 -4.651 -6.509 -24.482 1.00 4.22 N ATOM 0 H LYS A 12 -4.632 -3.181 -19.795 1.00 42.35 H new ATOM 0 HA LYS A 12 -3.163 -2.000 -21.951 1.00 1.15 H new ATOM 0 HB2 LYS A 12 -2.666 -4.224 -20.937 1.00 62.02 H new ATOM 0 HB3 LYS A 12 -4.215 -4.823 -21.496 1.00 62.02 H new ATOM 0 HG2 LYS A 12 -3.401 -4.189 -23.877 1.00 44.42 H new ATOM 0 HG3 LYS A 12 -1.809 -4.038 -23.161 1.00 44.42 H new ATOM 0 HD2 LYS A 12 -2.007 -6.281 -24.030 1.00 64.13 H new ATOM 0 HD3 LYS A 12 -2.024 -6.388 -22.281 1.00 64.13 H new ATOM 0 HE2 LYS A 12 -3.775 -7.825 -23.073 1.00 74.41 H new ATOM 0 HE3 LYS A 12 -4.555 -6.423 -22.369 1.00 74.41 H new ATOM 0 HZ1 LYS A 12 -5.612 -6.166 -24.282 1.00 4.22 H new ATOM 0 HZ2 LYS A 12 -4.137 -5.795 -25.037 1.00 4.22 H new ATOM 0 HZ3 LYS A 12 -4.706 -7.395 -25.024 1.00 4.22 H new ATOM 166 N THR A 13 -6.254 -3.019 -22.434 1.00 34.34 N ATOM 167 CA THR A 13 -7.372 -3.044 -23.369 1.00 42.01 C ATOM 168 C THR A 13 -7.703 -1.646 -23.900 1.00 31.51 C ATOM 169 O THR A 13 -8.002 -1.478 -25.083 1.00 34.43 O ATOM 170 CB THR A 13 -8.616 -3.658 -22.702 1.00 5.45 C ATOM 171 OG1 THR A 13 -8.256 -4.898 -22.079 1.00 72.23 O ATOM 172 CG2 THR A 13 -9.723 -3.903 -23.719 1.00 30.03 C ATOM 0 H THR A 13 -6.481 -3.370 -21.504 1.00 34.34 H new ATOM 0 HA THR A 13 -7.073 -3.662 -24.216 1.00 42.01 H new ATOM 0 HB THR A 13 -8.988 -2.956 -21.956 1.00 5.45 H new ATOM 0 HG1 THR A 13 -7.721 -4.718 -21.278 1.00 72.23 H new ATOM 0 HG21 THR A 13 -10.588 -4.337 -23.218 1.00 30.03 H new ATOM 0 HG22 THR A 13 -10.008 -2.958 -24.181 1.00 30.03 H new ATOM 0 HG23 THR A 13 -9.366 -4.590 -24.487 1.00 30.03 H new ATOM 180 N THR A 14 -7.640 -0.642 -23.037 1.00 64.32 N ATOM 181 CA THR A 14 -7.920 0.720 -23.461 1.00 32.30 C ATOM 182 C THR A 14 -6.746 1.293 -24.258 1.00 13.30 C ATOM 183 O THR A 14 -6.943 1.948 -25.287 1.00 72.25 O ATOM 184 CB THR A 14 -8.230 1.632 -22.264 1.00 61.14 C ATOM 185 OG1 THR A 14 -9.189 0.997 -21.409 1.00 4.51 O ATOM 186 CG2 THR A 14 -8.782 2.968 -22.742 1.00 14.23 C ATOM 0 H THR A 14 -7.400 -0.743 -22.051 1.00 64.32 H new ATOM 0 HA THR A 14 -8.802 0.684 -24.101 1.00 32.30 H new ATOM 0 HB THR A 14 -7.307 1.809 -21.712 1.00 61.14 H new ATOM 0 HG1 THR A 14 -8.759 0.261 -20.926 1.00 4.51 H new ATOM 0 HG21 THR A 14 -8.996 3.602 -21.882 1.00 14.23 H new ATOM 0 HG22 THR A 14 -8.047 3.458 -23.380 1.00 14.23 H new ATOM 0 HG23 THR A 14 -9.699 2.802 -23.307 1.00 14.23 H new ATOM 194 N TYR A 15 -5.525 1.020 -23.795 1.00 54.34 N ATOM 195 CA TYR A 15 -4.324 1.482 -24.485 1.00 15.33 C ATOM 196 C TYR A 15 -4.215 0.826 -25.863 1.00 64.12 C ATOM 197 O TYR A 15 -3.676 1.414 -26.802 1.00 50.23 O ATOM 198 CB TYR A 15 -3.072 1.195 -23.640 1.00 1.51 C ATOM 199 CG TYR A 15 -1.764 1.457 -24.363 1.00 13.33 C ATOM 200 CD1 TYR A 15 -1.330 2.753 -24.641 1.00 14.14 C ATOM 201 CD2 TYR A 15 -0.969 0.399 -24.781 1.00 74.55 C ATOM 202 CE1 TYR A 15 -0.144 2.976 -25.315 1.00 62.44 C ATOM 203 CE2 TYR A 15 0.214 0.616 -25.457 1.00 21.21 C ATOM 204 CZ TYR A 15 0.622 1.905 -25.721 1.00 32.33 C ATOM 205 OH TYR A 15 1.798 2.123 -26.405 1.00 34.21 O ATOM 0 H TYR A 15 -5.344 0.483 -22.947 1.00 54.34 H new ATOM 0 HA TYR A 15 -4.397 2.560 -24.626 1.00 15.33 H new ATOM 0 HB2 TYR A 15 -3.106 1.808 -22.739 1.00 1.51 H new ATOM 0 HB3 TYR A 15 -3.095 0.154 -23.318 1.00 1.51 H new ATOM 0 HD1 TYR A 15 -1.929 3.594 -24.325 1.00 14.14 H new ATOM 0 HD2 TYR A 15 -1.282 -0.613 -24.573 1.00 74.55 H new ATOM 0 HE1 TYR A 15 0.181 3.985 -25.522 1.00 62.44 H new ATOM 0 HE2 TYR A 15 0.817 -0.221 -25.778 1.00 21.21 H new ATOM 0 HH TYR A 15 2.227 2.937 -26.068 1.00 34.21 H new ATOM 215 N GLU A 16 -4.764 -0.379 -25.971 1.00 4.14 N ATOM 216 CA GLU A 16 -4.767 -1.139 -27.218 1.00 63.42 C ATOM 217 C GLU A 16 -5.343 -0.307 -28.359 1.00 43.01 C ATOM 218 O GLU A 16 -4.752 -0.201 -29.432 1.00 12.31 O ATOM 219 CB GLU A 16 -5.612 -2.405 -27.048 1.00 55.35 C ATOM 220 CG GLU A 16 -5.201 -3.550 -27.954 1.00 51.22 C ATOM 221 CD GLU A 16 -3.898 -4.180 -27.512 1.00 12.22 C ATOM 222 OE1 GLU A 16 -3.894 -4.865 -26.468 1.00 23.24 O ATOM 223 OE2 GLU A 16 -2.872 -3.991 -28.196 1.00 25.33 O ATOM 0 H GLU A 16 -5.221 -0.858 -25.195 1.00 4.14 H new ATOM 0 HA GLU A 16 -3.738 -1.405 -27.459 1.00 63.42 H new ATOM 0 HB2 GLU A 16 -5.548 -2.735 -26.011 1.00 55.35 H new ATOM 0 HB3 GLU A 16 -6.657 -2.160 -27.241 1.00 55.35 H new ATOM 0 HG2 GLU A 16 -5.986 -4.306 -27.962 1.00 51.22 H new ATOM 0 HG3 GLU A 16 -5.100 -3.186 -28.976 1.00 51.22 H new ATOM 230 N GLU A 17 -6.496 0.299 -28.111 1.00 15.22 N ATOM 231 CA GLU A 17 -7.188 1.052 -29.142 1.00 13.31 C ATOM 232 C GLU A 17 -6.630 2.463 -29.285 1.00 30.35 C ATOM 233 O GLU A 17 -6.604 3.004 -30.387 1.00 22.24 O ATOM 234 CB GLU A 17 -8.686 1.123 -28.860 1.00 61.53 C ATOM 235 CG GLU A 17 -9.386 -0.222 -28.904 1.00 44.52 C ATOM 236 CD GLU A 17 -10.891 -0.076 -28.949 1.00 0.20 C ATOM 237 OE1 GLU A 17 -11.499 0.203 -27.898 1.00 55.35 O ATOM 238 OE2 GLU A 17 -11.470 -0.208 -30.047 1.00 43.42 O ATOM 0 H GLU A 17 -6.969 0.283 -27.207 1.00 15.22 H new ATOM 0 HA GLU A 17 -7.025 0.521 -30.080 1.00 13.31 H new ATOM 0 HB2 GLU A 17 -8.840 1.569 -27.877 1.00 61.53 H new ATOM 0 HB3 GLU A 17 -9.151 1.787 -29.588 1.00 61.53 H new ATOM 0 HG2 GLU A 17 -9.049 -0.778 -29.779 1.00 44.52 H new ATOM 0 HG3 GLU A 17 -9.104 -0.806 -28.028 1.00 44.52 H new ATOM 245 N ILE A 18 -6.181 3.062 -28.187 1.00 51.34 N ATOM 246 CA ILE A 18 -5.710 4.444 -28.238 1.00 53.20 C ATOM 247 C ILE A 18 -4.363 4.534 -28.958 1.00 60.22 C ATOM 248 O ILE A 18 -4.053 5.542 -29.580 1.00 74.24 O ATOM 249 CB ILE A 18 -5.619 5.096 -26.833 1.00 21.51 C ATOM 250 CG1 ILE A 18 -5.304 6.591 -26.955 1.00 54.31 C ATOM 251 CG2 ILE A 18 -4.575 4.408 -25.974 1.00 11.01 C ATOM 252 CD1 ILE A 18 -5.190 7.301 -25.622 1.00 22.41 C ATOM 0 H ILE A 18 -6.133 2.624 -27.267 1.00 51.34 H new ATOM 0 HA ILE A 18 -6.453 5.006 -28.804 1.00 53.20 H new ATOM 0 HB ILE A 18 -6.588 4.978 -26.347 1.00 21.51 H new ATOM 0 HG12 ILE A 18 -4.369 6.713 -27.502 1.00 54.31 H new ATOM 0 HG13 ILE A 18 -6.084 7.070 -27.546 1.00 54.31 H new ATOM 0 HG21 ILE A 18 -4.535 4.888 -24.996 1.00 11.01 H new ATOM 0 HG22 ILE A 18 -4.839 3.357 -25.852 1.00 11.01 H new ATOM 0 HG23 ILE A 18 -3.600 4.484 -26.455 1.00 11.01 H new ATOM 0 HD11 ILE A 18 -4.966 8.355 -25.789 1.00 22.41 H new ATOM 0 HD12 ILE A 18 -6.132 7.212 -25.080 1.00 22.41 H new ATOM 0 HD13 ILE A 18 -4.390 6.848 -25.036 1.00 22.41 H new ATOM 264 N LYS A 19 -3.570 3.473 -28.901 1.00 32.50 N ATOM 265 CA LYS A 19 -2.301 3.464 -29.614 1.00 45.13 C ATOM 266 C LYS A 19 -2.519 3.151 -31.093 1.00 41.45 C ATOM 267 O LYS A 19 -1.709 3.519 -31.939 1.00 54.04 O ATOM 268 CB LYS A 19 -1.315 2.462 -28.999 1.00 11.13 C ATOM 269 CG LYS A 19 -1.597 1.005 -29.341 1.00 30.32 C ATOM 270 CD LYS A 19 -0.536 0.083 -28.756 1.00 43.42 C ATOM 271 CE LYS A 19 0.864 0.485 -29.199 1.00 42.34 C ATOM 272 NZ LYS A 19 1.914 -0.349 -28.556 1.00 43.24 N ATOM 0 H LYS A 19 -3.777 2.622 -28.378 1.00 32.50 H new ATOM 0 HA LYS A 19 -1.866 4.459 -29.523 1.00 45.13 H new ATOM 0 HB2 LYS A 19 -0.308 2.712 -29.333 1.00 11.13 H new ATOM 0 HB3 LYS A 19 -1.329 2.577 -27.915 1.00 11.13 H new ATOM 0 HG2 LYS A 19 -2.578 0.723 -28.958 1.00 30.32 H new ATOM 0 HG3 LYS A 19 -1.630 0.883 -30.424 1.00 30.32 H new ATOM 0 HD2 LYS A 19 -0.594 0.105 -27.668 1.00 43.42 H new ATOM 0 HD3 LYS A 19 -0.735 -0.943 -29.065 1.00 43.42 H new ATOM 0 HE2 LYS A 19 0.942 0.393 -30.282 1.00 42.34 H new ATOM 0 HE3 LYS A 19 1.034 1.534 -28.955 1.00 42.34 H new ATOM 0 HZ1 LYS A 19 2.851 -0.042 -28.885 1.00 43.24 H new ATOM 0 HZ2 LYS A 19 1.858 -0.242 -27.523 1.00 43.24 H new ATOM 0 HZ3 LYS A 19 1.768 -1.347 -28.809 1.00 43.24 H new ATOM 286 N LYS A 20 -3.619 2.473 -31.398 1.00 42.24 N ATOM 287 CA LYS A 20 -3.888 2.036 -32.762 1.00 14.34 C ATOM 288 C LYS A 20 -4.736 3.061 -33.516 1.00 10.42 C ATOM 289 O LYS A 20 -4.349 3.534 -34.588 1.00 4.00 O ATOM 290 CB LYS A 20 -4.602 0.681 -32.747 1.00 54.32 C ATOM 291 CG LYS A 20 -4.679 0.018 -34.114 1.00 73.23 C ATOM 292 CD LYS A 20 -5.563 -1.221 -34.092 1.00 11.23 C ATOM 293 CE LYS A 20 -7.025 -0.861 -33.874 1.00 64.21 C ATOM 294 NZ LYS A 20 -7.904 -2.059 -33.898 1.00 34.24 N ATOM 0 H LYS A 20 -4.337 2.215 -30.721 1.00 42.24 H new ATOM 0 HA LYS A 20 -2.933 1.938 -33.279 1.00 14.34 H new ATOM 0 HB2 LYS A 20 -4.084 0.014 -32.058 1.00 54.32 H new ATOM 0 HB3 LYS A 20 -5.612 0.816 -32.361 1.00 54.32 H new ATOM 0 HG2 LYS A 20 -5.069 0.730 -34.842 1.00 73.23 H new ATOM 0 HG3 LYS A 20 -3.676 -0.257 -34.442 1.00 73.23 H new ATOM 0 HD2 LYS A 20 -5.457 -1.761 -35.033 1.00 11.23 H new ATOM 0 HD3 LYS A 20 -5.231 -1.892 -33.300 1.00 11.23 H new ATOM 0 HE2 LYS A 20 -7.134 -0.351 -32.917 1.00 64.21 H new ATOM 0 HE3 LYS A 20 -7.345 -0.161 -34.646 1.00 64.21 H new ATOM 0 HZ1 LYS A 20 -8.891 -1.769 -33.746 1.00 34.24 H new ATOM 0 HZ2 LYS A 20 -7.821 -2.532 -34.820 1.00 34.24 H new ATOM 0 HZ3 LYS A 20 -7.616 -2.716 -33.145 1.00 34.24 H new ATOM 308 N ASP A 21 -5.890 3.402 -32.950 1.00 63.31 N ATOM 309 CA ASP A 21 -6.854 4.273 -33.622 1.00 13.14 C ATOM 310 C ASP A 21 -7.018 5.595 -32.875 1.00 55.01 C ATOM 311 O ASP A 21 -7.557 6.558 -33.419 1.00 23.12 O ATOM 312 CB ASP A 21 -8.206 3.560 -33.734 1.00 43.34 C ATOM 313 CG ASP A 21 -9.185 4.294 -34.629 1.00 14.42 C ATOM 314 OD1 ASP A 21 -8.958 4.331 -35.856 1.00 44.41 O ATOM 315 OD2 ASP A 21 -10.195 4.814 -34.117 1.00 11.11 O ATOM 0 H ASP A 21 -6.183 3.088 -32.025 1.00 63.31 H new ATOM 0 HA ASP A 21 -6.477 4.495 -34.620 1.00 13.14 H new ATOM 0 HB2 ASP A 21 -8.050 2.554 -34.123 1.00 43.34 H new ATOM 0 HB3 ASP A 21 -8.639 3.454 -32.739 1.00 43.34 H new ATOM 320 N LYS A 22 -6.558 5.607 -31.619 1.00 30.01 N ATOM 321 CA LYS A 22 -6.545 6.795 -30.741 1.00 51.30 C ATOM 322 C LYS A 22 -7.907 7.496 -30.653 1.00 52.21 C ATOM 323 O LYS A 22 -7.987 8.676 -30.316 1.00 34.40 O ATOM 324 CB LYS A 22 -5.464 7.799 -31.179 1.00 71.44 C ATOM 325 CG LYS A 22 -5.823 8.603 -32.412 1.00 61.52 C ATOM 326 CD LYS A 22 -4.860 9.741 -32.640 1.00 33.42 C ATOM 327 CE LYS A 22 -5.525 10.828 -33.453 1.00 54.42 C ATOM 328 NZ LYS A 22 -4.668 12.033 -33.579 1.00 70.23 N ATOM 0 H LYS A 22 -6.175 4.775 -31.169 1.00 30.01 H new ATOM 0 HA LYS A 22 -6.309 6.425 -29.743 1.00 51.30 H new ATOM 0 HB2 LYS A 22 -5.268 8.486 -30.356 1.00 71.44 H new ATOM 0 HB3 LYS A 22 -4.538 7.257 -31.370 1.00 71.44 H new ATOM 0 HG2 LYS A 22 -5.826 7.949 -33.284 1.00 61.52 H new ATOM 0 HG3 LYS A 22 -6.834 8.998 -32.307 1.00 61.52 H new ATOM 0 HD2 LYS A 22 -4.527 10.143 -31.683 1.00 33.42 H new ATOM 0 HD3 LYS A 22 -3.973 9.379 -33.159 1.00 33.42 H new ATOM 0 HE2 LYS A 22 -5.760 10.445 -34.446 1.00 54.42 H new ATOM 0 HE3 LYS A 22 -6.470 11.103 -32.985 1.00 54.42 H new ATOM 0 HZ1 LYS A 22 -5.240 12.885 -33.409 1.00 70.23 H new ATOM 0 HZ2 LYS A 22 -3.899 11.987 -32.880 1.00 70.23 H new ATOM 0 HZ3 LYS A 22 -4.264 12.073 -34.536 1.00 70.23 H new ATOM 342 N LYS A 23 -8.985 6.766 -30.911 1.00 21.41 N ATOM 343 CA LYS A 23 -10.309 7.371 -30.897 1.00 71.30 C ATOM 344 C LYS A 23 -10.830 7.495 -29.469 1.00 60.53 C ATOM 345 O LYS A 23 -11.804 8.202 -29.211 1.00 4.12 O ATOM 346 CB LYS A 23 -11.277 6.580 -31.777 1.00 45.20 C ATOM 347 CG LYS A 23 -12.222 7.468 -32.576 1.00 2.32 C ATOM 348 CD LYS A 23 -11.460 8.553 -33.340 1.00 50.15 C ATOM 349 CE LYS A 23 -10.447 7.972 -34.319 1.00 35.02 C ATOM 350 NZ LYS A 23 -11.088 7.188 -35.406 1.00 74.35 N ATOM 0 H LYS A 23 -8.970 5.770 -31.129 1.00 21.41 H new ATOM 0 HA LYS A 23 -10.232 8.376 -31.311 1.00 71.30 H new ATOM 0 HB2 LYS A 23 -10.706 5.956 -32.465 1.00 45.20 H new ATOM 0 HB3 LYS A 23 -11.863 5.909 -31.149 1.00 45.20 H new ATOM 0 HG2 LYS A 23 -12.790 6.858 -33.278 1.00 2.32 H new ATOM 0 HG3 LYS A 23 -12.942 7.933 -31.903 1.00 2.32 H new ATOM 0 HD2 LYS A 23 -12.169 9.177 -33.883 1.00 50.15 H new ATOM 0 HD3 LYS A 23 -10.945 9.200 -32.630 1.00 50.15 H new ATOM 0 HE2 LYS A 23 -9.864 8.782 -34.756 1.00 35.02 H new ATOM 0 HE3 LYS A 23 -9.749 7.333 -33.778 1.00 35.02 H new ATOM 0 HZ1 LYS A 23 -10.659 7.444 -36.318 1.00 74.35 H new ATOM 0 HZ2 LYS A 23 -10.948 6.173 -35.231 1.00 74.35 H new ATOM 0 HZ3 LYS A 23 -12.106 7.398 -35.431 1.00 74.35 H new ATOM 364 N HIS A 24 -10.169 6.811 -28.542 1.00 21.42 N ATOM 365 CA HIS A 24 -10.453 6.983 -27.122 1.00 42.13 C ATOM 366 C HIS A 24 -9.528 8.056 -26.573 1.00 40.54 C ATOM 367 O HIS A 24 -8.356 7.796 -26.326 1.00 65.21 O ATOM 368 CB HIS A 24 -10.258 5.680 -26.333 1.00 32.10 C ATOM 369 CG HIS A 24 -11.176 4.563 -26.729 1.00 5.55 C ATOM 370 ND1 HIS A 24 -12.473 4.444 -26.276 1.00 74.10 N ATOM 371 CD2 HIS A 24 -10.960 3.489 -27.519 1.00 4.11 C ATOM 372 CE1 HIS A 24 -13.008 3.341 -26.769 1.00 20.41 C ATOM 373 NE2 HIS A 24 -12.110 2.742 -27.526 1.00 4.45 N ATOM 0 H HIS A 24 -9.434 6.134 -28.747 1.00 21.42 H new ATOM 0 HA HIS A 24 -11.497 7.275 -27.011 1.00 42.13 H new ATOM 0 HB2 HIS A 24 -9.228 5.347 -26.458 1.00 32.10 H new ATOM 0 HB3 HIS A 24 -10.399 5.889 -25.273 1.00 32.10 H new ATOM 0 HD2 HIS A 24 -10.047 3.260 -28.049 1.00 4.11 H new ATOM 0 HE1 HIS A 24 -14.012 2.989 -26.583 1.00 20.41 H new ATOM 0 HE2 HIS A 24 -12.248 1.868 -28.033 1.00 4.45 H new ATOM 382 N ARG A 25 -10.059 9.259 -26.407 1.00 52.31 N ATOM 383 CA ARG A 25 -9.252 10.412 -26.031 1.00 72.41 C ATOM 384 C ARG A 25 -8.650 10.273 -24.644 1.00 4.52 C ATOM 385 O ARG A 25 -7.461 10.522 -24.451 1.00 75.05 O ATOM 386 CB ARG A 25 -10.084 11.695 -26.102 1.00 61.44 C ATOM 387 CG ARG A 25 -10.293 12.199 -27.516 1.00 64.33 C ATOM 388 CD ARG A 25 -8.966 12.527 -28.170 1.00 32.30 C ATOM 389 NE ARG A 25 -9.107 12.893 -29.575 1.00 55.21 N ATOM 390 CZ ARG A 25 -8.191 12.619 -30.500 1.00 51.41 C ATOM 391 NH1 ARG A 25 -7.052 12.030 -30.148 1.00 14.02 N ATOM 392 NH2 ARG A 25 -8.408 12.959 -31.767 1.00 43.34 N ATOM 0 H ARG A 25 -11.051 9.463 -26.528 1.00 52.31 H new ATOM 0 HA ARG A 25 -8.430 10.465 -26.745 1.00 72.41 H new ATOM 0 HB2 ARG A 25 -11.055 11.515 -25.641 1.00 61.44 H new ATOM 0 HB3 ARG A 25 -9.592 12.471 -25.516 1.00 61.44 H new ATOM 0 HG2 ARG A 25 -10.816 11.444 -28.103 1.00 64.33 H new ATOM 0 HG3 ARG A 25 -10.926 13.086 -27.501 1.00 64.33 H new ATOM 0 HD2 ARG A 25 -8.493 13.347 -27.631 1.00 32.30 H new ATOM 0 HD3 ARG A 25 -8.302 11.666 -28.088 1.00 32.30 H new ATOM 0 HE ARG A 25 -9.953 13.385 -29.863 1.00 55.21 H new ATOM 0 HH11 ARG A 25 -6.883 11.790 -29.171 1.00 14.02 H new ATOM 0 HH12 ARG A 25 -6.348 11.818 -30.855 1.00 14.02 H new ATOM 0 HH21 ARG A 25 -9.275 13.429 -32.028 1.00 43.34 H new ATOM 0 HH22 ARG A 25 -7.707 12.750 -32.478 1.00 43.34 H new ATOM 406 N TYR A 26 -9.459 9.872 -23.680 1.00 24.03 N ATOM 407 CA TYR A 26 -9.019 9.897 -22.298 1.00 11.34 C ATOM 408 C TYR A 26 -9.365 8.601 -21.579 1.00 34.50 C ATOM 409 O TYR A 26 -10.462 8.063 -21.735 1.00 34.24 O ATOM 410 CB TYR A 26 -9.649 11.094 -21.584 1.00 11.52 C ATOM 411 CG TYR A 26 -9.014 11.434 -20.254 1.00 23.30 C ATOM 412 CD1 TYR A 26 -7.637 11.361 -20.079 1.00 1.01 C ATOM 413 CD2 TYR A 26 -9.790 11.843 -19.179 1.00 1.50 C ATOM 414 CE1 TYR A 26 -7.054 11.684 -18.870 1.00 71.45 C ATOM 415 CE2 TYR A 26 -9.213 12.171 -17.967 1.00 45.20 C ATOM 416 CZ TYR A 26 -7.845 12.089 -17.818 1.00 23.44 C ATOM 417 OH TYR A 26 -7.266 12.418 -16.614 1.00 74.41 O ATOM 0 H TYR A 26 -10.409 9.530 -23.825 1.00 24.03 H new ATOM 0 HA TYR A 26 -7.934 9.996 -22.282 1.00 11.34 H new ATOM 0 HB2 TYR A 26 -9.586 11.965 -22.236 1.00 11.52 H new ATOM 0 HB3 TYR A 26 -10.708 10.891 -21.426 1.00 11.52 H new ATOM 0 HD1 TYR A 26 -7.013 11.046 -20.902 1.00 1.01 H new ATOM 0 HD2 TYR A 26 -10.862 11.906 -19.291 1.00 1.50 H new ATOM 0 HE1 TYR A 26 -5.983 11.619 -18.750 1.00 71.45 H new ATOM 0 HE2 TYR A 26 -9.831 12.490 -17.141 1.00 45.20 H new ATOM 0 HH TYR A 26 -7.913 12.905 -16.062 1.00 74.41 H new ATOM 427 N VAL A 27 -8.413 8.102 -20.803 1.00 4.34 N ATOM 428 CA VAL A 27 -8.609 6.897 -20.014 1.00 72.34 C ATOM 429 C VAL A 27 -8.128 7.110 -18.579 1.00 0.00 C ATOM 430 O VAL A 27 -7.012 7.576 -18.351 1.00 44.42 O ATOM 431 CB VAL A 27 -7.880 5.688 -20.651 1.00 44.32 C ATOM 432 CG1 VAL A 27 -6.442 6.036 -21.005 1.00 25.01 C ATOM 433 CG2 VAL A 27 -7.922 4.482 -19.728 1.00 40.12 C ATOM 0 H VAL A 27 -7.488 8.520 -20.704 1.00 4.34 H new ATOM 0 HA VAL A 27 -9.677 6.679 -19.996 1.00 72.34 H new ATOM 0 HB VAL A 27 -8.404 5.435 -21.573 1.00 44.32 H new ATOM 0 HG11 VAL A 27 -5.956 5.168 -21.450 1.00 25.01 H new ATOM 0 HG12 VAL A 27 -6.432 6.862 -21.717 1.00 25.01 H new ATOM 0 HG13 VAL A 27 -5.906 6.329 -20.102 1.00 25.01 H new ATOM 0 HG21 VAL A 27 -7.404 3.646 -20.198 1.00 40.12 H new ATOM 0 HG22 VAL A 27 -7.434 4.728 -18.785 1.00 40.12 H new ATOM 0 HG23 VAL A 27 -8.959 4.205 -19.538 1.00 40.12 H new ATOM 443 N ILE A 28 -8.990 6.791 -17.623 1.00 72.25 N ATOM 444 CA ILE A 28 -8.675 6.943 -16.210 1.00 54.31 C ATOM 445 C ILE A 28 -8.259 5.615 -15.596 1.00 64.01 C ATOM 446 O ILE A 28 -9.036 4.654 -15.573 1.00 24.34 O ATOM 447 CB ILE A 28 -9.883 7.518 -15.428 1.00 24.33 C ATOM 448 CG1 ILE A 28 -10.056 9.008 -15.740 1.00 24.31 C ATOM 449 CG2 ILE A 28 -9.731 7.297 -13.925 1.00 51.24 C ATOM 450 CD1 ILE A 28 -8.880 9.854 -15.302 1.00 64.04 C ATOM 0 H ILE A 28 -9.923 6.421 -17.804 1.00 72.25 H new ATOM 0 HA ILE A 28 -7.842 7.642 -16.138 1.00 54.31 H new ATOM 0 HB ILE A 28 -10.777 6.985 -15.750 1.00 24.33 H new ATOM 0 HG12 ILE A 28 -10.204 9.132 -16.813 1.00 24.31 H new ATOM 0 HG13 ILE A 28 -10.959 9.372 -15.249 1.00 24.31 H new ATOM 0 HG21 ILE A 28 -10.595 7.712 -13.407 1.00 51.24 H new ATOM 0 HG22 ILE A 28 -9.663 6.229 -13.719 1.00 51.24 H new ATOM 0 HG23 ILE A 28 -8.825 7.792 -13.574 1.00 51.24 H new ATOM 0 HD11 ILE A 28 -9.069 10.898 -15.553 1.00 64.04 H new ATOM 0 HD12 ILE A 28 -8.745 9.759 -14.225 1.00 64.04 H new ATOM 0 HD13 ILE A 28 -7.978 9.516 -15.812 1.00 64.04 H new ATOM 462 N PHE A 29 -7.033 5.577 -15.105 1.00 24.54 N ATOM 463 CA PHE A 29 -6.518 4.412 -14.417 1.00 35.11 C ATOM 464 C PHE A 29 -6.610 4.628 -12.911 1.00 42.21 C ATOM 465 O PHE A 29 -6.092 5.616 -12.382 1.00 4.40 O ATOM 466 CB PHE A 29 -5.055 4.143 -14.791 1.00 60.54 C ATOM 467 CG PHE A 29 -4.753 4.224 -16.259 1.00 61.12 C ATOM 468 CD1 PHE A 29 -4.923 3.124 -17.081 1.00 52.23 C ATOM 469 CD2 PHE A 29 -4.286 5.402 -16.814 1.00 75.54 C ATOM 470 CE1 PHE A 29 -4.632 3.199 -18.429 1.00 63.13 C ATOM 471 CE2 PHE A 29 -3.995 5.484 -18.159 1.00 2.21 C ATOM 472 CZ PHE A 29 -4.169 4.381 -18.969 1.00 42.22 C ATOM 0 H PHE A 29 -6.371 6.350 -15.173 1.00 24.54 H new ATOM 0 HA PHE A 29 -7.117 3.552 -14.717 1.00 35.11 H new ATOM 0 HB2 PHE A 29 -4.423 4.859 -14.265 1.00 60.54 H new ATOM 0 HB3 PHE A 29 -4.780 3.151 -14.432 1.00 60.54 H new ATOM 0 HD1 PHE A 29 -5.287 2.197 -16.664 1.00 52.23 H new ATOM 0 HD2 PHE A 29 -4.148 6.269 -16.185 1.00 75.54 H new ATOM 0 HE1 PHE A 29 -4.767 2.333 -19.060 1.00 63.13 H new ATOM 0 HE2 PHE A 29 -3.631 6.411 -18.578 1.00 2.21 H new ATOM 0 HZ PHE A 29 -3.943 4.443 -20.023 1.00 42.22 H new ATOM 482 N TYR A 30 -7.271 3.717 -12.227 1.00 4.45 N ATOM 483 CA TYR A 30 -7.363 3.773 -10.780 1.00 52.54 C ATOM 484 C TYR A 30 -6.563 2.628 -10.182 1.00 42.20 C ATOM 485 O TYR A 30 -6.449 1.563 -10.783 1.00 3.54 O ATOM 486 CB TYR A 30 -8.822 3.705 -10.323 1.00 41.55 C ATOM 487 CG TYR A 30 -8.993 3.682 -8.816 1.00 21.40 C ATOM 488 CD1 TYR A 30 -8.646 4.782 -8.044 1.00 25.01 C ATOM 489 CD2 TYR A 30 -9.493 2.559 -8.168 1.00 52.11 C ATOM 490 CE1 TYR A 30 -8.790 4.765 -6.671 1.00 60.11 C ATOM 491 CE2 TYR A 30 -9.638 2.535 -6.794 1.00 13.40 C ATOM 492 CZ TYR A 30 -9.288 3.641 -6.052 1.00 61.02 C ATOM 493 OH TYR A 30 -9.428 3.619 -4.684 1.00 42.42 O ATOM 0 H TYR A 30 -7.755 2.925 -12.651 1.00 4.45 H new ATOM 0 HA TYR A 30 -6.951 4.721 -10.434 1.00 52.54 H new ATOM 0 HB2 TYR A 30 -9.359 4.563 -10.727 1.00 41.55 H new ATOM 0 HB3 TYR A 30 -9.284 2.812 -10.745 1.00 41.55 H new ATOM 0 HD1 TYR A 30 -8.257 5.667 -8.526 1.00 25.01 H new ATOM 0 HD2 TYR A 30 -9.773 1.691 -8.747 1.00 52.11 H new ATOM 0 HE1 TYR A 30 -8.513 5.629 -6.086 1.00 60.11 H new ATOM 0 HE2 TYR A 30 -10.024 1.653 -6.304 1.00 13.40 H new ATOM 0 HH TYR A 30 -9.627 4.523 -4.361 1.00 42.42 H new ATOM 503 N ILE A 31 -5.995 2.852 -9.015 1.00 12.12 N ATOM 504 CA ILE A 31 -5.214 1.828 -8.357 1.00 21.41 C ATOM 505 C ILE A 31 -6.148 0.900 -7.565 1.00 41.02 C ATOM 506 O ILE A 31 -6.619 1.223 -6.474 1.00 13.33 O ATOM 507 CB ILE A 31 -4.115 2.482 -7.473 1.00 43.32 C ATOM 508 CG1 ILE A 31 -3.168 1.446 -6.857 1.00 23.34 C ATOM 509 CG2 ILE A 31 -4.718 3.370 -6.396 1.00 43.52 C ATOM 510 CD1 ILE A 31 -2.347 0.698 -7.877 1.00 52.21 C ATOM 0 H ILE A 31 -6.060 3.733 -8.504 1.00 12.12 H new ATOM 0 HA ILE A 31 -4.697 1.213 -9.094 1.00 21.41 H new ATOM 0 HB ILE A 31 -3.520 3.110 -8.136 1.00 43.32 H new ATOM 0 HG12 ILE A 31 -2.497 1.948 -6.160 1.00 23.34 H new ATOM 0 HG13 ILE A 31 -3.752 0.731 -6.278 1.00 23.34 H new ATOM 0 HG21 ILE A 31 -3.920 3.810 -5.798 1.00 43.52 H new ATOM 0 HG22 ILE A 31 -5.301 4.164 -6.863 1.00 43.52 H new ATOM 0 HG23 ILE A 31 -5.366 2.774 -5.754 1.00 43.52 H new ATOM 0 HD11 ILE A 31 -1.700 -0.018 -7.369 1.00 52.21 H new ATOM 0 HD12 ILE A 31 -3.011 0.167 -8.560 1.00 52.21 H new ATOM 0 HD13 ILE A 31 -1.736 1.403 -8.440 1.00 52.21 H new ATOM 522 N ARG A 32 -6.433 -0.254 -8.153 1.00 12.24 N ATOM 523 CA ARG A 32 -7.407 -1.183 -7.604 1.00 11.11 C ATOM 524 C ARG A 32 -6.774 -2.042 -6.527 1.00 54.30 C ATOM 525 O ARG A 32 -5.616 -2.463 -6.651 1.00 64.20 O ATOM 526 CB ARG A 32 -7.996 -2.076 -8.703 1.00 72.14 C ATOM 527 CG ARG A 32 -6.978 -2.986 -9.375 1.00 24.12 C ATOM 528 CD ARG A 32 -7.624 -3.896 -10.408 1.00 72.24 C ATOM 529 NE ARG A 32 -8.594 -4.812 -9.814 1.00 23.03 N ATOM 530 CZ ARG A 32 -8.681 -6.105 -10.126 1.00 24.25 C ATOM 531 NH1 ARG A 32 -7.849 -6.635 -11.018 1.00 60.31 N ATOM 532 NH2 ARG A 32 -9.594 -6.870 -9.544 1.00 51.51 N ATOM 0 H ARG A 32 -5.997 -0.570 -9.019 1.00 12.24 H new ATOM 0 HA ARG A 32 -8.214 -0.598 -7.163 1.00 11.11 H new ATOM 0 HB2 ARG A 32 -8.788 -2.689 -8.273 1.00 72.14 H new ATOM 0 HB3 ARG A 32 -8.459 -1.444 -9.461 1.00 72.14 H new ATOM 0 HG2 ARG A 32 -6.210 -2.379 -9.855 1.00 24.12 H new ATOM 0 HG3 ARG A 32 -6.479 -3.592 -8.619 1.00 24.12 H new ATOM 0 HD2 ARG A 32 -8.119 -3.288 -11.165 1.00 72.24 H new ATOM 0 HD3 ARG A 32 -6.850 -4.471 -10.917 1.00 72.24 H new ATOM 0 HE ARG A 32 -9.243 -4.441 -9.120 1.00 23.03 H new ATOM 0 HH11 ARG A 32 -7.142 -6.052 -11.465 1.00 60.31 H new ATOM 0 HH12 ARG A 32 -7.918 -7.625 -11.255 1.00 60.31 H new ATOM 0 HH21 ARG A 32 -10.232 -6.469 -8.856 1.00 51.51 H new ATOM 0 HH22 ARG A 32 -9.659 -7.859 -9.784 1.00 51.51 H new ATOM 546 N ASP A 33 -7.526 -2.256 -5.451 1.00 64.40 N ATOM 547 CA ASP A 33 -7.094 -3.092 -4.330 1.00 52.50 C ATOM 548 C ASP A 33 -5.869 -2.496 -3.645 1.00 62.44 C ATOM 549 O ASP A 33 -5.310 -3.088 -2.721 1.00 21.22 O ATOM 550 CB ASP A 33 -6.798 -4.519 -4.797 1.00 43.40 C ATOM 551 CG ASP A 33 -7.968 -5.151 -5.516 1.00 73.12 C ATOM 552 OD1 ASP A 33 -9.035 -5.322 -4.891 1.00 60.11 O ATOM 553 OD2 ASP A 33 -7.832 -5.464 -6.715 1.00 41.12 O ATOM 0 H ASP A 33 -8.456 -1.854 -5.330 1.00 64.40 H new ATOM 0 HA ASP A 33 -7.909 -3.126 -3.607 1.00 52.50 H new ATOM 0 HB2 ASP A 33 -5.932 -4.508 -5.459 1.00 43.40 H new ATOM 0 HB3 ASP A 33 -6.532 -5.131 -3.935 1.00 43.40 H new ATOM 558 N GLU A 34 -5.465 -1.320 -4.117 1.00 71.34 N ATOM 559 CA GLU A 34 -4.336 -0.586 -3.572 1.00 72.13 C ATOM 560 C GLU A 34 -3.006 -1.309 -3.817 1.00 13.11 C ATOM 561 O GLU A 34 -2.026 -1.067 -3.113 1.00 74.42 O ATOM 562 CB GLU A 34 -4.572 -0.306 -2.082 1.00 33.11 C ATOM 563 CG GLU A 34 -5.838 0.507 -1.852 1.00 12.11 C ATOM 564 CD GLU A 34 -6.137 0.786 -0.395 1.00 73.51 C ATOM 565 OE1 GLU A 34 -6.726 -0.089 0.275 1.00 45.31 O ATOM 566 OE2 GLU A 34 -5.833 1.900 0.077 1.00 41.12 O ATOM 0 H GLU A 34 -5.920 -0.848 -4.898 1.00 71.34 H new ATOM 0 HA GLU A 34 -4.260 0.367 -4.095 1.00 72.13 H new ATOM 0 HB2 GLU A 34 -4.643 -1.250 -1.542 1.00 33.11 H new ATOM 0 HB3 GLU A 34 -3.716 0.231 -1.673 1.00 33.11 H new ATOM 0 HG2 GLU A 34 -5.749 1.456 -2.382 1.00 12.11 H new ATOM 0 HG3 GLU A 34 -6.683 -0.025 -2.290 1.00 12.11 H new ATOM 573 N LYS A 35 -2.960 -2.179 -4.836 1.00 0.30 N ATOM 574 CA LYS A 35 -1.691 -2.801 -5.237 1.00 23.05 C ATOM 575 C LYS A 35 -1.629 -3.084 -6.745 1.00 43.52 C ATOM 576 O LYS A 35 -0.575 -3.459 -7.260 1.00 3.44 O ATOM 577 CB LYS A 35 -1.413 -4.102 -4.459 1.00 62.01 C ATOM 578 CG LYS A 35 -2.208 -5.312 -4.934 1.00 43.41 C ATOM 579 CD LYS A 35 -3.633 -5.283 -4.423 1.00 22.32 C ATOM 580 CE LYS A 35 -3.705 -5.600 -2.937 1.00 63.03 C ATOM 581 NZ LYS A 35 -3.719 -7.064 -2.675 1.00 74.45 N ATOM 0 H LYS A 35 -3.769 -2.463 -5.388 1.00 0.30 H new ATOM 0 HA LYS A 35 -0.918 -2.073 -4.991 1.00 23.05 H new ATOM 0 HB2 LYS A 35 -0.350 -4.332 -4.531 1.00 62.01 H new ATOM 0 HB3 LYS A 35 -1.631 -3.932 -3.405 1.00 62.01 H new ATOM 0 HG2 LYS A 35 -2.213 -5.339 -6.024 1.00 43.41 H new ATOM 0 HG3 LYS A 35 -1.718 -6.225 -4.595 1.00 43.41 H new ATOM 0 HD2 LYS A 35 -4.065 -4.299 -4.607 1.00 22.32 H new ATOM 0 HD3 LYS A 35 -4.233 -6.004 -4.978 1.00 22.32 H new ATOM 0 HE2 LYS A 35 -2.852 -5.150 -2.429 1.00 63.03 H new ATOM 0 HE3 LYS A 35 -4.602 -5.148 -2.514 1.00 63.03 H new ATOM 0 HZ1 LYS A 35 -3.769 -7.233 -1.650 1.00 74.45 H new ATOM 0 HZ2 LYS A 35 -4.547 -7.491 -3.137 1.00 74.45 H new ATOM 0 HZ3 LYS A 35 -2.851 -7.493 -3.055 1.00 74.45 H new ATOM 595 N GLN A 36 -2.741 -2.919 -7.456 1.00 42.43 N ATOM 596 CA GLN A 36 -2.749 -3.181 -8.897 1.00 72.21 C ATOM 597 C GLN A 36 -3.465 -2.080 -9.681 1.00 21.40 C ATOM 598 O GLN A 36 -4.295 -1.364 -9.140 1.00 11.03 O ATOM 599 CB GLN A 36 -3.341 -4.564 -9.199 1.00 0.54 C ATOM 600 CG GLN A 36 -4.418 -5.021 -8.226 1.00 54.44 C ATOM 601 CD GLN A 36 -4.757 -6.488 -8.401 1.00 72.34 C ATOM 602 OE1 GLN A 36 -3.916 -7.282 -8.823 1.00 1.34 O ATOM 603 NE2 GLN A 36 -5.977 -6.867 -8.061 1.00 51.52 N ATOM 0 H GLN A 36 -3.634 -2.611 -7.070 1.00 42.43 H new ATOM 0 HA GLN A 36 -1.712 -3.178 -9.232 1.00 72.21 H new ATOM 0 HB2 GLN A 36 -3.760 -4.553 -10.205 1.00 0.54 H new ATOM 0 HB3 GLN A 36 -2.535 -5.297 -9.198 1.00 0.54 H new ATOM 0 HG2 GLN A 36 -4.081 -4.846 -7.204 1.00 54.44 H new ATOM 0 HG3 GLN A 36 -5.316 -4.421 -8.372 1.00 54.44 H new ATOM 0 HE21 GLN A 36 -6.647 -6.180 -7.715 1.00 51.52 H new ATOM 0 HE22 GLN A 36 -6.249 -7.847 -8.144 1.00 51.52 H new ATOM 612 N ILE A 37 -3.122 -1.947 -10.956 1.00 11.43 N ATOM 613 CA ILE A 37 -3.639 -0.869 -11.796 1.00 43.01 C ATOM 614 C ILE A 37 -4.901 -1.304 -12.536 1.00 13.25 C ATOM 615 O ILE A 37 -4.959 -2.404 -13.080 1.00 43.11 O ATOM 616 CB ILE A 37 -2.582 -0.414 -12.830 1.00 11.31 C ATOM 617 CG1 ILE A 37 -1.224 -0.212 -12.148 1.00 1.22 C ATOM 618 CG2 ILE A 37 -3.031 0.867 -13.523 1.00 25.42 C ATOM 619 CD1 ILE A 37 -0.140 0.306 -13.070 1.00 21.21 C ATOM 0 H ILE A 37 -2.481 -2.578 -11.437 1.00 11.43 H new ATOM 0 HA ILE A 37 -3.879 -0.036 -11.135 1.00 43.01 H new ATOM 0 HB ILE A 37 -2.476 -1.192 -13.586 1.00 11.31 H new ATOM 0 HG12 ILE A 37 -1.346 0.486 -11.320 1.00 1.22 H new ATOM 0 HG13 ILE A 37 -0.900 -1.161 -11.720 1.00 1.22 H new ATOM 0 HG21 ILE A 37 -2.276 1.173 -14.247 1.00 25.42 H new ATOM 0 HG22 ILE A 37 -3.976 0.691 -14.037 1.00 25.42 H new ATOM 0 HG23 ILE A 37 -3.163 1.655 -12.781 1.00 25.42 H new ATOM 0 HD11 ILE A 37 0.789 0.422 -12.511 1.00 21.21 H new ATOM 0 HD12 ILE A 37 0.013 -0.401 -13.885 1.00 21.21 H new ATOM 0 HD13 ILE A 37 -0.440 1.271 -13.478 1.00 21.21 H new ATOM 631 N ASP A 38 -5.894 -0.425 -12.562 1.00 71.52 N ATOM 632 CA ASP A 38 -7.190 -0.725 -13.163 1.00 53.42 C ATOM 633 C ASP A 38 -7.687 0.464 -13.983 1.00 50.14 C ATOM 634 O ASP A 38 -7.185 1.571 -13.830 1.00 5.05 O ATOM 635 CB ASP A 38 -8.187 -1.047 -12.049 1.00 10.42 C ATOM 636 CG ASP A 38 -9.574 -1.391 -12.557 1.00 71.11 C ATOM 637 OD1 ASP A 38 -9.681 -2.155 -13.539 1.00 54.14 O ATOM 638 OD2 ASP A 38 -10.565 -0.927 -11.956 1.00 73.22 O ATOM 0 H ASP A 38 -5.826 0.514 -12.169 1.00 71.52 H new ATOM 0 HA ASP A 38 -7.091 -1.581 -13.831 1.00 53.42 H new ATOM 0 HB2 ASP A 38 -7.806 -1.883 -11.462 1.00 10.42 H new ATOM 0 HB3 ASP A 38 -8.257 -0.192 -11.377 1.00 10.42 H new ATOM 643 N VAL A 39 -8.663 0.235 -14.851 1.00 55.33 N ATOM 644 CA VAL A 39 -9.271 1.312 -15.624 1.00 2.45 C ATOM 645 C VAL A 39 -10.758 1.380 -15.324 1.00 52.10 C ATOM 646 O VAL A 39 -11.483 0.408 -15.529 1.00 45.32 O ATOM 647 CB VAL A 39 -9.070 1.128 -17.142 1.00 43.42 C ATOM 648 CG1 VAL A 39 -9.836 2.189 -17.918 1.00 20.12 C ATOM 649 CG2 VAL A 39 -7.598 1.179 -17.496 1.00 44.40 C ATOM 0 H VAL A 39 -9.052 -0.689 -15.039 1.00 55.33 H new ATOM 0 HA VAL A 39 -8.778 2.239 -15.331 1.00 2.45 H new ATOM 0 HB VAL A 39 -9.459 0.148 -17.419 1.00 43.42 H new ATOM 0 HG11 VAL A 39 -9.681 2.041 -18.987 1.00 20.12 H new ATOM 0 HG12 VAL A 39 -10.899 2.109 -17.691 1.00 20.12 H new ATOM 0 HG13 VAL A 39 -9.478 3.178 -17.633 1.00 20.12 H new ATOM 0 HG21 VAL A 39 -7.478 1.047 -18.571 1.00 44.40 H new ATOM 0 HG22 VAL A 39 -7.186 2.144 -17.200 1.00 44.40 H new ATOM 0 HG23 VAL A 39 -7.070 0.383 -16.971 1.00 44.40 H new ATOM 659 N GLU A 40 -11.213 2.524 -14.839 1.00 64.24 N ATOM 660 CA GLU A 40 -12.594 2.655 -14.406 1.00 74.24 C ATOM 661 C GLU A 40 -13.373 3.640 -15.267 1.00 31.44 C ATOM 662 O GLU A 40 -14.603 3.654 -15.238 1.00 0.32 O ATOM 663 CB GLU A 40 -12.645 3.096 -12.948 1.00 20.01 C ATOM 664 CG GLU A 40 -11.853 2.197 -12.019 1.00 14.30 C ATOM 665 CD GLU A 40 -12.093 2.531 -10.562 1.00 64.10 C ATOM 666 OE1 GLU A 40 -12.095 3.735 -10.210 1.00 12.22 O ATOM 667 OE2 GLU A 40 -12.294 1.591 -9.763 1.00 44.12 O ATOM 0 H GLU A 40 -10.651 3.369 -14.736 1.00 64.24 H new ATOM 0 HA GLU A 40 -13.063 1.677 -14.514 1.00 74.24 H new ATOM 0 HB2 GLU A 40 -12.262 4.114 -12.870 1.00 20.01 H new ATOM 0 HB3 GLU A 40 -13.684 3.120 -12.620 1.00 20.01 H new ATOM 0 HG2 GLU A 40 -12.125 1.158 -12.202 1.00 14.30 H new ATOM 0 HG3 GLU A 40 -10.790 2.292 -12.242 1.00 14.30 H new ATOM 674 N THR A 41 -12.671 4.465 -16.026 1.00 71.45 N ATOM 675 CA THR A 41 -13.333 5.476 -16.838 1.00 35.35 C ATOM 676 C THR A 41 -12.657 5.623 -18.197 1.00 11.43 C ATOM 677 O THR A 41 -11.454 5.869 -18.278 1.00 23.32 O ATOM 678 CB THR A 41 -13.348 6.842 -16.119 1.00 32.32 C ATOM 679 OG1 THR A 41 -13.978 6.711 -14.838 1.00 72.35 O ATOM 680 CG2 THR A 41 -14.085 7.891 -16.940 1.00 62.22 C ATOM 0 H THR A 41 -11.654 4.457 -16.098 1.00 71.45 H new ATOM 0 HA THR A 41 -14.360 5.144 -16.991 1.00 35.35 H new ATOM 0 HB THR A 41 -12.315 7.167 -15.993 1.00 32.32 H new ATOM 0 HG1 THR A 41 -13.983 7.580 -14.386 1.00 72.35 H new ATOM 0 HG21 THR A 41 -14.078 8.842 -16.407 1.00 62.22 H new ATOM 0 HG22 THR A 41 -13.591 8.012 -17.904 1.00 62.22 H new ATOM 0 HG23 THR A 41 -15.115 7.571 -17.098 1.00 62.22 H new ATOM 688 N VAL A 42 -13.435 5.456 -19.256 1.00 41.40 N ATOM 689 CA VAL A 42 -12.937 5.640 -20.609 1.00 25.00 C ATOM 690 C VAL A 42 -13.799 6.660 -21.345 1.00 50.44 C ATOM 691 O VAL A 42 -15.024 6.650 -21.222 1.00 54.23 O ATOM 692 CB VAL A 42 -12.906 4.311 -21.404 1.00 62.44 C ATOM 693 CG1 VAL A 42 -11.902 3.347 -20.797 1.00 50.30 C ATOM 694 CG2 VAL A 42 -14.286 3.670 -21.459 1.00 71.12 C ATOM 0 H VAL A 42 -14.419 5.192 -19.203 1.00 41.40 H new ATOM 0 HA VAL A 42 -11.912 6.004 -20.534 1.00 25.00 H new ATOM 0 HB VAL A 42 -12.598 4.541 -22.424 1.00 62.44 H new ATOM 0 HG11 VAL A 42 -11.896 2.420 -21.370 1.00 50.30 H new ATOM 0 HG12 VAL A 42 -10.908 3.794 -20.820 1.00 50.30 H new ATOM 0 HG13 VAL A 42 -12.180 3.134 -19.765 1.00 50.30 H new ATOM 0 HG21 VAL A 42 -14.233 2.739 -22.023 1.00 71.12 H new ATOM 0 HG22 VAL A 42 -14.631 3.461 -20.446 1.00 71.12 H new ATOM 0 HG23 VAL A 42 -14.984 4.350 -21.947 1.00 71.12 H new ATOM 704 N ALA A 43 -13.160 7.555 -22.079 1.00 72.23 N ATOM 705 CA ALA A 43 -13.874 8.581 -22.821 1.00 34.35 C ATOM 706 C ALA A 43 -13.283 8.747 -24.213 1.00 74.40 C ATOM 707 O ALA A 43 -12.073 8.604 -24.404 1.00 31.13 O ATOM 708 CB ALA A 43 -13.838 9.900 -22.066 1.00 74.12 C ATOM 0 H ALA A 43 -12.145 7.592 -22.177 1.00 72.23 H new ATOM 0 HA ALA A 43 -14.913 8.269 -22.927 1.00 34.35 H new ATOM 0 HB1 ALA A 43 -14.377 10.659 -22.634 1.00 74.12 H new ATOM 0 HB2 ALA A 43 -14.309 9.774 -21.091 1.00 74.12 H new ATOM 0 HB3 ALA A 43 -12.803 10.214 -21.931 1.00 74.12 H new ATOM 714 N ASP A 44 -14.136 9.038 -25.182 1.00 23.35 N ATOM 715 CA ASP A 44 -13.701 9.184 -26.565 1.00 52.23 C ATOM 716 C ASP A 44 -13.681 10.656 -26.976 1.00 33.20 C ATOM 717 O ASP A 44 -13.728 11.545 -26.128 1.00 20.33 O ATOM 718 CB ASP A 44 -14.617 8.383 -27.497 1.00 33.33 C ATOM 719 CG ASP A 44 -16.015 8.961 -27.582 1.00 4.44 C ATOM 720 OD1 ASP A 44 -16.824 8.718 -26.661 1.00 75.33 O ATOM 721 OD2 ASP A 44 -16.303 9.668 -28.564 1.00 74.23 O ATOM 0 H ASP A 44 -15.136 9.178 -25.038 1.00 23.35 H new ATOM 0 HA ASP A 44 -12.687 8.793 -26.648 1.00 52.23 H new ATOM 0 HB2 ASP A 44 -14.179 8.355 -28.495 1.00 33.33 H new ATOM 0 HB3 ASP A 44 -14.675 7.353 -27.145 1.00 33.33 H new ATOM 726 N ARG A 45 -13.625 10.901 -28.281 1.00 32.23 N ATOM 727 CA ARG A 45 -13.470 12.255 -28.814 1.00 51.05 C ATOM 728 C ARG A 45 -14.764 13.073 -28.738 1.00 12.50 C ATOM 729 O ARG A 45 -14.809 14.216 -29.192 1.00 44.32 O ATOM 730 CB ARG A 45 -12.946 12.198 -30.261 1.00 33.14 C ATOM 731 CG ARG A 45 -13.691 11.229 -31.179 1.00 20.43 C ATOM 732 CD ARG A 45 -15.030 11.780 -31.649 1.00 0.02 C ATOM 733 NE ARG A 45 -14.882 12.994 -32.452 1.00 24.13 N ATOM 734 CZ ARG A 45 -15.890 13.818 -32.743 1.00 0.23 C ATOM 735 NH1 ARG A 45 -17.117 13.552 -32.321 1.00 62.41 N ATOM 736 NH2 ARG A 45 -15.678 14.908 -33.469 1.00 33.21 N ATOM 0 H ARG A 45 -13.685 10.176 -28.996 1.00 32.23 H new ATOM 0 HA ARG A 45 -12.741 12.767 -28.186 1.00 51.05 H new ATOM 0 HB2 ARG A 45 -13.001 13.198 -30.691 1.00 33.14 H new ATOM 0 HB3 ARG A 45 -11.893 11.918 -30.240 1.00 33.14 H new ATOM 0 HG2 ARG A 45 -13.070 11.006 -32.046 1.00 20.43 H new ATOM 0 HG3 ARG A 45 -13.854 10.288 -30.653 1.00 20.43 H new ATOM 0 HD2 ARG A 45 -15.547 11.020 -32.235 1.00 0.02 H new ATOM 0 HD3 ARG A 45 -15.656 11.995 -30.783 1.00 0.02 H new ATOM 0 HE ARG A 45 -13.955 13.224 -32.810 1.00 24.13 H new ATOM 0 HH11 ARG A 45 -17.296 12.713 -31.770 1.00 62.41 H new ATOM 0 HH12 ARG A 45 -17.883 14.187 -32.547 1.00 62.41 H new ATOM 0 HH21 ARG A 45 -14.740 15.120 -33.808 1.00 33.21 H new ATOM 0 HH22 ARG A 45 -16.453 15.534 -33.688 1.00 33.21 H new ATOM 750 N ASN A 46 -15.807 12.491 -28.166 1.00 54.44 N ATOM 751 CA ASN A 46 -17.091 13.171 -28.050 1.00 11.31 C ATOM 752 C ASN A 46 -17.095 14.201 -26.921 1.00 73.43 C ATOM 753 O ASN A 46 -17.709 15.263 -27.043 1.00 13.13 O ATOM 754 CB ASN A 46 -18.203 12.146 -27.830 1.00 40.34 C ATOM 755 CG ASN A 46 -19.564 12.786 -27.667 1.00 25.30 C ATOM 756 OD1 ASN A 46 -20.226 13.104 -28.651 1.00 55.40 O ATOM 757 ND2 ASN A 46 -19.999 12.967 -26.428 1.00 23.05 N ATOM 0 H ASN A 46 -15.791 11.549 -27.774 1.00 54.44 H new ATOM 0 HA ASN A 46 -17.266 13.709 -28.982 1.00 11.31 H new ATOM 0 HB2 ASN A 46 -18.229 11.457 -28.675 1.00 40.34 H new ATOM 0 HB3 ASN A 46 -17.976 11.554 -26.943 1.00 40.34 H new ATOM 0 HD21 ASN A 46 -20.915 13.385 -26.265 1.00 23.05 H new ATOM 0 HD22 ASN A 46 -19.417 12.689 -25.638 1.00 23.05 H new ATOM 764 N ALA A 47 -16.404 13.892 -25.833 1.00 62.24 N ATOM 765 CA ALA A 47 -16.412 14.751 -24.657 1.00 14.40 C ATOM 766 C ALA A 47 -15.381 15.869 -24.778 1.00 21.25 C ATOM 767 O ALA A 47 -14.364 15.722 -25.459 1.00 52.35 O ATOM 768 CB ALA A 47 -16.157 13.927 -23.404 1.00 64.12 C ATOM 0 H ALA A 47 -15.831 13.053 -25.740 1.00 62.24 H new ATOM 0 HA ALA A 47 -17.396 15.213 -24.584 1.00 14.40 H new ATOM 0 HB1 ALA A 47 -16.165 14.580 -22.531 1.00 64.12 H new ATOM 0 HB2 ALA A 47 -16.937 13.172 -23.300 1.00 64.12 H new ATOM 0 HB3 ALA A 47 -15.186 13.438 -23.482 1.00 64.12 H new ATOM 774 N GLU A 48 -15.659 16.986 -24.115 1.00 62.30 N ATOM 775 CA GLU A 48 -14.747 18.124 -24.102 1.00 53.24 C ATOM 776 C GLU A 48 -13.900 18.107 -22.831 1.00 63.20 C ATOM 777 O GLU A 48 -14.194 17.357 -21.897 1.00 45.34 O ATOM 778 CB GLU A 48 -15.525 19.440 -24.207 1.00 50.43 C ATOM 779 CG GLU A 48 -16.519 19.658 -23.079 1.00 2.12 C ATOM 780 CD GLU A 48 -17.325 20.928 -23.254 1.00 13.42 C ATOM 781 OE1 GLU A 48 -18.303 20.913 -24.031 1.00 41.31 O ATOM 782 OE2 GLU A 48 -16.982 21.947 -22.624 1.00 2.31 O ATOM 0 H GLU A 48 -16.514 17.128 -23.577 1.00 62.30 H new ATOM 0 HA GLU A 48 -14.085 18.047 -24.965 1.00 53.24 H new ATOM 0 HB2 GLU A 48 -14.818 20.269 -24.220 1.00 50.43 H new ATOM 0 HB3 GLU A 48 -16.058 19.461 -25.157 1.00 50.43 H new ATOM 0 HG2 GLU A 48 -17.197 18.806 -23.026 1.00 2.12 H new ATOM 0 HG3 GLU A 48 -15.984 19.699 -22.130 1.00 2.12 H new ATOM 789 N TYR A 49 -12.874 18.955 -22.787 1.00 23.23 N ATOM 790 CA TYR A 49 -11.894 18.935 -21.701 1.00 51.34 C ATOM 791 C TYR A 49 -12.539 19.244 -20.354 1.00 41.13 C ATOM 792 O TYR A 49 -12.238 18.597 -19.352 1.00 41.31 O ATOM 793 CB TYR A 49 -10.767 19.934 -21.979 1.00 71.24 C ATOM 794 CG TYR A 49 -10.097 19.738 -23.322 1.00 44.25 C ATOM 795 CD1 TYR A 49 -9.263 18.651 -23.554 1.00 4.44 C ATOM 796 CD2 TYR A 49 -10.297 20.643 -24.357 1.00 74.55 C ATOM 797 CE1 TYR A 49 -8.647 18.474 -24.779 1.00 51.02 C ATOM 798 CE2 TYR A 49 -9.686 20.471 -25.585 1.00 5.52 C ATOM 799 CZ TYR A 49 -8.863 19.385 -25.791 1.00 72.14 C ATOM 800 OH TYR A 49 -8.249 19.215 -27.012 1.00 32.34 O ATOM 0 H TYR A 49 -12.699 19.668 -23.495 1.00 23.23 H new ATOM 0 HA TYR A 49 -11.480 17.928 -21.654 1.00 51.34 H new ATOM 0 HB2 TYR A 49 -11.170 20.946 -21.928 1.00 71.24 H new ATOM 0 HB3 TYR A 49 -10.017 19.850 -21.193 1.00 71.24 H new ATOM 0 HD1 TYR A 49 -9.093 17.933 -22.765 1.00 4.44 H new ATOM 0 HD2 TYR A 49 -10.941 21.496 -24.199 1.00 74.55 H new ATOM 0 HE1 TYR A 49 -7.999 17.625 -24.943 1.00 51.02 H new ATOM 0 HE2 TYR A 49 -9.853 21.184 -26.379 1.00 5.52 H new ATOM 0 HH TYR A 49 -7.348 18.854 -26.878 1.00 32.34 H new ATOM 810 N ASP A 50 -13.426 20.229 -20.340 1.00 32.15 N ATOM 811 CA ASP A 50 -14.107 20.645 -19.116 1.00 5.51 C ATOM 812 C ASP A 50 -14.886 19.493 -18.496 1.00 10.23 C ATOM 813 O ASP A 50 -14.890 19.313 -17.278 1.00 60.23 O ATOM 814 CB ASP A 50 -15.057 21.810 -19.405 1.00 45.54 C ATOM 815 CG ASP A 50 -14.325 23.093 -19.744 1.00 53.03 C ATOM 816 OD1 ASP A 50 -13.511 23.093 -20.692 1.00 41.22 O ATOM 817 OD2 ASP A 50 -14.539 24.105 -19.046 1.00 12.50 O ATOM 0 H ASP A 50 -13.694 20.760 -21.168 1.00 32.15 H new ATOM 0 HA ASP A 50 -13.344 20.966 -18.407 1.00 5.51 H new ATOM 0 HB2 ASP A 50 -15.713 21.541 -20.233 1.00 45.54 H new ATOM 0 HB3 ASP A 50 -15.693 21.978 -18.536 1.00 45.54 H new ATOM 822 N GLN A 51 -15.525 18.699 -19.344 1.00 3.43 N ATOM 823 CA GLN A 51 -16.356 17.598 -18.878 1.00 65.42 C ATOM 824 C GLN A 51 -15.513 16.477 -18.280 1.00 22.43 C ATOM 825 O GLN A 51 -15.984 15.735 -17.420 1.00 33.30 O ATOM 826 CB GLN A 51 -17.226 17.070 -20.016 1.00 52.14 C ATOM 827 CG GLN A 51 -18.241 18.092 -20.504 1.00 41.23 C ATOM 828 CD GLN A 51 -19.070 17.603 -21.674 1.00 31.23 C ATOM 829 OE1 GLN A 51 -18.612 16.801 -22.490 1.00 20.23 O ATOM 830 NE2 GLN A 51 -20.293 18.095 -21.771 1.00 22.10 N ATOM 0 H GLN A 51 -15.484 18.797 -20.358 1.00 3.43 H new ATOM 0 HA GLN A 51 -17.005 17.979 -18.089 1.00 65.42 H new ATOM 0 HB2 GLN A 51 -16.587 16.773 -20.848 1.00 52.14 H new ATOM 0 HB3 GLN A 51 -17.750 16.175 -19.681 1.00 52.14 H new ATOM 0 HG2 GLN A 51 -18.906 18.355 -19.681 1.00 41.23 H new ATOM 0 HG3 GLN A 51 -17.718 19.003 -20.794 1.00 41.23 H new ATOM 0 HE21 GLN A 51 -20.633 18.757 -21.074 1.00 22.10 H new ATOM 0 HE22 GLN A 51 -20.897 17.813 -22.543 1.00 22.10 H new ATOM 839 N PHE A 52 -14.264 16.362 -18.722 1.00 33.33 N ATOM 840 CA PHE A 52 -13.354 15.372 -18.155 1.00 13.04 C ATOM 841 C PHE A 52 -13.076 15.699 -16.693 1.00 10.25 C ATOM 842 O PHE A 52 -13.179 14.835 -15.822 1.00 61.20 O ATOM 843 CB PHE A 52 -12.035 15.315 -18.933 1.00 22.24 C ATOM 844 CG PHE A 52 -12.179 14.829 -20.347 1.00 30.34 C ATOM 845 CD1 PHE A 52 -12.808 13.626 -20.621 1.00 44.41 C ATOM 846 CD2 PHE A 52 -11.680 15.573 -21.402 1.00 55.34 C ATOM 847 CE1 PHE A 52 -12.939 13.178 -21.920 1.00 30.14 C ATOM 848 CE2 PHE A 52 -11.809 15.129 -22.704 1.00 65.13 C ATOM 849 CZ PHE A 52 -12.438 13.930 -22.964 1.00 73.33 C ATOM 0 H PHE A 52 -13.862 16.936 -19.463 1.00 33.33 H new ATOM 0 HA PHE A 52 -13.833 14.395 -18.227 1.00 13.04 H new ATOM 0 HB2 PHE A 52 -11.589 16.310 -18.945 1.00 22.24 H new ATOM 0 HB3 PHE A 52 -11.341 14.661 -18.404 1.00 22.24 H new ATOM 0 HD1 PHE A 52 -13.200 13.032 -19.809 1.00 44.41 H new ATOM 0 HD2 PHE A 52 -11.184 16.512 -21.205 1.00 55.34 H new ATOM 0 HE1 PHE A 52 -13.434 12.239 -22.120 1.00 30.14 H new ATOM 0 HE2 PHE A 52 -11.417 15.721 -23.518 1.00 65.13 H new ATOM 0 HZ PHE A 52 -12.539 13.580 -23.981 1.00 73.33 H new ATOM 859 N LEU A 53 -12.749 16.963 -16.438 1.00 11.24 N ATOM 860 CA LEU A 53 -12.478 17.441 -15.085 1.00 13.11 C ATOM 861 C LEU A 53 -13.693 17.250 -14.191 1.00 14.44 C ATOM 862 O LEU A 53 -13.584 16.751 -13.070 1.00 43.41 O ATOM 863 CB LEU A 53 -12.099 18.925 -15.101 1.00 14.21 C ATOM 864 CG LEU A 53 -10.644 19.253 -15.451 1.00 63.43 C ATOM 865 CD1 LEU A 53 -10.287 18.797 -16.858 1.00 51.25 C ATOM 866 CD2 LEU A 53 -10.409 20.744 -15.303 1.00 3.20 C ATOM 0 H LEU A 53 -12.665 17.681 -17.158 1.00 11.24 H new ATOM 0 HA LEU A 53 -11.645 16.858 -14.691 1.00 13.11 H new ATOM 0 HB2 LEU A 53 -12.745 19.435 -15.815 1.00 14.21 H new ATOM 0 HB3 LEU A 53 -12.317 19.344 -14.119 1.00 14.21 H new ATOM 0 HG LEU A 53 -9.998 18.712 -14.760 1.00 63.43 H new ATOM 0 HD11 LEU A 53 -9.247 19.047 -17.069 1.00 51.25 H new ATOM 0 HD12 LEU A 53 -10.424 17.718 -16.937 1.00 51.25 H new ATOM 0 HD13 LEU A 53 -10.934 19.298 -17.578 1.00 51.25 H new ATOM 0 HD21 LEU A 53 -9.373 20.976 -15.552 1.00 3.20 H new ATOM 0 HD22 LEU A 53 -11.074 21.286 -15.976 1.00 3.20 H new ATOM 0 HD23 LEU A 53 -10.610 21.044 -14.275 1.00 3.20 H new ATOM 878 N GLU A 54 -14.848 17.646 -14.708 1.00 63.35 N ATOM 879 CA GLU A 54 -16.094 17.576 -13.961 1.00 13.12 C ATOM 880 C GLU A 54 -16.423 16.134 -13.575 1.00 21.41 C ATOM 881 O GLU A 54 -16.936 15.873 -12.484 1.00 2.34 O ATOM 882 CB GLU A 54 -17.225 18.184 -14.798 1.00 22.44 C ATOM 883 CG GLU A 54 -18.557 18.278 -14.072 1.00 23.22 C ATOM 884 CD GLU A 54 -18.454 19.013 -12.755 1.00 11.05 C ATOM 885 OE1 GLU A 54 -18.203 20.237 -12.764 1.00 24.21 O ATOM 886 OE2 GLU A 54 -18.623 18.369 -11.703 1.00 74.51 O ATOM 0 H GLU A 54 -14.947 18.022 -15.651 1.00 63.35 H new ATOM 0 HA GLU A 54 -15.984 18.146 -13.038 1.00 13.12 H new ATOM 0 HB2 GLU A 54 -16.928 19.182 -15.119 1.00 22.44 H new ATOM 0 HB3 GLU A 54 -17.357 17.585 -15.699 1.00 22.44 H new ATOM 0 HG2 GLU A 54 -19.279 18.786 -14.711 1.00 23.22 H new ATOM 0 HG3 GLU A 54 -18.940 17.273 -13.894 1.00 23.22 H new ATOM 893 N ASP A 55 -16.101 15.199 -14.457 1.00 51.52 N ATOM 894 CA ASP A 55 -16.427 13.797 -14.229 1.00 75.42 C ATOM 895 C ASP A 55 -15.472 13.165 -13.220 1.00 13.23 C ATOM 896 O ASP A 55 -15.902 12.504 -12.274 1.00 31.14 O ATOM 897 CB ASP A 55 -16.383 13.012 -15.542 1.00 25.45 C ATOM 898 CG ASP A 55 -17.165 11.714 -15.469 1.00 71.33 C ATOM 899 OD1 ASP A 55 -16.760 10.798 -14.723 1.00 72.51 O ATOM 900 OD2 ASP A 55 -18.202 11.607 -16.154 1.00 52.30 O ATOM 0 H ASP A 55 -15.616 15.384 -15.335 1.00 51.52 H new ATOM 0 HA ASP A 55 -17.438 13.757 -13.822 1.00 75.42 H new ATOM 0 HB2 ASP A 55 -16.785 13.630 -16.345 1.00 25.45 H new ATOM 0 HB3 ASP A 55 -15.346 12.794 -15.797 1.00 25.45 H new ATOM 905 N ILE A 56 -14.177 13.391 -13.403 1.00 72.12 N ATOM 906 CA ILE A 56 -13.170 12.718 -12.586 1.00 11.22 C ATOM 907 C ILE A 56 -13.200 13.169 -11.125 1.00 74.22 C ATOM 908 O ILE A 56 -12.810 12.414 -10.234 1.00 51.32 O ATOM 909 CB ILE A 56 -11.742 12.880 -13.171 1.00 2.41 C ATOM 910 CG1 ILE A 56 -11.346 14.354 -13.339 1.00 75.45 C ATOM 911 CG2 ILE A 56 -11.642 12.158 -14.505 1.00 63.04 C ATOM 912 CD1 ILE A 56 -10.707 14.972 -12.114 1.00 11.11 C ATOM 0 H ILE A 56 -13.800 14.029 -14.103 1.00 72.12 H new ATOM 0 HA ILE A 56 -13.430 11.660 -12.610 1.00 11.22 H new ATOM 0 HB ILE A 56 -11.046 12.436 -12.459 1.00 2.41 H new ATOM 0 HG12 ILE A 56 -10.654 14.439 -14.177 1.00 75.45 H new ATOM 0 HG13 ILE A 56 -12.234 14.929 -13.600 1.00 75.45 H new ATOM 0 HG21 ILE A 56 -10.636 12.277 -14.909 1.00 63.04 H new ATOM 0 HG22 ILE A 56 -11.853 11.098 -14.362 1.00 63.04 H new ATOM 0 HG23 ILE A 56 -12.365 12.581 -15.203 1.00 63.04 H new ATOM 0 HD11 ILE A 56 -10.459 16.013 -12.319 1.00 11.11 H new ATOM 0 HD12 ILE A 56 -11.403 14.923 -11.277 1.00 11.11 H new ATOM 0 HD13 ILE A 56 -9.798 14.425 -11.863 1.00 11.11 H new ATOM 924 N GLN A 57 -13.686 14.380 -10.870 1.00 31.03 N ATOM 925 CA GLN A 57 -13.686 14.908 -9.513 1.00 40.04 C ATOM 926 C GLN A 57 -14.803 14.283 -8.675 1.00 60.40 C ATOM 927 O GLN A 57 -14.628 14.050 -7.480 1.00 1.02 O ATOM 928 CB GLN A 57 -13.757 16.449 -9.513 1.00 74.21 C ATOM 929 CG GLN A 57 -15.017 17.056 -10.122 1.00 30.55 C ATOM 930 CD GLN A 57 -16.188 17.076 -9.158 1.00 41.03 C ATOM 931 OE1 GLN A 57 -16.008 17.154 -7.944 1.00 12.05 O ATOM 932 NE2 GLN A 57 -17.395 17.018 -9.689 1.00 75.24 N ATOM 0 H GLN A 57 -14.079 15.005 -11.574 1.00 31.03 H new ATOM 0 HA GLN A 57 -12.741 14.631 -9.045 1.00 40.04 H new ATOM 0 HB2 GLN A 57 -13.669 16.798 -8.484 1.00 74.21 H new ATOM 0 HB3 GLN A 57 -12.893 16.834 -10.055 1.00 74.21 H new ATOM 0 HG2 GLN A 57 -14.803 18.074 -10.447 1.00 30.55 H new ATOM 0 HG3 GLN A 57 -15.294 16.489 -11.011 1.00 30.55 H new ATOM 0 HE21 GLN A 57 -17.504 16.954 -10.701 1.00 75.24 H new ATOM 0 HE22 GLN A 57 -18.218 17.037 -9.087 1.00 75.24 H new ATOM 941 N LYS A 58 -15.952 14.009 -9.296 1.00 40.43 N ATOM 942 CA LYS A 58 -17.049 13.347 -8.594 1.00 75.40 C ATOM 943 C LYS A 58 -16.866 11.832 -8.582 1.00 32.43 C ATOM 944 O LYS A 58 -17.593 11.114 -7.896 1.00 4.01 O ATOM 945 CB LYS A 58 -18.420 13.745 -9.173 1.00 71.23 C ATOM 946 CG LYS A 58 -18.565 13.635 -10.690 1.00 61.25 C ATOM 947 CD LYS A 58 -18.747 12.199 -11.162 1.00 74.12 C ATOM 948 CE LYS A 58 -19.167 12.154 -12.623 1.00 51.22 C ATOM 949 NZ LYS A 58 -19.125 10.776 -13.183 1.00 40.01 N ATOM 0 H LYS A 58 -16.144 14.233 -10.272 1.00 40.43 H new ATOM 0 HA LYS A 58 -17.026 13.690 -7.560 1.00 75.40 H new ATOM 0 HB2 LYS A 58 -19.183 13.120 -8.709 1.00 71.23 H new ATOM 0 HB3 LYS A 58 -18.630 14.774 -8.882 1.00 71.23 H new ATOM 0 HG2 LYS A 58 -19.419 14.230 -11.013 1.00 61.25 H new ATOM 0 HG3 LYS A 58 -17.682 14.060 -11.167 1.00 61.25 H new ATOM 0 HD2 LYS A 58 -17.815 11.649 -11.031 1.00 74.12 H new ATOM 0 HD3 LYS A 58 -19.499 11.703 -10.548 1.00 74.12 H new ATOM 0 HE2 LYS A 58 -20.177 12.552 -12.720 1.00 51.22 H new ATOM 0 HE3 LYS A 58 -18.512 12.801 -13.207 1.00 51.22 H new ATOM 0 HZ1 LYS A 58 -19.746 10.720 -14.015 1.00 40.01 H new ATOM 0 HZ2 LYS A 58 -18.150 10.544 -13.462 1.00 40.01 H new ATOM 0 HZ3 LYS A 58 -19.449 10.099 -12.463 1.00 40.01 H new ATOM 963 N CYS A 59 -15.894 11.354 -9.347 1.00 61.23 N ATOM 964 CA CYS A 59 -15.587 9.932 -9.390 1.00 43.11 C ATOM 965 C CYS A 59 -14.741 9.545 -8.178 1.00 24.14 C ATOM 966 O CYS A 59 -14.783 8.407 -7.710 1.00 45.35 O ATOM 967 CB CYS A 59 -14.852 9.587 -10.689 1.00 2.01 C ATOM 968 SG CYS A 59 -14.613 7.816 -10.966 1.00 20.22 S ATOM 0 H CYS A 59 -15.304 11.931 -9.947 1.00 61.23 H new ATOM 0 HA CYS A 59 -16.519 9.367 -9.361 1.00 43.11 H new ATOM 0 HB2 CYS A 59 -15.410 10.001 -11.529 1.00 2.01 H new ATOM 0 HB3 CYS A 59 -13.878 10.076 -10.681 1.00 2.01 H new ATOM 0 HG CYS A 59 -13.985 7.633 -12.090 1.00 20.22 H new ATOM 974 N GLY A 60 -13.985 10.506 -7.667 1.00 24.25 N ATOM 975 CA GLY A 60 -13.161 10.264 -6.502 1.00 54.54 C ATOM 976 C GLY A 60 -12.749 11.553 -5.826 1.00 33.42 C ATOM 977 O GLY A 60 -11.665 12.069 -6.088 1.00 0.14 O ATOM 0 H GLY A 60 -13.928 11.453 -8.041 1.00 24.25 H new ATOM 0 HA2 GLY A 60 -13.707 9.641 -5.794 1.00 54.54 H new ATOM 0 HA3 GLY A 60 -12.271 9.707 -6.796 1.00 54.54 H new ATOM 981 N PRO A 61 -13.596 12.088 -4.934 1.00 50.51 N ATOM 982 CA PRO A 61 -13.366 13.387 -4.285 1.00 60.42 C ATOM 983 C PRO A 61 -12.298 13.343 -3.188 1.00 44.22 C ATOM 984 O PRO A 61 -12.427 14.000 -2.152 1.00 24.31 O ATOM 985 CB PRO A 61 -14.734 13.717 -3.687 1.00 63.24 C ATOM 986 CG PRO A 61 -15.365 12.396 -3.423 1.00 53.31 C ATOM 987 CD PRO A 61 -14.858 11.464 -4.490 1.00 25.35 C ATOM 0 HA PRO A 61 -12.990 14.127 -4.992 1.00 60.42 H new ATOM 0 HB2 PRO A 61 -14.635 14.298 -2.770 1.00 63.24 H new ATOM 0 HB3 PRO A 61 -15.334 14.311 -4.377 1.00 63.24 H new ATOM 0 HG2 PRO A 61 -15.101 12.031 -2.430 1.00 53.31 H new ATOM 0 HG3 PRO A 61 -16.452 12.471 -3.457 1.00 53.31 H new ATOM 0 HD2 PRO A 61 -14.692 10.461 -4.098 1.00 25.35 H new ATOM 0 HD3 PRO A 61 -15.569 11.372 -5.311 1.00 25.35 H new ATOM 995 N GLY A 62 -11.229 12.603 -3.436 1.00 42.52 N ATOM 996 CA GLY A 62 -10.160 12.488 -2.465 1.00 0.33 C ATOM 997 C GLY A 62 -9.406 11.184 -2.603 1.00 55.51 C ATOM 998 O GLY A 62 -9.296 10.419 -1.644 1.00 64.30 O ATOM 0 H GLY A 62 -11.082 12.077 -4.297 1.00 42.52 H new ATOM 0 HA2 GLY A 62 -9.468 13.321 -2.587 1.00 0.33 H new ATOM 0 HA3 GLY A 62 -10.574 12.562 -1.460 1.00 0.33 H new ATOM 1002 N GLU A 63 -8.880 10.940 -3.798 1.00 63.32 N ATOM 1003 CA GLU A 63 -8.186 9.692 -4.113 1.00 44.44 C ATOM 1004 C GLU A 63 -7.208 9.918 -5.252 1.00 73.43 C ATOM 1005 O GLU A 63 -7.093 11.030 -5.766 1.00 31.50 O ATOM 1006 CB GLU A 63 -9.160 8.584 -4.527 1.00 31.13 C ATOM 1007 CG GLU A 63 -10.003 8.016 -3.400 1.00 1.11 C ATOM 1008 CD GLU A 63 -10.820 6.826 -3.850 1.00 2.11 C ATOM 1009 OE1 GLU A 63 -11.767 7.018 -4.638 1.00 35.11 O ATOM 1010 OE2 GLU A 63 -10.509 5.690 -3.436 1.00 21.51 O ATOM 0 H GLU A 63 -8.921 11.599 -4.576 1.00 63.32 H new ATOM 0 HA GLU A 63 -7.663 9.379 -3.210 1.00 44.44 H new ATOM 0 HB2 GLU A 63 -9.825 8.975 -5.297 1.00 31.13 H new ATOM 0 HB3 GLU A 63 -8.591 7.772 -4.980 1.00 31.13 H new ATOM 0 HG2 GLU A 63 -9.354 7.720 -2.576 1.00 1.11 H new ATOM 0 HG3 GLU A 63 -10.669 8.790 -3.019 1.00 1.11 H new ATOM 1017 N CYS A 64 -6.525 8.857 -5.652 1.00 25.11 N ATOM 1018 CA CYS A 64 -5.576 8.931 -6.746 1.00 11.14 C ATOM 1019 C CYS A 64 -6.104 8.226 -7.990 1.00 22.13 C ATOM 1020 O CYS A 64 -6.587 7.097 -7.920 1.00 72.30 O ATOM 1021 CB CYS A 64 -4.248 8.307 -6.316 1.00 63.14 C ATOM 1022 SG CYS A 64 -4.422 6.762 -5.388 1.00 5.34 S ATOM 0 H CYS A 64 -6.613 7.932 -5.232 1.00 25.11 H new ATOM 0 HA CYS A 64 -5.425 9.981 -6.996 1.00 11.14 H new ATOM 0 HB2 CYS A 64 -3.643 8.119 -7.203 1.00 63.14 H new ATOM 0 HB3 CYS A 64 -3.702 9.026 -5.705 1.00 63.14 H new ATOM 0 HG CYS A 64 -3.727 6.834 -4.292 1.00 5.34 H new ATOM 1028 N ARG A 65 -6.022 8.909 -9.122 1.00 14.25 N ATOM 1029 CA ARG A 65 -6.302 8.303 -10.416 1.00 61.34 C ATOM 1030 C ARG A 65 -5.566 9.049 -11.515 1.00 0.12 C ATOM 1031 O ARG A 65 -5.640 10.269 -11.619 1.00 64.33 O ATOM 1032 CB ARG A 65 -7.806 8.222 -10.724 1.00 22.12 C ATOM 1033 CG ARG A 65 -8.615 9.458 -10.362 1.00 40.43 C ATOM 1034 CD ARG A 65 -9.481 9.202 -9.137 1.00 62.44 C ATOM 1035 NE ARG A 65 -10.286 7.984 -9.284 1.00 52.24 N ATOM 1036 CZ ARG A 65 -10.945 7.398 -8.281 1.00 75.02 C ATOM 1037 NH1 ARG A 65 -10.944 7.948 -7.075 1.00 35.13 N ATOM 1038 NH2 ARG A 65 -11.604 6.262 -8.482 1.00 14.12 N ATOM 0 H ARG A 65 -5.761 9.894 -9.170 1.00 14.25 H new ATOM 0 HA ARG A 65 -5.940 7.276 -10.374 1.00 61.34 H new ATOM 0 HB2 ARG A 65 -7.931 8.026 -11.789 1.00 22.12 H new ATOM 0 HB3 ARG A 65 -8.223 7.367 -10.191 1.00 22.12 H new ATOM 0 HG2 ARG A 65 -7.942 10.294 -10.168 1.00 40.43 H new ATOM 0 HG3 ARG A 65 -9.245 9.744 -11.204 1.00 40.43 H new ATOM 0 HD2 ARG A 65 -8.846 9.114 -8.255 1.00 62.44 H new ATOM 0 HD3 ARG A 65 -10.139 10.055 -8.972 1.00 62.44 H new ATOM 0 HE ARG A 65 -10.346 7.559 -10.209 1.00 52.24 H new ATOM 0 HH11 ARG A 65 -10.440 8.820 -6.912 1.00 35.13 H new ATOM 0 HH12 ARG A 65 -11.448 7.500 -6.310 1.00 35.13 H new ATOM 0 HH21 ARG A 65 -11.609 5.832 -9.407 1.00 14.12 H new ATOM 0 HH22 ARG A 65 -12.105 5.820 -7.711 1.00 14.12 H new ATOM 1052 N TYR A 66 -4.851 8.297 -12.323 1.00 75.12 N ATOM 1053 CA TYR A 66 -4.000 8.853 -13.359 1.00 63.15 C ATOM 1054 C TYR A 66 -4.602 8.553 -14.717 1.00 63.11 C ATOM 1055 O TYR A 66 -5.325 7.576 -14.869 1.00 2.45 O ATOM 1056 CB TYR A 66 -2.587 8.265 -13.243 1.00 33.13 C ATOM 1057 CG TYR A 66 -2.536 6.991 -12.422 1.00 73.42 C ATOM 1058 CD1 TYR A 66 -2.724 5.749 -13.011 1.00 71.11 C ATOM 1059 CD2 TYR A 66 -2.328 7.039 -11.048 1.00 53.15 C ATOM 1060 CE1 TYR A 66 -2.709 4.591 -12.255 1.00 45.35 C ATOM 1061 CE2 TYR A 66 -2.306 5.886 -10.289 1.00 30.32 C ATOM 1062 CZ TYR A 66 -2.499 4.667 -10.896 1.00 35.10 C ATOM 1063 OH TYR A 66 -2.491 3.518 -10.139 1.00 25.13 O ATOM 0 H TYR A 66 -4.842 7.278 -12.282 1.00 75.12 H new ATOM 0 HA TYR A 66 -3.929 9.934 -13.239 1.00 63.15 H new ATOM 0 HB2 TYR A 66 -2.202 8.061 -14.242 1.00 33.13 H new ATOM 0 HB3 TYR A 66 -1.928 9.007 -12.792 1.00 33.13 H new ATOM 0 HD1 TYR A 66 -2.885 5.685 -14.077 1.00 71.11 H new ATOM 0 HD2 TYR A 66 -2.181 7.994 -10.566 1.00 53.15 H new ATOM 0 HE1 TYR A 66 -2.861 3.632 -12.728 1.00 45.35 H new ATOM 0 HE2 TYR A 66 -2.138 5.941 -9.224 1.00 30.32 H new ATOM 0 HH TYR A 66 -2.409 2.739 -10.728 1.00 25.13 H new ATOM 1073 N GLY A 67 -4.327 9.390 -15.696 1.00 2.25 N ATOM 1074 CA GLY A 67 -4.939 9.203 -16.988 1.00 52.42 C ATOM 1075 C GLY A 67 -3.989 9.419 -18.144 1.00 65.23 C ATOM 1076 O GLY A 67 -3.093 10.262 -18.070 1.00 61.42 O ATOM 0 H GLY A 67 -3.697 10.189 -15.623 1.00 2.25 H new ATOM 0 HA2 GLY A 67 -5.345 8.193 -17.046 1.00 52.42 H new ATOM 0 HA3 GLY A 67 -5.779 9.890 -17.086 1.00 52.42 H new ATOM 1080 N LEU A 68 -4.183 8.639 -19.203 1.00 1.35 N ATOM 1081 CA LEU A 68 -3.463 8.836 -20.451 1.00 53.41 C ATOM 1082 C LEU A 68 -4.375 9.554 -21.435 1.00 64.41 C ATOM 1083 O LEU A 68 -5.494 9.111 -21.695 1.00 31.53 O ATOM 1084 CB LEU A 68 -2.970 7.499 -21.035 1.00 21.51 C ATOM 1085 CG LEU A 68 -2.378 7.579 -22.444 1.00 10.23 C ATOM 1086 CD1 LEU A 68 -1.175 8.507 -22.469 1.00 4.45 C ATOM 1087 CD2 LEU A 68 -1.995 6.193 -22.938 1.00 43.21 C ATOM 0 H LEU A 68 -4.840 7.859 -19.218 1.00 1.35 H new ATOM 0 HA LEU A 68 -2.578 9.443 -20.259 1.00 53.41 H new ATOM 0 HB2 LEU A 68 -2.216 7.085 -20.365 1.00 21.51 H new ATOM 0 HB3 LEU A 68 -3.804 6.798 -21.049 1.00 21.51 H new ATOM 0 HG LEU A 68 -3.136 7.987 -23.113 1.00 10.23 H new ATOM 0 HD11 LEU A 68 -0.769 8.550 -23.480 1.00 4.45 H new ATOM 0 HD12 LEU A 68 -1.480 9.506 -22.158 1.00 4.45 H new ATOM 0 HD13 LEU A 68 -0.412 8.132 -21.787 1.00 4.45 H new ATOM 0 HD21 LEU A 68 -1.576 6.267 -23.941 1.00 43.21 H new ATOM 0 HD22 LEU A 68 -1.254 5.759 -22.266 1.00 43.21 H new ATOM 0 HD23 LEU A 68 -2.880 5.557 -22.961 1.00 43.21 H new ATOM 1099 N PHE A 69 -3.903 10.673 -21.949 1.00 20.22 N ATOM 1100 CA PHE A 69 -4.717 11.534 -22.788 1.00 31.54 C ATOM 1101 C PHE A 69 -4.013 11.817 -24.106 1.00 35.13 C ATOM 1102 O PHE A 69 -2.981 12.482 -24.121 1.00 63.35 O ATOM 1103 CB PHE A 69 -4.960 12.854 -22.053 1.00 25.00 C ATOM 1104 CG PHE A 69 -6.193 13.606 -22.485 1.00 22.23 C ATOM 1105 CD1 PHE A 69 -6.703 13.479 -23.768 1.00 10.53 C ATOM 1106 CD2 PHE A 69 -6.842 14.444 -21.593 1.00 24.45 C ATOM 1107 CE1 PHE A 69 -7.835 14.171 -24.151 1.00 62.10 C ATOM 1108 CE2 PHE A 69 -7.974 15.138 -21.971 1.00 1.40 C ATOM 1109 CZ PHE A 69 -8.470 15.002 -23.252 1.00 62.55 C ATOM 0 H PHE A 69 -2.952 11.010 -21.799 1.00 20.22 H new ATOM 0 HA PHE A 69 -5.663 11.035 -22.998 1.00 31.54 H new ATOM 0 HB2 PHE A 69 -5.033 12.650 -20.985 1.00 25.00 H new ATOM 0 HB3 PHE A 69 -4.092 13.497 -22.196 1.00 25.00 H new ATOM 0 HD1 PHE A 69 -6.209 12.831 -24.477 1.00 10.53 H new ATOM 0 HD2 PHE A 69 -6.458 14.556 -20.590 1.00 24.45 H new ATOM 0 HE1 PHE A 69 -8.222 14.062 -25.153 1.00 62.10 H new ATOM 0 HE2 PHE A 69 -8.471 15.787 -21.265 1.00 1.40 H new ATOM 0 HZ PHE A 69 -9.354 15.546 -23.550 1.00 62.55 H new ATOM 1119 N ASP A 70 -4.559 11.311 -25.199 1.00 23.20 N ATOM 1120 CA ASP A 70 -4.066 11.675 -26.521 1.00 20.43 C ATOM 1121 C ASP A 70 -5.039 12.627 -27.172 1.00 1.30 C ATOM 1122 O ASP A 70 -6.165 12.251 -27.487 1.00 20.41 O ATOM 1123 CB ASP A 70 -3.877 10.462 -27.441 1.00 3.42 C ATOM 1124 CG ASP A 70 -3.572 10.879 -28.881 1.00 73.11 C ATOM 1125 OD1 ASP A 70 -2.394 11.149 -29.190 1.00 4.12 O ATOM 1126 OD2 ASP A 70 -4.518 10.953 -29.704 1.00 33.35 O ATOM 0 H ASP A 70 -5.338 10.652 -25.200 1.00 23.20 H new ATOM 0 HA ASP A 70 -3.090 12.140 -26.380 1.00 20.43 H new ATOM 0 HB2 ASP A 70 -3.064 9.843 -27.063 1.00 3.42 H new ATOM 0 HB3 ASP A 70 -4.779 9.850 -27.424 1.00 3.42 H new ATOM 1131 N PHE A 71 -4.629 13.864 -27.349 1.00 61.52 N ATOM 1132 CA PHE A 71 -5.430 14.801 -28.103 1.00 21.41 C ATOM 1133 C PHE A 71 -4.563 15.535 -29.103 1.00 63.21 C ATOM 1134 O PHE A 71 -3.391 15.822 -28.846 1.00 53.11 O ATOM 1135 CB PHE A 71 -6.204 15.778 -27.202 1.00 32.50 C ATOM 1136 CG PHE A 71 -5.365 16.674 -26.333 1.00 51.15 C ATOM 1137 CD1 PHE A 71 -4.882 17.881 -26.814 1.00 55.34 C ATOM 1138 CD2 PHE A 71 -5.089 16.323 -25.024 1.00 51.33 C ATOM 1139 CE1 PHE A 71 -4.137 18.716 -26.006 1.00 4.15 C ATOM 1140 CE2 PHE A 71 -4.342 17.152 -24.212 1.00 3.53 C ATOM 1141 CZ PHE A 71 -3.866 18.351 -24.703 1.00 12.00 C ATOM 0 H PHE A 71 -3.754 14.241 -26.985 1.00 61.52 H new ATOM 0 HA PHE A 71 -6.185 14.230 -28.644 1.00 21.41 H new ATOM 0 HB2 PHE A 71 -6.834 16.404 -27.834 1.00 32.50 H new ATOM 0 HB3 PHE A 71 -6.869 15.201 -26.560 1.00 32.50 H new ATOM 0 HD1 PHE A 71 -5.091 18.171 -27.833 1.00 55.34 H new ATOM 0 HD2 PHE A 71 -5.463 15.388 -24.632 1.00 51.33 H new ATOM 0 HE1 PHE A 71 -3.767 19.654 -26.393 1.00 4.15 H new ATOM 0 HE2 PHE A 71 -4.130 16.863 -23.193 1.00 3.53 H new ATOM 0 HZ PHE A 71 -3.283 19.002 -24.069 1.00 12.00 H new ATOM 1151 N GLU A 72 -5.141 15.808 -30.251 1.00 63.11 N ATOM 1152 CA GLU A 72 -4.430 16.458 -31.326 1.00 5.10 C ATOM 1153 C GLU A 72 -4.576 17.965 -31.207 1.00 53.45 C ATOM 1154 O GLU A 72 -5.656 18.521 -31.405 1.00 25.20 O ATOM 1155 CB GLU A 72 -4.962 15.944 -32.664 1.00 23.14 C ATOM 1156 CG GLU A 72 -6.480 15.862 -32.723 1.00 61.15 C ATOM 1157 CD GLU A 72 -6.969 14.980 -33.847 1.00 20.11 C ATOM 1158 OE1 GLU A 72 -6.640 13.776 -33.837 1.00 5.21 O ATOM 1159 OE2 GLU A 72 -7.684 15.481 -34.742 1.00 53.33 O ATOM 0 H GLU A 72 -6.113 15.586 -30.464 1.00 63.11 H new ATOM 0 HA GLU A 72 -3.367 16.224 -31.267 1.00 5.10 H new ATOM 0 HB2 GLU A 72 -4.610 16.599 -33.461 1.00 23.14 H new ATOM 0 HB3 GLU A 72 -4.545 14.955 -32.856 1.00 23.14 H new ATOM 0 HG2 GLU A 72 -6.857 15.479 -31.775 1.00 61.15 H new ATOM 0 HG3 GLU A 72 -6.890 16.864 -32.847 1.00 61.15 H new ATOM 1166 N TYR A 73 -3.482 18.618 -30.861 1.00 34.23 N ATOM 1167 CA TYR A 73 -3.502 20.044 -30.613 1.00 62.35 C ATOM 1168 C TYR A 73 -2.745 20.775 -31.708 1.00 43.14 C ATOM 1169 O TYR A 73 -1.614 20.418 -32.044 1.00 60.34 O ATOM 1170 CB TYR A 73 -2.896 20.346 -29.242 1.00 1.20 C ATOM 1171 CG TYR A 73 -3.642 21.412 -28.472 1.00 14.22 C ATOM 1172 CD1 TYR A 73 -5.032 21.422 -28.438 1.00 33.10 C ATOM 1173 CD2 TYR A 73 -2.961 22.399 -27.775 1.00 22.12 C ATOM 1174 CE1 TYR A 73 -5.720 22.390 -27.733 1.00 23.23 C ATOM 1175 CE2 TYR A 73 -3.643 23.367 -27.066 1.00 5.31 C ATOM 1176 CZ TYR A 73 -5.020 23.359 -27.048 1.00 73.11 C ATOM 1177 OH TYR A 73 -5.696 24.326 -26.342 1.00 2.02 O ATOM 0 H TYR A 73 -2.568 18.181 -30.746 1.00 34.23 H new ATOM 0 HA TYR A 73 -4.535 20.392 -30.618 1.00 62.35 H new ATOM 0 HB2 TYR A 73 -2.878 19.429 -28.652 1.00 1.20 H new ATOM 0 HB3 TYR A 73 -1.861 20.662 -29.373 1.00 1.20 H new ATOM 0 HD1 TYR A 73 -5.582 20.661 -28.971 1.00 33.10 H new ATOM 0 HD2 TYR A 73 -1.881 22.410 -27.787 1.00 22.12 H new ATOM 0 HE1 TYR A 73 -6.800 22.387 -27.719 1.00 23.23 H new ATOM 0 HE2 TYR A 73 -3.099 24.128 -26.527 1.00 5.31 H new ATOM 0 HH TYR A 73 -5.052 24.930 -25.917 1.00 2.02 H new ATOM 1187 N MET A 74 -3.383 21.786 -32.270 1.00 52.32 N ATOM 1188 CA MET A 74 -2.796 22.556 -33.354 1.00 64.20 C ATOM 1189 C MET A 74 -1.845 23.619 -32.804 1.00 31.34 C ATOM 1190 O MET A 74 -2.148 24.277 -31.808 1.00 45.11 O ATOM 1191 CB MET A 74 -3.895 23.212 -34.198 1.00 22.24 C ATOM 1192 CG MET A 74 -4.757 24.203 -33.425 1.00 74.24 C ATOM 1193 SD MET A 74 -6.102 24.885 -34.413 1.00 33.11 S ATOM 1194 CE MET A 74 -7.097 23.420 -34.685 1.00 74.11 C ATOM 0 H MET A 74 -4.314 22.095 -31.992 1.00 52.32 H new ATOM 0 HA MET A 74 -2.226 21.877 -33.989 1.00 64.20 H new ATOM 0 HB2 MET A 74 -3.434 23.727 -35.041 1.00 22.24 H new ATOM 0 HB3 MET A 74 -4.536 22.433 -34.612 1.00 22.24 H new ATOM 0 HG2 MET A 74 -5.173 23.708 -32.548 1.00 74.24 H new ATOM 0 HG3 MET A 74 -4.129 25.018 -33.064 1.00 74.24 H new ATOM 0 HE1 MET A 74 -8.111 23.714 -34.957 1.00 74.11 H new ATOM 0 HE2 MET A 74 -6.662 22.829 -35.491 1.00 74.11 H new ATOM 0 HE3 MET A 74 -7.125 22.825 -33.772 1.00 74.11 H new ATOM 1204 N HIS A 75 -0.692 23.772 -33.440 1.00 61.33 N ATOM 1205 CA HIS A 75 0.289 24.765 -33.014 1.00 44.12 C ATOM 1206 C HIS A 75 0.816 25.571 -34.191 1.00 54.33 C ATOM 1207 O HIS A 75 1.029 25.041 -35.280 1.00 41.03 O ATOM 1208 CB HIS A 75 1.478 24.109 -32.306 1.00 52.02 C ATOM 1209 CG HIS A 75 1.188 23.607 -30.926 1.00 70.42 C ATOM 1210 ND1 HIS A 75 0.710 24.407 -29.917 1.00 5.55 N ATOM 1211 CD2 HIS A 75 1.358 22.382 -30.382 1.00 54.30 C ATOM 1212 CE1 HIS A 75 0.602 23.698 -28.810 1.00 45.24 C ATOM 1213 NE2 HIS A 75 0.990 22.460 -29.061 1.00 63.31 N ATOM 0 H HIS A 75 -0.411 23.223 -34.252 1.00 61.33 H new ATOM 0 HA HIS A 75 -0.228 25.429 -32.321 1.00 44.12 H new ATOM 0 HB2 HIS A 75 1.830 23.276 -32.914 1.00 52.02 H new ATOM 0 HB3 HIS A 75 2.293 24.830 -32.251 1.00 52.02 H new ATOM 0 HD2 HIS A 75 1.718 21.501 -30.893 1.00 54.30 H new ATOM 0 HE1 HIS A 75 0.254 24.068 -27.857 1.00 45.24 H new ATOM 0 HE2 HIS A 75 1.012 21.693 -28.389 1.00 63.31 H new ATOM 1222 N GLN A 76 1.017 26.856 -33.965 1.00 11.13 N ATOM 1223 CA GLN A 76 1.695 27.709 -34.925 1.00 62.50 C ATOM 1224 C GLN A 76 2.706 28.591 -34.204 1.00 63.14 C ATOM 1225 O GLN A 76 2.451 29.053 -33.092 1.00 12.11 O ATOM 1226 CB GLN A 76 0.695 28.571 -35.698 1.00 1.22 C ATOM 1227 CG GLN A 76 -0.191 29.433 -34.816 1.00 14.04 C ATOM 1228 CD GLN A 76 -1.009 30.426 -35.613 1.00 24.42 C ATOM 1229 OE1 GLN A 76 -0.583 31.558 -35.837 1.00 65.13 O ATOM 1230 NE2 GLN A 76 -2.177 30.004 -36.064 1.00 32.21 N ATOM 0 H GLN A 76 0.717 27.336 -33.116 1.00 11.13 H new ATOM 0 HA GLN A 76 2.216 27.076 -35.643 1.00 62.50 H new ATOM 0 HB2 GLN A 76 1.242 29.216 -36.386 1.00 1.22 H new ATOM 0 HB3 GLN A 76 0.064 27.921 -36.304 1.00 1.22 H new ATOM 0 HG2 GLN A 76 -0.861 28.792 -34.242 1.00 14.04 H new ATOM 0 HG3 GLN A 76 0.429 29.970 -34.098 1.00 14.04 H new ATOM 0 HE21 GLN A 76 -2.492 29.057 -35.855 1.00 32.21 H new ATOM 0 HE22 GLN A 76 -2.763 30.625 -36.621 1.00 32.21 H new ATOM 1239 N CYS A 77 3.855 28.808 -34.821 1.00 70.12 N ATOM 1240 CA CYS A 77 4.891 29.635 -34.222 1.00 44.52 C ATOM 1241 C CYS A 77 5.099 30.890 -35.058 1.00 33.10 C ATOM 1242 O CYS A 77 4.824 30.887 -36.261 1.00 44.41 O ATOM 1243 CB CYS A 77 6.203 28.849 -34.093 1.00 43.22 C ATOM 1244 SG CYS A 77 7.517 29.731 -33.212 1.00 1.34 S ATOM 0 H CYS A 77 4.095 28.424 -35.735 1.00 70.12 H new ATOM 0 HA CYS A 77 4.572 29.927 -33.221 1.00 44.52 H new ATOM 0 HB2 CYS A 77 6.001 27.911 -33.576 1.00 43.22 H new ATOM 0 HB3 CYS A 77 6.559 28.593 -35.091 1.00 43.22 H new ATOM 0 HG CYS A 77 8.579 28.983 -33.155 1.00 1.34 H new ATOM 1250 N GLN A 78 5.537 31.966 -34.398 1.00 4.53 N ATOM 1251 CA GLN A 78 5.817 33.256 -35.042 1.00 5.51 C ATOM 1252 C GLN A 78 4.532 33.985 -35.453 1.00 61.23 C ATOM 1253 O GLN A 78 4.530 35.203 -35.620 1.00 50.21 O ATOM 1254 CB GLN A 78 6.746 33.081 -36.251 1.00 1.02 C ATOM 1255 CG GLN A 78 7.117 34.393 -36.924 1.00 53.11 C ATOM 1256 CD GLN A 78 8.104 34.215 -38.059 1.00 50.02 C ATOM 1257 OE1 GLN A 78 8.939 33.313 -38.037 1.00 32.01 O ATOM 1258 NE2 GLN A 78 8.011 35.073 -39.062 1.00 53.05 N ATOM 0 H GLN A 78 5.709 31.968 -33.393 1.00 4.53 H new ATOM 0 HA GLN A 78 6.324 33.875 -34.302 1.00 5.51 H new ATOM 0 HB2 GLN A 78 7.657 32.576 -35.929 1.00 1.02 H new ATOM 0 HB3 GLN A 78 6.262 32.431 -36.980 1.00 1.02 H new ATOM 0 HG2 GLN A 78 6.213 34.868 -37.306 1.00 53.11 H new ATOM 0 HG3 GLN A 78 7.542 35.069 -36.182 1.00 53.11 H new ATOM 0 HE21 GLN A 78 7.303 35.807 -39.041 1.00 53.05 H new ATOM 0 HE22 GLN A 78 8.647 35.000 -39.856 1.00 53.05 H new ATOM 1267 N GLY A 79 3.440 33.252 -35.583 1.00 71.02 N ATOM 1268 CA GLY A 79 2.195 33.852 -36.015 1.00 34.21 C ATOM 1269 C GLY A 79 1.795 33.391 -37.399 1.00 3.11 C ATOM 1270 O GLY A 79 0.782 33.832 -37.943 1.00 71.34 O ATOM 0 H GLY A 79 3.392 32.250 -35.397 1.00 71.02 H new ATOM 0 HA2 GLY A 79 1.406 33.600 -35.307 1.00 34.21 H new ATOM 0 HA3 GLY A 79 2.294 34.937 -36.009 1.00 34.21 H new ATOM 1274 N THR A 80 2.604 32.508 -37.973 1.00 4.20 N ATOM 1275 CA THR A 80 2.290 31.907 -39.256 1.00 41.22 C ATOM 1276 C THR A 80 1.052 31.026 -39.120 1.00 60.14 C ATOM 1277 O THR A 80 1.053 30.056 -38.359 1.00 14.32 O ATOM 1278 CB THR A 80 3.479 31.075 -39.772 1.00 32.51 C ATOM 1279 OG1 THR A 80 4.672 31.871 -39.732 1.00 1.34 O ATOM 1280 CG2 THR A 80 3.238 30.593 -41.196 1.00 22.24 C ATOM 0 H THR A 80 3.485 32.194 -37.565 1.00 4.20 H new ATOM 0 HA THR A 80 2.090 32.701 -39.976 1.00 41.22 H new ATOM 0 HB THR A 80 3.590 30.201 -39.130 1.00 32.51 H new ATOM 0 HG1 THR A 80 5.429 31.342 -40.059 1.00 1.34 H new ATOM 0 HG21 THR A 80 4.095 30.009 -41.532 1.00 22.24 H new ATOM 0 HG22 THR A 80 2.342 29.973 -41.223 1.00 22.24 H new ATOM 0 HG23 THR A 80 3.104 31.452 -41.853 1.00 22.24 H new ATOM 1288 N SER A 81 0.002 31.370 -39.851 1.00 62.21 N ATOM 1289 CA SER A 81 -1.291 30.721 -39.694 1.00 30.21 C ATOM 1290 C SER A 81 -1.323 29.346 -40.360 1.00 22.54 C ATOM 1291 O SER A 81 -2.028 29.129 -41.349 1.00 60.30 O ATOM 1292 CB SER A 81 -2.391 31.617 -40.262 1.00 62.31 C ATOM 1293 OG SER A 81 -2.330 32.914 -39.686 1.00 42.22 O ATOM 0 H SER A 81 0.021 32.100 -40.563 1.00 62.21 H new ATOM 0 HA SER A 81 -1.463 30.567 -38.629 1.00 30.21 H new ATOM 0 HB2 SER A 81 -2.285 31.689 -41.344 1.00 62.31 H new ATOM 0 HB3 SER A 81 -3.367 31.172 -40.066 1.00 62.31 H new ATOM 0 HG SER A 81 -3.041 33.473 -40.063 1.00 42.22 H new ATOM 1299 N GLU A 82 -0.533 28.430 -39.823 1.00 32.44 N ATOM 1300 CA GLU A 82 -0.547 27.049 -40.271 1.00 14.32 C ATOM 1301 C GLU A 82 -1.366 26.201 -39.310 1.00 42.50 C ATOM 1302 O GLU A 82 -2.166 25.365 -39.735 1.00 44.14 O ATOM 1303 CB GLU A 82 0.877 26.492 -40.366 1.00 75.23 C ATOM 1304 CG GLU A 82 1.744 27.190 -41.401 1.00 33.33 C ATOM 1305 CD GLU A 82 1.192 27.057 -42.806 1.00 1.22 C ATOM 1306 OE1 GLU A 82 1.451 26.021 -43.458 1.00 50.34 O ATOM 1307 OE2 GLU A 82 0.497 27.984 -43.265 1.00 73.22 O ATOM 0 H GLU A 82 0.130 28.621 -39.071 1.00 32.44 H new ATOM 0 HA GLU A 82 -0.999 27.015 -41.262 1.00 14.32 H new ATOM 0 HB2 GLU A 82 1.355 26.576 -39.390 1.00 75.23 H new ATOM 0 HB3 GLU A 82 0.826 25.430 -40.606 1.00 75.23 H new ATOM 0 HG2 GLU A 82 1.829 28.246 -41.146 1.00 33.33 H new ATOM 0 HG3 GLU A 82 2.750 26.772 -41.368 1.00 33.33 H new ATOM 1314 N SER A 83 -1.166 26.445 -38.013 1.00 0.22 N ATOM 1315 CA SER A 83 -1.809 25.669 -36.955 1.00 70.13 C ATOM 1316 C SER A 83 -1.672 24.173 -37.225 1.00 2.20 C ATOM 1317 O SER A 83 -2.660 23.472 -37.448 1.00 75.54 O ATOM 1318 CB SER A 83 -3.282 26.063 -36.811 1.00 1.03 C ATOM 1319 OG SER A 83 -3.418 27.422 -36.418 1.00 75.01 O ATOM 0 H SER A 83 -0.554 27.185 -37.669 1.00 0.22 H new ATOM 0 HA SER A 83 -1.306 25.893 -36.014 1.00 70.13 H new ATOM 0 HB2 SER A 83 -3.798 25.903 -37.758 1.00 1.03 H new ATOM 0 HB3 SER A 83 -3.762 25.419 -36.074 1.00 1.03 H new ATOM 0 HG SER A 83 -3.416 27.481 -35.440 1.00 75.01 H new ATOM 1325 N SER A 84 -0.434 23.705 -37.226 1.00 71.43 N ATOM 1326 CA SER A 84 -0.139 22.315 -37.509 1.00 12.33 C ATOM 1327 C SER A 84 -0.654 21.426 -36.385 1.00 44.31 C ATOM 1328 O SER A 84 -0.404 21.693 -35.208 1.00 44.25 O ATOM 1329 CB SER A 84 1.367 22.142 -37.675 1.00 34.33 C ATOM 1330 OG SER A 84 1.889 23.134 -38.544 1.00 2.15 O ATOM 0 H SER A 84 0.388 24.276 -37.032 1.00 71.43 H new ATOM 0 HA SER A 84 -0.638 22.021 -38.432 1.00 12.33 H new ATOM 0 HB2 SER A 84 1.856 22.208 -36.703 1.00 34.33 H new ATOM 0 HB3 SER A 84 1.583 21.151 -38.074 1.00 34.33 H new ATOM 0 HG SER A 84 2.857 23.010 -38.638 1.00 2.15 H new ATOM 1336 N LYS A 85 -1.379 20.382 -36.747 1.00 73.21 N ATOM 1337 CA LYS A 85 -1.956 19.484 -35.766 1.00 4.13 C ATOM 1338 C LYS A 85 -0.918 18.488 -35.275 1.00 21.24 C ATOM 1339 O LYS A 85 -0.349 17.727 -36.062 1.00 32.51 O ATOM 1340 CB LYS A 85 -3.143 18.731 -36.360 1.00 4.41 C ATOM 1341 CG LYS A 85 -3.812 17.806 -35.362 1.00 43.10 C ATOM 1342 CD LYS A 85 -4.843 16.910 -36.019 1.00 11.10 C ATOM 1343 CE LYS A 85 -6.033 17.694 -36.544 1.00 40.43 C ATOM 1344 NZ LYS A 85 -7.112 16.790 -37.019 1.00 65.01 N ATOM 0 H LYS A 85 -1.582 20.136 -37.716 1.00 73.21 H new ATOM 0 HA LYS A 85 -2.300 20.084 -34.924 1.00 4.13 H new ATOM 0 HB2 LYS A 85 -3.875 19.449 -36.730 1.00 4.41 H new ATOM 0 HB3 LYS A 85 -2.806 18.149 -37.218 1.00 4.41 H new ATOM 0 HG2 LYS A 85 -3.056 17.191 -34.875 1.00 43.10 H new ATOM 0 HG3 LYS A 85 -4.291 18.399 -34.583 1.00 43.10 H new ATOM 0 HD2 LYS A 85 -4.378 16.365 -36.841 1.00 11.10 H new ATOM 0 HD3 LYS A 85 -5.188 16.168 -35.299 1.00 11.10 H new ATOM 0 HE2 LYS A 85 -6.419 18.342 -35.757 1.00 40.43 H new ATOM 0 HE3 LYS A 85 -5.713 18.341 -37.361 1.00 40.43 H new ATOM 0 HZ1 LYS A 85 -7.789 17.330 -37.595 1.00 65.01 H new ATOM 0 HZ2 LYS A 85 -6.699 16.028 -37.594 1.00 65.01 H new ATOM 0 HZ3 LYS A 85 -7.605 16.378 -36.201 1.00 65.01 H new ATOM 1358 N LYS A 86 -0.672 18.491 -33.976 1.00 62.34 N ATOM 1359 CA LYS A 86 0.261 17.554 -33.386 1.00 31.22 C ATOM 1360 C LYS A 86 -0.454 16.682 -32.364 1.00 43.32 C ATOM 1361 O LYS A 86 -1.048 17.192 -31.413 1.00 61.04 O ATOM 1362 CB LYS A 86 1.422 18.301 -32.720 1.00 53.32 C ATOM 1363 CG LYS A 86 2.662 17.445 -32.487 1.00 12.24 C ATOM 1364 CD LYS A 86 3.523 17.329 -33.743 1.00 4.11 C ATOM 1365 CE LYS A 86 2.820 16.570 -34.861 1.00 5.42 C ATOM 1366 NZ LYS A 86 3.621 16.549 -36.113 1.00 71.21 N ATOM 0 H LYS A 86 -1.106 19.132 -33.312 1.00 62.34 H new ATOM 0 HA LYS A 86 0.664 16.920 -34.175 1.00 31.22 H new ATOM 0 HB2 LYS A 86 1.694 19.154 -33.341 1.00 53.32 H new ATOM 0 HB3 LYS A 86 1.083 18.698 -31.763 1.00 53.32 H new ATOM 0 HG2 LYS A 86 3.254 17.877 -31.680 1.00 12.24 H new ATOM 0 HG3 LYS A 86 2.359 16.450 -32.162 1.00 12.24 H new ATOM 0 HD2 LYS A 86 3.785 18.327 -34.094 1.00 4.11 H new ATOM 0 HD3 LYS A 86 4.456 16.823 -33.495 1.00 4.11 H new ATOM 0 HE2 LYS A 86 2.626 15.547 -34.538 1.00 5.42 H new ATOM 0 HE3 LYS A 86 1.852 17.031 -35.058 1.00 5.42 H new ATOM 0 HZ1 LYS A 86 3.105 16.022 -36.846 1.00 71.21 H new ATOM 0 HZ2 LYS A 86 3.785 17.524 -36.437 1.00 71.21 H new ATOM 0 HZ3 LYS A 86 4.535 16.086 -35.933 1.00 71.21 H new ATOM 1380 N GLN A 87 -0.420 15.374 -32.577 1.00 54.30 N ATOM 1381 CA GLN A 87 -0.997 14.438 -31.627 1.00 71.10 C ATOM 1382 C GLN A 87 -0.049 14.281 -30.446 1.00 4.23 C ATOM 1383 O GLN A 87 1.159 14.102 -30.626 1.00 44.34 O ATOM 1384 CB GLN A 87 -1.290 13.078 -32.288 1.00 2.23 C ATOM 1385 CG GLN A 87 -0.063 12.217 -32.584 1.00 64.41 C ATOM 1386 CD GLN A 87 0.884 12.827 -33.602 1.00 71.33 C ATOM 1387 OE1 GLN A 87 0.471 13.564 -34.500 1.00 23.51 O ATOM 1388 NE2 GLN A 87 2.162 12.524 -33.464 1.00 33.21 N ATOM 0 H GLN A 87 0.001 14.939 -33.398 1.00 54.30 H new ATOM 0 HA GLN A 87 -1.950 14.831 -31.274 1.00 71.10 H new ATOM 0 HB2 GLN A 87 -1.961 12.515 -31.639 1.00 2.23 H new ATOM 0 HB3 GLN A 87 -1.823 13.254 -33.222 1.00 2.23 H new ATOM 0 HG2 GLN A 87 0.480 12.044 -31.655 1.00 64.41 H new ATOM 0 HG3 GLN A 87 -0.393 11.244 -32.947 1.00 64.41 H new ATOM 0 HE21 GLN A 87 2.462 11.910 -32.707 1.00 33.21 H new ATOM 0 HE22 GLN A 87 2.849 12.904 -34.115 1.00 33.21 H new ATOM 1397 N LYS A 88 -0.582 14.396 -29.245 1.00 35.23 N ATOM 1398 CA LYS A 88 0.244 14.396 -28.053 1.00 14.33 C ATOM 1399 C LYS A 88 -0.424 13.607 -26.936 1.00 62.44 C ATOM 1400 O LYS A 88 -1.565 13.887 -26.565 1.00 74.31 O ATOM 1401 CB LYS A 88 0.493 15.840 -27.604 1.00 51.11 C ATOM 1402 CG LYS A 88 1.278 16.672 -28.611 1.00 22.15 C ATOM 1403 CD LYS A 88 0.996 18.160 -28.463 1.00 43.55 C ATOM 1404 CE LYS A 88 1.408 18.692 -27.099 1.00 60.33 C ATOM 1405 NZ LYS A 88 2.874 18.582 -26.874 1.00 42.44 N ATOM 0 H LYS A 88 -1.582 14.491 -29.069 1.00 35.23 H new ATOM 0 HA LYS A 88 1.196 13.919 -28.284 1.00 14.33 H new ATOM 0 HB2 LYS A 88 -0.466 16.323 -27.417 1.00 51.11 H new ATOM 0 HB3 LYS A 88 1.033 15.828 -26.657 1.00 51.11 H new ATOM 0 HG2 LYS A 88 2.345 16.490 -28.479 1.00 22.15 H new ATOM 0 HG3 LYS A 88 1.023 16.353 -29.622 1.00 22.15 H new ATOM 0 HD2 LYS A 88 1.529 18.708 -29.240 1.00 43.55 H new ATOM 0 HD3 LYS A 88 -0.068 18.343 -28.616 1.00 43.55 H new ATOM 0 HE2 LYS A 88 1.106 19.736 -27.011 1.00 60.33 H new ATOM 0 HE3 LYS A 88 0.880 18.141 -26.321 1.00 60.33 H new ATOM 0 HZ1 LYS A 88 3.170 19.284 -26.167 1.00 42.44 H new ATOM 0 HZ2 LYS A 88 3.102 17.627 -26.530 1.00 42.44 H new ATOM 0 HZ3 LYS A 88 3.376 18.757 -27.767 1.00 42.44 H new ATOM 1419 N LEU A 89 0.295 12.628 -26.402 1.00 42.30 N ATOM 1420 CA LEU A 89 -0.209 11.830 -25.295 1.00 5.14 C ATOM 1421 C LEU A 89 0.361 12.335 -23.981 1.00 22.15 C ATOM 1422 O LEU A 89 1.578 12.504 -23.837 1.00 12.43 O ATOM 1423 CB LEU A 89 0.132 10.344 -25.449 1.00 21.32 C ATOM 1424 CG LEU A 89 -0.387 9.650 -26.715 1.00 15.13 C ATOM 1425 CD1 LEU A 89 0.455 10.012 -27.931 1.00 60.23 C ATOM 1426 CD2 LEU A 89 -0.409 8.144 -26.515 1.00 44.10 C ATOM 0 H LEU A 89 1.229 12.368 -26.719 1.00 42.30 H new ATOM 0 HA LEU A 89 -1.294 11.932 -25.299 1.00 5.14 H new ATOM 0 HB2 LEU A 89 1.217 10.238 -25.422 1.00 21.32 H new ATOM 0 HB3 LEU A 89 -0.261 9.812 -24.583 1.00 21.32 H new ATOM 0 HG LEU A 89 -1.403 9.999 -26.898 1.00 15.13 H new ATOM 0 HD11 LEU A 89 0.061 9.504 -28.811 1.00 60.23 H new ATOM 0 HD12 LEU A 89 0.421 11.090 -28.089 1.00 60.23 H new ATOM 0 HD13 LEU A 89 1.487 9.702 -27.765 1.00 60.23 H new ATOM 0 HD21 LEU A 89 -0.779 7.662 -27.420 1.00 44.10 H new ATOM 0 HD22 LEU A 89 0.600 7.790 -26.302 1.00 44.10 H new ATOM 0 HD23 LEU A 89 -1.064 7.898 -25.679 1.00 44.10 H new ATOM 1438 N PHE A 90 -0.522 12.580 -23.034 1.00 11.15 N ATOM 1439 CA PHE A 90 -0.134 13.072 -21.727 1.00 32.32 C ATOM 1440 C PHE A 90 -0.542 12.090 -20.648 1.00 13.11 C ATOM 1441 O PHE A 90 -1.625 11.515 -20.699 1.00 22.52 O ATOM 1442 CB PHE A 90 -0.789 14.423 -21.457 1.00 74.52 C ATOM 1443 CG PHE A 90 -0.487 15.436 -22.512 1.00 42.21 C ATOM 1444 CD1 PHE A 90 0.663 16.194 -22.446 1.00 0.51 C ATOM 1445 CD2 PHE A 90 -1.347 15.616 -23.580 1.00 45.32 C ATOM 1446 CE1 PHE A 90 0.955 17.117 -23.425 1.00 41.20 C ATOM 1447 CE2 PHE A 90 -1.062 16.540 -24.561 1.00 24.23 C ATOM 1448 CZ PHE A 90 0.090 17.290 -24.483 1.00 4.43 C ATOM 0 H PHE A 90 -1.526 12.444 -23.148 1.00 11.15 H new ATOM 0 HA PHE A 90 0.950 13.186 -21.713 1.00 32.32 H new ATOM 0 HB2 PHE A 90 -1.869 14.290 -21.386 1.00 74.52 H new ATOM 0 HB3 PHE A 90 -0.450 14.799 -20.492 1.00 74.52 H new ATOM 0 HD1 PHE A 90 1.342 16.062 -21.617 1.00 0.51 H new ATOM 0 HD2 PHE A 90 -2.250 15.027 -23.645 1.00 45.32 H new ATOM 0 HE1 PHE A 90 1.860 17.704 -23.364 1.00 41.20 H new ATOM 0 HE2 PHE A 90 -1.741 16.676 -25.390 1.00 24.23 H new ATOM 0 HZ PHE A 90 0.316 18.014 -25.252 1.00 4.43 H new ATOM 1458 N LEU A 91 0.335 11.894 -19.688 1.00 11.42 N ATOM 1459 CA LEU A 91 0.033 11.085 -18.524 1.00 43.21 C ATOM 1460 C LEU A 91 0.005 11.981 -17.302 1.00 63.53 C ATOM 1461 O LEU A 91 1.000 12.624 -16.979 1.00 12.44 O ATOM 1462 CB LEU A 91 1.088 9.993 -18.343 1.00 1.30 C ATOM 1463 CG LEU A 91 0.909 9.103 -17.114 1.00 34.04 C ATOM 1464 CD1 LEU A 91 -0.315 8.215 -17.268 1.00 13.14 C ATOM 1465 CD2 LEU A 91 2.157 8.267 -16.884 1.00 30.44 C ATOM 0 H LEU A 91 1.275 12.289 -19.690 1.00 11.42 H new ATOM 0 HA LEU A 91 -0.937 10.605 -18.658 1.00 43.21 H new ATOM 0 HB2 LEU A 91 1.088 9.361 -19.231 1.00 1.30 H new ATOM 0 HB3 LEU A 91 2.069 10.465 -18.288 1.00 1.30 H new ATOM 0 HG LEU A 91 0.755 9.740 -16.243 1.00 34.04 H new ATOM 0 HD11 LEU A 91 -0.424 7.589 -16.382 1.00 13.14 H new ATOM 0 HD12 LEU A 91 -1.203 8.836 -17.385 1.00 13.14 H new ATOM 0 HD13 LEU A 91 -0.197 7.582 -18.147 1.00 13.14 H new ATOM 0 HD21 LEU A 91 2.016 7.637 -16.005 1.00 30.44 H new ATOM 0 HD22 LEU A 91 2.340 7.638 -17.756 1.00 30.44 H new ATOM 0 HD23 LEU A 91 3.012 8.925 -16.726 1.00 30.44 H new ATOM 1477 N MET A 92 -1.128 12.056 -16.638 1.00 12.04 N ATOM 1478 CA MET A 92 -1.230 12.904 -15.465 1.00 52.24 C ATOM 1479 C MET A 92 -1.843 12.162 -14.290 1.00 32.45 C ATOM 1480 O MET A 92 -2.945 11.624 -14.379 1.00 51.12 O ATOM 1481 CB MET A 92 -1.993 14.200 -15.776 1.00 1.12 C ATOM 1482 CG MET A 92 -3.382 14.016 -16.368 1.00 74.42 C ATOM 1483 SD MET A 92 -4.073 15.584 -16.935 1.00 4.53 S ATOM 1484 CE MET A 92 -5.690 15.064 -17.503 1.00 42.11 C ATOM 0 H MET A 92 -1.979 11.550 -16.883 1.00 12.04 H new ATOM 0 HA MET A 92 -0.217 13.184 -15.175 1.00 52.24 H new ATOM 0 HB2 MET A 92 -2.083 14.778 -14.856 1.00 1.12 H new ATOM 0 HB3 MET A 92 -1.397 14.794 -16.469 1.00 1.12 H new ATOM 0 HG2 MET A 92 -3.333 13.316 -17.202 1.00 74.42 H new ATOM 0 HG3 MET A 92 -4.042 13.576 -15.620 1.00 74.42 H new ATOM 0 HE1 MET A 92 -6.160 15.877 -18.057 1.00 42.11 H new ATOM 0 HE2 MET A 92 -5.585 14.195 -18.152 1.00 42.11 H new ATOM 0 HE3 MET A 92 -6.311 14.804 -16.645 1.00 42.11 H new ATOM 1494 N SER A 93 -1.092 12.121 -13.199 1.00 23.42 N ATOM 1495 CA SER A 93 -1.527 11.462 -11.983 1.00 33.22 C ATOM 1496 C SER A 93 -2.337 12.424 -11.127 1.00 0.31 C ATOM 1497 O SER A 93 -1.776 13.278 -10.449 1.00 54.14 O ATOM 1498 CB SER A 93 -0.315 10.939 -11.202 1.00 54.25 C ATOM 1499 OG SER A 93 -0.713 10.216 -10.048 1.00 1.14 O ATOM 0 H SER A 93 -0.166 12.544 -13.135 1.00 23.42 H new ATOM 0 HA SER A 93 -2.160 10.615 -12.248 1.00 33.22 H new ATOM 0 HB2 SER A 93 0.285 10.296 -11.846 1.00 54.25 H new ATOM 0 HB3 SER A 93 0.318 11.776 -10.908 1.00 54.25 H new ATOM 0 HG SER A 93 0.082 9.895 -9.573 1.00 1.14 H new ATOM 1505 N TRP A 94 -3.654 12.304 -11.177 1.00 12.25 N ATOM 1506 CA TRP A 94 -4.514 13.181 -10.403 1.00 42.24 C ATOM 1507 C TRP A 94 -4.684 12.634 -8.993 1.00 71.14 C ATOM 1508 O TRP A 94 -5.331 11.605 -8.788 1.00 54.03 O ATOM 1509 CB TRP A 94 -5.878 13.344 -11.078 1.00 52.23 C ATOM 1510 CG TRP A 94 -6.730 14.406 -10.444 1.00 33.00 C ATOM 1511 CD1 TRP A 94 -6.623 15.755 -10.623 1.00 24.01 C ATOM 1512 CD2 TRP A 94 -7.817 14.208 -9.531 1.00 41.34 C ATOM 1513 NE1 TRP A 94 -7.575 16.407 -9.878 1.00 75.32 N ATOM 1514 CE2 TRP A 94 -8.322 15.480 -9.201 1.00 51.14 C ATOM 1515 CE3 TRP A 94 -8.415 13.078 -8.963 1.00 30.24 C ATOM 1516 CZ2 TRP A 94 -9.392 15.653 -8.328 1.00 33.14 C ATOM 1517 CZ3 TRP A 94 -9.478 13.251 -8.097 1.00 33.41 C ATOM 1518 CH2 TRP A 94 -9.957 14.530 -7.787 1.00 21.43 C ATOM 0 H TRP A 94 -4.147 11.612 -11.742 1.00 12.25 H new ATOM 0 HA TRP A 94 -4.044 14.163 -10.348 1.00 42.24 H new ATOM 0 HB2 TRP A 94 -5.729 13.587 -12.130 1.00 52.23 H new ATOM 0 HB3 TRP A 94 -6.409 12.393 -11.043 1.00 52.23 H new ATOM 0 HD1 TRP A 94 -5.896 16.239 -11.258 1.00 24.01 H new ATOM 0 HE1 TRP A 94 -7.705 17.418 -9.836 1.00 75.32 H new ATOM 0 HE3 TRP A 94 -8.052 12.088 -9.197 1.00 30.24 H new ATOM 0 HZ2 TRP A 94 -9.763 16.638 -8.086 1.00 33.14 H new ATOM 0 HZ3 TRP A 94 -9.947 12.386 -7.652 1.00 33.41 H new ATOM 0 HH2 TRP A 94 -10.790 14.632 -7.107 1.00 21.43 H new ATOM 1529 N CYS A 95 -4.077 13.314 -8.036 1.00 4.44 N ATOM 1530 CA CYS A 95 -4.166 12.933 -6.639 1.00 22.24 C ATOM 1531 C CYS A 95 -3.579 14.019 -5.758 1.00 14.52 C ATOM 1532 O CYS A 95 -2.464 14.487 -5.991 1.00 40.33 O ATOM 1533 CB CYS A 95 -3.422 11.623 -6.372 1.00 44.21 C ATOM 1534 SG CYS A 95 -3.491 11.083 -4.644 1.00 55.14 S ATOM 0 H CYS A 95 -3.510 14.144 -8.206 1.00 4.44 H new ATOM 0 HA CYS A 95 -5.221 12.795 -6.405 1.00 22.24 H new ATOM 0 HB2 CYS A 95 -3.843 10.841 -7.004 1.00 44.21 H new ATOM 0 HB3 CYS A 95 -2.379 11.742 -6.664 1.00 44.21 H new ATOM 0 HG CYS A 95 -2.663 10.097 -4.464 1.00 55.14 H new ATOM 1540 N PRO A 96 -4.329 14.447 -4.742 1.00 60.43 N ATOM 1541 CA PRO A 96 -3.822 15.356 -3.724 1.00 12.33 C ATOM 1542 C PRO A 96 -2.665 14.728 -2.953 1.00 32.24 C ATOM 1543 O PRO A 96 -2.864 13.833 -2.132 1.00 14.44 O ATOM 1544 CB PRO A 96 -5.030 15.584 -2.806 1.00 41.01 C ATOM 1545 CG PRO A 96 -6.208 15.205 -3.629 1.00 25.12 C ATOM 1546 CD PRO A 96 -5.736 14.095 -4.515 1.00 62.43 C ATOM 0 HA PRO A 96 -3.429 16.281 -4.146 1.00 12.33 H new ATOM 0 HB2 PRO A 96 -4.963 14.973 -1.905 1.00 41.01 H new ATOM 0 HB3 PRO A 96 -5.091 16.623 -2.483 1.00 41.01 H new ATOM 0 HG2 PRO A 96 -7.037 14.880 -3.001 1.00 25.12 H new ATOM 0 HG3 PRO A 96 -6.565 16.051 -4.216 1.00 25.12 H new ATOM 0 HD2 PRO A 96 -5.839 13.121 -4.036 1.00 62.43 H new ATOM 0 HD3 PRO A 96 -6.299 14.052 -5.447 1.00 62.43 H new ATOM 1554 N ASP A 97 -1.452 15.178 -3.247 1.00 41.44 N ATOM 1555 CA ASP A 97 -0.253 14.675 -2.573 1.00 73.04 C ATOM 1556 C ASP A 97 -0.267 15.076 -1.101 1.00 14.22 C ATOM 1557 O ASP A 97 0.422 14.487 -0.269 1.00 62.45 O ATOM 1558 CB ASP A 97 1.003 15.219 -3.269 1.00 13.21 C ATOM 1559 CG ASP A 97 2.299 14.702 -2.666 1.00 1.25 C ATOM 1560 OD1 ASP A 97 2.735 13.592 -3.031 1.00 21.34 O ATOM 1561 OD2 ASP A 97 2.904 15.414 -1.839 1.00 61.12 O ATOM 0 H ASP A 97 -1.268 15.893 -3.950 1.00 41.44 H new ATOM 0 HA ASP A 97 -0.242 13.587 -2.631 1.00 73.04 H new ATOM 0 HB2 ASP A 97 0.970 14.950 -4.325 1.00 13.21 H new ATOM 0 HB3 ASP A 97 0.996 16.308 -3.217 1.00 13.21 H new ATOM 1566 N THR A 98 -1.083 16.072 -0.791 1.00 43.34 N ATOM 1567 CA THR A 98 -1.210 16.587 0.561 1.00 63.53 C ATOM 1568 C THR A 98 -2.284 15.823 1.347 1.00 23.03 C ATOM 1569 O THR A 98 -2.645 16.202 2.463 1.00 31.22 O ATOM 1570 CB THR A 98 -1.573 18.081 0.509 1.00 30.44 C ATOM 1571 OG1 THR A 98 -1.086 18.639 -0.723 1.00 42.14 O ATOM 1572 CG2 THR A 98 -0.966 18.835 1.685 1.00 44.13 C ATOM 0 H THR A 98 -1.676 16.546 -1.472 1.00 43.34 H new ATOM 0 HA THR A 98 -0.256 16.453 1.070 1.00 63.53 H new ATOM 0 HB THR A 98 -2.657 18.179 0.566 1.00 30.44 H new ATOM 0 HG1 THR A 98 -1.315 19.591 -0.764 1.00 42.14 H new ATOM 0 HG21 THR A 98 -1.239 19.888 1.622 1.00 44.13 H new ATOM 0 HG22 THR A 98 -1.343 18.418 2.619 1.00 44.13 H new ATOM 0 HG23 THR A 98 0.119 18.739 1.657 1.00 44.13 H new ATOM 1580 N ALA A 99 -2.794 14.744 0.757 1.00 13.11 N ATOM 1581 CA ALA A 99 -3.820 13.934 1.403 1.00 71.13 C ATOM 1582 C ALA A 99 -3.188 12.899 2.330 1.00 42.33 C ATOM 1583 O ALA A 99 -1.974 12.906 2.545 1.00 0.42 O ATOM 1584 CB ALA A 99 -4.695 13.251 0.363 1.00 23.34 C ATOM 0 H ALA A 99 -2.513 14.412 -0.166 1.00 13.11 H new ATOM 0 HA ALA A 99 -4.446 14.594 2.003 1.00 71.13 H new ATOM 0 HB1 ALA A 99 -5.455 12.651 0.864 1.00 23.34 H new ATOM 0 HB2 ALA A 99 -5.179 14.005 -0.257 1.00 23.34 H new ATOM 0 HB3 ALA A 99 -4.079 12.606 -0.264 1.00 23.34 H new ATOM 1590 N LYS A 100 -4.015 12.023 2.887 1.00 33.52 N ATOM 1591 CA LYS A 100 -3.540 10.997 3.803 1.00 60.34 C ATOM 1592 C LYS A 100 -2.604 10.025 3.092 1.00 25.30 C ATOM 1593 O LYS A 100 -2.871 9.596 1.964 1.00 3.24 O ATOM 1594 CB LYS A 100 -4.726 10.260 4.429 1.00 63.11 C ATOM 1595 CG LYS A 100 -4.334 9.259 5.505 1.00 31.34 C ATOM 1596 CD LYS A 100 -5.492 8.982 6.451 1.00 42.14 C ATOM 1597 CE LYS A 100 -6.687 8.387 5.726 1.00 53.43 C ATOM 1598 NZ LYS A 100 -7.889 8.339 6.598 1.00 62.32 N ATOM 0 H LYS A 100 -5.021 12.004 2.719 1.00 33.52 H new ATOM 0 HA LYS A 100 -2.973 11.478 4.601 1.00 60.34 H new ATOM 0 HB2 LYS A 100 -5.409 10.992 4.860 1.00 63.11 H new ATOM 0 HB3 LYS A 100 -5.272 9.738 3.643 1.00 63.11 H new ATOM 0 HG2 LYS A 100 -4.012 8.328 5.038 1.00 31.34 H new ATOM 0 HG3 LYS A 100 -3.484 9.643 6.070 1.00 31.34 H new ATOM 0 HD2 LYS A 100 -5.165 8.298 7.234 1.00 42.14 H new ATOM 0 HD3 LYS A 100 -5.790 9.909 6.941 1.00 42.14 H new ATOM 0 HE2 LYS A 100 -6.905 8.979 4.837 1.00 53.43 H new ATOM 0 HE3 LYS A 100 -6.443 7.380 5.387 1.00 53.43 H new ATOM 0 HZ1 LYS A 100 -8.685 7.927 6.070 1.00 62.32 H new ATOM 0 HZ2 LYS A 100 -7.688 7.754 7.434 1.00 62.32 H new ATOM 0 HZ3 LYS A 100 -8.136 9.302 6.901 1.00 62.32 H new ATOM 1612 N VAL A 101 -1.513 9.681 3.773 1.00 62.14 N ATOM 1613 CA VAL A 101 -0.443 8.868 3.200 1.00 35.12 C ATOM 1614 C VAL A 101 -0.966 7.579 2.564 1.00 24.21 C ATOM 1615 O VAL A 101 -0.482 7.174 1.512 1.00 75.25 O ATOM 1616 CB VAL A 101 0.635 8.536 4.263 1.00 23.54 C ATOM 1617 CG1 VAL A 101 0.042 7.761 5.430 1.00 2.45 C ATOM 1618 CG2 VAL A 101 1.798 7.771 3.643 1.00 3.52 C ATOM 0 H VAL A 101 -1.346 9.959 4.740 1.00 62.14 H new ATOM 0 HA VAL A 101 0.010 9.466 2.409 1.00 35.12 H new ATOM 0 HB VAL A 101 1.017 9.481 4.649 1.00 23.54 H new ATOM 0 HG11 VAL A 101 0.824 7.544 6.158 1.00 2.45 H new ATOM 0 HG12 VAL A 101 -0.739 8.357 5.903 1.00 2.45 H new ATOM 0 HG13 VAL A 101 -0.385 6.826 5.067 1.00 2.45 H new ATOM 0 HG21 VAL A 101 2.540 7.551 4.411 1.00 3.52 H new ATOM 0 HG22 VAL A 101 1.432 6.838 3.214 1.00 3.52 H new ATOM 0 HG23 VAL A 101 2.255 8.376 2.860 1.00 3.52 H new ATOM 1628 N LYS A 102 -1.975 6.968 3.177 1.00 54.45 N ATOM 1629 CA LYS A 102 -2.525 5.702 2.691 1.00 0.10 C ATOM 1630 C LYS A 102 -2.914 5.759 1.216 1.00 31.21 C ATOM 1631 O LYS A 102 -2.612 4.846 0.453 1.00 4.32 O ATOM 1632 CB LYS A 102 -3.742 5.298 3.522 1.00 21.20 C ATOM 1633 CG LYS A 102 -3.403 4.442 4.731 1.00 0.15 C ATOM 1634 CD LYS A 102 -2.841 3.094 4.308 1.00 33.15 C ATOM 1635 CE LYS A 102 -2.615 2.181 5.498 1.00 72.44 C ATOM 1636 NZ LYS A 102 -2.040 0.874 5.086 1.00 21.13 N ATOM 0 H LYS A 102 -2.432 7.329 4.015 1.00 54.45 H new ATOM 0 HA LYS A 102 -1.736 4.957 2.796 1.00 0.10 H new ATOM 0 HB2 LYS A 102 -4.255 6.199 3.859 1.00 21.20 H new ATOM 0 HB3 LYS A 102 -4.439 4.752 2.886 1.00 21.20 H new ATOM 0 HG2 LYS A 102 -2.677 4.962 5.356 1.00 0.15 H new ATOM 0 HG3 LYS A 102 -4.297 4.293 5.337 1.00 0.15 H new ATOM 0 HD2 LYS A 102 -3.528 2.617 3.609 1.00 33.15 H new ATOM 0 HD3 LYS A 102 -1.899 3.242 3.779 1.00 33.15 H new ATOM 0 HE2 LYS A 102 -1.944 2.666 6.207 1.00 72.44 H new ATOM 0 HE3 LYS A 102 -3.560 2.016 6.015 1.00 72.44 H new ATOM 0 HZ1 LYS A 102 -1.899 0.277 5.926 1.00 21.13 H new ATOM 0 HZ2 LYS A 102 -2.692 0.400 4.429 1.00 21.13 H new ATOM 0 HZ3 LYS A 102 -1.126 1.030 4.615 1.00 21.13 H new ATOM 1650 N LYS A 103 -3.567 6.838 0.810 1.00 14.53 N ATOM 1651 CA LYS A 103 -4.106 6.916 -0.538 1.00 55.23 C ATOM 1652 C LYS A 103 -3.050 7.415 -1.522 1.00 45.43 C ATOM 1653 O LYS A 103 -3.004 6.982 -2.674 1.00 75.43 O ATOM 1654 CB LYS A 103 -5.336 7.828 -0.571 1.00 54.43 C ATOM 1655 CG LYS A 103 -6.376 7.429 -1.614 1.00 23.32 C ATOM 1656 CD LYS A 103 -7.330 6.354 -1.093 1.00 72.25 C ATOM 1657 CE LYS A 103 -6.628 5.027 -0.841 1.00 22.43 C ATOM 1658 NZ LYS A 103 -7.539 4.014 -0.246 1.00 60.20 N ATOM 0 H LYS A 103 -3.735 7.662 1.387 1.00 14.53 H new ATOM 0 HA LYS A 103 -4.405 5.912 -0.840 1.00 55.23 H new ATOM 0 HB2 LYS A 103 -5.804 7.826 0.413 1.00 54.43 H new ATOM 0 HB3 LYS A 103 -5.013 8.850 -0.768 1.00 54.43 H new ATOM 0 HG2 LYS A 103 -6.948 8.308 -1.910 1.00 23.32 H new ATOM 0 HG3 LYS A 103 -5.871 7.062 -2.507 1.00 23.32 H new ATOM 0 HD2 LYS A 103 -7.791 6.699 -0.168 1.00 72.25 H new ATOM 0 HD3 LYS A 103 -8.134 6.205 -1.814 1.00 72.25 H new ATOM 0 HE2 LYS A 103 -6.227 4.646 -1.780 1.00 22.43 H new ATOM 0 HE3 LYS A 103 -5.780 5.187 -0.175 1.00 22.43 H new ATOM 0 HZ1 LYS A 103 -7.080 3.081 -0.263 1.00 60.20 H new ATOM 0 HZ2 LYS A 103 -7.754 4.276 0.737 1.00 60.20 H new ATOM 0 HZ3 LYS A 103 -8.421 3.976 -0.795 1.00 60.20 H new ATOM 1672 N LYS A 104 -2.196 8.318 -1.061 1.00 34.23 N ATOM 1673 CA LYS A 104 -1.188 8.923 -1.925 1.00 54.21 C ATOM 1674 C LYS A 104 0.046 8.027 -2.069 1.00 60.44 C ATOM 1675 O LYS A 104 0.873 8.233 -2.954 1.00 73.14 O ATOM 1676 CB LYS A 104 -0.810 10.325 -1.418 1.00 25.22 C ATOM 1677 CG LYS A 104 -0.220 10.370 -0.014 1.00 35.40 C ATOM 1678 CD LYS A 104 1.295 10.169 -0.001 1.00 73.30 C ATOM 1679 CE LYS A 104 2.035 11.321 -0.676 1.00 53.54 C ATOM 1680 NZ LYS A 104 2.045 11.204 -2.161 1.00 34.02 N ATOM 0 H LYS A 104 -2.180 8.648 -0.096 1.00 34.23 H new ATOM 0 HA LYS A 104 -1.621 9.029 -2.920 1.00 54.21 H new ATOM 0 HB2 LYS A 104 -0.092 10.763 -2.111 1.00 25.22 H new ATOM 0 HB3 LYS A 104 -1.700 10.954 -1.441 1.00 25.22 H new ATOM 0 HG2 LYS A 104 -0.458 11.330 0.445 1.00 35.40 H new ATOM 0 HG3 LYS A 104 -0.689 9.599 0.597 1.00 35.40 H new ATOM 0 HD2 LYS A 104 1.638 10.073 1.029 1.00 73.30 H new ATOM 0 HD3 LYS A 104 1.540 9.235 -0.507 1.00 73.30 H new ATOM 0 HE2 LYS A 104 1.567 12.264 -0.393 1.00 53.54 H new ATOM 0 HE3 LYS A 104 3.062 11.352 -0.311 1.00 53.54 H new ATOM 0 HZ1 LYS A 104 2.835 11.758 -2.548 1.00 34.02 H new ATOM 0 HZ2 LYS A 104 2.158 10.206 -2.430 1.00 34.02 H new ATOM 0 HZ3 LYS A 104 1.148 11.566 -2.544 1.00 34.02 H new ATOM 1694 N MET A 105 0.175 7.045 -1.191 1.00 5.15 N ATOM 1695 CA MET A 105 1.309 6.126 -1.235 1.00 0.33 C ATOM 1696 C MET A 105 1.156 5.153 -2.402 1.00 11.25 C ATOM 1697 O MET A 105 2.141 4.694 -2.977 1.00 21.34 O ATOM 1698 CB MET A 105 1.405 5.353 0.087 1.00 21.20 C ATOM 1699 CG MET A 105 2.805 4.866 0.439 1.00 4.14 C ATOM 1700 SD MET A 105 3.280 3.370 -0.444 1.00 24.13 S ATOM 1701 CE MET A 105 4.937 3.114 0.188 1.00 72.43 C ATOM 0 H MET A 105 -0.489 6.861 -0.439 1.00 5.15 H new ATOM 0 HA MET A 105 2.224 6.701 -1.378 1.00 0.33 H new ATOM 0 HB2 MET A 105 1.044 5.992 0.893 1.00 21.20 H new ATOM 0 HB3 MET A 105 0.737 4.493 0.039 1.00 21.20 H new ATOM 0 HG2 MET A 105 3.524 5.655 0.216 1.00 4.14 H new ATOM 0 HG3 MET A 105 2.859 4.679 1.512 1.00 4.14 H new ATOM 0 HE1 MET A 105 5.366 2.221 -0.267 1.00 72.43 H new ATOM 0 HE2 MET A 105 5.556 3.978 -0.054 1.00 72.43 H new ATOM 0 HE3 MET A 105 4.898 2.987 1.270 1.00 72.43 H new ATOM 1711 N LEU A 106 -0.090 4.892 -2.772 1.00 1.52 N ATOM 1712 CA LEU A 106 -0.417 3.859 -3.751 1.00 63.34 C ATOM 1713 C LEU A 106 0.195 4.129 -5.126 1.00 12.52 C ATOM 1714 O LEU A 106 0.940 3.299 -5.651 1.00 42.34 O ATOM 1715 CB LEU A 106 -1.933 3.743 -3.887 1.00 53.30 C ATOM 1716 CG LEU A 106 -2.686 3.552 -2.572 1.00 61.35 C ATOM 1717 CD1 LEU A 106 -4.182 3.479 -2.820 1.00 23.11 C ATOM 1718 CD2 LEU A 106 -2.202 2.301 -1.855 1.00 52.25 C ATOM 0 H LEU A 106 -0.902 5.388 -2.404 1.00 1.52 H new ATOM 0 HA LEU A 106 0.009 2.925 -3.384 1.00 63.34 H new ATOM 0 HB2 LEU A 106 -2.309 4.642 -4.376 1.00 53.30 H new ATOM 0 HB3 LEU A 106 -2.161 2.904 -4.544 1.00 53.30 H new ATOM 0 HG LEU A 106 -2.485 4.412 -1.934 1.00 61.35 H new ATOM 0 HD11 LEU A 106 -4.702 3.343 -1.872 1.00 23.11 H new ATOM 0 HD12 LEU A 106 -4.519 4.404 -3.289 1.00 23.11 H new ATOM 0 HD13 LEU A 106 -4.401 2.638 -3.478 1.00 23.11 H new ATOM 0 HD21 LEU A 106 -2.750 2.182 -0.920 1.00 52.25 H new ATOM 0 HD22 LEU A 106 -2.371 1.430 -2.488 1.00 52.25 H new ATOM 0 HD23 LEU A 106 -1.137 2.393 -1.642 1.00 52.25 H new ATOM 1730 N TYR A 107 -0.111 5.293 -5.697 1.00 63.31 N ATOM 1731 CA TYR A 107 0.262 5.599 -7.081 1.00 35.54 C ATOM 1732 C TYR A 107 1.774 5.727 -7.261 1.00 31.45 C ATOM 1733 O TYR A 107 2.263 5.698 -8.390 1.00 53.23 O ATOM 1734 CB TYR A 107 -0.439 6.873 -7.576 1.00 34.12 C ATOM 1735 CG TYR A 107 -0.078 8.129 -6.817 1.00 34.11 C ATOM 1736 CD1 TYR A 107 1.046 8.876 -7.153 1.00 32.31 C ATOM 1737 CD2 TYR A 107 -0.866 8.573 -5.768 1.00 24.25 C ATOM 1738 CE1 TYR A 107 1.370 10.026 -6.461 1.00 40.44 C ATOM 1739 CE2 TYR A 107 -0.549 9.722 -5.076 1.00 32.44 C ATOM 1740 CZ TYR A 107 0.568 10.443 -5.422 1.00 54.21 C ATOM 1741 OH TYR A 107 0.879 11.587 -4.728 1.00 3.34 O ATOM 0 H TYR A 107 -0.617 6.042 -5.224 1.00 63.31 H new ATOM 0 HA TYR A 107 -0.072 4.755 -7.685 1.00 35.54 H new ATOM 0 HB2 TYR A 107 -0.197 7.019 -8.629 1.00 34.12 H new ATOM 0 HB3 TYR A 107 -1.517 6.725 -7.515 1.00 34.12 H new ATOM 0 HD1 TYR A 107 1.676 8.551 -7.968 1.00 32.31 H new ATOM 0 HD2 TYR A 107 -1.744 8.009 -5.488 1.00 24.25 H new ATOM 0 HE1 TYR A 107 2.247 10.595 -6.733 1.00 40.44 H new ATOM 0 HE2 TYR A 107 -1.178 10.055 -4.263 1.00 32.44 H new ATOM 0 HH TYR A 107 0.781 12.364 -5.317 1.00 3.34 H new ATOM 1751 N SER A 108 2.497 5.882 -6.154 1.00 42.02 N ATOM 1752 CA SER A 108 3.945 6.076 -6.184 1.00 22.40 C ATOM 1753 C SER A 108 4.632 5.058 -7.099 1.00 24.13 C ATOM 1754 O SER A 108 5.465 5.421 -7.930 1.00 32.05 O ATOM 1755 CB SER A 108 4.513 5.971 -4.769 1.00 61.44 C ATOM 1756 OG SER A 108 3.755 6.754 -3.862 1.00 55.03 O ATOM 0 H SER A 108 2.098 5.877 -5.215 1.00 42.02 H new ATOM 0 HA SER A 108 4.141 7.071 -6.585 1.00 22.40 H new ATOM 0 HB2 SER A 108 4.510 4.929 -4.448 1.00 61.44 H new ATOM 0 HB3 SER A 108 5.551 6.303 -4.764 1.00 61.44 H new ATOM 0 HG SER A 108 3.089 6.188 -3.419 1.00 55.03 H new ATOM 1762 N SER A 109 4.268 3.788 -6.961 1.00 24.32 N ATOM 1763 CA SER A 109 4.844 2.747 -7.803 1.00 42.21 C ATOM 1764 C SER A 109 4.121 2.654 -9.145 1.00 43.20 C ATOM 1765 O SER A 109 4.762 2.509 -10.188 1.00 65.42 O ATOM 1766 CB SER A 109 4.810 1.395 -7.091 1.00 62.01 C ATOM 1767 OG SER A 109 5.667 1.393 -5.960 1.00 2.55 O ATOM 0 H SER A 109 3.584 3.457 -6.281 1.00 24.32 H new ATOM 0 HA SER A 109 5.883 3.017 -7.995 1.00 42.21 H new ATOM 0 HB2 SER A 109 3.790 1.170 -6.779 1.00 62.01 H new ATOM 0 HB3 SER A 109 5.113 0.608 -7.782 1.00 62.01 H new ATOM 0 HG SER A 109 6.561 1.095 -6.228 1.00 2.55 H new ATOM 1773 N SER A 110 2.792 2.746 -9.115 1.00 72.15 N ATOM 1774 CA SER A 110 1.980 2.637 -10.320 1.00 13.50 C ATOM 1775 C SER A 110 2.420 3.614 -11.413 1.00 21.32 C ATOM 1776 O SER A 110 2.520 3.236 -12.582 1.00 55.34 O ATOM 1777 CB SER A 110 0.529 2.893 -9.952 1.00 71.31 C ATOM 1778 OG SER A 110 0.214 2.269 -8.719 1.00 73.41 O ATOM 0 H SER A 110 2.254 2.897 -8.261 1.00 72.15 H new ATOM 0 HA SER A 110 2.106 1.633 -10.725 1.00 13.50 H new ATOM 0 HB2 SER A 110 0.349 3.966 -9.880 1.00 71.31 H new ATOM 0 HB3 SER A 110 -0.124 2.512 -10.737 1.00 71.31 H new ATOM 0 HG SER A 110 -0.459 2.801 -8.246 1.00 73.41 H new ATOM 1784 N PHE A 111 2.705 4.853 -11.014 1.00 21.53 N ATOM 1785 CA PHE A 111 3.013 5.934 -11.951 1.00 45.44 C ATOM 1786 C PHE A 111 4.098 5.537 -12.953 1.00 1.33 C ATOM 1787 O PHE A 111 3.932 5.714 -14.157 1.00 54.30 O ATOM 1788 CB PHE A 111 3.448 7.189 -11.177 1.00 75.35 C ATOM 1789 CG PHE A 111 3.707 8.400 -12.043 1.00 21.45 C ATOM 1790 CD1 PHE A 111 4.958 8.614 -12.604 1.00 12.32 C ATOM 1791 CD2 PHE A 111 2.702 9.327 -12.290 1.00 51.22 C ATOM 1792 CE1 PHE A 111 5.201 9.721 -13.395 1.00 14.02 C ATOM 1793 CE2 PHE A 111 2.941 10.436 -13.080 1.00 10.43 C ATOM 1794 CZ PHE A 111 4.191 10.633 -13.633 1.00 62.15 C ATOM 0 H PHE A 111 2.729 5.136 -10.034 1.00 21.53 H new ATOM 0 HA PHE A 111 2.106 6.145 -12.518 1.00 45.44 H new ATOM 0 HB2 PHE A 111 2.676 7.437 -10.449 1.00 75.35 H new ATOM 0 HB3 PHE A 111 4.354 6.959 -10.616 1.00 75.35 H new ATOM 0 HD1 PHE A 111 5.753 7.906 -12.420 1.00 12.32 H new ATOM 0 HD2 PHE A 111 1.722 9.179 -11.860 1.00 51.22 H new ATOM 0 HE1 PHE A 111 6.179 9.873 -13.827 1.00 14.02 H new ATOM 0 HE2 PHE A 111 2.150 11.148 -13.265 1.00 10.43 H new ATOM 0 HZ PHE A 111 4.379 11.499 -14.251 1.00 62.15 H new ATOM 1804 N ASP A 112 5.204 4.997 -12.462 1.00 63.23 N ATOM 1805 CA ASP A 112 6.344 4.716 -13.331 1.00 64.12 C ATOM 1806 C ASP A 112 6.202 3.374 -14.043 1.00 31.30 C ATOM 1807 O ASP A 112 6.689 3.203 -15.161 1.00 42.23 O ATOM 1808 CB ASP A 112 7.656 4.753 -12.547 1.00 11.14 C ATOM 1809 CG ASP A 112 8.865 4.745 -13.466 1.00 44.00 C ATOM 1810 OD1 ASP A 112 9.035 5.718 -14.234 1.00 24.32 O ATOM 1811 OD2 ASP A 112 9.654 3.776 -13.423 1.00 10.44 O ATOM 0 H ASP A 112 5.339 4.747 -11.482 1.00 63.23 H new ATOM 0 HA ASP A 112 6.362 5.499 -14.089 1.00 64.12 H new ATOM 0 HB2 ASP A 112 7.681 5.646 -11.922 1.00 11.14 H new ATOM 0 HB3 ASP A 112 7.703 3.894 -11.877 1.00 11.14 H new ATOM 1816 N ALA A 113 5.526 2.431 -13.405 1.00 10.34 N ATOM 1817 CA ALA A 113 5.396 1.084 -13.953 1.00 31.25 C ATOM 1818 C ALA A 113 4.568 1.073 -15.232 1.00 52.42 C ATOM 1819 O ALA A 113 4.933 0.416 -16.211 1.00 31.31 O ATOM 1820 CB ALA A 113 4.790 0.149 -12.923 1.00 60.10 C ATOM 0 H ALA A 113 5.059 2.570 -12.509 1.00 10.34 H new ATOM 0 HA ALA A 113 6.397 0.733 -14.205 1.00 31.25 H new ATOM 0 HB1 ALA A 113 4.700 -0.851 -13.348 1.00 60.10 H new ATOM 0 HB2 ALA A 113 5.431 0.113 -12.042 1.00 60.10 H new ATOM 0 HB3 ALA A 113 3.803 0.512 -12.638 1.00 60.10 H new ATOM 1826 N LEU A 114 3.462 1.812 -15.238 1.00 62.32 N ATOM 1827 CA LEU A 114 2.592 1.841 -16.406 1.00 34.15 C ATOM 1828 C LEU A 114 3.248 2.583 -17.568 1.00 53.22 C ATOM 1829 O LEU A 114 2.902 2.349 -18.723 1.00 24.04 O ATOM 1830 CB LEU A 114 1.213 2.429 -16.064 1.00 34.22 C ATOM 1831 CG LEU A 114 1.201 3.731 -15.256 1.00 53.32 C ATOM 1832 CD1 LEU A 114 1.570 4.924 -16.119 1.00 43.01 C ATOM 1833 CD2 LEU A 114 -0.164 3.938 -14.624 1.00 20.12 C ATOM 0 H LEU A 114 3.151 2.391 -14.458 1.00 62.32 H new ATOM 0 HA LEU A 114 2.434 0.811 -16.725 1.00 34.15 H new ATOM 0 HB2 LEU A 114 0.676 2.602 -16.997 1.00 34.22 H new ATOM 0 HB3 LEU A 114 0.651 1.678 -15.508 1.00 34.22 H new ATOM 0 HG LEU A 114 1.951 3.647 -14.470 1.00 53.32 H new ATOM 0 HD11 LEU A 114 1.552 5.830 -15.514 1.00 43.01 H new ATOM 0 HD12 LEU A 114 2.570 4.781 -16.529 1.00 43.01 H new ATOM 0 HD13 LEU A 114 0.854 5.018 -16.935 1.00 43.01 H new ATOM 0 HD21 LEU A 114 -0.163 4.866 -14.052 1.00 20.12 H new ATOM 0 HD22 LEU A 114 -0.922 3.994 -15.405 1.00 20.12 H new ATOM 0 HD23 LEU A 114 -0.388 3.103 -13.961 1.00 20.12 H new ATOM 1845 N LYS A 115 4.222 3.441 -17.257 1.00 32.01 N ATOM 1846 CA LYS A 115 4.977 4.175 -18.281 1.00 3.02 C ATOM 1847 C LYS A 115 5.676 3.212 -19.235 1.00 3.35 C ATOM 1848 O LYS A 115 6.019 3.567 -20.362 1.00 30.05 O ATOM 1849 CB LYS A 115 6.013 5.095 -17.626 1.00 24.43 C ATOM 1850 CG LYS A 115 5.399 6.281 -16.900 1.00 52.43 C ATOM 1851 CD LYS A 115 6.395 6.998 -15.992 1.00 24.40 C ATOM 1852 CE LYS A 115 7.585 7.574 -16.749 1.00 63.23 C ATOM 1853 NZ LYS A 115 8.753 6.648 -16.760 1.00 42.44 N ATOM 0 H LYS A 115 4.509 3.647 -16.300 1.00 32.01 H new ATOM 0 HA LYS A 115 4.270 4.780 -18.849 1.00 3.02 H new ATOM 0 HB2 LYS A 115 6.607 4.515 -16.920 1.00 24.43 H new ATOM 0 HB3 LYS A 115 6.697 5.462 -18.392 1.00 24.43 H new ATOM 0 HG2 LYS A 115 5.008 6.987 -17.633 1.00 52.43 H new ATOM 0 HG3 LYS A 115 4.553 5.938 -16.305 1.00 52.43 H new ATOM 0 HD2 LYS A 115 5.883 7.803 -15.465 1.00 24.40 H new ATOM 0 HD3 LYS A 115 6.756 6.301 -15.236 1.00 24.40 H new ATOM 0 HE2 LYS A 115 7.288 7.793 -17.775 1.00 63.23 H new ATOM 0 HE3 LYS A 115 7.879 8.520 -16.294 1.00 63.23 H new ATOM 0 HZ1 LYS A 115 9.632 7.199 -16.836 1.00 42.44 H new ATOM 0 HZ2 LYS A 115 8.766 6.095 -15.879 1.00 42.44 H new ATOM 0 HZ3 LYS A 115 8.677 6.003 -17.572 1.00 42.44 H new ATOM 1867 N LYS A 116 5.885 1.992 -18.764 1.00 41.43 N ATOM 1868 CA LYS A 116 6.521 0.951 -19.552 1.00 54.41 C ATOM 1869 C LYS A 116 5.522 0.320 -20.526 1.00 13.44 C ATOM 1870 O LYS A 116 5.903 -0.188 -21.582 1.00 43.00 O ATOM 1871 CB LYS A 116 7.127 -0.089 -18.596 1.00 35.34 C ATOM 1872 CG LYS A 116 7.577 -1.392 -19.239 1.00 63.12 C ATOM 1873 CD LYS A 116 6.485 -2.451 -19.165 1.00 11.03 C ATOM 1874 CE LYS A 116 6.030 -2.692 -17.728 1.00 62.23 C ATOM 1875 NZ LYS A 116 7.127 -3.222 -16.875 1.00 54.22 N ATOM 0 H LYS A 116 5.618 1.697 -17.825 1.00 41.43 H new ATOM 0 HA LYS A 116 7.320 1.378 -20.158 1.00 54.41 H new ATOM 0 HB2 LYS A 116 7.983 0.362 -18.094 1.00 35.34 H new ATOM 0 HB3 LYS A 116 6.391 -0.320 -17.826 1.00 35.34 H new ATOM 0 HG2 LYS A 116 7.843 -1.213 -20.281 1.00 63.12 H new ATOM 0 HG3 LYS A 116 8.474 -1.756 -18.739 1.00 63.12 H new ATOM 0 HD2 LYS A 116 5.633 -2.138 -19.769 1.00 11.03 H new ATOM 0 HD3 LYS A 116 6.853 -3.384 -19.592 1.00 11.03 H new ATOM 0 HE2 LYS A 116 5.660 -1.758 -17.304 1.00 62.23 H new ATOM 0 HE3 LYS A 116 5.197 -3.395 -17.725 1.00 62.23 H new ATOM 0 HZ1 LYS A 116 6.757 -3.435 -15.926 1.00 54.22 H new ATOM 0 HZ2 LYS A 116 7.509 -4.091 -17.301 1.00 54.22 H new ATOM 0 HZ3 LYS A 116 7.883 -2.512 -16.801 1.00 54.22 H new ATOM 1889 N SER A 117 4.241 0.379 -20.186 1.00 12.45 N ATOM 1890 CA SER A 117 3.213 -0.238 -21.009 1.00 10.43 C ATOM 1891 C SER A 117 2.572 0.798 -21.935 1.00 61.24 C ATOM 1892 O SER A 117 2.600 0.642 -23.156 1.00 15.34 O ATOM 1893 CB SER A 117 2.150 -0.902 -20.130 1.00 42.44 C ATOM 1894 OG SER A 117 1.305 -1.747 -20.895 1.00 24.13 O ATOM 0 H SER A 117 3.891 0.846 -19.349 1.00 12.45 H new ATOM 0 HA SER A 117 3.681 -1.006 -21.625 1.00 10.43 H new ATOM 0 HB2 SER A 117 2.635 -1.483 -19.345 1.00 42.44 H new ATOM 0 HB3 SER A 117 1.552 -0.136 -19.637 1.00 42.44 H new ATOM 0 HG SER A 117 0.637 -2.159 -20.308 1.00 24.13 H new ATOM 1900 N LEU A 118 2.030 1.870 -21.358 1.00 72.44 N ATOM 1901 CA LEU A 118 1.366 2.915 -22.140 1.00 25.34 C ATOM 1902 C LEU A 118 2.383 3.876 -22.754 1.00 13.10 C ATOM 1903 O LEU A 118 2.211 5.095 -22.726 1.00 24.10 O ATOM 1904 CB LEU A 118 0.323 3.662 -21.290 1.00 14.44 C ATOM 1905 CG LEU A 118 0.712 3.985 -19.841 1.00 4.15 C ATOM 1906 CD1 LEU A 118 1.683 5.153 -19.767 1.00 23.41 C ATOM 1907 CD2 LEU A 118 -0.532 4.278 -19.017 1.00 22.51 C ATOM 0 H LEU A 118 2.037 2.039 -20.352 1.00 72.44 H new ATOM 0 HA LEU A 118 0.836 2.434 -22.962 1.00 25.34 H new ATOM 0 HB2 LEU A 118 0.082 4.598 -21.794 1.00 14.44 H new ATOM 0 HB3 LEU A 118 -0.590 3.066 -21.272 1.00 14.44 H new ATOM 0 HG LEU A 118 1.216 3.111 -19.429 1.00 4.15 H new ATOM 0 HD11 LEU A 118 1.935 5.351 -18.725 1.00 23.41 H new ATOM 0 HD12 LEU A 118 2.590 4.908 -20.319 1.00 23.41 H new ATOM 0 HD13 LEU A 118 1.221 6.038 -20.204 1.00 23.41 H new ATOM 0 HD21 LEU A 118 -0.243 4.506 -17.991 1.00 22.51 H new ATOM 0 HD22 LEU A 118 -1.058 5.132 -19.444 1.00 22.51 H new ATOM 0 HD23 LEU A 118 -1.187 3.407 -19.025 1.00 22.51 H new ATOM 1919 N VAL A 119 3.429 3.303 -23.338 1.00 12.10 N ATOM 1920 CA VAL A 119 4.481 4.077 -23.980 1.00 75.11 C ATOM 1921 C VAL A 119 3.898 4.933 -25.105 1.00 10.12 C ATOM 1922 O VAL A 119 2.960 4.522 -25.791 1.00 55.31 O ATOM 1923 CB VAL A 119 5.609 3.158 -24.522 1.00 2.04 C ATOM 1924 CG1 VAL A 119 5.096 2.240 -25.621 1.00 52.30 C ATOM 1925 CG2 VAL A 119 6.788 3.975 -25.023 1.00 61.32 C ATOM 0 H VAL A 119 3.570 2.294 -23.379 1.00 12.10 H new ATOM 0 HA VAL A 119 4.921 4.734 -23.230 1.00 75.11 H new ATOM 0 HB VAL A 119 5.948 2.537 -23.693 1.00 2.04 H new ATOM 0 HG11 VAL A 119 5.910 1.610 -25.979 1.00 52.30 H new ATOM 0 HG12 VAL A 119 4.297 1.612 -25.227 1.00 52.30 H new ATOM 0 HG13 VAL A 119 4.712 2.840 -26.446 1.00 52.30 H new ATOM 0 HG21 VAL A 119 7.562 3.305 -25.397 1.00 61.32 H new ATOM 0 HG22 VAL A 119 6.459 4.633 -25.827 1.00 61.32 H new ATOM 0 HG23 VAL A 119 7.190 4.574 -24.205 1.00 61.32 H new ATOM 1935 N GLY A 120 4.451 6.121 -25.280 1.00 21.32 N ATOM 1936 CA GLY A 120 3.877 7.091 -26.188 1.00 64.22 C ATOM 1937 C GLY A 120 3.670 8.407 -25.480 1.00 41.14 C ATOM 1938 O GLY A 120 3.625 9.469 -26.101 1.00 45.34 O ATOM 0 H GLY A 120 5.297 6.434 -24.804 1.00 21.32 H new ATOM 0 HA2 GLY A 120 4.535 7.231 -27.046 1.00 64.22 H new ATOM 0 HA3 GLY A 120 2.926 6.722 -26.572 1.00 64.22 H new ATOM 1942 N VAL A 121 3.528 8.317 -24.163 1.00 65.35 N ATOM 1943 CA VAL A 121 3.479 9.490 -23.302 1.00 44.14 C ATOM 1944 C VAL A 121 4.733 10.346 -23.462 1.00 61.31 C ATOM 1945 O VAL A 121 5.833 9.932 -23.092 1.00 21.51 O ATOM 1946 CB VAL A 121 3.348 9.092 -21.819 1.00 22.11 C ATOM 1947 CG1 VAL A 121 3.270 10.324 -20.939 1.00 14.22 C ATOM 1948 CG2 VAL A 121 2.136 8.209 -21.603 1.00 13.41 C ATOM 0 H VAL A 121 3.444 7.431 -23.664 1.00 65.35 H new ATOM 0 HA VAL A 121 2.603 10.063 -23.605 1.00 44.14 H new ATOM 0 HB VAL A 121 4.237 8.526 -21.541 1.00 22.11 H new ATOM 0 HG11 VAL A 121 3.178 10.021 -19.896 1.00 14.22 H new ATOM 0 HG12 VAL A 121 4.174 10.919 -21.065 1.00 14.22 H new ATOM 0 HG13 VAL A 121 2.402 10.919 -21.222 1.00 14.22 H new ATOM 0 HG21 VAL A 121 2.064 7.941 -20.549 1.00 13.41 H new ATOM 0 HG22 VAL A 121 1.236 8.746 -21.903 1.00 13.41 H new ATOM 0 HG23 VAL A 121 2.234 7.303 -22.202 1.00 13.41 H new ATOM 1958 N GLN A 122 4.563 11.536 -24.016 1.00 13.21 N ATOM 1959 CA GLN A 122 5.673 12.464 -24.174 1.00 10.43 C ATOM 1960 C GLN A 122 5.737 13.419 -22.988 1.00 1.30 C ATOM 1961 O GLN A 122 6.776 14.020 -22.711 1.00 34.05 O ATOM 1962 CB GLN A 122 5.533 13.243 -25.482 1.00 63.12 C ATOM 1963 CG GLN A 122 5.610 12.365 -26.722 1.00 21.24 C ATOM 1964 CD GLN A 122 6.937 11.636 -26.844 1.00 62.22 C ATOM 1965 OE1 GLN A 122 7.093 10.516 -26.356 1.00 51.30 O ATOM 1966 NE2 GLN A 122 7.906 12.268 -27.489 1.00 71.24 N ATOM 0 H GLN A 122 3.669 11.882 -24.364 1.00 13.21 H new ATOM 0 HA GLN A 122 6.601 11.894 -24.210 1.00 10.43 H new ATOM 0 HB2 GLN A 122 4.580 13.773 -25.480 1.00 63.12 H new ATOM 0 HB3 GLN A 122 6.317 13.998 -25.532 1.00 63.12 H new ATOM 0 HG2 GLN A 122 4.801 11.635 -26.696 1.00 21.24 H new ATOM 0 HG3 GLN A 122 5.456 12.981 -27.608 1.00 21.24 H new ATOM 0 HE21 GLN A 122 7.738 13.195 -27.880 1.00 71.24 H new ATOM 0 HE22 GLN A 122 8.820 11.827 -27.595 1.00 71.24 H new ATOM 1975 N LYS A 123 4.623 13.541 -22.280 1.00 74.22 N ATOM 1976 CA LYS A 123 4.543 14.425 -21.125 1.00 43.31 C ATOM 1977 C LYS A 123 3.822 13.738 -19.973 1.00 32.12 C ATOM 1978 O LYS A 123 2.619 13.482 -20.042 1.00 23.25 O ATOM 1979 CB LYS A 123 3.817 15.725 -21.499 1.00 74.44 C ATOM 1980 CG LYS A 123 3.434 16.613 -20.313 1.00 71.14 C ATOM 1981 CD LYS A 123 4.557 17.554 -19.891 1.00 34.10 C ATOM 1982 CE LYS A 123 5.729 16.815 -19.266 1.00 31.34 C ATOM 1983 NZ LYS A 123 6.832 17.737 -18.890 1.00 45.23 N ATOM 0 H LYS A 123 3.760 13.038 -22.486 1.00 74.22 H new ATOM 0 HA LYS A 123 5.557 14.665 -20.806 1.00 43.31 H new ATOM 0 HB2 LYS A 123 4.453 16.298 -22.173 1.00 74.44 H new ATOM 0 HB3 LYS A 123 2.912 15.473 -22.052 1.00 74.44 H new ATOM 0 HG2 LYS A 123 2.554 17.200 -20.574 1.00 71.14 H new ATOM 0 HG3 LYS A 123 3.158 15.983 -19.468 1.00 71.14 H new ATOM 0 HD2 LYS A 123 4.905 18.112 -20.760 1.00 34.10 H new ATOM 0 HD3 LYS A 123 4.169 18.282 -19.179 1.00 34.10 H new ATOM 0 HE2 LYS A 123 5.388 16.278 -18.381 1.00 31.34 H new ATOM 0 HE3 LYS A 123 6.103 16.069 -19.968 1.00 31.34 H new ATOM 0 HZ1 LYS A 123 7.611 17.192 -18.468 1.00 45.23 H new ATOM 0 HZ2 LYS A 123 7.175 18.232 -19.738 1.00 45.23 H new ATOM 0 HZ3 LYS A 123 6.483 18.433 -18.201 1.00 45.23 H new ATOM 1997 N TYR A 124 4.561 13.433 -18.921 1.00 31.10 N ATOM 1998 CA TYR A 124 3.969 12.879 -17.716 1.00 13.01 C ATOM 1999 C TYR A 124 4.108 13.862 -16.561 1.00 0.35 C ATOM 2000 O TYR A 124 5.169 14.451 -16.356 1.00 24.23 O ATOM 2001 CB TYR A 124 4.577 11.515 -17.360 1.00 64.14 C ATOM 2002 CG TYR A 124 6.037 11.351 -17.723 1.00 50.40 C ATOM 2003 CD1 TYR A 124 7.047 11.824 -16.893 1.00 41.42 C ATOM 2004 CD2 TYR A 124 6.401 10.711 -18.900 1.00 15.35 C ATOM 2005 CE1 TYR A 124 8.378 11.663 -17.229 1.00 65.55 C ATOM 2006 CE2 TYR A 124 7.728 10.544 -19.242 1.00 41.32 C ATOM 2007 CZ TYR A 124 8.714 11.022 -18.405 1.00 35.32 C ATOM 2008 OH TYR A 124 10.038 10.854 -18.741 1.00 52.01 O ATOM 0 H TYR A 124 5.572 13.560 -18.877 1.00 31.10 H new ATOM 0 HA TYR A 124 2.908 12.715 -17.906 1.00 13.01 H new ATOM 0 HB2 TYR A 124 4.464 11.352 -16.288 1.00 64.14 H new ATOM 0 HB3 TYR A 124 4.004 10.736 -17.863 1.00 64.14 H new ATOM 0 HD1 TYR A 124 6.788 12.325 -15.972 1.00 41.42 H new ATOM 0 HD2 TYR A 124 5.632 10.337 -19.560 1.00 15.35 H new ATOM 0 HE1 TYR A 124 9.152 12.037 -16.575 1.00 65.55 H new ATOM 0 HE2 TYR A 124 7.993 10.041 -20.161 1.00 41.32 H new ATOM 0 HH TYR A 124 10.101 10.383 -19.598 1.00 52.01 H new ATOM 2018 N ILE A 125 3.018 14.056 -15.839 1.00 13.21 N ATOM 2019 CA ILE A 125 2.963 15.014 -14.745 1.00 31.25 C ATOM 2020 C ILE A 125 1.971 14.513 -13.691 1.00 10.32 C ATOM 2021 O ILE A 125 1.142 13.652 -13.982 1.00 12.21 O ATOM 2022 CB ILE A 125 2.519 16.408 -15.261 1.00 21.30 C ATOM 2023 CG1 ILE A 125 2.799 17.502 -14.227 1.00 50.43 C ATOM 2024 CG2 ILE A 125 1.044 16.393 -15.628 1.00 3.40 C ATOM 2025 CD1 ILE A 125 4.272 17.782 -14.024 1.00 53.14 C ATOM 0 H ILE A 125 2.144 13.554 -15.994 1.00 13.21 H new ATOM 0 HA ILE A 125 3.956 15.110 -14.306 1.00 31.25 H new ATOM 0 HB ILE A 125 3.103 16.634 -16.153 1.00 21.30 H new ATOM 0 HG12 ILE A 125 2.303 18.421 -14.539 1.00 50.43 H new ATOM 0 HG13 ILE A 125 2.359 17.210 -13.274 1.00 50.43 H new ATOM 0 HG21 ILE A 125 0.749 17.378 -15.988 1.00 3.40 H new ATOM 0 HG22 ILE A 125 0.871 15.654 -16.410 1.00 3.40 H new ATOM 0 HG23 ILE A 125 0.453 16.136 -14.749 1.00 3.40 H new ATOM 0 HD11 ILE A 125 4.394 18.567 -13.278 1.00 53.14 H new ATOM 0 HD12 ILE A 125 4.771 16.876 -13.681 1.00 53.14 H new ATOM 0 HD13 ILE A 125 4.714 18.105 -14.966 1.00 53.14 H new ATOM 2037 N GLN A 126 2.058 15.018 -12.475 1.00 64.21 N ATOM 2038 CA GLN A 126 1.054 14.727 -11.465 1.00 55.11 C ATOM 2039 C GLN A 126 0.242 15.978 -11.163 1.00 32.30 C ATOM 2040 O GLN A 126 0.781 17.080 -11.117 1.00 61.40 O ATOM 2041 CB GLN A 126 1.708 14.186 -10.190 1.00 42.13 C ATOM 2042 CG GLN A 126 0.813 14.241 -8.960 1.00 13.51 C ATOM 2043 CD GLN A 126 1.532 13.838 -7.690 1.00 20.33 C ATOM 2044 OE1 GLN A 126 0.926 13.309 -6.763 1.00 21.11 O ATOM 2045 NE2 GLN A 126 2.830 14.086 -7.640 1.00 73.10 N ATOM 0 H GLN A 126 2.811 15.630 -12.161 1.00 64.21 H new ATOM 0 HA GLN A 126 0.384 13.959 -11.851 1.00 55.11 H new ATOM 0 HB2 GLN A 126 2.010 13.153 -10.360 1.00 42.13 H new ATOM 0 HB3 GLN A 126 2.616 14.755 -9.991 1.00 42.13 H new ATOM 0 HG2 GLN A 126 0.423 15.252 -8.845 1.00 13.51 H new ATOM 0 HG3 GLN A 126 -0.044 13.584 -9.111 1.00 13.51 H new ATOM 0 HE21 GLN A 126 3.296 14.527 -8.433 1.00 73.10 H new ATOM 0 HE22 GLN A 126 3.365 13.836 -6.809 1.00 73.10 H new ATOM 2054 N ALA A 127 -1.053 15.799 -10.976 1.00 3.03 N ATOM 2055 CA ALA A 127 -1.941 16.898 -10.638 1.00 72.41 C ATOM 2056 C ALA A 127 -2.455 16.716 -9.219 1.00 40.02 C ATOM 2057 O ALA A 127 -3.202 15.782 -8.941 1.00 33.20 O ATOM 2058 CB ALA A 127 -3.099 16.970 -11.620 1.00 24.44 C ATOM 0 H ALA A 127 -1.517 14.894 -11.053 1.00 3.03 H new ATOM 0 HA ALA A 127 -1.388 17.835 -10.700 1.00 72.41 H new ATOM 0 HB1 ALA A 127 -3.753 17.799 -11.351 1.00 24.44 H new ATOM 0 HB2 ALA A 127 -2.713 17.125 -12.627 1.00 24.44 H new ATOM 0 HB3 ALA A 127 -3.663 16.038 -11.587 1.00 24.44 H new ATOM 2064 N THR A 128 -2.052 17.606 -8.324 1.00 11.53 N ATOM 2065 CA THR A 128 -2.373 17.460 -6.912 1.00 31.43 C ATOM 2066 C THR A 128 -3.753 18.017 -6.577 1.00 73.01 C ATOM 2067 O THR A 128 -4.221 17.899 -5.442 1.00 21.11 O ATOM 2068 CB THR A 128 -1.332 18.179 -6.040 1.00 51.41 C ATOM 2069 OG1 THR A 128 -1.218 19.547 -6.451 1.00 53.11 O ATOM 2070 CG2 THR A 128 0.024 17.508 -6.149 1.00 44.41 C ATOM 0 H THR A 128 -1.503 18.435 -8.550 1.00 11.53 H new ATOM 0 HA THR A 128 -2.365 16.390 -6.702 1.00 31.43 H new ATOM 0 HB THR A 128 -1.663 18.129 -5.003 1.00 51.41 H new ATOM 0 HG1 THR A 128 -0.555 20.002 -5.892 1.00 53.11 H new ATOM 0 HG21 THR A 128 0.743 18.036 -5.522 1.00 44.41 H new ATOM 0 HG22 THR A 128 -0.055 16.473 -5.817 1.00 44.41 H new ATOM 0 HG23 THR A 128 0.360 17.532 -7.186 1.00 44.41 H new ATOM 2078 N ASP A 129 -4.395 18.629 -7.557 1.00 34.50 N ATOM 2079 CA ASP A 129 -5.671 19.290 -7.336 1.00 20.33 C ATOM 2080 C ASP A 129 -6.329 19.597 -8.675 1.00 1.32 C ATOM 2081 O ASP A 129 -5.692 19.469 -9.722 1.00 63.45 O ATOM 2082 CB ASP A 129 -5.452 20.585 -6.536 1.00 71.52 C ATOM 2083 CG ASP A 129 -6.744 21.286 -6.167 1.00 32.42 C ATOM 2084 OD1 ASP A 129 -7.364 20.910 -5.153 1.00 43.22 O ATOM 2085 OD2 ASP A 129 -7.147 22.215 -6.898 1.00 53.33 O ATOM 0 H ASP A 129 -4.053 18.682 -8.516 1.00 34.50 H new ATOM 0 HA ASP A 129 -6.327 18.633 -6.766 1.00 20.33 H new ATOM 0 HB2 ASP A 129 -4.900 20.353 -5.625 1.00 71.52 H new ATOM 0 HB3 ASP A 129 -4.832 21.265 -7.120 1.00 71.52 H new ATOM 2090 N LEU A 130 -7.598 19.994 -8.640 1.00 32.43 N ATOM 2091 CA LEU A 130 -8.321 20.385 -9.844 1.00 23.24 C ATOM 2092 C LEU A 130 -7.616 21.559 -10.517 1.00 53.32 C ATOM 2093 O LEU A 130 -7.647 21.703 -11.740 1.00 1.42 O ATOM 2094 CB LEU A 130 -9.762 20.767 -9.490 1.00 70.42 C ATOM 2095 CG LEU A 130 -10.668 21.092 -10.680 1.00 72.04 C ATOM 2096 CD1 LEU A 130 -10.853 19.866 -11.562 1.00 32.01 C ATOM 2097 CD2 LEU A 130 -12.013 21.610 -10.195 1.00 14.21 C ATOM 0 H LEU A 130 -8.149 20.053 -7.784 1.00 32.43 H new ATOM 0 HA LEU A 130 -8.341 19.543 -10.535 1.00 23.24 H new ATOM 0 HB2 LEU A 130 -10.209 19.947 -8.928 1.00 70.42 H new ATOM 0 HB3 LEU A 130 -9.738 21.632 -8.827 1.00 70.42 H new ATOM 0 HG LEU A 130 -10.192 21.871 -11.275 1.00 72.04 H new ATOM 0 HD11 LEU A 130 -11.500 20.117 -12.403 1.00 32.01 H new ATOM 0 HD12 LEU A 130 -9.883 19.537 -11.936 1.00 32.01 H new ATOM 0 HD13 LEU A 130 -11.308 19.065 -10.980 1.00 32.01 H new ATOM 0 HD21 LEU A 130 -12.646 21.837 -11.053 1.00 14.21 H new ATOM 0 HD22 LEU A 130 -12.495 20.851 -9.579 1.00 14.21 H new ATOM 0 HD23 LEU A 130 -11.863 22.514 -9.605 1.00 14.21 H new ATOM 2109 N SER A 131 -6.968 22.381 -9.696 1.00 72.04 N ATOM 2110 CA SER A 131 -6.168 23.502 -10.174 1.00 4.24 C ATOM 2111 C SER A 131 -5.139 23.045 -11.206 1.00 51.51 C ATOM 2112 O SER A 131 -4.902 23.721 -12.207 1.00 12.34 O ATOM 2113 CB SER A 131 -5.447 24.160 -8.989 1.00 74.35 C ATOM 2114 OG SER A 131 -4.555 25.174 -9.424 1.00 4.54 O ATOM 0 H SER A 131 -6.984 22.288 -8.680 1.00 72.04 H new ATOM 0 HA SER A 131 -6.836 24.220 -10.650 1.00 4.24 H new ATOM 0 HB2 SER A 131 -6.181 24.588 -8.306 1.00 74.35 H new ATOM 0 HB3 SER A 131 -4.896 23.403 -8.431 1.00 74.35 H new ATOM 0 HG SER A 131 -3.686 24.775 -9.639 1.00 4.54 H new ATOM 2120 N GLU A 132 -4.552 21.882 -10.970 1.00 14.13 N ATOM 2121 CA GLU A 132 -3.438 21.410 -11.779 1.00 62.23 C ATOM 2122 C GLU A 132 -3.920 20.451 -12.865 1.00 75.33 C ATOM 2123 O GLU A 132 -3.117 19.863 -13.591 1.00 62.03 O ATOM 2124 CB GLU A 132 -2.414 20.713 -10.879 1.00 64.45 C ATOM 2125 CG GLU A 132 -2.041 21.517 -9.641 1.00 35.41 C ATOM 2126 CD GLU A 132 -1.431 22.864 -9.977 1.00 63.04 C ATOM 2127 OE1 GLU A 132 -0.208 22.915 -10.226 1.00 53.24 O ATOM 2128 OE2 GLU A 132 -2.167 23.876 -9.988 1.00 35.12 O ATOM 0 H GLU A 132 -4.829 21.246 -10.223 1.00 14.13 H new ATOM 0 HA GLU A 132 -2.973 22.266 -12.267 1.00 62.23 H new ATOM 0 HB2 GLU A 132 -2.814 19.748 -10.568 1.00 64.45 H new ATOM 0 HB3 GLU A 132 -1.512 20.513 -11.457 1.00 64.45 H new ATOM 0 HG2 GLU A 132 -2.931 21.668 -9.030 1.00 35.41 H new ATOM 0 HG3 GLU A 132 -1.335 20.944 -9.040 1.00 35.41 H new ATOM 2135 N ALA A 133 -5.233 20.295 -12.970 1.00 45.15 N ATOM 2136 CA ALA A 133 -5.814 19.376 -13.940 1.00 15.53 C ATOM 2137 C ALA A 133 -6.620 20.118 -14.997 1.00 54.51 C ATOM 2138 O ALA A 133 -7.082 19.520 -15.968 1.00 41.41 O ATOM 2139 CB ALA A 133 -6.691 18.351 -13.242 1.00 74.35 C ATOM 0 H ALA A 133 -5.915 20.792 -12.397 1.00 45.15 H new ATOM 0 HA ALA A 133 -4.993 18.862 -14.440 1.00 15.53 H new ATOM 0 HB1 ALA A 133 -7.117 17.673 -13.981 1.00 74.35 H new ATOM 0 HB2 ALA A 133 -6.091 17.783 -12.531 1.00 74.35 H new ATOM 0 HB3 ALA A 133 -7.495 18.861 -12.712 1.00 74.35 H new ATOM 2145 N SER A 134 -6.792 21.420 -14.807 1.00 73.43 N ATOM 2146 CA SER A 134 -7.541 22.225 -15.753 1.00 21.43 C ATOM 2147 C SER A 134 -6.789 22.300 -17.072 1.00 61.45 C ATOM 2148 O SER A 134 -5.562 22.304 -17.081 1.00 73.53 O ATOM 2149 CB SER A 134 -7.779 23.631 -15.191 1.00 32.20 C ATOM 2150 OG SER A 134 -6.555 24.312 -14.973 1.00 25.42 O ATOM 0 H SER A 134 -6.423 21.936 -14.008 1.00 73.43 H new ATOM 0 HA SER A 134 -8.511 21.758 -15.924 1.00 21.43 H new ATOM 0 HB2 SER A 134 -8.397 24.202 -15.884 1.00 32.20 H new ATOM 0 HB3 SER A 134 -8.331 23.562 -14.254 1.00 32.20 H new ATOM 0 HG SER A 134 -6.185 24.050 -14.104 1.00 25.42 H new ATOM 2156 N ARG A 135 -7.516 22.353 -18.185 1.00 22.01 N ATOM 2157 CA ARG A 135 -6.884 22.468 -19.501 1.00 31.51 C ATOM 2158 C ARG A 135 -5.995 23.708 -19.576 1.00 73.21 C ATOM 2159 O ARG A 135 -5.086 23.779 -20.395 1.00 60.42 O ATOM 2160 CB ARG A 135 -7.917 22.476 -20.645 1.00 41.21 C ATOM 2161 CG ARG A 135 -9.057 23.474 -20.490 1.00 21.31 C ATOM 2162 CD ARG A 135 -10.150 22.932 -19.583 1.00 1.32 C ATOM 2163 NE ARG A 135 -11.274 23.852 -19.443 1.00 2.34 N ATOM 2164 CZ ARG A 135 -11.265 24.951 -18.686 1.00 63.24 C ATOM 2165 NH1 ARG A 135 -10.148 25.351 -18.089 1.00 32.43 N ATOM 2166 NH2 ARG A 135 -12.376 25.655 -18.538 1.00 42.15 N ATOM 0 H ARG A 135 -8.535 22.319 -18.205 1.00 22.01 H new ATOM 0 HA ARG A 135 -6.261 21.583 -19.630 1.00 31.51 H new ATOM 0 HB2 ARG A 135 -7.397 22.687 -21.580 1.00 41.21 H new ATOM 0 HB3 ARG A 135 -8.342 21.476 -20.735 1.00 41.21 H new ATOM 0 HG2 ARG A 135 -8.672 24.408 -20.080 1.00 21.31 H new ATOM 0 HG3 ARG A 135 -9.476 23.705 -21.469 1.00 21.31 H new ATOM 0 HD2 ARG A 135 -10.510 21.983 -19.982 1.00 1.32 H new ATOM 0 HD3 ARG A 135 -9.730 22.725 -18.599 1.00 1.32 H new ATOM 0 HE ARG A 135 -12.127 23.640 -19.960 1.00 2.34 H new ATOM 0 HH11 ARG A 135 -9.287 24.817 -18.207 1.00 32.43 H new ATOM 0 HH12 ARG A 135 -10.151 26.192 -17.512 1.00 32.43 H new ATOM 0 HH21 ARG A 135 -13.234 25.357 -19.002 1.00 42.15 H new ATOM 0 HH22 ARG A 135 -12.374 26.496 -17.960 1.00 42.15 H new ATOM 2180 N GLU A 136 -6.253 24.671 -18.697 1.00 4.24 N ATOM 2181 CA GLU A 136 -5.452 25.884 -18.624 1.00 33.42 C ATOM 2182 C GLU A 136 -4.080 25.571 -18.022 1.00 23.15 C ATOM 2183 O GLU A 136 -3.062 26.111 -18.450 1.00 63.14 O ATOM 2184 CB GLU A 136 -6.190 26.931 -17.788 1.00 72.33 C ATOM 2185 CG GLU A 136 -5.652 28.342 -17.946 1.00 21.42 C ATOM 2186 CD GLU A 136 -6.553 29.374 -17.302 1.00 52.13 C ATOM 2187 OE1 GLU A 136 -7.599 29.708 -17.897 1.00 11.40 O ATOM 2188 OE2 GLU A 136 -6.226 29.852 -16.197 1.00 45.21 O ATOM 0 H GLU A 136 -7.016 24.632 -18.022 1.00 4.24 H new ATOM 0 HA GLU A 136 -5.298 26.282 -19.627 1.00 33.42 H new ATOM 0 HB2 GLU A 136 -7.245 26.923 -18.063 1.00 72.33 H new ATOM 0 HB3 GLU A 136 -6.133 26.647 -16.737 1.00 72.33 H new ATOM 0 HG2 GLU A 136 -4.659 28.402 -17.502 1.00 21.42 H new ATOM 0 HG3 GLU A 136 -5.541 28.570 -19.006 1.00 21.42 H new ATOM 2195 N ALA A 137 -4.062 24.680 -17.034 1.00 63.13 N ATOM 2196 CA ALA A 137 -2.812 24.209 -16.445 1.00 3.44 C ATOM 2197 C ALA A 137 -2.206 23.110 -17.312 1.00 13.23 C ATOM 2198 O ALA A 137 -0.993 22.897 -17.323 1.00 22.32 O ATOM 2199 CB ALA A 137 -3.049 23.705 -15.031 1.00 40.24 C ATOM 0 H ALA A 137 -4.901 24.269 -16.624 1.00 63.13 H new ATOM 0 HA ALA A 137 -2.110 25.042 -16.398 1.00 3.44 H new ATOM 0 HB1 ALA A 137 -2.107 23.357 -14.606 1.00 40.24 H new ATOM 0 HB2 ALA A 137 -3.447 24.514 -14.418 1.00 40.24 H new ATOM 0 HB3 ALA A 137 -3.763 22.882 -15.053 1.00 40.24 H new ATOM 2205 N VAL A 138 -3.069 22.405 -18.034 1.00 21.44 N ATOM 2206 CA VAL A 138 -2.633 21.414 -19.006 1.00 61.34 C ATOM 2207 C VAL A 138 -1.883 22.101 -20.143 1.00 0.51 C ATOM 2208 O VAL A 138 -0.922 21.559 -20.686 1.00 75.14 O ATOM 2209 CB VAL A 138 -3.829 20.601 -19.563 1.00 71.12 C ATOM 2210 CG1 VAL A 138 -3.409 19.722 -20.735 1.00 2.21 C ATOM 2211 CG2 VAL A 138 -4.442 19.745 -18.465 1.00 22.34 C ATOM 0 H VAL A 138 -4.082 22.504 -17.962 1.00 21.44 H new ATOM 0 HA VAL A 138 -1.965 20.715 -18.503 1.00 61.34 H new ATOM 0 HB VAL A 138 -4.573 21.311 -19.924 1.00 71.12 H new ATOM 0 HG11 VAL A 138 -4.272 19.166 -21.101 1.00 2.21 H new ATOM 0 HG12 VAL A 138 -3.014 20.347 -21.536 1.00 2.21 H new ATOM 0 HG13 VAL A 138 -2.639 19.023 -20.408 1.00 2.21 H new ATOM 0 HG21 VAL A 138 -5.281 19.179 -18.870 1.00 22.34 H new ATOM 0 HG22 VAL A 138 -3.691 19.055 -18.080 1.00 22.34 H new ATOM 0 HG23 VAL A 138 -4.794 20.387 -17.657 1.00 22.34 H new ATOM 2221 N GLU A 139 -2.323 23.308 -20.470 1.00 13.44 N ATOM 2222 CA GLU A 139 -1.679 24.135 -21.482 1.00 51.45 C ATOM 2223 C GLU A 139 -0.179 24.260 -21.224 1.00 61.25 C ATOM 2224 O GLU A 139 0.640 23.885 -22.062 1.00 24.13 O ATOM 2225 CB GLU A 139 -2.318 25.527 -21.483 1.00 52.33 C ATOM 2226 CG GLU A 139 -1.700 26.498 -22.474 1.00 64.51 C ATOM 2227 CD GLU A 139 -1.962 26.113 -23.912 1.00 44.31 C ATOM 2228 OE1 GLU A 139 -3.127 26.209 -24.347 1.00 14.10 O ATOM 2229 OE2 GLU A 139 -1.003 25.753 -24.622 1.00 13.52 O ATOM 0 H GLU A 139 -3.139 23.743 -20.040 1.00 13.44 H new ATOM 0 HA GLU A 139 -1.817 23.659 -22.453 1.00 51.45 H new ATOM 0 HB2 GLU A 139 -3.380 25.426 -21.705 1.00 52.33 H new ATOM 0 HB3 GLU A 139 -2.241 25.950 -20.481 1.00 52.33 H new ATOM 0 HG2 GLU A 139 -2.096 27.497 -22.292 1.00 64.51 H new ATOM 0 HG3 GLU A 139 -0.624 26.546 -22.306 1.00 64.51 H new ATOM 2236 N GLU A 140 0.175 24.754 -20.044 1.00 25.43 N ATOM 2237 CA GLU A 140 1.561 25.091 -19.742 1.00 54.53 C ATOM 2238 C GLU A 140 2.481 23.871 -19.706 1.00 1.53 C ATOM 2239 O GLU A 140 3.688 24.012 -19.893 1.00 71.12 O ATOM 2240 CB GLU A 140 1.653 25.889 -18.441 1.00 50.04 C ATOM 2241 CG GLU A 140 0.840 25.315 -17.299 1.00 50.02 C ATOM 2242 CD GLU A 140 0.828 26.230 -16.096 1.00 30.21 C ATOM 2243 OE1 GLU A 140 0.113 27.252 -16.131 1.00 51.41 O ATOM 2244 OE2 GLU A 140 1.548 25.946 -15.120 1.00 0.32 O ATOM 0 H GLU A 140 -0.478 24.930 -19.281 1.00 25.43 H new ATOM 0 HA GLU A 140 1.916 25.715 -20.562 1.00 54.53 H new ATOM 0 HB2 GLU A 140 2.698 25.945 -18.136 1.00 50.04 H new ATOM 0 HB3 GLU A 140 1.321 26.910 -18.630 1.00 50.04 H new ATOM 0 HG2 GLU A 140 -0.183 25.142 -17.633 1.00 50.02 H new ATOM 0 HG3 GLU A 140 1.250 24.346 -17.013 1.00 50.02 H new ATOM 2251 N LYS A 141 1.935 22.680 -19.474 1.00 11.20 N ATOM 2252 CA LYS A 141 2.751 21.470 -19.548 1.00 14.24 C ATOM 2253 C LYS A 141 2.807 20.937 -20.981 1.00 50.43 C ATOM 2254 O LYS A 141 3.824 20.387 -21.399 1.00 31.44 O ATOM 2255 CB LYS A 141 2.246 20.362 -18.607 1.00 64.50 C ATOM 2256 CG LYS A 141 0.771 20.041 -18.762 1.00 4.11 C ATOM 2257 CD LYS A 141 0.413 18.714 -18.116 1.00 41.43 C ATOM 2258 CE LYS A 141 -1.090 18.481 -18.129 1.00 42.12 C ATOM 2259 NZ LYS A 141 -1.464 17.165 -17.545 1.00 52.43 N ATOM 0 H LYS A 141 0.954 22.527 -19.238 1.00 11.20 H new ATOM 0 HA LYS A 141 3.753 21.753 -19.225 1.00 14.24 H new ATOM 0 HB2 LYS A 141 2.825 19.456 -18.787 1.00 64.50 H new ATOM 0 HB3 LYS A 141 2.435 20.662 -17.576 1.00 64.50 H new ATOM 0 HG2 LYS A 141 0.176 20.836 -18.313 1.00 4.11 H new ATOM 0 HG3 LYS A 141 0.515 20.011 -19.821 1.00 4.11 H new ATOM 0 HD2 LYS A 141 0.914 17.903 -18.645 1.00 41.43 H new ATOM 0 HD3 LYS A 141 0.777 18.697 -17.089 1.00 41.43 H new ATOM 0 HE2 LYS A 141 -1.583 19.277 -17.571 1.00 42.12 H new ATOM 0 HE3 LYS A 141 -1.455 18.537 -19.155 1.00 42.12 H new ATOM 0 HZ1 LYS A 141 -2.466 16.970 -17.742 1.00 52.43 H new ATOM 0 HZ2 LYS A 141 -0.876 16.418 -17.967 1.00 52.43 H new ATOM 0 HZ3 LYS A 141 -1.311 17.186 -16.516 1.00 52.43 H new ATOM 2273 N LEU A 142 1.726 21.117 -21.741 1.00 14.11 N ATOM 2274 CA LEU A 142 1.644 20.523 -23.071 1.00 73.24 C ATOM 2275 C LEU A 142 2.532 21.267 -24.065 1.00 4.22 C ATOM 2276 O LEU A 142 3.254 20.637 -24.843 1.00 40.12 O ATOM 2277 CB LEU A 142 0.181 20.432 -23.570 1.00 11.54 C ATOM 2278 CG LEU A 142 -0.521 21.736 -23.980 1.00 11.01 C ATOM 2279 CD1 LEU A 142 -0.226 22.084 -25.433 1.00 61.22 C ATOM 2280 CD2 LEU A 142 -2.022 21.614 -23.773 1.00 72.40 C ATOM 0 H LEU A 142 0.909 21.660 -21.463 1.00 14.11 H new ATOM 0 HA LEU A 142 2.019 19.502 -22.996 1.00 73.24 H new ATOM 0 HB2 LEU A 142 0.161 19.758 -24.426 1.00 11.54 H new ATOM 0 HB3 LEU A 142 -0.412 19.966 -22.783 1.00 11.54 H new ATOM 0 HG LEU A 142 -0.136 22.537 -23.350 1.00 11.01 H new ATOM 0 HD11 LEU A 142 -0.735 23.011 -25.696 1.00 61.22 H new ATOM 0 HD12 LEU A 142 0.848 22.210 -25.566 1.00 61.22 H new ATOM 0 HD13 LEU A 142 -0.580 21.280 -26.079 1.00 61.22 H new ATOM 0 HD21 LEU A 142 -2.507 22.545 -24.067 1.00 72.40 H new ATOM 0 HD22 LEU A 142 -2.408 20.796 -24.381 1.00 72.40 H new ATOM 0 HD23 LEU A 142 -2.229 21.414 -22.722 1.00 72.40 H new ATOM 2292 N ARG A 143 2.503 22.599 -24.027 1.00 71.43 N ATOM 2293 CA ARG A 143 3.305 23.394 -24.955 1.00 44.11 C ATOM 2294 C ARG A 143 4.751 23.485 -24.497 1.00 54.24 C ATOM 2295 O ARG A 143 5.633 23.825 -25.279 1.00 61.21 O ATOM 2296 CB ARG A 143 2.698 24.785 -25.221 1.00 14.34 C ATOM 2297 CG ARG A 143 2.111 25.498 -24.010 1.00 31.22 C ATOM 2298 CD ARG A 143 3.160 26.183 -23.150 1.00 61.54 C ATOM 2299 NE ARG A 143 2.535 26.983 -22.095 1.00 43.14 N ATOM 2300 CZ ARG A 143 3.160 27.932 -21.399 1.00 64.32 C ATOM 2301 NH1 ARG A 143 4.447 28.181 -21.607 1.00 61.02 N ATOM 2302 NH2 ARG A 143 2.495 28.625 -20.481 1.00 51.33 N ATOM 0 H ARG A 143 1.941 23.144 -23.373 1.00 71.43 H new ATOM 0 HA ARG A 143 3.294 22.870 -25.911 1.00 44.11 H new ATOM 0 HB2 ARG A 143 3.471 25.421 -25.653 1.00 14.34 H new ATOM 0 HB3 ARG A 143 1.915 24.681 -25.972 1.00 14.34 H new ATOM 0 HG2 ARG A 143 1.388 26.240 -24.349 1.00 31.22 H new ATOM 0 HG3 ARG A 143 1.566 24.777 -23.401 1.00 31.22 H new ATOM 0 HD2 ARG A 143 3.815 25.434 -22.704 1.00 61.54 H new ATOM 0 HD3 ARG A 143 3.785 26.822 -23.773 1.00 61.54 H new ATOM 0 HE ARG A 143 1.555 26.802 -21.878 1.00 43.14 H new ATOM 0 HH11 ARG A 143 4.964 27.644 -22.303 1.00 61.02 H new ATOM 0 HH12 ARG A 143 4.919 28.909 -21.070 1.00 61.02 H new ATOM 0 HH21 ARG A 143 1.508 28.430 -20.310 1.00 51.33 H new ATOM 0 HH22 ARG A 143 2.971 29.352 -19.947 1.00 51.33 H new ATOM 2316 N ALA A 144 4.992 23.176 -23.229 1.00 45.42 N ATOM 2317 CA ALA A 144 6.352 23.113 -22.708 1.00 0.25 C ATOM 2318 C ALA A 144 7.135 21.996 -23.397 1.00 55.21 C ATOM 2319 O ALA A 144 8.359 22.056 -23.515 1.00 12.11 O ATOM 2320 CB ALA A 144 6.337 22.895 -21.204 1.00 62.02 C ATOM 0 H ALA A 144 4.266 22.966 -22.544 1.00 45.42 H new ATOM 0 HA ALA A 144 6.844 24.063 -22.915 1.00 0.25 H new ATOM 0 HB1 ALA A 144 7.361 22.851 -20.833 1.00 62.02 H new ATOM 0 HB2 ALA A 144 5.812 23.719 -20.722 1.00 62.02 H new ATOM 0 HB3 ALA A 144 5.828 21.958 -20.977 1.00 62.02 H new ATOM 2326 N THR A 145 6.412 20.975 -23.845 1.00 35.01 N ATOM 2327 CA THR A 145 7.013 19.860 -24.558 1.00 74.10 C ATOM 2328 C THR A 145 7.226 20.210 -26.033 1.00 62.42 C ATOM 2329 O THR A 145 8.134 19.690 -26.684 1.00 65.22 O ATOM 2330 CB THR A 145 6.120 18.606 -24.449 1.00 44.21 C ATOM 2331 OG1 THR A 145 5.808 18.358 -23.073 1.00 21.12 O ATOM 2332 CG2 THR A 145 6.804 17.382 -25.041 1.00 33.05 C ATOM 0 H THR A 145 5.402 20.899 -23.724 1.00 35.01 H new ATOM 0 HA THR A 145 7.981 19.652 -24.101 1.00 74.10 H new ATOM 0 HB THR A 145 5.206 18.792 -25.014 1.00 44.21 H new ATOM 0 HG1 THR A 145 4.837 18.392 -22.947 1.00 21.12 H new ATOM 0 HG21 THR A 145 6.147 16.517 -24.947 1.00 33.05 H new ATOM 0 HG22 THR A 145 7.021 17.560 -26.094 1.00 33.05 H new ATOM 0 HG23 THR A 145 7.734 17.191 -24.506 1.00 33.05 H new ATOM 2340 N ASP A 146 6.392 21.108 -26.547 1.00 52.33 N ATOM 2341 CA ASP A 146 6.460 21.502 -27.951 1.00 21.43 C ATOM 2342 C ASP A 146 7.514 22.581 -28.152 1.00 52.04 C ATOM 2343 O ASP A 146 8.287 22.544 -29.110 1.00 2.31 O ATOM 2344 CB ASP A 146 5.105 22.027 -28.444 1.00 64.14 C ATOM 2345 CG ASP A 146 3.983 21.023 -28.289 1.00 3.41 C ATOM 2346 OD1 ASP A 146 4.113 19.885 -28.784 1.00 11.12 O ATOM 2347 OD2 ASP A 146 2.959 21.361 -27.657 1.00 22.31 O ATOM 0 H ASP A 146 5.661 21.577 -26.013 1.00 52.33 H new ATOM 0 HA ASP A 146 6.729 20.617 -28.527 1.00 21.43 H new ATOM 0 HB2 ASP A 146 4.852 22.933 -27.893 1.00 64.14 H new ATOM 0 HB3 ASP A 146 5.191 22.306 -29.494 1.00 64.14 H new