USER MOD reduce.3.24.130724 H: found=0, std=0, add=1411, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1411 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 23 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 25 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 1 MET N :NH3+ -136:sc= 0.0111 (180deg=-0.111) USER MOD Set 2.2: A 5 ASN : amide:sc= -0.14 K(o=-0.13,f=0.51) USER MOD Set 2.3: A 135 ASN : amide:sc= 0.00155 K(o=-0.13,f=0.41) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= 0.0905 K(o=0.09,f=-3.5!) USER MOD Single : A 4 SER OG : rot 180:sc= 0.0111 USER MOD Single : A 14 SER OG : rot 170:sc= -0.923 USER MOD Single : A 15 TYR OH : rot 180:sc= 0.348 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0111) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 28 SER OG : rot 79:sc= 1.05 USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.00249 USER MOD Single : A 43 SER OG : rot -170:sc= 0.989 USER MOD Single : A 47 LYS NZ :NH3+ 138:sc= 1.21 (180deg=0.847) USER MOD Single : A 48 GLN : amide:sc= -0.54 K(o=-0.54,f=-6.6!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot -93:sc= 1.26 USER MOD Single : A 70 SER OG : rot 81:sc= 1.22 USER MOD Single : A 71 GLN : amide:sc= -1.26 K(o=-1.3,f=-0.036) USER MOD Single : A 73 HIS : no HD1:sc= -0.227 X(o=-0.23,f=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.67 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot -116:sc= 1.25 USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -2.49! K(o=-2.5!,f=-1.8) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 96 ASN : amide:sc= 0.783 K(o=0.78,f=-7.1!) USER MOD Single : A 105 SER OG : rot 71:sc= 1.2 USER MOD Single : A 111 CYS SG : rot -73:sc= 0.199 USER MOD Single : A 114 SER OG : rot -84:sc= 1.22 USER MOD Single : A 117 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0796) USER MOD Single : A 119 MET CE :methyl -144:sc= -5.06! (180deg=-8.1!) USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl 173:sc= -2.96 (180deg=-3.33!) USER MOD Single : A 132 THR OG1 : rot 74:sc= 1.29 USER MOD Single : A 133 TYR OH : rot 60:sc= 0.59 USER MOD Single : A 137 HIS : no HE2:sc= 1.1 K(o=1.1,f=-5.5!) USER MOD Single : A 143 GLN : amide:sc= -0.204 X(o=-0.2,f=-0.081) USER MOD Single : A 145 ASN : amide:sc= 0.91 K(o=0.91,f=0) USER MOD Single : A 150 THR OG1 : rot -140:sc= 0 USER MOD Single : A 155 TYR OH : rot 42:sc= 1.16 USER MOD Single : A 157 ASN : amide:sc= 0.382 X(o=0.38,f=-0.062) USER MOD Single : A 158 ASN : amide:sc= -0.0118 K(o=-0.012,f=-0.99) USER MOD Single : A 163 SER OG : rot 65:sc= 0.515 USER MOD Single : A 165 LYS NZ :NH3+ -132:sc= 1.12 (180deg=0.805) USER MOD Single : A 167 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 172 HIS : no HD1:sc=-0.00207 X(o=-0.0021,f=-0.076) USER MOD Single : A 173 HIS : no HE2:sc= 0.702 K(o=0.7,f=-2.2!) USER MOD Single : A 174 HIS : no HD1:sc= 0.71 K(o=0.71,f=-4.5!) USER MOD Single : A 175 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 176 HIS : no HD1:sc= 0.218 K(o=0.22,f=-2.3!) USER MOD Single : A 177 HIS : no HD1:sc= 0 X(o=0,f=-0.0036) USER MOD Single : A 180 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 181 HIS : no HE2:sc= 1.03 K(o=1,f=-5.3!) USER MOD Single : A 182 HIS : no HD1:sc=-0.00107 X(o=-0.0011,f=-0.0083) USER MOD Single : A 183 HIS : no HD1:sc= 0 X(o=0,f=-0.00025) USER MOD Single : A 184 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 185 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.858 2.539 12.833 1.00 3.19 N ATOM 2 CA MET A 1 11.384 1.871 14.048 1.00 2.85 C ATOM 3 C MET A 1 10.316 0.976 14.660 1.00 2.27 C ATOM 4 O MET A 1 10.579 -0.180 14.997 1.00 2.72 O ATOM 5 CB MET A 1 11.845 2.907 15.077 1.00 3.07 C ATOM 6 CG MET A 1 12.931 3.837 14.564 1.00 3.85 C ATOM 7 SD MET A 1 14.390 2.947 13.989 1.00 4.63 S ATOM 8 CE MET A 1 15.414 4.304 13.417 1.00 5.45 C ATOM 0 H1 MET A 1 11.572 2.500 12.078 1.00 3.19 H new ATOM 0 H2 MET A 1 9.994 2.055 12.517 1.00 3.19 H new ATOM 0 H3 MET A 1 10.639 3.532 13.050 1.00 3.19 H new ATOM 0 HA MET A 1 12.240 1.261 13.759 1.00 2.85 H new ATOM 0 HB2 MET A 1 10.987 3.502 15.389 1.00 3.07 H new ATOM 0 HB3 MET A 1 12.212 2.388 15.962 1.00 3.07 H new ATOM 0 HG2 MET A 1 12.533 4.440 13.748 1.00 3.85 H new ATOM 0 HG3 MET A 1 13.219 4.526 15.358 1.00 3.85 H new ATOM 0 HE1 MET A 1 16.355 3.912 13.031 1.00 5.45 H new ATOM 0 HE2 MET A 1 14.894 4.844 12.626 1.00 5.45 H new ATOM 0 HE3 MET A 1 15.616 4.982 14.246 1.00 5.45 H new ATOM 20 N SER A 2 9.109 1.510 14.796 1.00 1.75 N ATOM 21 CA SER A 2 7.987 0.740 15.303 1.00 1.66 C ATOM 22 C SER A 2 7.576 -0.322 14.285 1.00 1.36 C ATOM 23 O SER A 2 7.830 -0.175 13.088 1.00 1.24 O ATOM 24 CB SER A 2 6.814 1.673 15.609 1.00 2.18 C ATOM 25 OG SER A 2 7.212 2.711 16.493 1.00 2.93 O ATOM 0 H SER A 2 8.884 2.477 14.561 1.00 1.75 H new ATOM 0 HA SER A 2 8.284 0.238 16.224 1.00 1.66 H new ATOM 0 HB2 SER A 2 6.435 2.104 14.682 1.00 2.18 H new ATOM 0 HB3 SER A 2 5.997 1.104 16.053 1.00 2.18 H new ATOM 0 HG SER A 2 6.448 3.297 16.674 1.00 2.93 H new ATOM 31 N GLN A 3 6.953 -1.392 14.761 1.00 1.37 N ATOM 32 CA GLN A 3 6.539 -2.481 13.886 1.00 1.24 C ATOM 33 C GLN A 3 5.536 -1.997 12.846 1.00 0.92 C ATOM 34 O GLN A 3 5.491 -2.523 11.739 1.00 0.86 O ATOM 35 CB GLN A 3 5.936 -3.644 14.686 1.00 1.49 C ATOM 36 CG GLN A 3 6.955 -4.450 15.484 1.00 1.69 C ATOM 37 CD GLN A 3 7.566 -3.673 16.637 1.00 2.43 C ATOM 38 OE1 GLN A 3 6.929 -2.785 17.212 1.00 3.10 O ATOM 39 NE2 GLN A 3 8.802 -4.000 16.984 1.00 2.97 N ATOM 0 H GLN A 3 6.724 -1.529 15.745 1.00 1.37 H new ATOM 0 HA GLN A 3 7.432 -2.839 13.374 1.00 1.24 H new ATOM 0 HB2 GLN A 3 5.186 -3.248 15.371 1.00 1.49 H new ATOM 0 HB3 GLN A 3 5.419 -4.313 13.999 1.00 1.49 H new ATOM 0 HG2 GLN A 3 6.473 -5.347 15.874 1.00 1.69 H new ATOM 0 HG3 GLN A 3 7.750 -4.780 14.816 1.00 1.69 H new ATOM 0 HE21 GLN A 3 9.294 -4.740 16.483 1.00 2.97 H new ATOM 0 HE22 GLN A 3 9.262 -3.512 17.752 1.00 2.97 H new ATOM 48 N SER A 4 4.770 -0.967 13.196 1.00 0.88 N ATOM 49 CA SER A 4 3.710 -0.451 12.332 1.00 0.77 C ATOM 50 C SER A 4 4.244 -0.042 10.960 1.00 0.62 C ATOM 51 O SER A 4 3.611 -0.313 9.937 1.00 0.64 O ATOM 52 CB SER A 4 3.020 0.731 13.014 1.00 1.02 C ATOM 53 OG SER A 4 3.970 1.577 13.645 1.00 1.34 O ATOM 0 H SER A 4 4.865 -0.469 14.081 1.00 0.88 H new ATOM 0 HA SER A 4 2.986 -1.250 12.170 1.00 0.77 H new ATOM 0 HB2 SER A 4 2.453 1.300 12.278 1.00 1.02 H new ATOM 0 HB3 SER A 4 2.307 0.364 13.752 1.00 1.02 H new ATOM 0 HG SER A 4 3.507 2.327 14.073 1.00 1.34 H new ATOM 59 N ASN A 5 5.415 0.590 10.937 1.00 0.59 N ATOM 60 CA ASN A 5 6.022 1.021 9.678 1.00 0.55 C ATOM 61 C ASN A 5 6.353 -0.190 8.808 1.00 0.43 C ATOM 62 O ASN A 5 6.232 -0.148 7.585 1.00 0.44 O ATOM 63 CB ASN A 5 7.306 1.829 9.923 1.00 0.65 C ATOM 64 CG ASN A 5 7.178 2.817 11.069 1.00 0.94 C ATOM 65 OD1 ASN A 5 7.491 2.494 12.213 1.00 1.71 O ATOM 66 ND2 ASN A 5 6.714 4.021 10.782 1.00 0.67 N ATOM 0 H ASN A 5 5.960 0.814 11.769 1.00 0.59 H new ATOM 0 HA ASN A 5 5.300 1.658 9.167 1.00 0.55 H new ATOM 0 HB2 ASN A 5 8.126 1.142 10.133 1.00 0.65 H new ATOM 0 HB3 ASN A 5 7.568 2.369 9.013 1.00 0.65 H new ATOM 0 HD21 ASN A 5 6.606 4.716 11.521 1.00 0.67 H new ATOM 0 HD22 ASN A 5 6.464 4.256 9.821 1.00 0.67 H new ATOM 73 N ARG A 6 6.753 -1.278 9.449 1.00 0.41 N ATOM 74 CA ARG A 6 7.158 -2.476 8.735 1.00 0.41 C ATOM 75 C ARG A 6 5.951 -3.352 8.390 1.00 0.37 C ATOM 76 O ARG A 6 5.973 -4.069 7.390 1.00 0.38 O ATOM 77 CB ARG A 6 8.178 -3.260 9.568 1.00 0.54 C ATOM 78 CG ARG A 6 8.669 -4.529 8.893 1.00 0.65 C ATOM 79 CD ARG A 6 9.852 -5.142 9.623 1.00 0.83 C ATOM 80 NE ARG A 6 11.032 -4.282 9.571 1.00 1.50 N ATOM 81 CZ ARG A 6 12.210 -4.668 9.086 1.00 2.14 C ATOM 82 NH1 ARG A 6 12.366 -5.893 8.599 1.00 2.16 N ATOM 83 NH2 ARG A 6 13.232 -3.826 9.067 1.00 3.18 N ATOM 0 H ARG A 6 6.805 -1.354 10.465 1.00 0.41 H new ATOM 0 HA ARG A 6 7.624 -2.176 7.796 1.00 0.41 H new ATOM 0 HB2 ARG A 6 9.033 -2.617 9.779 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.729 -3.519 10.527 1.00 0.54 H new ATOM 0 HG2 ARG A 6 7.856 -5.254 8.848 1.00 0.65 H new ATOM 0 HG3 ARG A 6 8.954 -4.306 7.865 1.00 0.65 H new ATOM 0 HD2 ARG A 6 9.582 -5.324 10.663 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.089 -6.110 9.181 1.00 0.83 H new ATOM 0 HE ARG A 6 10.948 -3.330 9.927 1.00 1.50 H new ATOM 0 HH11 ARG A 6 11.581 -6.544 8.595 1.00 2.16 H new ATOM 0 HH12 ARG A 6 13.271 -6.183 8.229 1.00 2.16 H new ATOM 0 HH21 ARG A 6 13.118 -2.878 9.425 1.00 3.18 H new ATOM 0 HH22 ARG A 6 14.133 -4.126 8.695 1.00 3.18 H new ATOM 97 N GLU A 7 4.899 -3.281 9.207 1.00 0.36 N ATOM 98 CA GLU A 7 3.687 -4.075 8.981 1.00 0.37 C ATOM 99 C GLU A 7 3.113 -3.802 7.600 1.00 0.29 C ATOM 100 O GLU A 7 2.711 -4.720 6.883 1.00 0.29 O ATOM 101 CB GLU A 7 2.612 -3.753 10.027 1.00 0.46 C ATOM 102 CG GLU A 7 2.968 -4.161 11.446 1.00 0.60 C ATOM 103 CD GLU A 7 1.861 -3.832 12.427 1.00 1.39 C ATOM 104 OE1 GLU A 7 0.863 -4.585 12.466 1.00 1.58 O ATOM 105 OE2 GLU A 7 1.978 -2.825 13.155 1.00 2.00 O ATOM 0 H GLU A 7 4.860 -2.682 10.032 1.00 0.36 H new ATOM 0 HA GLU A 7 3.971 -5.124 9.063 1.00 0.37 H new ATOM 0 HB2 GLU A 7 2.416 -2.681 10.010 1.00 0.46 H new ATOM 0 HB3 GLU A 7 1.685 -4.251 9.741 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.171 -5.231 11.475 1.00 0.60 H new ATOM 0 HG3 GLU A 7 3.884 -3.654 11.750 1.00 0.60 H new ATOM 112 N LEU A 8 3.108 -2.530 7.236 1.00 0.27 N ATOM 113 CA LEU A 8 2.498 -2.077 5.996 1.00 0.28 C ATOM 114 C LEU A 8 3.301 -2.566 4.806 1.00 0.28 C ATOM 115 O LEU A 8 2.758 -2.822 3.735 1.00 0.39 O ATOM 116 CB LEU A 8 2.426 -0.552 5.998 1.00 0.31 C ATOM 117 CG LEU A 8 1.878 0.052 7.287 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.866 1.566 7.201 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.488 -0.486 7.572 1.00 0.35 C ATOM 0 H LEU A 8 3.526 -1.783 7.791 1.00 0.27 H new ATOM 0 HA LEU A 8 1.490 -2.485 5.919 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.425 -0.153 5.820 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.801 -0.229 5.165 1.00 0.31 H new ATOM 0 HG LEU A 8 2.530 -0.234 8.112 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.472 1.980 8.129 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.881 1.930 7.044 1.00 0.36 H new ATOM 0 HD13 LEU A 8 1.236 1.878 6.368 1.00 0.36 H new ATOM 0 HD21 LEU A 8 0.110 -0.046 8.495 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.178 -0.229 6.748 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.532 -1.570 7.678 1.00 0.35 H new ATOM 131 N VAL A 9 4.597 -2.695 5.014 1.00 0.26 N ATOM 132 CA VAL A 9 5.490 -3.209 3.998 1.00 0.28 C ATOM 133 C VAL A 9 5.360 -4.723 3.904 1.00 0.29 C ATOM 134 O VAL A 9 4.940 -5.257 2.880 1.00 0.31 O ATOM 135 CB VAL A 9 6.946 -2.841 4.328 1.00 0.32 C ATOM 136 CG1 VAL A 9 7.894 -3.415 3.293 1.00 0.38 C ATOM 137 CG2 VAL A 9 7.101 -1.333 4.425 1.00 0.31 C ATOM 0 H VAL A 9 5.058 -2.447 5.890 1.00 0.26 H new ATOM 0 HA VAL A 9 5.217 -2.762 3.042 1.00 0.28 H new ATOM 0 HB VAL A 9 7.201 -3.276 5.295 1.00 0.32 H new ATOM 0 HG11 VAL A 9 8.918 -3.142 3.547 1.00 0.38 H new ATOM 0 HG12 VAL A 9 7.801 -4.501 3.277 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.645 -3.015 2.310 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.137 -1.088 4.659 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.826 -0.877 3.474 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.451 -0.950 5.212 1.00 0.31 H new ATOM 147 N VAL A 10 5.708 -5.396 4.997 1.00 0.30 N ATOM 148 CA VAL A 10 5.730 -6.852 5.060 1.00 0.32 C ATOM 149 C VAL A 10 4.436 -7.473 4.556 1.00 0.35 C ATOM 150 O VAL A 10 4.457 -8.282 3.629 1.00 0.36 O ATOM 151 CB VAL A 10 5.991 -7.330 6.502 1.00 0.37 C ATOM 152 CG1 VAL A 10 5.749 -8.823 6.635 1.00 0.42 C ATOM 153 CG2 VAL A 10 7.408 -6.989 6.917 1.00 0.38 C ATOM 0 H VAL A 10 5.984 -4.943 5.868 1.00 0.30 H new ATOM 0 HA VAL A 10 6.540 -7.178 4.408 1.00 0.32 H new ATOM 0 HB VAL A 10 5.294 -6.814 7.162 1.00 0.37 H new ATOM 0 HG11 VAL A 10 5.941 -9.133 7.662 1.00 0.42 H new ATOM 0 HG12 VAL A 10 4.715 -9.049 6.375 1.00 0.42 H new ATOM 0 HG13 VAL A 10 6.418 -9.361 5.963 1.00 0.42 H new ATOM 0 HG21 VAL A 10 7.581 -7.331 7.937 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.112 -7.480 6.245 1.00 0.38 H new ATOM 0 HG23 VAL A 10 7.552 -5.910 6.867 1.00 0.38 H new ATOM 163 N ASP A 11 3.314 -7.087 5.153 1.00 0.39 N ATOM 164 CA ASP A 11 2.044 -7.741 4.852 1.00 0.46 C ATOM 165 C ASP A 11 1.594 -7.429 3.431 1.00 0.44 C ATOM 166 O ASP A 11 0.789 -8.156 2.852 1.00 0.50 O ATOM 167 CB ASP A 11 0.957 -7.337 5.852 1.00 0.55 C ATOM 168 CG ASP A 11 -0.211 -8.306 5.840 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.078 -9.411 6.414 1.00 0.92 O ATOM 170 OD2 ASP A 11 -1.267 -7.976 5.260 1.00 0.84 O ATOM 0 H ASP A 11 3.256 -6.335 5.839 1.00 0.39 H new ATOM 0 HA ASP A 11 2.203 -8.816 4.939 1.00 0.46 H new ATOM 0 HB2 ASP A 11 1.383 -7.295 6.854 1.00 0.55 H new ATOM 0 HB3 ASP A 11 0.600 -6.335 5.615 1.00 0.55 H new ATOM 175 N PHE A 12 2.123 -6.353 2.863 1.00 0.41 N ATOM 176 CA PHE A 12 1.828 -6.015 1.478 1.00 0.42 C ATOM 177 C PHE A 12 2.673 -6.883 0.553 1.00 0.37 C ATOM 178 O PHE A 12 2.176 -7.417 -0.442 1.00 0.41 O ATOM 179 CB PHE A 12 2.097 -4.527 1.198 1.00 0.44 C ATOM 180 CG PHE A 12 1.515 -4.043 -0.105 1.00 0.48 C ATOM 181 CD1 PHE A 12 2.159 -4.293 -1.309 1.00 0.46 C ATOM 182 CD2 PHE A 12 0.319 -3.344 -0.125 1.00 0.62 C ATOM 183 CE1 PHE A 12 1.619 -3.854 -2.505 1.00 0.51 C ATOM 184 CE2 PHE A 12 -0.223 -2.903 -1.318 1.00 0.68 C ATOM 185 CZ PHE A 12 0.427 -3.159 -2.508 1.00 0.60 C ATOM 0 H PHE A 12 2.753 -5.705 3.335 1.00 0.41 H new ATOM 0 HA PHE A 12 0.770 -6.203 1.294 1.00 0.42 H new ATOM 0 HB2 PHE A 12 1.685 -3.932 2.013 1.00 0.44 H new ATOM 0 HB3 PHE A 12 3.173 -4.356 1.191 1.00 0.44 H new ATOM 0 HD1 PHE A 12 3.092 -4.836 -1.312 1.00 0.46 H new ATOM 0 HD2 PHE A 12 -0.196 -3.141 0.802 1.00 0.62 H new ATOM 0 HE1 PHE A 12 2.130 -4.055 -3.435 1.00 0.51 H new ATOM 0 HE2 PHE A 12 -1.155 -2.358 -1.319 1.00 0.68 H new ATOM 0 HZ PHE A 12 0.003 -2.816 -3.440 1.00 0.60 H new ATOM 195 N LEU A 13 3.949 -7.037 0.898 1.00 0.33 N ATOM 196 CA LEU A 13 4.858 -7.849 0.103 1.00 0.32 C ATOM 197 C LEU A 13 4.417 -9.306 0.137 1.00 0.33 C ATOM 198 O LEU A 13 4.360 -9.977 -0.895 1.00 0.35 O ATOM 199 CB LEU A 13 6.294 -7.728 0.628 1.00 0.32 C ATOM 200 CG LEU A 13 6.801 -6.297 0.841 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.283 -6.297 1.176 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.528 -5.438 -0.382 1.00 0.38 C ATOM 0 H LEU A 13 4.373 -6.610 1.721 1.00 0.33 H new ATOM 0 HA LEU A 13 4.833 -7.488 -0.925 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.362 -8.264 1.575 1.00 0.32 H new ATOM 0 HB3 LEU A 13 6.962 -8.231 -0.072 1.00 0.32 H new ATOM 0 HG LEU A 13 6.259 -5.868 1.684 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.623 -5.272 1.323 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.450 -6.869 2.089 1.00 0.40 H new ATOM 0 HD13 LEU A 13 8.841 -6.750 0.357 1.00 0.40 H new ATOM 0 HD21 LEU A 13 6.897 -4.427 -0.206 1.00 0.38 H new ATOM 0 HD22 LEU A 13 7.036 -5.865 -1.247 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.455 -5.405 -0.571 1.00 0.38 H new ATOM 214 N SER A 14 4.081 -9.780 1.329 1.00 0.34 N ATOM 215 CA SER A 14 3.636 -11.150 1.507 1.00 0.38 C ATOM 216 C SER A 14 2.301 -11.376 0.803 1.00 0.39 C ATOM 217 O SER A 14 2.041 -12.460 0.291 1.00 0.41 O ATOM 218 CB SER A 14 3.521 -11.476 2.996 1.00 0.45 C ATOM 219 OG SER A 14 2.611 -10.608 3.647 1.00 1.14 O ATOM 0 H SER A 14 4.109 -9.231 2.188 1.00 0.34 H new ATOM 0 HA SER A 14 4.373 -11.817 1.060 1.00 0.38 H new ATOM 0 HB2 SER A 14 3.193 -12.508 3.120 1.00 0.45 H new ATOM 0 HB3 SER A 14 4.502 -11.395 3.464 1.00 0.45 H new ATOM 0 HG SER A 14 2.436 -10.937 4.553 1.00 1.14 H new ATOM 225 N TYR A 15 1.471 -10.336 0.760 1.00 0.42 N ATOM 226 CA TYR A 15 0.168 -10.415 0.102 1.00 0.47 C ATOM 227 C TYR A 15 0.344 -10.698 -1.386 1.00 0.45 C ATOM 228 O TYR A 15 -0.467 -11.392 -2.001 1.00 0.52 O ATOM 229 CB TYR A 15 -0.611 -9.110 0.308 1.00 0.55 C ATOM 230 CG TYR A 15 -1.993 -9.105 -0.310 1.00 0.66 C ATOM 231 CD1 TYR A 15 -3.016 -9.880 0.223 1.00 0.79 C ATOM 232 CD2 TYR A 15 -2.277 -8.320 -1.422 1.00 0.78 C ATOM 233 CE1 TYR A 15 -4.281 -9.873 -0.336 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.537 -8.309 -1.984 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.535 -9.087 -1.438 1.00 1.02 C ATOM 236 OH TYR A 15 -5.793 -9.074 -1.997 1.00 1.20 O ATOM 0 H TYR A 15 1.678 -9.427 1.174 1.00 0.42 H new ATOM 0 HA TYR A 15 -0.399 -11.233 0.547 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.703 -8.921 1.377 1.00 0.55 H new ATOM 0 HB3 TYR A 15 -0.035 -8.286 -0.113 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.820 -10.497 1.087 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -1.498 -7.709 -1.853 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -5.066 -10.481 0.090 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -3.740 -7.694 -2.848 1.00 0.94 H new ATOM 0 HH TYR A 15 -5.803 -8.467 -2.766 1.00 1.20 H new ATOM 246 N LYS A 16 1.418 -10.168 -1.951 1.00 0.40 N ATOM 247 CA LYS A 16 1.732 -10.395 -3.350 1.00 0.41 C ATOM 248 C LYS A 16 2.382 -11.761 -3.535 1.00 0.35 C ATOM 249 O LYS A 16 1.903 -12.577 -4.323 1.00 0.39 O ATOM 250 CB LYS A 16 2.646 -9.291 -3.885 1.00 0.49 C ATOM 251 CG LYS A 16 1.919 -8.004 -4.260 1.00 0.90 C ATOM 252 CD LYS A 16 1.043 -8.205 -5.489 1.00 0.83 C ATOM 253 CE LYS A 16 0.548 -6.881 -6.057 1.00 1.35 C ATOM 254 NZ LYS A 16 -0.408 -6.195 -5.148 1.00 1.39 N ATOM 0 H LYS A 16 2.088 -9.576 -1.459 1.00 0.40 H new ATOM 0 HA LYS A 16 0.802 -10.374 -3.917 1.00 0.41 H new ATOM 0 HB2 LYS A 16 3.400 -9.063 -3.132 1.00 0.49 H new ATOM 0 HB3 LYS A 16 3.174 -9.665 -4.762 1.00 0.49 H new ATOM 0 HG2 LYS A 16 1.305 -7.673 -3.423 1.00 0.90 H new ATOM 0 HG3 LYS A 16 2.646 -7.215 -4.453 1.00 0.90 H new ATOM 0 HD2 LYS A 16 1.607 -8.740 -6.253 1.00 0.83 H new ATOM 0 HD3 LYS A 16 0.189 -8.830 -5.228 1.00 0.83 H new ATOM 0 HE2 LYS A 16 1.400 -6.228 -6.243 1.00 1.35 H new ATOM 0 HE3 LYS A 16 0.067 -7.059 -7.019 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 -0.715 -5.300 -5.579 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 -1.235 -6.805 -4.990 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 0.057 -6.000 -4.239 1.00 1.39 H new ATOM 268 N LEU A 17 3.455 -12.009 -2.791 1.00 0.30 N ATOM 269 CA LEU A 17 4.182 -13.274 -2.864 1.00 0.27 C ATOM 270 C LEU A 17 3.267 -14.470 -2.636 1.00 0.31 C ATOM 271 O LEU A 17 3.372 -15.477 -3.336 1.00 0.32 O ATOM 272 CB LEU A 17 5.306 -13.295 -1.829 1.00 0.25 C ATOM 273 CG LEU A 17 6.453 -12.335 -2.109 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.421 -12.329 -0.947 1.00 0.29 C ATOM 275 CD2 LEU A 17 7.166 -12.722 -3.387 1.00 0.25 C ATOM 0 H LEU A 17 3.845 -11.343 -2.123 1.00 0.30 H new ATOM 0 HA LEU A 17 4.598 -13.351 -3.869 1.00 0.27 H new ATOM 0 HB2 LEU A 17 4.885 -13.059 -0.852 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.705 -14.307 -1.768 1.00 0.25 H new ATOM 0 HG LEU A 17 6.047 -11.331 -2.232 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.238 -11.639 -1.158 1.00 0.29 H new ATOM 0 HD12 LEU A 17 6.902 -12.012 -0.043 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.822 -13.332 -0.802 1.00 0.29 H new ATOM 0 HD21 LEU A 17 7.984 -12.025 -3.573 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.565 -13.732 -3.290 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.464 -12.688 -4.220 1.00 0.25 H new ATOM 287 N SER A 18 2.364 -14.350 -1.672 1.00 0.37 N ATOM 288 CA SER A 18 1.472 -15.446 -1.313 1.00 0.44 C ATOM 289 C SER A 18 0.583 -15.835 -2.496 1.00 0.47 C ATOM 290 O SER A 18 0.321 -17.018 -2.722 1.00 0.51 O ATOM 291 CB SER A 18 0.618 -15.054 -0.100 1.00 0.54 C ATOM 292 OG SER A 18 -0.232 -16.113 0.304 1.00 1.26 O ATOM 0 H SER A 18 2.229 -13.501 -1.122 1.00 0.37 H new ATOM 0 HA SER A 18 2.078 -16.313 -1.049 1.00 0.44 H new ATOM 0 HB2 SER A 18 1.269 -14.773 0.728 1.00 0.54 H new ATOM 0 HB3 SER A 18 0.017 -14.178 -0.345 1.00 0.54 H new ATOM 0 HG SER A 18 -0.761 -15.831 1.079 1.00 1.26 H new ATOM 298 N GLN A 19 0.137 -14.846 -3.264 1.00 0.48 N ATOM 299 CA GLN A 19 -0.701 -15.117 -4.425 1.00 0.53 C ATOM 300 C GLN A 19 0.167 -15.561 -5.601 1.00 0.48 C ATOM 301 O GLN A 19 -0.308 -16.193 -6.543 1.00 0.55 O ATOM 302 CB GLN A 19 -1.525 -13.881 -4.793 1.00 0.59 C ATOM 303 CG GLN A 19 -2.484 -14.100 -5.953 1.00 0.71 C ATOM 304 CD GLN A 19 -3.341 -12.882 -6.235 1.00 1.06 C ATOM 305 OE1 GLN A 19 -4.430 -12.736 -5.682 1.00 1.72 O ATOM 306 NE2 GLN A 19 -2.855 -11.995 -7.092 1.00 1.65 N ATOM 0 H GLN A 19 0.340 -13.859 -3.105 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.394 -15.922 -4.180 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -2.094 -13.563 -3.919 1.00 0.59 H new ATOM 0 HB3 GLN A 19 -0.846 -13.066 -5.045 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -1.915 -14.355 -6.847 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -3.129 -14.951 -5.732 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -1.947 -12.153 -7.530 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -3.389 -11.155 -7.314 1.00 1.65 H new ATOM 315 N LYS A 20 1.449 -15.232 -5.524 1.00 0.41 N ATOM 316 CA LYS A 20 2.417 -15.663 -6.526 1.00 0.40 C ATOM 317 C LYS A 20 2.874 -17.094 -6.248 1.00 0.44 C ATOM 318 O LYS A 20 3.651 -17.663 -7.009 1.00 0.48 O ATOM 319 CB LYS A 20 3.625 -14.719 -6.544 1.00 0.36 C ATOM 320 CG LYS A 20 3.319 -13.323 -7.073 1.00 0.68 C ATOM 321 CD LYS A 20 3.182 -13.311 -8.591 1.00 0.61 C ATOM 322 CE LYS A 20 2.861 -11.919 -9.124 1.00 1.06 C ATOM 323 NZ LYS A 20 1.482 -11.484 -8.777 1.00 1.87 N ATOM 0 H LYS A 20 1.845 -14.665 -4.774 1.00 0.41 H new ATOM 0 HA LYS A 20 1.935 -15.634 -7.503 1.00 0.40 H new ATOM 0 HB2 LYS A 20 4.020 -14.633 -5.532 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.410 -15.163 -7.156 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.397 -12.957 -6.622 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.113 -12.639 -6.774 1.00 0.68 H new ATOM 0 HD2 LYS A 20 4.108 -13.667 -9.042 1.00 0.61 H new ATOM 0 HD3 LYS A 20 2.395 -14.004 -8.890 1.00 0.61 H new ATOM 0 HE2 LYS A 20 3.577 -11.204 -8.720 1.00 1.06 H new ATOM 0 HE3 LYS A 20 2.980 -11.911 -10.207 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 1.287 -10.562 -9.218 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 0.798 -12.186 -9.126 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 1.394 -11.399 -7.744 1.00 1.87 H new ATOM 337 N GLY A 21 2.394 -17.666 -5.149 1.00 0.48 N ATOM 338 CA GLY A 21 2.702 -19.050 -4.837 1.00 0.54 C ATOM 339 C GLY A 21 3.799 -19.207 -3.800 1.00 0.53 C ATOM 340 O GLY A 21 4.089 -20.323 -3.369 1.00 0.67 O ATOM 0 H GLY A 21 1.797 -17.196 -4.468 1.00 0.48 H new ATOM 0 HA2 GLY A 21 1.799 -19.543 -4.476 1.00 0.54 H new ATOM 0 HA3 GLY A 21 3.001 -19.562 -5.751 1.00 0.54 H new ATOM 344 N TYR A 22 4.401 -18.104 -3.380 1.00 0.43 N ATOM 345 CA TYR A 22 5.513 -18.168 -2.437 1.00 0.42 C ATOM 346 C TYR A 22 5.025 -17.929 -1.013 1.00 0.43 C ATOM 347 O TYR A 22 4.061 -17.193 -0.795 1.00 0.46 O ATOM 348 CB TYR A 22 6.590 -17.133 -2.792 1.00 0.40 C ATOM 349 CG TYR A 22 7.103 -17.230 -4.213 1.00 0.48 C ATOM 350 CD1 TYR A 22 7.462 -18.452 -4.773 1.00 0.65 C ATOM 351 CD2 TYR A 22 7.226 -16.091 -4.999 1.00 0.47 C ATOM 352 CE1 TYR A 22 7.930 -18.535 -6.071 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.693 -16.166 -6.298 1.00 0.57 C ATOM 354 CZ TYR A 22 8.044 -17.389 -6.829 1.00 0.69 C ATOM 355 OH TYR A 22 8.512 -17.467 -8.122 1.00 0.81 O ATOM 0 H TYR A 22 4.143 -17.161 -3.672 1.00 0.43 H new ATOM 0 HA TYR A 22 5.947 -19.166 -2.502 1.00 0.42 H new ATOM 0 HB2 TYR A 22 6.184 -16.134 -2.632 1.00 0.40 H new ATOM 0 HB3 TYR A 22 7.429 -17.250 -2.106 1.00 0.40 H new ATOM 0 HD1 TYR A 22 7.373 -19.352 -4.183 1.00 0.65 H new ATOM 0 HD2 TYR A 22 6.952 -15.131 -4.588 1.00 0.47 H new ATOM 0 HE1 TYR A 22 8.205 -19.492 -6.489 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.783 -15.270 -6.895 1.00 0.57 H new ATOM 0 HH TYR A 22 8.530 -16.571 -8.518 1.00 0.81 H new ATOM 365 N SER A 23 5.684 -18.554 -0.050 1.00 0.45 N ATOM 366 CA SER A 23 5.349 -18.366 1.352 1.00 0.49 C ATOM 367 C SER A 23 6.305 -17.359 1.986 1.00 0.43 C ATOM 368 O SER A 23 7.521 -17.453 1.812 1.00 0.44 O ATOM 369 CB SER A 23 5.411 -19.702 2.098 1.00 0.59 C ATOM 370 OG SER A 23 5.046 -19.551 3.460 1.00 1.41 O ATOM 0 H SER A 23 6.457 -19.198 -0.215 1.00 0.45 H new ATOM 0 HA SER A 23 4.333 -17.979 1.422 1.00 0.49 H new ATOM 0 HB2 SER A 23 4.745 -20.419 1.619 1.00 0.59 H new ATOM 0 HB3 SER A 23 6.420 -20.110 2.033 1.00 0.59 H new ATOM 0 HG SER A 23 5.094 -20.420 3.910 1.00 1.41 H new ATOM 376 N TRP A 24 5.760 -16.407 2.731 1.00 0.43 N ATOM 377 CA TRP A 24 6.566 -15.339 3.309 1.00 0.41 C ATOM 378 C TRP A 24 7.335 -15.841 4.525 1.00 0.47 C ATOM 379 O TRP A 24 8.516 -15.528 4.697 1.00 0.53 O ATOM 380 CB TRP A 24 5.685 -14.142 3.695 1.00 0.44 C ATOM 381 CG TRP A 24 6.438 -13.050 4.401 1.00 0.46 C ATOM 382 CD1 TRP A 24 6.457 -12.808 5.746 1.00 0.55 C ATOM 383 CD2 TRP A 24 7.287 -12.059 3.803 1.00 0.43 C ATOM 384 NE1 TRP A 24 7.267 -11.737 6.019 1.00 0.57 N ATOM 385 CE2 TRP A 24 7.786 -11.257 4.846 1.00 0.50 C ATOM 386 CE3 TRP A 24 7.676 -11.773 2.491 1.00 0.39 C ATOM 387 CZ2 TRP A 24 8.651 -10.190 4.616 1.00 0.51 C ATOM 388 CZ3 TRP A 24 8.534 -10.713 2.266 1.00 0.43 C ATOM 389 CH2 TRP A 24 9.014 -9.933 3.324 1.00 0.48 C ATOM 0 H TRP A 24 4.765 -16.352 2.949 1.00 0.43 H new ATOM 0 HA TRP A 24 7.284 -15.013 2.556 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.226 -13.733 2.795 1.00 0.44 H new ATOM 0 HB3 TRP A 24 4.875 -14.488 4.337 1.00 0.44 H new ATOM 0 HD1 TRP A 24 5.913 -13.377 6.485 1.00 0.55 H new ATOM 0 HE1 TRP A 24 7.454 -11.358 6.947 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.312 -12.370 1.668 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 9.022 -9.586 5.431 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 8.839 -10.483 1.256 1.00 0.43 H new ATOM 0 HH2 TRP A 24 9.684 -9.112 3.115 1.00 0.48 H new ATOM 400 N SER A 25 6.672 -16.635 5.357 1.00 0.54 N ATOM 401 CA SER A 25 7.293 -17.166 6.564 1.00 0.63 C ATOM 402 C SER A 25 8.464 -18.087 6.219 1.00 0.63 C ATOM 403 O SER A 25 9.364 -18.296 7.032 1.00 0.75 O ATOM 404 CB SER A 25 6.253 -17.917 7.399 1.00 0.75 C ATOM 405 OG SER A 25 5.565 -18.874 6.612 1.00 1.20 O ATOM 0 H SER A 25 5.704 -16.925 5.218 1.00 0.54 H new ATOM 0 HA SER A 25 7.682 -16.331 7.146 1.00 0.63 H new ATOM 0 HB2 SER A 25 6.743 -18.414 8.236 1.00 0.75 H new ATOM 0 HB3 SER A 25 5.541 -17.209 7.822 1.00 0.75 H new ATOM 0 HG SER A 25 4.907 -19.342 7.167 1.00 1.20 H new ATOM 411 N GLN A 26 8.459 -18.607 4.998 1.00 0.61 N ATOM 412 CA GLN A 26 9.491 -19.531 4.552 1.00 0.73 C ATOM 413 C GLN A 26 10.795 -18.788 4.244 1.00 0.79 C ATOM 414 O GLN A 26 11.876 -19.374 4.289 1.00 0.93 O ATOM 415 CB GLN A 26 9.011 -20.293 3.307 1.00 0.80 C ATOM 416 CG GLN A 26 9.946 -21.410 2.871 1.00 1.25 C ATOM 417 CD GLN A 26 9.551 -22.022 1.535 1.00 1.53 C ATOM 418 OE1 GLN A 26 8.377 -22.038 1.165 1.00 1.91 O ATOM 419 NE2 GLN A 26 10.529 -22.532 0.800 1.00 2.26 N ATOM 0 H GLN A 26 7.747 -18.402 4.297 1.00 0.61 H new ATOM 0 HA GLN A 26 9.685 -20.242 5.355 1.00 0.73 H new ATOM 0 HB2 GLN A 26 8.026 -20.714 3.508 1.00 0.80 H new ATOM 0 HB3 GLN A 26 8.894 -19.588 2.484 1.00 0.80 H new ATOM 0 HG2 GLN A 26 10.962 -21.021 2.801 1.00 1.25 H new ATOM 0 HG3 GLN A 26 9.955 -22.189 3.634 1.00 1.25 H new ATOM 0 HE21 GLN A 26 11.491 -22.501 1.139 1.00 2.26 H new ATOM 0 HE22 GLN A 26 10.320 -22.955 -0.104 1.00 2.26 H new ATOM 428 N PHE A 27 10.696 -17.496 3.941 1.00 0.76 N ATOM 429 CA PHE A 27 11.877 -16.718 3.573 1.00 0.92 C ATOM 430 C PHE A 27 12.201 -15.689 4.653 1.00 0.98 C ATOM 431 O PHE A 27 13.131 -14.894 4.512 1.00 1.18 O ATOM 432 CB PHE A 27 11.667 -16.015 2.224 1.00 0.99 C ATOM 433 CG PHE A 27 11.209 -16.935 1.125 1.00 0.97 C ATOM 434 CD1 PHE A 27 11.839 -18.150 0.907 1.00 1.07 C ATOM 435 CD2 PHE A 27 10.149 -16.581 0.307 1.00 0.93 C ATOM 436 CE1 PHE A 27 11.417 -18.994 -0.102 1.00 1.13 C ATOM 437 CE2 PHE A 27 9.724 -17.421 -0.703 1.00 0.96 C ATOM 438 CZ PHE A 27 10.359 -18.629 -0.908 1.00 1.05 C ATOM 0 H PHE A 27 9.822 -16.970 3.942 1.00 0.76 H new ATOM 0 HA PHE A 27 12.718 -17.406 3.480 1.00 0.92 H new ATOM 0 HB2 PHE A 27 10.932 -15.220 2.350 1.00 0.99 H new ATOM 0 HB3 PHE A 27 12.601 -15.541 1.923 1.00 0.99 H new ATOM 0 HD1 PHE A 27 12.670 -18.440 1.533 1.00 1.07 H new ATOM 0 HD2 PHE A 27 9.649 -15.636 0.461 1.00 0.93 H new ATOM 0 HE1 PHE A 27 11.915 -19.939 -0.260 1.00 1.13 H new ATOM 0 HE2 PHE A 27 8.895 -17.133 -1.332 1.00 0.96 H new ATOM 0 HZ PHE A 27 10.028 -19.287 -1.698 1.00 1.05 H new ATOM 448 N SER A 28 11.428 -15.709 5.730 1.00 0.93 N ATOM 449 CA SER A 28 11.636 -14.788 6.834 1.00 1.07 C ATOM 450 C SER A 28 12.377 -15.471 7.973 1.00 1.04 C ATOM 451 O SER A 28 12.394 -16.701 8.064 1.00 1.02 O ATOM 452 CB SER A 28 10.292 -14.254 7.326 1.00 1.21 C ATOM 453 OG SER A 28 9.637 -13.524 6.304 1.00 1.73 O ATOM 0 H SER A 28 10.650 -16.355 5.861 1.00 0.93 H new ATOM 0 HA SER A 28 12.244 -13.955 6.481 1.00 1.07 H new ATOM 0 HB2 SER A 28 9.662 -15.083 7.648 1.00 1.21 H new ATOM 0 HB3 SER A 28 10.446 -13.614 8.195 1.00 1.21 H new ATOM 0 HG SER A 28 9.222 -14.147 5.672 1.00 1.73 H new ATOM 459 N ASP A 29 12.994 -14.679 8.837 1.00 1.25 N ATOM 460 CA ASP A 29 13.679 -15.218 9.998 1.00 1.33 C ATOM 461 C ASP A 29 12.700 -15.337 11.150 1.00 1.40 C ATOM 462 O ASP A 29 12.304 -14.339 11.750 1.00 1.62 O ATOM 463 CB ASP A 29 14.862 -14.338 10.411 1.00 1.63 C ATOM 464 CG ASP A 29 15.913 -14.219 9.330 1.00 1.96 C ATOM 465 OD1 ASP A 29 16.696 -15.177 9.138 1.00 2.43 O ATOM 466 OD2 ASP A 29 15.971 -13.162 8.670 1.00 2.16 O ATOM 0 H ASP A 29 13.033 -13.663 8.755 1.00 1.25 H new ATOM 0 HA ASP A 29 14.070 -16.202 9.738 1.00 1.33 H new ATOM 0 HB2 ASP A 29 14.497 -13.343 10.666 1.00 1.63 H new ATOM 0 HB3 ASP A 29 15.319 -14.751 11.311 1.00 1.63 H new ATOM 471 N VAL A 30 12.283 -16.555 11.428 1.00 1.40 N ATOM 472 CA VAL A 30 11.330 -16.810 12.490 1.00 1.63 C ATOM 473 C VAL A 30 12.063 -17.231 13.757 1.00 1.66 C ATOM 474 O VAL A 30 12.123 -16.481 14.729 1.00 1.79 O ATOM 475 CB VAL A 30 10.335 -17.908 12.072 1.00 1.89 C ATOM 476 CG1 VAL A 30 9.226 -18.053 13.100 1.00 2.24 C ATOM 477 CG2 VAL A 30 9.758 -17.609 10.697 1.00 1.95 C ATOM 0 H VAL A 30 12.591 -17.390 10.930 1.00 1.40 H new ATOM 0 HA VAL A 30 10.775 -15.892 12.684 1.00 1.63 H new ATOM 0 HB VAL A 30 10.873 -18.854 12.021 1.00 1.89 H new ATOM 0 HG11 VAL A 30 8.536 -18.835 12.783 1.00 2.24 H new ATOM 0 HG12 VAL A 30 9.657 -18.319 14.065 1.00 2.24 H new ATOM 0 HG13 VAL A 30 8.688 -17.109 13.191 1.00 2.24 H new ATOM 0 HG21 VAL A 30 9.057 -18.395 10.418 1.00 1.95 H new ATOM 0 HG22 VAL A 30 9.238 -16.651 10.721 1.00 1.95 H new ATOM 0 HG23 VAL A 30 10.565 -17.566 9.965 1.00 1.95 H new ATOM 487 N GLU A 31 12.628 -18.429 13.735 1.00 1.67 N ATOM 488 CA GLU A 31 13.370 -18.946 14.875 1.00 1.83 C ATOM 489 C GLU A 31 14.642 -18.132 15.098 1.00 1.78 C ATOM 490 O GLU A 31 15.012 -17.834 16.233 1.00 1.99 O ATOM 491 CB GLU A 31 13.736 -20.410 14.647 1.00 2.07 C ATOM 492 CG GLU A 31 14.371 -21.077 15.854 1.00 2.55 C ATOM 493 CD GLU A 31 15.074 -22.368 15.500 1.00 2.93 C ATOM 494 OE1 GLU A 31 14.425 -23.272 14.931 1.00 3.27 O ATOM 495 OE2 GLU A 31 16.282 -22.484 15.790 1.00 3.42 O ATOM 0 H GLU A 31 12.586 -19.063 12.937 1.00 1.67 H new ATOM 0 HA GLU A 31 12.737 -18.867 15.759 1.00 1.83 H new ATOM 0 HB2 GLU A 31 12.837 -20.961 14.370 1.00 2.07 H new ATOM 0 HB3 GLU A 31 14.423 -20.476 13.803 1.00 2.07 H new ATOM 0 HG2 GLU A 31 15.085 -20.391 16.310 1.00 2.55 H new ATOM 0 HG3 GLU A 31 13.602 -21.279 16.600 1.00 2.55 H new ATOM 502 N GLU A 32 15.292 -17.755 14.003 1.00 1.61 N ATOM 503 CA GLU A 32 16.571 -17.051 14.072 1.00 1.65 C ATOM 504 C GLU A 32 16.376 -15.552 14.288 1.00 1.75 C ATOM 505 O GLU A 32 17.337 -14.783 14.276 1.00 2.00 O ATOM 506 CB GLU A 32 17.386 -17.300 12.801 1.00 1.54 C ATOM 507 CG GLU A 32 17.745 -18.761 12.589 1.00 1.79 C ATOM 508 CD GLU A 32 18.553 -18.982 11.329 1.00 2.33 C ATOM 509 OE1 GLU A 32 17.949 -19.136 10.249 1.00 3.01 O ATOM 510 OE2 GLU A 32 19.801 -18.994 11.410 1.00 2.57 O ATOM 0 H GLU A 32 14.956 -17.924 13.055 1.00 1.61 H new ATOM 0 HA GLU A 32 17.118 -17.444 14.929 1.00 1.65 H new ATOM 0 HB2 GLU A 32 16.820 -16.944 11.940 1.00 1.54 H new ATOM 0 HB3 GLU A 32 18.302 -16.711 12.845 1.00 1.54 H new ATOM 0 HG2 GLU A 32 18.311 -19.121 13.448 1.00 1.79 H new ATOM 0 HG3 GLU A 32 16.831 -19.353 12.539 1.00 1.79 H new ATOM 517 N ASN A 33 15.132 -15.145 14.490 1.00 1.77 N ATOM 518 CA ASN A 33 14.812 -13.752 14.771 1.00 2.01 C ATOM 519 C ASN A 33 13.421 -13.657 15.379 1.00 1.89 C ATOM 520 O ASN A 33 12.417 -13.636 14.666 1.00 2.13 O ATOM 521 CB ASN A 33 14.899 -12.896 13.500 1.00 2.35 C ATOM 522 CG ASN A 33 14.601 -11.428 13.756 1.00 3.05 C ATOM 523 OD1 ASN A 33 14.799 -10.918 14.861 1.00 3.61 O ATOM 524 ND2 ASN A 33 14.147 -10.727 12.727 1.00 3.58 N ATOM 0 H ASN A 33 14.322 -15.764 14.464 1.00 1.77 H new ATOM 0 HA ASN A 33 15.543 -13.367 15.482 1.00 2.01 H new ATOM 0 HB2 ASN A 33 15.897 -12.990 13.072 1.00 2.35 H new ATOM 0 HB3 ASN A 33 14.197 -13.281 12.760 1.00 2.35 H new ATOM 0 HD21 ASN A 33 13.950 -9.732 12.835 1.00 3.58 H new ATOM 0 HD22 ASN A 33 13.995 -11.182 11.827 1.00 3.58 H new ATOM 531 N ARG A 34 13.366 -13.629 16.703 1.00 1.88 N ATOM 532 CA ARG A 34 12.098 -13.607 17.418 1.00 1.96 C ATOM 533 C ARG A 34 11.418 -12.258 17.239 1.00 1.98 C ATOM 534 O ARG A 34 11.824 -11.260 17.833 1.00 2.34 O ATOM 535 CB ARG A 34 12.298 -13.914 18.911 1.00 2.42 C ATOM 536 CG ARG A 34 12.551 -15.387 19.222 1.00 2.86 C ATOM 537 CD ARG A 34 13.868 -15.881 18.641 1.00 3.54 C ATOM 538 NE ARG A 34 15.009 -15.141 19.174 1.00 3.97 N ATOM 539 CZ ARG A 34 16.258 -15.265 18.725 1.00 4.63 C ATOM 540 NH1 ARG A 34 16.538 -16.106 17.736 1.00 4.92 N ATOM 541 NH2 ARG A 34 17.229 -14.549 19.274 1.00 5.33 N ATOM 0 H ARG A 34 14.189 -13.621 17.306 1.00 1.88 H new ATOM 0 HA ARG A 34 11.458 -14.383 16.999 1.00 1.96 H new ATOM 0 HB2 ARG A 34 13.139 -13.327 19.281 1.00 2.42 H new ATOM 0 HB3 ARG A 34 11.415 -13.586 19.459 1.00 2.42 H new ATOM 0 HG2 ARG A 34 12.555 -15.533 20.302 1.00 2.86 H new ATOM 0 HG3 ARG A 34 11.733 -15.986 18.823 1.00 2.86 H new ATOM 0 HD2 ARG A 34 13.988 -16.942 18.862 1.00 3.54 H new ATOM 0 HD3 ARG A 34 13.846 -15.782 17.556 1.00 3.54 H new ATOM 0 HE ARG A 34 14.839 -14.488 19.939 1.00 3.97 H new ATOM 0 HH11 ARG A 34 15.795 -16.663 17.314 1.00 4.92 H new ATOM 0 HH12 ARG A 34 17.496 -16.195 17.398 1.00 4.92 H new ATOM 0 HH21 ARG A 34 17.019 -13.906 20.037 1.00 5.33 H new ATOM 0 HH22 ARG A 34 18.186 -14.641 18.933 1.00 5.33 H new ATOM 555 N THR A 35 10.402 -12.228 16.392 1.00 1.80 N ATOM 556 CA THR A 35 9.694 -10.998 16.095 1.00 1.96 C ATOM 557 C THR A 35 8.244 -11.071 16.557 1.00 1.86 C ATOM 558 O THR A 35 7.394 -11.671 15.896 1.00 2.02 O ATOM 559 CB THR A 35 9.748 -10.691 14.587 1.00 2.32 C ATOM 560 OG1 THR A 35 9.658 -11.908 13.835 1.00 2.88 O ATOM 561 CG2 THR A 35 11.032 -9.961 14.226 1.00 2.78 C ATOM 0 H THR A 35 10.049 -13.047 15.897 1.00 1.80 H new ATOM 0 HA THR A 35 10.189 -10.193 16.639 1.00 1.96 H new ATOM 0 HB THR A 35 8.903 -10.048 14.341 1.00 2.32 H new ATOM 0 HG1 THR A 35 9.692 -11.704 12.877 1.00 2.88 H new ATOM 0 HG21 THR A 35 11.045 -9.756 13.156 1.00 2.78 H new ATOM 0 HG22 THR A 35 11.083 -9.021 14.776 1.00 2.78 H new ATOM 0 HG23 THR A 35 11.889 -10.582 14.487 1.00 2.78 H new ATOM 569 N GLU A 36 7.979 -10.496 17.718 1.00 1.87 N ATOM 570 CA GLU A 36 6.624 -10.393 18.227 1.00 1.94 C ATOM 571 C GLU A 36 5.916 -9.219 17.572 1.00 1.78 C ATOM 572 O GLU A 36 6.138 -8.065 17.939 1.00 1.92 O ATOM 573 CB GLU A 36 6.629 -10.223 19.748 1.00 2.27 C ATOM 574 CG GLU A 36 7.145 -11.437 20.496 1.00 2.71 C ATOM 575 CD GLU A 36 6.328 -12.677 20.213 1.00 3.32 C ATOM 576 OE1 GLU A 36 5.151 -12.729 20.628 1.00 3.86 O ATOM 577 OE2 GLU A 36 6.853 -13.603 19.563 1.00 3.69 O ATOM 0 H GLU A 36 8.690 -10.092 18.328 1.00 1.87 H new ATOM 0 HA GLU A 36 6.091 -11.313 17.987 1.00 1.94 H new ATOM 0 HB2 GLU A 36 7.243 -9.360 20.006 1.00 2.27 H new ATOM 0 HB3 GLU A 36 5.615 -10.004 20.084 1.00 2.27 H new ATOM 0 HG2 GLU A 36 8.183 -11.618 20.218 1.00 2.71 H new ATOM 0 HG3 GLU A 36 7.133 -11.233 21.567 1.00 2.71 H new ATOM 584 N ALA A 37 5.095 -9.517 16.577 1.00 1.73 N ATOM 585 CA ALA A 37 4.343 -8.493 15.883 1.00 1.70 C ATOM 586 C ALA A 37 3.055 -8.181 16.635 1.00 1.55 C ATOM 587 O ALA A 37 2.154 -9.020 16.713 1.00 1.78 O ATOM 588 CB ALA A 37 4.042 -8.936 14.463 1.00 2.06 C ATOM 0 H ALA A 37 4.935 -10.464 16.234 1.00 1.73 H new ATOM 0 HA ALA A 37 4.943 -7.584 15.840 1.00 1.70 H new ATOM 0 HB1 ALA A 37 3.476 -8.158 13.951 1.00 2.06 H new ATOM 0 HB2 ALA A 37 4.977 -9.114 13.931 1.00 2.06 H new ATOM 0 HB3 ALA A 37 3.457 -9.855 14.485 1.00 2.06 H new ATOM 594 N PRO A 38 2.950 -6.970 17.201 1.00 1.53 N ATOM 595 CA PRO A 38 1.795 -6.566 18.004 1.00 1.68 C ATOM 596 C PRO A 38 0.567 -6.329 17.141 1.00 1.55 C ATOM 597 O PRO A 38 0.651 -6.346 15.912 1.00 1.51 O ATOM 598 CB PRO A 38 2.244 -5.254 18.670 1.00 2.02 C ATOM 599 CG PRO A 38 3.699 -5.116 18.360 1.00 2.11 C ATOM 600 CD PRO A 38 3.935 -5.888 17.097 1.00 1.77 C ATOM 0 HA PRO A 38 1.509 -7.335 18.721 1.00 1.68 H new ATOM 0 HB2 PRO A 38 1.680 -4.406 18.282 1.00 2.02 H new ATOM 0 HB3 PRO A 38 2.075 -5.284 19.746 1.00 2.02 H new ATOM 0 HG2 PRO A 38 3.972 -4.068 18.232 1.00 2.11 H new ATOM 0 HG3 PRO A 38 4.309 -5.507 19.174 1.00 2.11 H new ATOM 0 HD2 PRO A 38 3.773 -5.275 16.210 1.00 1.77 H new ATOM 0 HD3 PRO A 38 4.954 -6.270 17.039 1.00 1.77 H new ATOM 608 N GLU A 39 -0.569 -6.116 17.780 1.00 1.87 N ATOM 609 CA GLU A 39 -1.798 -5.853 17.054 1.00 1.91 C ATOM 610 C GLU A 39 -1.837 -4.399 16.594 1.00 1.53 C ATOM 611 O GLU A 39 -2.100 -3.483 17.374 1.00 1.78 O ATOM 612 CB GLU A 39 -3.022 -6.205 17.909 1.00 2.57 C ATOM 613 CG GLU A 39 -3.064 -5.519 19.265 1.00 3.24 C ATOM 614 CD GLU A 39 -4.246 -5.964 20.094 1.00 3.67 C ATOM 615 OE1 GLU A 39 -5.381 -5.538 19.796 1.00 4.19 O ATOM 616 OE2 GLU A 39 -4.050 -6.756 21.041 1.00 3.88 O ATOM 0 H GLU A 39 -0.666 -6.120 18.795 1.00 1.87 H new ATOM 0 HA GLU A 39 -1.825 -6.488 16.169 1.00 1.91 H new ATOM 0 HB2 GLU A 39 -3.923 -5.942 17.355 1.00 2.57 H new ATOM 0 HB3 GLU A 39 -3.044 -7.284 18.061 1.00 2.57 H new ATOM 0 HG2 GLU A 39 -2.142 -5.732 19.806 1.00 3.24 H new ATOM 0 HG3 GLU A 39 -3.108 -4.439 19.123 1.00 3.24 H new ATOM 623 N GLY A 40 -1.526 -4.193 15.325 1.00 1.33 N ATOM 624 CA GLY A 40 -1.514 -2.861 14.772 1.00 1.39 C ATOM 625 C GLY A 40 -2.908 -2.365 14.463 1.00 1.23 C ATOM 626 O GLY A 40 -3.423 -2.588 13.367 1.00 1.20 O ATOM 0 H GLY A 40 -1.280 -4.932 14.666 1.00 1.33 H new ATOM 0 HA2 GLY A 40 -1.034 -2.180 15.476 1.00 1.39 H new ATOM 0 HA3 GLY A 40 -0.915 -2.852 13.861 1.00 1.39 H new ATOM 630 N THR A 41 -3.516 -1.699 15.434 1.00 1.33 N ATOM 631 CA THR A 41 -4.858 -1.158 15.284 1.00 1.34 C ATOM 632 C THR A 41 -4.923 -0.223 14.075 1.00 1.09 C ATOM 633 O THR A 41 -5.667 -0.472 13.123 1.00 1.05 O ATOM 634 CB THR A 41 -5.275 -0.390 16.553 1.00 1.62 C ATOM 635 OG1 THR A 41 -4.949 -1.163 17.721 1.00 1.89 O ATOM 636 CG2 THR A 41 -6.767 -0.090 16.541 1.00 1.79 C ATOM 0 H THR A 41 -3.094 -1.519 16.345 1.00 1.33 H new ATOM 0 HA THR A 41 -5.545 -1.990 15.130 1.00 1.34 H new ATOM 0 HB THR A 41 -4.731 0.554 16.575 1.00 1.62 H new ATOM 0 HG1 THR A 41 -5.215 -0.669 18.525 1.00 1.89 H new ATOM 0 HG21 THR A 41 -7.036 0.453 17.447 1.00 1.79 H new ATOM 0 HG22 THR A 41 -7.009 0.517 15.669 1.00 1.79 H new ATOM 0 HG23 THR A 41 -7.326 -1.025 16.498 1.00 1.79 H new ATOM 644 N GLU A 42 -4.131 0.846 14.115 1.00 1.02 N ATOM 645 CA GLU A 42 -4.068 1.790 13.008 1.00 0.87 C ATOM 646 C GLU A 42 -3.388 1.146 11.804 1.00 0.73 C ATOM 647 O GLU A 42 -3.719 1.454 10.658 1.00 0.63 O ATOM 648 CB GLU A 42 -3.306 3.064 13.396 1.00 1.05 C ATOM 649 CG GLU A 42 -3.879 3.806 14.595 1.00 1.53 C ATOM 650 CD GLU A 42 -3.568 3.131 15.914 1.00 2.12 C ATOM 651 OE1 GLU A 42 -2.396 2.758 16.133 1.00 2.82 O ATOM 652 OE2 GLU A 42 -4.492 2.960 16.733 1.00 2.42 O ATOM 0 H GLU A 42 -3.525 1.078 14.902 1.00 1.02 H new ATOM 0 HA GLU A 42 -5.092 2.063 12.753 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -2.270 2.801 13.610 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -3.293 3.739 12.540 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -3.482 4.821 14.610 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -4.960 3.888 14.481 1.00 1.53 H new ATOM 659 N SER A 43 -2.447 0.246 12.078 1.00 0.79 N ATOM 660 CA SER A 43 -1.700 -0.439 11.029 1.00 0.75 C ATOM 661 C SER A 43 -2.640 -1.177 10.083 1.00 0.67 C ATOM 662 O SER A 43 -2.474 -1.120 8.870 1.00 0.62 O ATOM 663 CB SER A 43 -0.703 -1.428 11.638 1.00 0.94 C ATOM 664 OG SER A 43 0.056 -0.827 12.674 1.00 1.14 O ATOM 0 H SER A 43 -2.183 -0.027 13.025 1.00 0.79 H new ATOM 0 HA SER A 43 -1.155 0.316 10.462 1.00 0.75 H new ATOM 0 HB2 SER A 43 -1.239 -2.291 12.032 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.033 -1.796 10.861 1.00 0.94 H new ATOM 0 HG SER A 43 0.787 -1.426 12.934 1.00 1.14 H new ATOM 670 N GLU A 44 -3.641 -1.849 10.645 1.00 0.72 N ATOM 671 CA GLU A 44 -4.603 -2.601 9.846 1.00 0.73 C ATOM 672 C GLU A 44 -5.342 -1.687 8.869 1.00 0.61 C ATOM 673 O GLU A 44 -5.663 -2.092 7.750 1.00 0.66 O ATOM 674 CB GLU A 44 -5.612 -3.308 10.753 1.00 0.85 C ATOM 675 CG GLU A 44 -6.631 -4.138 9.991 1.00 1.32 C ATOM 676 CD GLU A 44 -7.744 -4.647 10.878 1.00 1.96 C ATOM 677 OE1 GLU A 44 -8.641 -3.851 11.223 1.00 2.98 O ATOM 678 OE2 GLU A 44 -7.740 -5.846 11.219 1.00 1.90 O ATOM 0 H GLU A 44 -3.807 -1.888 11.651 1.00 0.72 H new ATOM 0 HA GLU A 44 -4.050 -3.345 9.273 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -5.075 -3.954 11.447 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -6.136 -2.563 11.351 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -7.057 -3.536 9.188 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -6.128 -4.984 9.523 1.00 1.32 H new ATOM 685 N ALA A 45 -5.583 -0.449 9.285 1.00 0.53 N ATOM 686 CA ALA A 45 -6.332 0.496 8.472 1.00 0.45 C ATOM 687 C ALA A 45 -5.540 0.876 7.232 1.00 0.39 C ATOM 688 O ALA A 45 -6.019 0.735 6.110 1.00 0.39 O ATOM 689 CB ALA A 45 -6.680 1.731 9.281 1.00 0.48 C ATOM 0 H ALA A 45 -5.269 -0.078 10.182 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.259 0.020 8.154 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.240 2.428 8.658 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.286 1.444 10.140 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -5.764 2.209 9.627 1.00 0.48 H new ATOM 695 N VAL A 46 -4.319 1.341 7.444 1.00 0.36 N ATOM 696 CA VAL A 46 -3.446 1.718 6.346 1.00 0.32 C ATOM 697 C VAL A 46 -3.047 0.496 5.522 1.00 0.34 C ATOM 698 O VAL A 46 -2.942 0.569 4.300 1.00 0.35 O ATOM 699 CB VAL A 46 -2.192 2.465 6.851 1.00 0.33 C ATOM 700 CG1 VAL A 46 -1.750 1.946 8.205 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.069 2.342 5.846 1.00 0.34 C ATOM 0 H VAL A 46 -3.910 1.466 8.370 1.00 0.36 H new ATOM 0 HA VAL A 46 -4.004 2.399 5.704 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.450 3.518 6.965 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -0.865 2.492 8.533 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.553 2.088 8.929 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.514 0.885 8.128 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.191 2.873 6.214 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -0.823 1.290 5.702 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.382 2.774 4.896 1.00 0.34 H new ATOM 711 N LYS A 47 -2.845 -0.622 6.196 1.00 0.41 N ATOM 712 CA LYS A 47 -2.534 -1.880 5.523 1.00 0.50 C ATOM 713 C LYS A 47 -3.625 -2.219 4.506 1.00 0.51 C ATOM 714 O LYS A 47 -3.344 -2.725 3.418 1.00 0.59 O ATOM 715 CB LYS A 47 -2.409 -3.008 6.553 1.00 0.63 C ATOM 716 CG LYS A 47 -1.767 -4.273 6.012 1.00 0.84 C ATOM 717 CD LYS A 47 -1.701 -5.353 7.080 1.00 1.45 C ATOM 718 CE LYS A 47 -3.056 -6.003 7.320 1.00 1.93 C ATOM 719 NZ LYS A 47 -3.515 -6.774 6.135 1.00 2.14 N ATOM 0 H LYS A 47 -2.890 -0.689 7.213 1.00 0.41 H new ATOM 0 HA LYS A 47 -1.585 -1.772 4.997 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -1.823 -2.649 7.399 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -3.402 -3.251 6.932 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -2.337 -4.637 5.157 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -0.762 -4.050 5.653 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -0.982 -6.115 6.781 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -1.337 -4.920 8.012 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -2.994 -6.666 8.183 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -3.791 -5.234 7.561 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -3.933 -7.674 6.447 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -4.228 -6.222 5.617 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -2.706 -6.966 5.511 1.00 2.14 H new ATOM 733 N GLN A 48 -4.869 -1.924 4.863 1.00 0.47 N ATOM 734 CA GLN A 48 -5.993 -2.128 3.956 1.00 0.52 C ATOM 735 C GLN A 48 -6.084 -0.985 2.956 1.00 0.48 C ATOM 736 O GLN A 48 -6.444 -1.189 1.798 1.00 0.54 O ATOM 737 CB GLN A 48 -7.307 -2.265 4.732 1.00 0.55 C ATOM 738 CG GLN A 48 -7.574 -3.680 5.223 1.00 0.85 C ATOM 739 CD GLN A 48 -7.850 -4.649 4.086 1.00 1.50 C ATOM 740 OE1 GLN A 48 -7.492 -5.824 4.156 1.00 2.23 O ATOM 741 NE2 GLN A 48 -8.515 -4.173 3.044 1.00 2.02 N ATOM 0 H GLN A 48 -5.125 -1.543 5.774 1.00 0.47 H new ATOM 0 HA GLN A 48 -5.823 -3.056 3.411 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -7.288 -1.589 5.587 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -8.132 -1.948 4.094 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -6.715 -4.031 5.794 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -8.426 -3.670 5.903 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -8.795 -3.192 3.022 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -8.747 -4.787 2.263 1.00 2.02 H new ATOM 750 N ALA A 49 -5.739 0.215 3.409 1.00 0.42 N ATOM 751 CA ALA A 49 -5.717 1.383 2.546 1.00 0.40 C ATOM 752 C ALA A 49 -4.760 1.175 1.382 1.00 0.39 C ATOM 753 O ALA A 49 -5.124 1.375 0.226 1.00 0.42 O ATOM 754 CB ALA A 49 -5.321 2.615 3.341 1.00 0.36 C ATOM 0 H ALA A 49 -5.470 0.402 4.375 1.00 0.42 H new ATOM 0 HA ALA A 49 -6.719 1.532 2.142 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -5.308 3.484 2.683 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -6.041 2.778 4.143 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.329 2.469 3.768 1.00 0.36 H new ATOM 760 N LEU A 50 -3.539 0.751 1.694 1.00 0.38 N ATOM 761 CA LEU A 50 -2.532 0.491 0.669 1.00 0.39 C ATOM 762 C LEU A 50 -2.908 -0.722 -0.168 1.00 0.46 C ATOM 763 O LEU A 50 -2.567 -0.797 -1.346 1.00 0.49 O ATOM 764 CB LEU A 50 -1.142 0.283 1.280 1.00 0.39 C ATOM 765 CG LEU A 50 -0.305 1.554 1.461 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.102 2.258 0.127 1.00 0.31 C ATOM 767 CD2 LEU A 50 -0.952 2.490 2.461 1.00 0.29 C ATOM 0 H LEU A 50 -3.222 0.580 2.648 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.497 1.371 0.027 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.259 -0.196 2.252 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -0.586 -0.410 0.648 1.00 0.39 H new ATOM 0 HG LEU A 50 0.671 1.262 1.850 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.495 3.158 0.278 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.416 1.590 -0.562 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.071 2.531 -0.292 1.00 0.31 H new ATOM 0 HD21 LEU A 50 -0.339 3.384 2.572 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -1.944 2.772 2.107 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -1.040 1.989 3.425 1.00 0.29 H new ATOM 779 N ARG A 51 -3.614 -1.663 0.442 1.00 0.52 N ATOM 780 CA ARG A 51 -4.072 -2.849 -0.268 1.00 0.61 C ATOM 781 C ARG A 51 -5.001 -2.446 -1.407 1.00 0.62 C ATOM 782 O ARG A 51 -4.852 -2.909 -2.542 1.00 0.69 O ATOM 783 CB ARG A 51 -4.789 -3.802 0.690 1.00 0.67 C ATOM 784 CG ARG A 51 -5.262 -5.089 0.036 1.00 0.98 C ATOM 785 CD ARG A 51 -5.994 -5.979 1.025 1.00 1.49 C ATOM 786 NE ARG A 51 -6.468 -7.213 0.405 1.00 2.00 N ATOM 787 CZ ARG A 51 -7.270 -8.088 1.008 1.00 2.89 C ATOM 788 NH1 ARG A 51 -7.718 -7.853 2.234 1.00 3.39 N ATOM 789 NH2 ARG A 51 -7.633 -9.197 0.378 1.00 3.74 N ATOM 0 H ARG A 51 -3.882 -1.629 1.426 1.00 0.52 H new ATOM 0 HA ARG A 51 -3.207 -3.366 -0.683 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -4.117 -4.049 1.512 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -5.648 -3.289 1.123 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -5.921 -4.853 -0.800 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -4.407 -5.626 -0.374 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -5.330 -6.222 1.854 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -6.841 -5.435 1.444 1.00 1.49 H new ATOM 0 HE ARG A 51 -6.166 -7.417 -0.548 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -7.448 -6.998 2.720 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -8.332 -8.527 2.691 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -7.298 -9.379 -0.568 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -8.247 -9.868 0.839 1.00 3.74 H new ATOM 803 N GLU A 52 -5.938 -1.558 -1.101 1.00 0.59 N ATOM 804 CA GLU A 52 -6.880 -1.067 -2.099 1.00 0.62 C ATOM 805 C GLU A 52 -6.201 -0.049 -3.006 1.00 0.59 C ATOM 806 O GLU A 52 -6.518 0.056 -4.189 1.00 0.65 O ATOM 807 CB GLU A 52 -8.103 -0.444 -1.423 1.00 0.66 C ATOM 808 CG GLU A 52 -8.836 -1.400 -0.493 1.00 0.92 C ATOM 809 CD GLU A 52 -9.177 -2.715 -1.162 1.00 1.23 C ATOM 810 OE1 GLU A 52 -10.198 -2.775 -1.876 1.00 1.45 O ATOM 811 OE2 GLU A 52 -8.426 -3.695 -0.975 1.00 1.88 O ATOM 0 H GLU A 52 -6.066 -1.163 -0.169 1.00 0.59 H new ATOM 0 HA GLU A 52 -7.214 -1.909 -2.705 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -7.788 0.432 -0.856 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -8.794 -0.095 -2.190 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -8.219 -1.592 0.385 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -9.753 -0.927 -0.141 1.00 0.92 H new ATOM 818 N ALA A 53 -5.258 0.694 -2.443 1.00 0.52 N ATOM 819 CA ALA A 53 -4.493 1.665 -3.204 1.00 0.49 C ATOM 820 C ALA A 53 -3.672 0.978 -4.284 1.00 0.52 C ATOM 821 O ALA A 53 -3.714 1.371 -5.450 1.00 0.53 O ATOM 822 CB ALA A 53 -3.591 2.453 -2.275 1.00 0.43 C ATOM 0 H ALA A 53 -5.005 0.640 -1.456 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.187 2.350 -3.691 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.020 3.180 -2.852 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.198 2.974 -1.534 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -2.906 1.773 -1.769 1.00 0.43 H new ATOM 828 N GLY A 54 -2.928 -0.046 -3.886 1.00 0.57 N ATOM 829 CA GLY A 54 -2.133 -0.808 -4.830 1.00 0.64 C ATOM 830 C GLY A 54 -2.998 -1.520 -5.848 1.00 0.74 C ATOM 831 O GLY A 54 -2.590 -1.717 -6.992 1.00 0.82 O ATOM 0 H GLY A 54 -2.861 -0.364 -2.919 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -1.441 -0.141 -5.344 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -1.530 -1.539 -4.291 1.00 0.64 H new ATOM 835 N ASP A 55 -4.199 -1.898 -5.429 1.00 0.79 N ATOM 836 CA ASP A 55 -5.158 -2.532 -6.327 1.00 0.92 C ATOM 837 C ASP A 55 -5.629 -1.533 -7.372 1.00 0.88 C ATOM 838 O ASP A 55 -5.691 -1.841 -8.563 1.00 0.97 O ATOM 839 CB ASP A 55 -6.359 -3.075 -5.545 1.00 1.04 C ATOM 840 CG ASP A 55 -7.471 -3.560 -6.455 1.00 1.12 C ATOM 841 OD1 ASP A 55 -7.381 -4.702 -6.956 1.00 1.34 O ATOM 842 OD2 ASP A 55 -8.439 -2.799 -6.677 1.00 1.29 O ATOM 0 H ASP A 55 -4.533 -1.777 -4.473 1.00 0.79 H new ATOM 0 HA ASP A 55 -4.664 -3.367 -6.824 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -6.032 -3.896 -4.906 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -6.745 -2.295 -4.889 1.00 1.04 H new ATOM 847 N GLU A 56 -5.941 -0.328 -6.916 1.00 0.79 N ATOM 848 CA GLU A 56 -6.391 0.735 -7.800 1.00 0.83 C ATOM 849 C GLU A 56 -5.258 1.187 -8.719 1.00 0.78 C ATOM 850 O GLU A 56 -5.483 1.485 -9.892 1.00 0.85 O ATOM 851 CB GLU A 56 -6.923 1.915 -6.978 1.00 0.83 C ATOM 852 CG GLU A 56 -7.472 3.055 -7.819 1.00 0.94 C ATOM 853 CD GLU A 56 -8.038 4.168 -6.971 1.00 1.27 C ATOM 854 OE1 GLU A 56 -9.239 4.112 -6.633 1.00 1.38 O ATOM 855 OE2 GLU A 56 -7.288 5.104 -6.630 1.00 2.06 O ATOM 0 H GLU A 56 -5.890 -0.062 -5.933 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.199 0.351 -8.422 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -7.709 1.557 -6.313 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -6.120 2.296 -6.347 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -6.679 3.451 -8.453 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -8.249 2.674 -8.481 1.00 0.94 H new ATOM 862 N PHE A 57 -4.038 1.221 -8.188 1.00 0.72 N ATOM 863 CA PHE A 57 -2.872 1.583 -8.987 1.00 0.76 C ATOM 864 C PHE A 57 -2.673 0.557 -10.100 1.00 0.82 C ATOM 865 O PHE A 57 -2.350 0.906 -11.232 1.00 0.90 O ATOM 866 CB PHE A 57 -1.612 1.674 -8.110 1.00 0.77 C ATOM 867 CG PHE A 57 -0.410 2.223 -8.835 1.00 0.94 C ATOM 868 CD1 PHE A 57 -0.194 3.591 -8.905 1.00 1.07 C ATOM 869 CD2 PHE A 57 0.499 1.374 -9.452 1.00 1.05 C ATOM 870 CE1 PHE A 57 0.903 4.102 -9.575 1.00 1.26 C ATOM 871 CE2 PHE A 57 1.598 1.882 -10.121 1.00 1.25 C ATOM 872 CZ PHE A 57 1.799 3.246 -10.183 1.00 1.34 C ATOM 0 H PHE A 57 -3.833 1.003 -7.213 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.044 2.564 -9.430 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -1.825 2.305 -7.247 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -1.373 0.682 -7.728 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -0.891 4.266 -8.430 1.00 1.07 H new ATOM 0 HD2 PHE A 57 0.346 0.306 -9.409 1.00 1.05 H new ATOM 0 HE1 PHE A 57 1.058 5.170 -9.622 1.00 1.26 H new ATOM 0 HE2 PHE A 57 2.299 1.211 -10.595 1.00 1.25 H new ATOM 0 HZ PHE A 57 2.656 3.643 -10.707 1.00 1.34 H new ATOM 882 N GLU A 58 -2.904 -0.707 -9.767 1.00 0.83 N ATOM 883 CA GLU A 58 -2.791 -1.802 -10.725 1.00 0.95 C ATOM 884 C GLU A 58 -3.908 -1.726 -11.766 1.00 0.99 C ATOM 885 O GLU A 58 -3.689 -1.963 -12.951 1.00 1.08 O ATOM 886 CB GLU A 58 -2.853 -3.142 -9.969 1.00 1.05 C ATOM 887 CG GLU A 58 -2.886 -4.383 -10.855 1.00 1.35 C ATOM 888 CD GLU A 58 -1.648 -4.543 -11.707 1.00 1.27 C ATOM 889 OE1 GLU A 58 -0.544 -4.698 -11.141 1.00 1.45 O ATOM 890 OE2 GLU A 58 -1.774 -4.531 -12.950 1.00 1.61 O ATOM 0 H GLU A 58 -3.174 -1.002 -8.829 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.838 -1.723 -11.249 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -1.989 -3.209 -9.308 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.740 -3.143 -9.335 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -3.003 -5.266 -10.227 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -3.761 -4.335 -11.503 1.00 1.35 H new ATOM 897 N LEU A 59 -5.103 -1.370 -11.320 1.00 0.98 N ATOM 898 CA LEU A 59 -6.273 -1.359 -12.184 1.00 1.10 C ATOM 899 C LEU A 59 -6.238 -0.165 -13.141 1.00 1.10 C ATOM 900 O LEU A 59 -6.635 -0.277 -14.300 1.00 1.24 O ATOM 901 CB LEU A 59 -7.542 -1.345 -11.311 1.00 1.19 C ATOM 902 CG LEU A 59 -8.867 -1.699 -12.004 1.00 1.36 C ATOM 903 CD1 LEU A 59 -9.385 -0.543 -12.844 1.00 1.59 C ATOM 904 CD2 LEU A 59 -8.707 -2.951 -12.855 1.00 1.56 C ATOM 0 H LEU A 59 -5.288 -1.083 -10.359 1.00 0.98 H new ATOM 0 HA LEU A 59 -6.277 -2.258 -12.800 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -7.394 -2.042 -10.486 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.642 -0.351 -10.875 1.00 1.19 H new ATOM 0 HG LEU A 59 -9.605 -1.897 -11.226 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -10.323 -0.830 -13.319 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -9.552 0.325 -12.206 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -8.652 -0.293 -13.611 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -9.655 -3.186 -13.338 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -7.945 -2.779 -13.616 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -8.406 -3.785 -12.222 1.00 1.56 H new ATOM 916 N ARG A 60 -5.739 0.967 -12.661 1.00 1.00 N ATOM 917 CA ARG A 60 -5.775 2.207 -13.440 1.00 1.06 C ATOM 918 C ARG A 60 -4.438 2.506 -14.118 1.00 1.00 C ATOM 919 O ARG A 60 -4.401 2.862 -15.296 1.00 1.07 O ATOM 920 CB ARG A 60 -6.179 3.395 -12.553 1.00 1.10 C ATOM 921 CG ARG A 60 -7.664 3.454 -12.211 1.00 1.19 C ATOM 922 CD ARG A 60 -8.524 3.753 -13.435 1.00 1.31 C ATOM 923 NE ARG A 60 -8.205 5.051 -14.030 1.00 1.81 N ATOM 924 CZ ARG A 60 -9.100 6.020 -14.234 1.00 2.26 C ATOM 925 NH1 ARG A 60 -10.377 5.830 -13.927 1.00 2.15 N ATOM 926 NH2 ARG A 60 -8.721 7.175 -14.760 1.00 3.21 N ATOM 0 H ARG A 60 -5.306 1.057 -11.742 1.00 1.00 H new ATOM 0 HA ARG A 60 -6.522 2.064 -14.221 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -5.607 3.351 -11.626 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -5.898 4.320 -13.057 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -7.973 2.504 -11.775 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -7.831 4.221 -11.455 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -8.380 2.969 -14.179 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -9.576 3.734 -13.151 1.00 1.31 H new ATOM 0 HE ARG A 60 -7.239 5.226 -14.306 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -10.680 4.939 -13.533 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -11.056 6.575 -14.085 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -7.744 7.325 -15.010 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -9.407 7.914 -14.915 1.00 3.21 H new ATOM 940 N TYR A 61 -3.343 2.351 -13.386 1.00 0.91 N ATOM 941 CA TYR A 61 -2.036 2.772 -13.882 1.00 0.90 C ATOM 942 C TYR A 61 -1.134 1.564 -14.123 1.00 0.84 C ATOM 943 O TYR A 61 0.064 1.604 -13.838 1.00 0.83 O ATOM 944 CB TYR A 61 -1.366 3.734 -12.888 1.00 0.96 C ATOM 945 CG TYR A 61 -2.179 4.975 -12.568 1.00 1.05 C ATOM 946 CD1 TYR A 61 -2.741 5.753 -13.577 1.00 1.27 C ATOM 947 CD2 TYR A 61 -2.372 5.379 -11.250 1.00 1.04 C ATOM 948 CE1 TYR A 61 -3.470 6.892 -13.280 1.00 1.38 C ATOM 949 CE2 TYR A 61 -3.101 6.514 -10.949 1.00 1.14 C ATOM 950 CZ TYR A 61 -3.646 7.265 -11.966 1.00 1.27 C ATOM 951 OH TYR A 61 -4.371 8.399 -11.666 1.00 1.41 O ATOM 0 H TYR A 61 -3.331 1.940 -12.453 1.00 0.91 H new ATOM 0 HA TYR A 61 -2.186 3.290 -14.829 1.00 0.90 H new ATOM 0 HB2 TYR A 61 -1.166 3.197 -11.961 1.00 0.96 H new ATOM 0 HB3 TYR A 61 -0.402 4.041 -13.293 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -2.606 5.463 -14.609 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -1.944 4.795 -10.448 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -3.898 7.485 -14.075 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -3.243 6.811 -9.920 1.00 1.14 H new ATOM 0 HH TYR A 61 -4.401 8.520 -10.694 1.00 1.41 H new ATOM 961 N ARG A 62 -1.713 0.502 -14.669 1.00 0.86 N ATOM 962 CA ARG A 62 -0.972 -0.724 -14.958 1.00 0.85 C ATOM 963 C ARG A 62 0.182 -0.458 -15.927 1.00 0.87 C ATOM 964 O ARG A 62 1.292 -0.962 -15.742 1.00 0.85 O ATOM 965 CB ARG A 62 -1.920 -1.781 -15.534 1.00 0.95 C ATOM 966 CG ARG A 62 -1.226 -3.042 -16.029 1.00 1.04 C ATOM 967 CD ARG A 62 -2.232 -4.069 -16.525 1.00 1.23 C ATOM 968 NE ARG A 62 -3.142 -3.515 -17.528 1.00 1.73 N ATOM 969 CZ ARG A 62 -4.285 -4.096 -17.896 1.00 2.16 C ATOM 970 NH1 ARG A 62 -4.657 -5.246 -17.342 1.00 2.24 N ATOM 971 NH2 ARG A 62 -5.060 -3.526 -18.812 1.00 3.02 N ATOM 0 H ARG A 62 -2.700 0.463 -14.923 1.00 0.86 H new ATOM 0 HA ARG A 62 -0.545 -1.095 -14.026 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.646 -2.056 -14.769 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -2.479 -1.340 -16.360 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -0.536 -2.788 -16.834 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -0.631 -3.472 -15.223 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -1.700 -4.920 -16.951 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -2.810 -4.445 -15.681 1.00 1.23 H new ATOM 0 HE ARG A 62 -2.887 -2.633 -17.972 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -4.068 -5.685 -16.634 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -5.531 -5.689 -17.625 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -4.782 -2.641 -19.236 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -5.933 -3.973 -19.091 1.00 3.02 H new ATOM 985 N ARG A 63 -0.079 0.360 -16.941 1.00 0.94 N ATOM 986 CA ARG A 63 0.930 0.677 -17.948 1.00 1.01 C ATOM 987 C ARG A 63 2.080 1.465 -17.321 1.00 0.95 C ATOM 988 O ARG A 63 3.221 1.408 -17.789 1.00 0.99 O ATOM 989 CB ARG A 63 0.298 1.472 -19.096 1.00 1.16 C ATOM 990 CG ARG A 63 1.191 1.608 -20.323 1.00 1.70 C ATOM 991 CD ARG A 63 1.533 0.252 -20.924 1.00 2.14 C ATOM 992 NE ARG A 63 0.337 -0.527 -21.246 1.00 2.71 N ATOM 993 CZ ARG A 63 0.344 -1.841 -21.476 1.00 3.58 C ATOM 994 NH1 ARG A 63 1.484 -2.522 -21.442 1.00 3.92 N ATOM 995 NH2 ARG A 63 -0.790 -2.474 -21.746 1.00 4.52 N ATOM 0 H ARG A 63 -0.980 0.816 -17.088 1.00 0.94 H new ATOM 0 HA ARG A 63 1.330 -0.255 -18.348 1.00 1.01 H new ATOM 0 HB2 ARG A 63 -0.633 0.988 -19.389 1.00 1.16 H new ATOM 0 HB3 ARG A 63 0.040 2.468 -18.735 1.00 1.16 H new ATOM 0 HG2 ARG A 63 0.690 2.222 -21.071 1.00 1.70 H new ATOM 0 HG3 ARG A 63 2.110 2.127 -20.049 1.00 1.70 H new ATOM 0 HD2 ARG A 63 2.125 0.396 -21.828 1.00 2.14 H new ATOM 0 HD3 ARG A 63 2.152 -0.308 -20.223 1.00 2.14 H new ATOM 0 HE ARG A 63 -0.556 -0.036 -21.298 1.00 2.71 H new ATOM 0 HH11 ARG A 63 2.360 -2.040 -21.239 1.00 3.92 H new ATOM 0 HH12 ARG A 63 1.483 -3.527 -21.619 1.00 3.92 H new ATOM 0 HH21 ARG A 63 -1.668 -1.956 -21.778 1.00 4.52 H new ATOM 0 HH22 ARG A 63 -0.784 -3.479 -21.922 1.00 4.52 H new ATOM 1009 N ALA A 64 1.774 2.192 -16.253 1.00 0.90 N ATOM 1010 CA ALA A 64 2.789 2.917 -15.506 1.00 0.89 C ATOM 1011 C ALA A 64 3.563 1.967 -14.605 1.00 0.75 C ATOM 1012 O ALA A 64 4.788 2.041 -14.512 1.00 0.73 O ATOM 1013 CB ALA A 64 2.153 4.020 -14.677 1.00 0.94 C ATOM 0 H ALA A 64 0.828 2.294 -15.886 1.00 0.90 H new ATOM 0 HA ALA A 64 3.481 3.369 -16.217 1.00 0.89 H new ATOM 0 HB1 ALA A 64 2.927 4.552 -14.124 1.00 0.94 H new ATOM 0 HB2 ALA A 64 1.633 4.716 -15.335 1.00 0.94 H new ATOM 0 HB3 ALA A 64 1.442 3.584 -13.976 1.00 0.94 H new ATOM 1019 N PHE A 65 2.830 1.068 -13.956 1.00 0.69 N ATOM 1020 CA PHE A 65 3.412 0.087 -13.042 1.00 0.61 C ATOM 1021 C PHE A 65 4.535 -0.693 -13.721 1.00 0.59 C ATOM 1022 O PHE A 65 5.638 -0.791 -13.186 1.00 0.59 O ATOM 1023 CB PHE A 65 2.328 -0.876 -12.541 1.00 0.62 C ATOM 1024 CG PHE A 65 2.796 -1.827 -11.473 1.00 0.59 C ATOM 1025 CD1 PHE A 65 2.848 -1.426 -10.147 1.00 0.60 C ATOM 1026 CD2 PHE A 65 3.178 -3.122 -11.792 1.00 0.64 C ATOM 1027 CE1 PHE A 65 3.270 -2.297 -9.163 1.00 0.64 C ATOM 1028 CE2 PHE A 65 3.600 -3.997 -10.810 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.646 -3.584 -9.493 1.00 0.66 C ATOM 0 H PHE A 65 1.817 0.998 -14.048 1.00 0.69 H new ATOM 0 HA PHE A 65 3.834 0.622 -12.191 1.00 0.61 H new ATOM 0 HB2 PHE A 65 1.492 -0.294 -12.153 1.00 0.62 H new ATOM 0 HB3 PHE A 65 1.951 -1.452 -13.386 1.00 0.62 H new ATOM 0 HD1 PHE A 65 2.555 -0.421 -9.881 1.00 0.60 H new ATOM 0 HD2 PHE A 65 3.145 -3.450 -12.820 1.00 0.64 H new ATOM 0 HE1 PHE A 65 3.306 -1.972 -8.134 1.00 0.64 H new ATOM 0 HE2 PHE A 65 3.894 -5.003 -11.072 1.00 0.68 H new ATOM 0 HZ PHE A 65 3.975 -4.266 -8.723 1.00 0.66 H new ATOM 1039 N SER A 66 4.250 -1.228 -14.902 1.00 0.64 N ATOM 1040 CA SER A 66 5.223 -2.018 -15.652 1.00 0.68 C ATOM 1041 C SER A 66 6.497 -1.215 -15.940 1.00 0.66 C ATOM 1042 O SER A 66 7.611 -1.732 -15.829 1.00 0.68 O ATOM 1043 CB SER A 66 4.593 -2.498 -16.961 1.00 0.83 C ATOM 1044 OG SER A 66 3.353 -3.141 -16.714 1.00 1.20 O ATOM 0 H SER A 66 3.347 -1.129 -15.365 1.00 0.64 H new ATOM 0 HA SER A 66 5.506 -2.878 -15.045 1.00 0.68 H new ATOM 0 HB2 SER A 66 4.442 -1.651 -17.630 1.00 0.83 H new ATOM 0 HB3 SER A 66 5.271 -3.186 -17.466 1.00 0.83 H new ATOM 0 HG SER A 66 2.964 -3.439 -17.563 1.00 1.20 H new ATOM 1050 N ASP A 67 6.328 0.052 -16.291 1.00 0.68 N ATOM 1051 CA ASP A 67 7.465 0.907 -16.624 1.00 0.73 C ATOM 1052 C ASP A 67 8.239 1.310 -15.369 1.00 0.65 C ATOM 1053 O ASP A 67 9.466 1.196 -15.321 1.00 0.66 O ATOM 1054 CB ASP A 67 6.996 2.158 -17.375 1.00 0.89 C ATOM 1055 CG ASP A 67 8.145 3.068 -17.766 1.00 1.36 C ATOM 1056 OD1 ASP A 67 8.849 2.753 -18.749 1.00 1.41 O ATOM 1057 OD2 ASP A 67 8.342 4.107 -17.101 1.00 2.06 O ATOM 0 H ASP A 67 5.420 0.512 -16.353 1.00 0.68 H new ATOM 0 HA ASP A 67 8.132 0.336 -17.269 1.00 0.73 H new ATOM 0 HB2 ASP A 67 6.454 1.857 -18.272 1.00 0.89 H new ATOM 0 HB3 ASP A 67 6.295 2.711 -16.750 1.00 0.89 H new ATOM 1062 N LEU A 68 7.517 1.751 -14.346 1.00 0.63 N ATOM 1063 CA LEU A 68 8.139 2.263 -13.133 1.00 0.66 C ATOM 1064 C LEU A 68 8.854 1.160 -12.354 1.00 0.57 C ATOM 1065 O LEU A 68 9.902 1.402 -11.752 1.00 0.63 O ATOM 1066 CB LEU A 68 7.095 2.952 -12.249 1.00 0.75 C ATOM 1067 CG LEU A 68 6.448 4.207 -12.848 1.00 0.81 C ATOM 1068 CD1 LEU A 68 5.432 4.797 -11.882 1.00 1.64 C ATOM 1069 CD2 LEU A 68 7.506 5.243 -13.202 1.00 1.07 C ATOM 0 H LEU A 68 6.497 1.764 -14.333 1.00 0.63 H new ATOM 0 HA LEU A 68 8.890 2.994 -13.431 1.00 0.66 H new ATOM 0 HB2 LEU A 68 6.308 2.234 -12.018 1.00 0.75 H new ATOM 0 HB3 LEU A 68 7.566 3.223 -11.304 1.00 0.75 H new ATOM 0 HG LEU A 68 5.930 3.919 -13.763 1.00 0.81 H new ATOM 0 HD11 LEU A 68 4.983 5.687 -12.324 1.00 1.64 H new ATOM 0 HD12 LEU A 68 4.654 4.061 -11.678 1.00 1.64 H new ATOM 0 HD13 LEU A 68 5.930 5.066 -10.950 1.00 1.64 H new ATOM 0 HD21 LEU A 68 7.025 6.125 -13.625 1.00 1.07 H new ATOM 0 HD22 LEU A 68 8.054 5.525 -12.303 1.00 1.07 H new ATOM 0 HD23 LEU A 68 8.198 4.822 -13.932 1.00 1.07 H new ATOM 1081 N THR A 69 8.311 -0.054 -12.380 1.00 0.49 N ATOM 1082 CA THR A 69 8.939 -1.171 -11.681 1.00 0.49 C ATOM 1083 C THR A 69 10.207 -1.625 -12.393 1.00 0.46 C ATOM 1084 O THR A 69 11.044 -2.297 -11.808 1.00 0.51 O ATOM 1085 CB THR A 69 7.993 -2.373 -11.521 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.412 -2.715 -12.784 1.00 0.71 O ATOM 1087 CG2 THR A 69 6.900 -2.072 -10.508 1.00 0.63 C ATOM 0 H THR A 69 7.448 -0.288 -12.871 1.00 0.49 H new ATOM 0 HA THR A 69 9.190 -0.800 -10.687 1.00 0.49 H new ATOM 0 HB THR A 69 8.575 -3.219 -11.156 1.00 0.51 H new ATOM 0 HG1 THR A 69 6.552 -2.255 -12.884 1.00 0.71 H new ATOM 0 HG21 THR A 69 6.244 -2.937 -10.413 1.00 0.63 H new ATOM 0 HG22 THR A 69 7.351 -1.850 -9.541 1.00 0.63 H new ATOM 0 HG23 THR A 69 6.320 -1.212 -10.843 1.00 0.63 H new ATOM 1095 N SER A 70 10.346 -1.247 -13.657 1.00 0.46 N ATOM 1096 CA SER A 70 11.549 -1.559 -14.409 1.00 0.49 C ATOM 1097 C SER A 70 12.654 -0.564 -14.064 1.00 0.48 C ATOM 1098 O SER A 70 13.842 -0.862 -14.190 1.00 0.53 O ATOM 1099 CB SER A 70 11.256 -1.551 -15.912 1.00 0.57 C ATOM 1100 OG SER A 70 10.227 -2.476 -16.231 1.00 1.31 O ATOM 0 H SER A 70 9.642 -0.726 -14.180 1.00 0.46 H new ATOM 0 HA SER A 70 11.888 -2.558 -14.136 1.00 0.49 H new ATOM 0 HB2 SER A 70 10.960 -0.549 -16.224 1.00 0.57 H new ATOM 0 HB3 SER A 70 12.161 -1.802 -16.465 1.00 0.57 H new ATOM 0 HG SER A 70 9.354 -2.075 -16.035 1.00 1.31 H new ATOM 1106 N GLN A 71 12.249 0.613 -13.599 1.00 0.49 N ATOM 1107 CA GLN A 71 13.192 1.638 -13.179 1.00 0.53 C ATOM 1108 C GLN A 71 13.736 1.301 -11.794 1.00 0.46 C ATOM 1109 O GLN A 71 14.864 1.644 -11.450 1.00 0.53 O ATOM 1110 CB GLN A 71 12.505 3.007 -13.159 1.00 0.63 C ATOM 1111 CG GLN A 71 13.446 4.168 -12.882 1.00 0.69 C ATOM 1112 CD GLN A 71 12.718 5.493 -12.733 1.00 0.83 C ATOM 1113 OE1 GLN A 71 13.244 6.545 -13.097 1.00 1.22 O ATOM 1114 NE2 GLN A 71 11.514 5.459 -12.180 1.00 0.82 N ATOM 0 H GLN A 71 11.269 0.880 -13.504 1.00 0.49 H new ATOM 0 HA GLN A 71 14.020 1.674 -13.887 1.00 0.53 H new ATOM 0 HB2 GLN A 71 12.016 3.170 -14.119 1.00 0.63 H new ATOM 0 HB3 GLN A 71 11.723 2.998 -12.400 1.00 0.63 H new ATOM 0 HG2 GLN A 71 14.009 3.964 -11.972 1.00 0.69 H new ATOM 0 HG3 GLN A 71 14.169 4.245 -13.694 1.00 0.69 H new ATOM 0 HE21 GLN A 71 11.111 4.568 -11.891 1.00 0.82 H new ATOM 0 HE22 GLN A 71 10.991 6.324 -12.044 1.00 0.82 H new ATOM 1123 N LEU A 72 12.918 0.610 -11.011 1.00 0.39 N ATOM 1124 CA LEU A 72 13.295 0.201 -9.665 1.00 0.33 C ATOM 1125 C LEU A 72 13.506 -1.312 -9.623 1.00 0.34 C ATOM 1126 O LEU A 72 13.554 -1.914 -8.553 1.00 0.37 O ATOM 1127 CB LEU A 72 12.203 0.624 -8.666 1.00 0.37 C ATOM 1128 CG LEU A 72 12.537 0.415 -7.184 1.00 0.46 C ATOM 1129 CD1 LEU A 72 13.777 1.204 -6.796 1.00 0.96 C ATOM 1130 CD2 LEU A 72 11.357 0.815 -6.314 1.00 0.92 C ATOM 0 H LEU A 72 11.981 0.319 -11.289 1.00 0.39 H new ATOM 0 HA LEU A 72 14.229 0.690 -9.386 1.00 0.33 H new ATOM 0 HB2 LEU A 72 11.982 1.680 -8.824 1.00 0.37 H new ATOM 0 HB3 LEU A 72 11.293 0.070 -8.895 1.00 0.37 H new ATOM 0 HG LEU A 72 12.743 -0.643 -7.024 1.00 0.46 H new ATOM 0 HD11 LEU A 72 13.996 1.042 -5.741 1.00 0.96 H new ATOM 0 HD12 LEU A 72 14.623 0.871 -7.398 1.00 0.96 H new ATOM 0 HD13 LEU A 72 13.602 2.266 -6.971 1.00 0.96 H new ATOM 0 HD21 LEU A 72 11.610 0.661 -5.265 1.00 0.92 H new ATOM 0 HD22 LEU A 72 11.122 1.866 -6.480 1.00 0.92 H new ATOM 0 HD23 LEU A 72 10.491 0.205 -6.572 1.00 0.92 H new ATOM 1142 N HIS A 73 13.654 -1.908 -10.804 1.00 0.41 N ATOM 1143 CA HIS A 73 13.802 -3.358 -10.934 1.00 0.46 C ATOM 1144 C HIS A 73 14.985 -3.843 -10.101 1.00 0.41 C ATOM 1145 O HIS A 73 16.088 -3.305 -10.213 1.00 0.45 O ATOM 1146 CB HIS A 73 13.994 -3.738 -12.409 1.00 0.60 C ATOM 1147 CG HIS A 73 13.928 -5.212 -12.674 1.00 1.34 C ATOM 1148 ND1 HIS A 73 15.044 -5.984 -12.908 1.00 2.07 N ATOM 1149 CD2 HIS A 73 12.868 -6.050 -12.759 1.00 2.33 C ATOM 1150 CE1 HIS A 73 14.675 -7.233 -13.126 1.00 2.86 C ATOM 1151 NE2 HIS A 73 13.359 -7.300 -13.041 1.00 3.01 N ATOM 0 H HIS A 73 13.675 -1.406 -11.692 1.00 0.41 H new ATOM 0 HA HIS A 73 12.897 -3.840 -10.565 1.00 0.46 H new ATOM 0 HB2 HIS A 73 13.230 -3.238 -13.004 1.00 0.60 H new ATOM 0 HB3 HIS A 73 14.959 -3.362 -12.748 1.00 0.60 H new ATOM 0 HD2 HIS A 73 11.829 -5.784 -12.629 1.00 2.33 H new ATOM 0 HE1 HIS A 73 15.337 -8.059 -13.338 1.00 2.86 H new ATOM 0 HE2 HIS A 73 12.799 -8.143 -13.165 1.00 3.01 H new ATOM 1160 N ILE A 74 14.756 -4.851 -9.269 1.00 0.37 N ATOM 1161 CA ILE A 74 15.766 -5.289 -8.320 1.00 0.36 C ATOM 1162 C ILE A 74 16.839 -6.137 -9.010 1.00 0.45 C ATOM 1163 O ILE A 74 16.641 -6.627 -10.124 1.00 0.61 O ATOM 1164 CB ILE A 74 15.128 -6.074 -7.145 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.102 -6.179 -5.970 1.00 0.31 C ATOM 1166 CG2 ILE A 74 14.690 -7.462 -7.593 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.497 -6.800 -4.738 1.00 0.34 C ATOM 0 H ILE A 74 13.883 -5.377 -9.233 1.00 0.37 H new ATOM 0 HA ILE A 74 16.243 -4.397 -7.914 1.00 0.36 H new ATOM 0 HB ILE A 74 14.246 -5.525 -6.816 1.00 0.31 H new ATOM 0 HG12 ILE A 74 16.966 -6.769 -6.277 1.00 0.31 H new ATOM 0 HG13 ILE A 74 16.468 -5.183 -5.722 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.246 -7.993 -6.751 1.00 0.35 H new ATOM 0 HG22 ILE A 74 13.955 -7.371 -8.393 1.00 0.35 H new ATOM 0 HG23 ILE A 74 15.555 -8.017 -7.956 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.245 -6.842 -3.947 1.00 0.34 H new ATOM 0 HD12 ILE A 74 14.651 -6.199 -4.406 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.157 -7.809 -4.969 1.00 0.34 H new ATOM 1179 N THR A 75 17.971 -6.300 -8.338 1.00 0.61 N ATOM 1180 CA THR A 75 19.094 -7.049 -8.869 1.00 0.73 C ATOM 1181 C THR A 75 20.107 -7.262 -7.741 1.00 0.58 C ATOM 1182 O THR A 75 20.144 -6.469 -6.800 1.00 0.57 O ATOM 1183 CB THR A 75 19.746 -6.294 -10.058 1.00 1.02 C ATOM 1184 OG1 THR A 75 20.590 -7.169 -10.816 1.00 1.38 O ATOM 1185 CG2 THR A 75 20.557 -5.095 -9.579 1.00 1.56 C ATOM 0 H THR A 75 18.133 -5.914 -7.408 1.00 0.61 H new ATOM 0 HA THR A 75 18.751 -8.013 -9.245 1.00 0.73 H new ATOM 0 HB THR A 75 18.937 -5.935 -10.694 1.00 1.02 H new ATOM 0 HG1 THR A 75 20.989 -6.674 -11.561 1.00 1.38 H new ATOM 0 HG21 THR A 75 21.000 -4.589 -10.437 1.00 1.56 H new ATOM 0 HG22 THR A 75 19.904 -4.403 -9.047 1.00 1.56 H new ATOM 0 HG23 THR A 75 21.348 -5.434 -8.910 1.00 1.56 H new ATOM 1193 N PRO A 76 20.907 -8.341 -7.780 1.00 0.66 N ATOM 1194 CA PRO A 76 21.907 -8.612 -6.741 1.00 0.73 C ATOM 1195 C PRO A 76 22.903 -7.466 -6.587 1.00 0.72 C ATOM 1196 O PRO A 76 23.773 -7.265 -7.438 1.00 0.81 O ATOM 1197 CB PRO A 76 22.617 -9.877 -7.233 1.00 0.93 C ATOM 1198 CG PRO A 76 21.660 -10.512 -8.180 1.00 1.06 C ATOM 1199 CD PRO A 76 20.898 -9.385 -8.817 1.00 0.90 C ATOM 0 HA PRO A 76 21.447 -8.728 -5.759 1.00 0.73 H new ATOM 0 HB2 PRO A 76 23.558 -9.635 -7.726 1.00 0.93 H new ATOM 0 HB3 PRO A 76 22.854 -10.544 -6.404 1.00 0.93 H new ATOM 0 HG2 PRO A 76 22.187 -11.100 -8.931 1.00 1.06 H new ATOM 0 HG3 PRO A 76 20.987 -11.192 -7.657 1.00 1.06 H new ATOM 0 HD2 PRO A 76 21.377 -9.044 -9.735 1.00 0.90 H new ATOM 0 HD3 PRO A 76 19.883 -9.683 -9.079 1.00 0.90 H new ATOM 1207 N GLY A 77 22.749 -6.697 -5.519 1.00 0.86 N ATOM 1208 CA GLY A 77 23.661 -5.609 -5.247 1.00 1.10 C ATOM 1209 C GLY A 77 23.007 -4.251 -5.395 1.00 1.00 C ATOM 1210 O GLY A 77 23.593 -3.332 -5.964 1.00 1.32 O ATOM 0 H GLY A 77 22.003 -6.810 -4.833 1.00 0.86 H new ATOM 0 HA2 GLY A 77 24.052 -5.712 -4.235 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.512 -5.674 -5.925 1.00 1.10 H new ATOM 1214 N THR A 78 21.791 -4.121 -4.891 1.00 0.85 N ATOM 1215 CA THR A 78 21.091 -2.847 -4.926 1.00 0.82 C ATOM 1216 C THR A 78 20.815 -2.350 -3.510 1.00 0.85 C ATOM 1217 O THR A 78 19.694 -2.419 -3.011 1.00 1.52 O ATOM 1218 CB THR A 78 19.777 -2.925 -5.746 1.00 0.90 C ATOM 1219 OG1 THR A 78 19.049 -1.696 -5.631 1.00 1.52 O ATOM 1220 CG2 THR A 78 18.896 -4.085 -5.297 1.00 1.15 C ATOM 0 H THR A 78 21.269 -4.880 -4.454 1.00 0.85 H new ATOM 0 HA THR A 78 21.742 -2.132 -5.430 1.00 0.82 H new ATOM 0 HB THR A 78 20.052 -3.094 -6.787 1.00 0.90 H new ATOM 0 HG1 THR A 78 18.222 -1.755 -6.154 1.00 1.52 H new ATOM 0 HG21 THR A 78 17.986 -4.104 -5.897 1.00 1.15 H new ATOM 0 HG22 THR A 78 19.436 -5.023 -5.427 1.00 1.15 H new ATOM 0 HG23 THR A 78 18.636 -3.959 -4.246 1.00 1.15 H new ATOM 1228 N ALA A 79 21.866 -1.874 -2.853 1.00 0.68 N ATOM 1229 CA ALA A 79 21.762 -1.359 -1.494 1.00 0.73 C ATOM 1230 C ALA A 79 20.789 -0.180 -1.424 1.00 0.62 C ATOM 1231 O ALA A 79 20.385 0.360 -2.457 1.00 0.56 O ATOM 1232 CB ALA A 79 23.136 -0.938 -1.001 1.00 0.85 C ATOM 0 H ALA A 79 22.807 -1.834 -3.244 1.00 0.68 H new ATOM 0 HA ALA A 79 21.374 -2.150 -0.853 1.00 0.73 H new ATOM 0 HB1 ALA A 79 23.056 -0.553 0.016 1.00 0.85 H new ATOM 0 HB2 ALA A 79 23.806 -1.798 -1.012 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.534 -0.160 -1.653 1.00 0.85 H new ATOM 1238 N TYR A 80 20.428 0.232 -0.209 1.00 0.63 N ATOM 1239 CA TYR A 80 19.510 1.359 -0.034 1.00 0.58 C ATOM 1240 C TYR A 80 20.064 2.616 -0.703 1.00 0.50 C ATOM 1241 O TYR A 80 19.310 3.489 -1.112 1.00 0.46 O ATOM 1242 CB TYR A 80 19.229 1.631 1.452 1.00 0.67 C ATOM 1243 CG TYR A 80 18.242 2.765 1.679 1.00 0.80 C ATOM 1244 CD1 TYR A 80 16.886 2.599 1.409 1.00 0.89 C ATOM 1245 CD2 TYR A 80 18.670 4.004 2.146 1.00 1.14 C ATOM 1246 CE1 TYR A 80 15.989 3.636 1.599 1.00 1.24 C ATOM 1247 CE2 TYR A 80 17.778 5.043 2.334 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.441 4.854 2.061 1.00 1.58 C ATOM 1249 OH TYR A 80 15.555 5.892 2.242 1.00 2.03 O ATOM 0 H TYR A 80 20.752 -0.192 0.660 1.00 0.63 H new ATOM 0 HA TYR A 80 18.568 1.091 -0.512 1.00 0.58 H new ATOM 0 HB2 TYR A 80 18.841 0.723 1.914 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.167 1.868 1.955 1.00 0.67 H new ATOM 0 HD1 TYR A 80 16.529 1.647 1.046 1.00 0.89 H new ATOM 0 HD2 TYR A 80 19.716 4.156 2.365 1.00 1.14 H new ATOM 0 HE1 TYR A 80 14.940 3.492 1.386 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.128 5.999 2.694 1.00 1.55 H new ATOM 0 HH TYR A 80 15.778 6.623 1.629 1.00 2.03 H new ATOM 1259 N GLN A 81 21.383 2.688 -0.834 1.00 0.56 N ATOM 1260 CA GLN A 81 22.036 3.808 -1.501 1.00 0.59 C ATOM 1261 C GLN A 81 21.585 3.902 -2.963 1.00 0.54 C ATOM 1262 O GLN A 81 21.435 4.992 -3.513 1.00 0.63 O ATOM 1263 CB GLN A 81 23.555 3.640 -1.415 1.00 0.72 C ATOM 1264 CG GLN A 81 24.346 4.845 -1.895 1.00 0.84 C ATOM 1265 CD GLN A 81 25.839 4.651 -1.730 1.00 1.40 C ATOM 1266 OE1 GLN A 81 26.411 4.985 -0.691 1.00 2.01 O ATOM 1267 NE2 GLN A 81 26.479 4.091 -2.743 1.00 2.18 N ATOM 0 H GLN A 81 22.026 1.978 -0.484 1.00 0.56 H new ATOM 0 HA GLN A 81 21.752 4.734 -1.002 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.827 3.430 -0.381 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.846 2.771 -2.004 1.00 0.72 H new ATOM 0 HG2 GLN A 81 24.119 5.032 -2.945 1.00 0.84 H new ATOM 0 HG3 GLN A 81 24.032 5.729 -1.339 1.00 0.84 H new ATOM 0 HE21 GLN A 81 25.969 3.829 -3.586 1.00 2.18 H new ATOM 0 HE22 GLN A 81 27.483 3.921 -2.681 1.00 2.18 H new ATOM 1276 N SER A 82 21.353 2.749 -3.580 1.00 0.48 N ATOM 1277 CA SER A 82 20.868 2.695 -4.952 1.00 0.47 C ATOM 1278 C SER A 82 19.342 2.774 -4.979 1.00 0.40 C ATOM 1279 O SER A 82 18.752 3.339 -5.897 1.00 0.42 O ATOM 1280 CB SER A 82 21.345 1.408 -5.626 1.00 0.55 C ATOM 1281 OG SER A 82 22.759 1.297 -5.569 1.00 1.17 O ATOM 0 H SER A 82 21.494 1.836 -3.148 1.00 0.48 H new ATOM 0 HA SER A 82 21.268 3.548 -5.500 1.00 0.47 H new ATOM 0 HB2 SER A 82 20.889 0.547 -5.137 1.00 0.55 H new ATOM 0 HB3 SER A 82 21.017 1.395 -6.666 1.00 0.55 H new ATOM 0 HG SER A 82 23.040 0.465 -6.005 1.00 1.17 H new ATOM 1287 N PHE A 83 18.715 2.215 -3.952 1.00 0.36 N ATOM 1288 CA PHE A 83 17.260 2.232 -3.825 1.00 0.33 C ATOM 1289 C PHE A 83 16.769 3.669 -3.625 1.00 0.31 C ATOM 1290 O PHE A 83 15.726 4.065 -4.150 1.00 0.32 O ATOM 1291 CB PHE A 83 16.845 1.335 -2.644 1.00 0.35 C ATOM 1292 CG PHE A 83 15.375 1.022 -2.566 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.826 -0.003 -3.325 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.545 1.737 -1.717 1.00 0.32 C ATOM 1295 CE1 PHE A 83 13.481 -0.305 -3.239 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.198 1.441 -1.630 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.665 0.419 -2.391 1.00 0.38 C ATOM 0 H PHE A 83 19.195 1.740 -3.188 1.00 0.36 H new ATOM 0 HA PHE A 83 16.803 1.845 -4.736 1.00 0.33 H new ATOM 0 HB2 PHE A 83 17.397 0.398 -2.708 1.00 0.35 H new ATOM 0 HB3 PHE A 83 17.147 1.820 -1.716 1.00 0.35 H new ATOM 0 HD1 PHE A 83 15.459 -0.571 -3.991 1.00 0.38 H new ATOM 0 HD2 PHE A 83 14.956 2.535 -1.116 1.00 0.32 H new ATOM 0 HE1 PHE A 83 13.068 -1.106 -3.834 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.562 2.009 -0.967 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.613 0.186 -2.323 1.00 0.38 H new ATOM 1307 N GLU A 84 17.562 4.450 -2.896 1.00 0.34 N ATOM 1308 CA GLU A 84 17.253 5.850 -2.611 1.00 0.39 C ATOM 1309 C GLU A 84 17.277 6.679 -3.894 1.00 0.37 C ATOM 1310 O GLU A 84 16.598 7.693 -3.994 1.00 0.40 O ATOM 1311 CB GLU A 84 18.268 6.410 -1.598 1.00 0.51 C ATOM 1312 CG GLU A 84 18.066 7.875 -1.232 1.00 0.64 C ATOM 1313 CD GLU A 84 16.800 8.131 -0.437 1.00 0.90 C ATOM 1314 OE1 GLU A 84 16.768 7.784 0.764 1.00 0.95 O ATOM 1315 OE2 GLU A 84 15.854 8.717 -0.996 1.00 1.58 O ATOM 0 H GLU A 84 18.439 4.130 -2.485 1.00 0.34 H new ATOM 0 HA GLU A 84 16.251 5.908 -2.185 1.00 0.39 H new ATOM 0 HB2 GLU A 84 18.218 5.813 -0.688 1.00 0.51 H new ATOM 0 HB3 GLU A 84 19.272 6.287 -2.005 1.00 0.51 H new ATOM 0 HG2 GLU A 84 18.924 8.219 -0.654 1.00 0.64 H new ATOM 0 HG3 GLU A 84 18.038 8.469 -2.145 1.00 0.64 H new ATOM 1322 N GLN A 85 18.043 6.228 -4.882 1.00 0.37 N ATOM 1323 CA GLN A 85 18.170 6.954 -6.145 1.00 0.42 C ATOM 1324 C GLN A 85 16.814 7.115 -6.821 1.00 0.38 C ATOM 1325 O GLN A 85 16.499 8.174 -7.360 1.00 0.46 O ATOM 1326 CB GLN A 85 19.127 6.223 -7.091 1.00 0.50 C ATOM 1327 CG GLN A 85 20.579 6.205 -6.633 1.00 0.61 C ATOM 1328 CD GLN A 85 21.436 5.281 -7.475 1.00 1.44 C ATOM 1329 OE1 GLN A 85 21.161 5.055 -8.654 1.00 1.90 O ATOM 1330 NE2 GLN A 85 22.487 4.743 -6.881 1.00 2.16 N ATOM 0 H GLN A 85 18.585 5.365 -4.835 1.00 0.37 H new ATOM 0 HA GLN A 85 18.571 7.942 -5.920 1.00 0.42 H new ATOM 0 HB2 GLN A 85 18.784 5.195 -7.210 1.00 0.50 H new ATOM 0 HB3 GLN A 85 19.075 6.692 -8.073 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.985 7.216 -6.679 1.00 0.61 H new ATOM 0 HG3 GLN A 85 20.625 5.890 -5.590 1.00 0.61 H new ATOM 0 HE21 GLN A 85 22.683 4.954 -5.902 1.00 2.16 H new ATOM 0 HE22 GLN A 85 23.102 4.117 -7.401 1.00 2.16 H new ATOM 1339 N VAL A 86 16.008 6.068 -6.761 1.00 0.31 N ATOM 1340 CA VAL A 86 14.717 6.059 -7.423 1.00 0.31 C ATOM 1341 C VAL A 86 13.662 6.697 -6.535 1.00 0.29 C ATOM 1342 O VAL A 86 12.930 7.592 -6.956 1.00 0.32 O ATOM 1343 CB VAL A 86 14.282 4.622 -7.754 1.00 0.33 C ATOM 1344 CG1 VAL A 86 12.963 4.619 -8.511 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.364 3.905 -8.543 1.00 0.36 C ATOM 0 H VAL A 86 16.228 5.209 -6.257 1.00 0.31 H new ATOM 0 HA VAL A 86 14.815 6.628 -8.347 1.00 0.31 H new ATOM 0 HB VAL A 86 14.133 4.084 -6.818 1.00 0.33 H new ATOM 0 HG11 VAL A 86 12.674 3.592 -8.735 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.192 5.088 -7.900 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.076 5.175 -9.442 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.038 2.890 -8.768 1.00 0.36 H new ATOM 0 HG22 VAL A 86 15.551 4.441 -9.474 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.281 3.870 -7.954 1.00 0.36 H new ATOM 1355 N VAL A 87 13.596 6.226 -5.300 1.00 0.28 N ATOM 1356 CA VAL A 87 12.573 6.659 -4.363 1.00 0.32 C ATOM 1357 C VAL A 87 12.715 8.141 -4.003 1.00 0.35 C ATOM 1358 O VAL A 87 11.755 8.780 -3.564 1.00 0.37 O ATOM 1359 CB VAL A 87 12.597 5.794 -3.095 1.00 0.38 C ATOM 1360 CG1 VAL A 87 12.457 4.334 -3.473 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.871 6.019 -2.302 1.00 0.41 C ATOM 0 H VAL A 87 14.246 5.537 -4.921 1.00 0.28 H new ATOM 0 HA VAL A 87 11.609 6.533 -4.857 1.00 0.32 H new ATOM 0 HB VAL A 87 11.759 6.083 -2.461 1.00 0.38 H new ATOM 0 HG11 VAL A 87 12.474 3.721 -2.572 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.513 4.183 -3.997 1.00 0.38 H new ATOM 0 HG13 VAL A 87 13.283 4.046 -4.123 1.00 0.38 H new ATOM 0 HG21 VAL A 87 13.860 5.393 -1.410 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.733 5.759 -2.917 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.937 7.067 -2.009 1.00 0.41 H new ATOM 1371 N ASN A 88 13.909 8.686 -4.213 1.00 0.38 N ATOM 1372 CA ASN A 88 14.145 10.119 -4.041 1.00 0.47 C ATOM 1373 C ASN A 88 13.347 10.904 -5.071 1.00 0.44 C ATOM 1374 O ASN A 88 12.834 11.986 -4.789 1.00 0.45 O ATOM 1375 CB ASN A 88 15.637 10.445 -4.196 1.00 0.61 C ATOM 1376 CG ASN A 88 15.936 11.936 -4.123 1.00 0.78 C ATOM 1377 OD1 ASN A 88 15.284 12.679 -3.392 1.00 0.87 O ATOM 1378 ND2 ASN A 88 16.921 12.387 -4.889 1.00 0.97 N ATOM 0 H ASN A 88 14.731 8.157 -4.503 1.00 0.38 H new ATOM 0 HA ASN A 88 13.825 10.401 -3.038 1.00 0.47 H new ATOM 0 HB2 ASN A 88 16.198 9.930 -3.416 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.990 10.057 -5.151 1.00 0.61 H new ATOM 0 HD21 ASN A 88 17.158 13.379 -4.883 1.00 0.97 H new ATOM 0 HD22 ASN A 88 17.441 11.742 -5.483 1.00 0.97 H new ATOM 1385 N GLU A 89 13.207 10.325 -6.255 1.00 0.42 N ATOM 1386 CA GLU A 89 12.541 10.997 -7.357 1.00 0.45 C ATOM 1387 C GLU A 89 11.028 10.965 -7.172 1.00 0.38 C ATOM 1388 O GLU A 89 10.296 11.672 -7.859 1.00 0.43 O ATOM 1389 CB GLU A 89 12.949 10.370 -8.692 1.00 0.54 C ATOM 1390 CG GLU A 89 14.441 10.480 -8.972 1.00 0.65 C ATOM 1391 CD GLU A 89 14.821 9.985 -10.351 1.00 1.23 C ATOM 1392 OE1 GLU A 89 14.682 10.759 -11.320 1.00 1.28 O ATOM 1393 OE2 GLU A 89 15.270 8.827 -10.475 1.00 2.04 O ATOM 0 H GLU A 89 13.547 9.389 -6.475 1.00 0.42 H new ATOM 0 HA GLU A 89 12.853 12.041 -7.366 1.00 0.45 H new ATOM 0 HB2 GLU A 89 12.661 9.319 -8.696 1.00 0.54 H new ATOM 0 HB3 GLU A 89 12.397 10.854 -9.498 1.00 0.54 H new ATOM 0 HG2 GLU A 89 14.749 11.520 -8.868 1.00 0.65 H new ATOM 0 HG3 GLU A 89 14.989 9.908 -8.223 1.00 0.65 H new ATOM 1400 N LEU A 90 10.566 10.141 -6.236 1.00 0.31 N ATOM 1401 CA LEU A 90 9.161 10.131 -5.855 1.00 0.27 C ATOM 1402 C LEU A 90 8.896 11.248 -4.857 1.00 0.25 C ATOM 1403 O LEU A 90 7.880 11.937 -4.927 1.00 0.26 O ATOM 1404 CB LEU A 90 8.767 8.797 -5.224 1.00 0.26 C ATOM 1405 CG LEU A 90 9.071 7.555 -6.054 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.657 6.308 -5.291 1.00 0.31 C ATOM 1407 CD2 LEU A 90 8.363 7.620 -7.396 1.00 0.37 C ATOM 0 H LEU A 90 11.146 9.472 -5.729 1.00 0.31 H new ATOM 0 HA LEU A 90 8.566 10.279 -6.756 1.00 0.27 H new ATOM 0 HB2 LEU A 90 9.278 8.705 -4.266 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.698 8.818 -5.014 1.00 0.26 H new ATOM 0 HG LEU A 90 10.144 7.513 -6.240 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.877 5.425 -5.890 1.00 0.31 H new ATOM 0 HD12 LEU A 90 9.208 6.256 -4.352 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.588 6.347 -5.082 1.00 0.31 H new ATOM 0 HD21 LEU A 90 8.593 6.724 -7.973 1.00 0.37 H new ATOM 0 HD22 LEU A 90 7.286 7.682 -7.237 1.00 0.37 H new ATOM 0 HD23 LEU A 90 8.700 8.500 -7.943 1.00 0.37 H new ATOM 1419 N PHE A 91 9.830 11.422 -3.930 1.00 0.27 N ATOM 1420 CA PHE A 91 9.707 12.448 -2.905 1.00 0.29 C ATOM 1421 C PHE A 91 9.916 13.826 -3.526 1.00 0.33 C ATOM 1422 O PHE A 91 9.184 14.771 -3.231 1.00 0.33 O ATOM 1423 CB PHE A 91 10.724 12.211 -1.780 1.00 0.35 C ATOM 1424 CG PHE A 91 10.358 12.882 -0.485 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.720 14.196 -0.234 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.648 12.191 0.482 1.00 0.37 C ATOM 1427 CE1 PHE A 91 10.377 14.808 0.957 1.00 0.53 C ATOM 1428 CE2 PHE A 91 9.303 12.799 1.674 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.667 14.109 1.911 1.00 0.50 C ATOM 0 H PHE A 91 10.682 10.864 -3.868 1.00 0.27 H new ATOM 0 HA PHE A 91 8.706 12.398 -2.477 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.821 11.139 -1.609 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.701 12.572 -2.103 1.00 0.35 H new ATOM 0 HD1 PHE A 91 11.276 14.748 -0.977 1.00 0.46 H new ATOM 0 HD2 PHE A 91 9.361 11.165 0.303 1.00 0.37 H new ATOM 0 HE1 PHE A 91 10.665 15.833 1.141 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.749 12.249 2.420 1.00 0.43 H new ATOM 0 HZ PHE A 91 9.397 14.586 2.841 1.00 0.50 H new ATOM 1439 N ARG A 92 10.897 13.919 -4.420 1.00 0.39 N ATOM 1440 CA ARG A 92 11.216 15.173 -5.089 1.00 0.49 C ATOM 1441 C ARG A 92 10.147 15.512 -6.127 1.00 0.51 C ATOM 1442 O ARG A 92 10.105 16.617 -6.662 1.00 0.62 O ATOM 1443 CB ARG A 92 12.593 15.074 -5.750 1.00 0.56 C ATOM 1444 CG ARG A 92 13.110 16.392 -6.309 1.00 1.24 C ATOM 1445 CD ARG A 92 14.456 16.209 -6.986 1.00 1.54 C ATOM 1446 NE ARG A 92 14.356 15.394 -8.196 1.00 2.30 N ATOM 1447 CZ ARG A 92 15.227 14.442 -8.533 1.00 2.99 C ATOM 1448 NH1 ARG A 92 16.236 14.135 -7.726 1.00 3.13 N ATOM 1449 NH2 ARG A 92 15.085 13.783 -9.676 1.00 3.95 N ATOM 0 H ARG A 92 11.487 13.135 -4.698 1.00 0.39 H new ATOM 0 HA ARG A 92 11.238 15.972 -4.348 1.00 0.49 H new ATOM 0 HB2 ARG A 92 13.308 14.696 -5.020 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.545 14.343 -6.557 1.00 0.56 H new ATOM 0 HG2 ARG A 92 12.392 16.794 -7.024 1.00 1.24 H new ATOM 0 HG3 ARG A 92 13.201 17.121 -5.504 1.00 1.24 H new ATOM 0 HD2 ARG A 92 14.869 17.185 -7.240 1.00 1.54 H new ATOM 0 HD3 ARG A 92 15.151 15.740 -6.290 1.00 1.54 H new ATOM 0 HE ARG A 92 13.569 15.565 -8.823 1.00 2.30 H new ATOM 0 HH11 ARG A 92 16.349 14.629 -6.841 1.00 3.13 H new ATOM 0 HH12 ARG A 92 16.898 13.405 -7.992 1.00 3.13 H new ATOM 0 HH21 ARG A 92 14.308 14.004 -10.299 1.00 3.95 H new ATOM 0 HH22 ARG A 92 15.753 13.055 -9.931 1.00 3.95 H new ATOM 1463 N ASP A 93 9.271 14.549 -6.384 1.00 0.46 N ATOM 1464 CA ASP A 93 8.166 14.722 -7.328 1.00 0.53 C ATOM 1465 C ASP A 93 7.033 15.513 -6.670 1.00 0.50 C ATOM 1466 O ASP A 93 5.976 15.732 -7.265 1.00 0.60 O ATOM 1467 CB ASP A 93 7.660 13.339 -7.789 1.00 0.62 C ATOM 1468 CG ASP A 93 6.550 13.409 -8.821 1.00 0.90 C ATOM 1469 OD1 ASP A 93 6.832 13.789 -9.976 1.00 1.14 O ATOM 1470 OD2 ASP A 93 5.393 13.068 -8.485 1.00 1.11 O ATOM 0 H ASP A 93 9.303 13.628 -5.947 1.00 0.46 H new ATOM 0 HA ASP A 93 8.517 15.279 -8.197 1.00 0.53 H new ATOM 0 HB2 ASP A 93 8.496 12.776 -8.205 1.00 0.62 H new ATOM 0 HB3 ASP A 93 7.303 12.785 -6.921 1.00 0.62 H new ATOM 1475 N GLY A 94 7.270 15.974 -5.449 1.00 0.45 N ATOM 1476 CA GLY A 94 6.215 16.617 -4.699 1.00 0.47 C ATOM 1477 C GLY A 94 5.353 15.588 -4.013 1.00 0.39 C ATOM 1478 O GLY A 94 4.142 15.779 -3.895 1.00 0.42 O ATOM 0 H GLY A 94 8.168 15.914 -4.969 1.00 0.45 H new ATOM 0 HA2 GLY A 94 6.646 17.291 -3.959 1.00 0.47 H new ATOM 0 HA3 GLY A 94 5.604 17.225 -5.367 1.00 0.47 H new ATOM 1482 N VAL A 95 6.015 14.496 -3.594 1.00 0.32 N ATOM 1483 CA VAL A 95 5.386 13.267 -3.086 1.00 0.26 C ATOM 1484 C VAL A 95 3.946 13.456 -2.613 1.00 0.25 C ATOM 1485 O VAL A 95 3.677 14.090 -1.597 1.00 0.29 O ATOM 1486 CB VAL A 95 6.229 12.648 -1.944 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.538 13.676 -0.864 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.526 11.434 -1.348 1.00 0.33 C ATOM 0 H VAL A 95 7.034 14.444 -3.600 1.00 0.32 H new ATOM 0 HA VAL A 95 5.351 12.588 -3.938 1.00 0.26 H new ATOM 0 HB VAL A 95 7.176 12.320 -2.372 1.00 0.31 H new ATOM 0 HG11 VAL A 95 7.131 13.210 -0.077 1.00 0.40 H new ATOM 0 HG12 VAL A 95 7.099 14.503 -1.299 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.606 14.052 -0.442 1.00 0.40 H new ATOM 0 HG21 VAL A 95 6.137 11.016 -0.548 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.558 11.735 -0.946 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.379 10.682 -2.123 1.00 0.33 H new ATOM 1498 N ASN A 96 3.028 12.923 -3.393 1.00 0.24 N ATOM 1499 CA ASN A 96 1.622 12.916 -3.030 1.00 0.29 C ATOM 1500 C ASN A 96 1.226 11.494 -2.630 1.00 0.23 C ATOM 1501 O ASN A 96 2.062 10.588 -2.662 1.00 0.21 O ATOM 1502 CB ASN A 96 0.770 13.421 -4.203 1.00 0.41 C ATOM 1503 CG ASN A 96 -0.542 14.050 -3.750 1.00 1.33 C ATOM 1504 OD1 ASN A 96 -1.078 13.711 -2.697 1.00 2.13 O ATOM 1505 ND2 ASN A 96 -1.073 14.970 -4.544 1.00 2.00 N ATOM 0 H ASN A 96 3.231 12.485 -4.291 1.00 0.24 H new ATOM 0 HA ASN A 96 1.449 13.584 -2.186 1.00 0.29 H new ATOM 0 HB2 ASN A 96 1.342 14.154 -4.773 1.00 0.41 H new ATOM 0 HB3 ASN A 96 0.557 12.590 -4.876 1.00 0.41 H new ATOM 0 HD21 ASN A 96 -1.952 15.419 -4.287 1.00 2.00 H new ATOM 0 HD22 ASN A 96 -0.602 15.228 -5.411 1.00 2.00 H new ATOM 1512 N TRP A 97 -0.035 11.292 -2.266 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.495 9.993 -1.778 1.00 0.24 C ATOM 1514 C TRP A 97 -0.288 8.892 -2.824 1.00 0.25 C ATOM 1515 O TRP A 97 0.037 7.755 -2.476 1.00 0.25 O ATOM 1516 CB TRP A 97 -1.969 10.055 -1.358 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.234 11.028 -0.243 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -2.945 12.193 -0.321 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.786 10.926 1.118 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.969 12.815 0.902 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -2.265 12.060 1.800 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -1.030 9.988 1.827 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -2.012 12.281 3.153 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.779 10.208 3.169 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -1.269 11.346 3.820 1.00 0.30 C ATOM 0 H TRP A 97 -0.759 12.010 -2.299 1.00 0.25 H new ATOM 0 HA TRP A 97 0.107 9.745 -0.904 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.574 10.331 -2.222 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.292 9.061 -1.047 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.419 12.569 -1.215 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -3.436 13.698 1.108 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.648 9.106 1.335 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -2.389 13.159 3.656 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 -0.195 9.489 3.724 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -1.056 11.489 4.869 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.449 9.238 -4.099 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.269 8.268 -5.167 1.00 0.29 C ATOM 1538 C GLY A 98 1.157 7.750 -5.255 1.00 0.26 C ATOM 1539 O GLY A 98 1.388 6.621 -5.691 1.00 0.27 O ATOM 0 H GLY A 98 -0.702 10.175 -4.412 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -0.947 7.429 -5.008 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.544 8.725 -6.117 1.00 0.29 H new ATOM 1543 N ARG A 99 2.113 8.564 -4.824 1.00 0.26 N ATOM 1544 CA ARG A 99 3.519 8.171 -4.858 1.00 0.25 C ATOM 1545 C ARG A 99 3.811 7.196 -3.730 1.00 0.21 C ATOM 1546 O ARG A 99 4.637 6.296 -3.871 1.00 0.20 O ATOM 1547 CB ARG A 99 4.441 9.390 -4.763 1.00 0.30 C ATOM 1548 CG ARG A 99 4.422 10.278 -6.002 1.00 0.70 C ATOM 1549 CD ARG A 99 4.867 9.516 -7.241 1.00 1.40 C ATOM 1550 NE ARG A 99 4.850 10.350 -8.442 1.00 1.74 N ATOM 1551 CZ ARG A 99 4.557 9.894 -9.659 1.00 2.46 C ATOM 1552 NH1 ARG A 99 4.184 8.633 -9.830 1.00 3.06 N ATOM 1553 NH2 ARG A 99 4.610 10.708 -10.704 1.00 2.98 N ATOM 0 H ARG A 99 1.943 9.497 -4.448 1.00 0.26 H new ATOM 0 HA ARG A 99 3.713 7.683 -5.813 1.00 0.25 H new ATOM 0 HB2 ARG A 99 4.152 9.985 -3.897 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.461 9.049 -4.588 1.00 0.30 H new ATOM 0 HG2 ARG A 99 3.416 10.669 -6.156 1.00 0.70 H new ATOM 0 HG3 ARG A 99 5.077 11.136 -5.846 1.00 0.70 H new ATOM 0 HD2 ARG A 99 5.874 9.129 -7.085 1.00 1.40 H new ATOM 0 HD3 ARG A 99 4.214 8.656 -7.390 1.00 1.40 H new ATOM 0 HE ARG A 99 5.076 11.340 -8.342 1.00 1.74 H new ATOM 0 HH11 ARG A 99 4.120 8.007 -9.027 1.00 3.06 H new ATOM 0 HH12 ARG A 99 3.961 8.289 -10.764 1.00 3.06 H new ATOM 0 HH21 ARG A 99 4.875 11.685 -10.577 1.00 2.98 H new ATOM 0 HH22 ARG A 99 4.385 10.358 -11.635 1.00 2.98 H new ATOM 1567 N ILE A 100 3.109 7.371 -2.617 1.00 0.22 N ATOM 1568 CA ILE A 100 3.197 6.442 -1.504 1.00 0.21 C ATOM 1569 C ILE A 100 2.641 5.091 -1.929 1.00 0.20 C ATOM 1570 O ILE A 100 3.244 4.047 -1.680 1.00 0.19 O ATOM 1571 CB ILE A 100 2.423 6.965 -0.275 1.00 0.24 C ATOM 1572 CG1 ILE A 100 3.086 8.236 0.261 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.344 5.901 0.808 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.483 8.743 1.550 1.00 0.30 C ATOM 0 H ILE A 100 2.471 8.152 -2.464 1.00 0.22 H new ATOM 0 HA ILE A 100 4.245 6.340 -1.222 1.00 0.21 H new ATOM 0 HB ILE A 100 1.405 7.205 -0.582 1.00 0.24 H new ATOM 0 HG12 ILE A 100 4.147 8.042 0.419 1.00 0.26 H new ATOM 0 HG13 ILE A 100 3.014 9.018 -0.495 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.794 6.293 1.664 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.830 5.022 0.418 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.351 5.624 1.120 1.00 0.24 H new ATOM 0 HD11 ILE A 100 3.006 9.646 1.866 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.429 8.971 1.394 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.579 7.979 2.322 1.00 0.30 H new ATOM 1586 N VAL A 101 1.491 5.134 -2.589 1.00 0.21 N ATOM 1587 CA VAL A 101 0.876 3.944 -3.147 1.00 0.21 C ATOM 1588 C VAL A 101 1.854 3.227 -4.062 1.00 0.20 C ATOM 1589 O VAL A 101 2.097 2.028 -3.915 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.378 4.303 -3.954 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -0.984 3.060 -4.572 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.389 5.010 -3.076 1.00 0.26 C ATOM 0 H VAL A 101 0.963 5.992 -2.750 1.00 0.21 H new ATOM 0 HA VAL A 101 0.597 3.295 -2.317 1.00 0.21 H new ATOM 0 HB VAL A 101 -0.090 4.980 -4.758 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -1.873 3.333 -5.141 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.257 2.593 -5.236 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.259 2.359 -3.784 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.272 5.257 -3.665 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.674 4.357 -2.251 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.949 5.925 -2.679 1.00 0.26 H new ATOM 1602 N ALA A 102 2.407 3.976 -5.006 1.00 0.19 N ATOM 1603 CA ALA A 102 3.362 3.437 -5.957 1.00 0.19 C ATOM 1604 C ALA A 102 4.540 2.790 -5.244 1.00 0.17 C ATOM 1605 O ALA A 102 4.946 1.685 -5.590 1.00 0.19 O ATOM 1606 CB ALA A 102 3.844 4.532 -6.887 1.00 0.21 C ATOM 0 H ALA A 102 2.206 4.968 -5.132 1.00 0.19 H new ATOM 0 HA ALA A 102 2.862 2.667 -6.544 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.560 4.118 -7.597 1.00 0.21 H new ATOM 0 HB2 ALA A 102 2.995 4.949 -7.429 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.324 5.319 -6.305 1.00 0.21 H new ATOM 1612 N PHE A 103 5.062 3.475 -4.230 1.00 0.16 N ATOM 1613 CA PHE A 103 6.211 2.981 -3.471 1.00 0.17 C ATOM 1614 C PHE A 103 5.939 1.591 -2.902 1.00 0.17 C ATOM 1615 O PHE A 103 6.780 0.695 -2.993 1.00 0.21 O ATOM 1616 CB PHE A 103 6.567 3.955 -2.338 1.00 0.17 C ATOM 1617 CG PHE A 103 7.679 3.462 -1.452 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.974 3.376 -1.932 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.427 3.072 -0.142 1.00 0.17 C ATOM 1620 CE1 PHE A 103 9.997 2.913 -1.128 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.446 2.607 0.664 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.733 2.527 0.169 1.00 0.26 C ATOM 0 H PHE A 103 4.707 4.377 -3.913 1.00 0.16 H new ATOM 0 HA PHE A 103 7.057 2.910 -4.155 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.855 4.913 -2.770 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.680 4.133 -1.730 1.00 0.17 H new ATOM 0 HD1 PHE A 103 9.187 3.675 -2.948 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.422 3.134 0.250 1.00 0.17 H new ATOM 0 HE1 PHE A 103 11.003 2.853 -1.515 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.238 2.306 1.680 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.532 2.162 0.798 1.00 0.26 H new ATOM 1632 N PHE A 104 4.757 1.409 -2.335 1.00 0.16 N ATOM 1633 CA PHE A 104 4.393 0.130 -1.741 1.00 0.18 C ATOM 1634 C PHE A 104 4.071 -0.894 -2.825 1.00 0.19 C ATOM 1635 O PHE A 104 4.377 -2.078 -2.684 1.00 0.23 O ATOM 1636 CB PHE A 104 3.207 0.291 -0.784 1.00 0.19 C ATOM 1637 CG PHE A 104 3.581 0.881 0.551 1.00 0.21 C ATOM 1638 CD1 PHE A 104 3.913 2.221 0.675 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.597 0.087 1.688 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.254 2.757 1.902 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.937 0.618 2.917 1.00 0.33 C ATOM 1642 CZ PHE A 104 4.265 1.954 3.024 1.00 0.30 C ATOM 0 H PHE A 104 4.035 2.127 -2.273 1.00 0.16 H new ATOM 0 HA PHE A 104 5.246 -0.232 -1.168 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.456 0.926 -1.254 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.746 -0.684 -0.624 1.00 0.19 H new ATOM 0 HD1 PHE A 104 3.905 2.855 -0.199 1.00 0.24 H new ATOM 0 HD2 PHE A 104 3.340 -0.959 1.612 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.511 3.803 1.983 1.00 0.27 H new ATOM 0 HE2 PHE A 104 3.946 -0.012 3.794 1.00 0.33 H new ATOM 0 HZ PHE A 104 4.530 2.371 3.985 1.00 0.30 H new ATOM 1652 N SER A 105 3.476 -0.427 -3.914 1.00 0.18 N ATOM 1653 CA SER A 105 3.132 -1.300 -5.028 1.00 0.21 C ATOM 1654 C SER A 105 4.395 -1.835 -5.706 1.00 0.21 C ATOM 1655 O SER A 105 4.427 -2.982 -6.152 1.00 0.23 O ATOM 1656 CB SER A 105 2.260 -0.551 -6.039 1.00 0.25 C ATOM 1657 OG SER A 105 1.118 0.007 -5.408 1.00 1.04 O ATOM 0 H SER A 105 3.221 0.551 -4.050 1.00 0.18 H new ATOM 0 HA SER A 105 2.568 -2.148 -4.639 1.00 0.21 H new ATOM 0 HB2 SER A 105 2.842 0.240 -6.512 1.00 0.25 H new ATOM 0 HB3 SER A 105 1.947 -1.232 -6.830 1.00 0.25 H new ATOM 0 HG SER A 105 1.392 0.756 -4.839 1.00 1.04 H new ATOM 1663 N PHE A 106 5.441 -1.008 -5.760 1.00 0.20 N ATOM 1664 CA PHE A 106 6.710 -1.424 -6.347 1.00 0.21 C ATOM 1665 C PHE A 106 7.282 -2.593 -5.565 1.00 0.22 C ATOM 1666 O PHE A 106 7.688 -3.593 -6.148 1.00 0.24 O ATOM 1667 CB PHE A 106 7.734 -0.280 -6.366 1.00 0.23 C ATOM 1668 CG PHE A 106 7.353 0.896 -7.225 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.527 0.742 -8.330 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.834 2.162 -6.926 1.00 0.27 C ATOM 1671 CE1 PHE A 106 6.186 1.828 -9.112 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.498 3.249 -7.706 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.672 3.083 -8.800 1.00 0.33 C ATOM 0 H PHE A 106 5.432 -0.052 -5.406 1.00 0.20 H new ATOM 0 HA PHE A 106 6.512 -1.720 -7.377 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.887 0.069 -5.345 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.689 -0.672 -6.715 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.147 -0.237 -8.581 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.480 2.299 -6.071 1.00 0.27 H new ATOM 0 HE1 PHE A 106 5.540 1.696 -9.967 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.881 4.229 -7.461 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.406 3.933 -9.411 1.00 0.33 H new ATOM 1683 N GLY A 107 7.288 -2.470 -4.241 1.00 0.23 N ATOM 1684 CA GLY A 107 7.783 -3.541 -3.397 1.00 0.27 C ATOM 1685 C GLY A 107 7.013 -4.828 -3.606 1.00 0.32 C ATOM 1686 O GLY A 107 7.585 -5.916 -3.567 1.00 0.37 O ATOM 0 H GLY A 107 6.958 -1.646 -3.738 1.00 0.23 H new ATOM 0 HA2 GLY A 107 8.839 -3.711 -3.609 1.00 0.27 H new ATOM 0 HA3 GLY A 107 7.712 -3.241 -2.351 1.00 0.27 H new ATOM 1690 N GLY A 108 5.713 -4.695 -3.843 1.00 0.33 N ATOM 1691 CA GLY A 108 4.869 -5.844 -4.124 1.00 0.41 C ATOM 1692 C GLY A 108 5.302 -6.592 -5.372 1.00 0.42 C ATOM 1693 O GLY A 108 5.034 -7.781 -5.518 1.00 0.63 O ATOM 0 H GLY A 108 5.223 -3.801 -3.846 1.00 0.33 H new ATOM 0 HA2 GLY A 108 4.890 -6.523 -3.272 1.00 0.41 H new ATOM 0 HA3 GLY A 108 3.837 -5.513 -4.242 1.00 0.41 H new ATOM 1697 N ALA A 109 5.958 -5.890 -6.278 1.00 0.27 N ATOM 1698 CA ALA A 109 6.528 -6.510 -7.460 1.00 0.26 C ATOM 1699 C ALA A 109 7.957 -6.956 -7.187 1.00 0.23 C ATOM 1700 O ALA A 109 8.362 -8.055 -7.573 1.00 0.24 O ATOM 1701 CB ALA A 109 6.494 -5.538 -8.625 1.00 0.29 C ATOM 0 H ALA A 109 6.110 -4.883 -6.217 1.00 0.27 H new ATOM 0 HA ALA A 109 5.934 -7.388 -7.716 1.00 0.26 H new ATOM 0 HB1 ALA A 109 6.924 -6.012 -9.507 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.462 -5.254 -8.832 1.00 0.29 H new ATOM 0 HB3 ALA A 109 7.072 -4.648 -8.374 1.00 0.29 H new ATOM 1707 N LEU A 110 8.702 -6.097 -6.500 1.00 0.22 N ATOM 1708 CA LEU A 110 10.103 -6.341 -6.188 1.00 0.23 C ATOM 1709 C LEU A 110 10.283 -7.640 -5.424 1.00 0.21 C ATOM 1710 O LEU A 110 11.154 -8.448 -5.748 1.00 0.21 O ATOM 1711 CB LEU A 110 10.660 -5.184 -5.361 1.00 0.25 C ATOM 1712 CG LEU A 110 10.645 -3.829 -6.053 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.173 -2.757 -5.120 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.462 -3.883 -7.330 1.00 0.36 C ATOM 0 H LEU A 110 8.349 -5.209 -6.143 1.00 0.22 H new ATOM 0 HA LEU A 110 10.646 -6.419 -7.130 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.086 -5.109 -4.437 1.00 0.25 H new ATOM 0 HB3 LEU A 110 11.687 -5.420 -5.080 1.00 0.25 H new ATOM 0 HG LEU A 110 9.617 -3.578 -6.315 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.157 -1.793 -5.628 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.546 -2.709 -4.229 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.196 -2.998 -4.831 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.443 -2.907 -7.816 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.492 -4.150 -7.092 1.00 0.36 H new ATOM 0 HD23 LEU A 110 11.039 -4.630 -8.001 1.00 0.36 H new ATOM 1726 N CYS A 111 9.461 -7.833 -4.403 1.00 0.21 N ATOM 1727 CA CYS A 111 9.543 -9.023 -3.572 1.00 0.21 C ATOM 1728 C CYS A 111 9.345 -10.284 -4.405 1.00 0.21 C ATOM 1729 O CYS A 111 9.937 -11.323 -4.132 1.00 0.25 O ATOM 1730 CB CYS A 111 8.510 -8.959 -2.450 1.00 0.22 C ATOM 1731 SG CYS A 111 6.811 -8.716 -3.014 1.00 1.34 S ATOM 0 H CYS A 111 8.728 -7.178 -4.130 1.00 0.21 H new ATOM 0 HA CYS A 111 10.539 -9.061 -3.130 1.00 0.21 H new ATOM 0 HB2 CYS A 111 8.560 -9.883 -1.873 1.00 0.22 H new ATOM 0 HB3 CYS A 111 8.775 -8.146 -1.774 1.00 0.22 H new ATOM 0 HG CYS A 111 6.660 -7.491 -3.421 1.00 1.34 H new ATOM 1737 N VAL A 112 8.529 -10.174 -5.438 1.00 0.19 N ATOM 1738 CA VAL A 112 8.242 -11.301 -6.301 1.00 0.20 C ATOM 1739 C VAL A 112 9.411 -11.580 -7.232 1.00 0.22 C ATOM 1740 O VAL A 112 9.950 -12.688 -7.251 1.00 0.25 O ATOM 1741 CB VAL A 112 6.977 -11.041 -7.134 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.707 -12.204 -8.069 1.00 0.27 C ATOM 1743 CG2 VAL A 112 5.788 -10.798 -6.222 1.00 0.25 C ATOM 0 H VAL A 112 8.052 -9.311 -5.699 1.00 0.19 H new ATOM 0 HA VAL A 112 8.078 -12.171 -5.665 1.00 0.20 H new ATOM 0 HB VAL A 112 7.136 -10.148 -7.739 1.00 0.23 H new ATOM 0 HG11 VAL A 112 5.808 -12.002 -8.651 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.554 -12.333 -8.743 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.565 -13.114 -7.486 1.00 0.27 H new ATOM 0 HG21 VAL A 112 4.898 -10.615 -6.825 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.627 -11.674 -5.593 1.00 0.25 H new ATOM 0 HG23 VAL A 112 5.984 -9.930 -5.592 1.00 0.25 H new ATOM 1753 N GLU A 113 9.801 -10.566 -7.993 1.00 0.22 N ATOM 1754 CA GLU A 113 10.857 -10.713 -8.990 1.00 0.25 C ATOM 1755 C GLU A 113 12.178 -11.141 -8.359 1.00 0.25 C ATOM 1756 O GLU A 113 13.004 -11.773 -9.013 1.00 0.30 O ATOM 1757 CB GLU A 113 11.039 -9.419 -9.784 1.00 0.29 C ATOM 1758 CG GLU A 113 11.358 -8.201 -8.936 1.00 0.30 C ATOM 1759 CD GLU A 113 11.416 -6.933 -9.759 1.00 0.39 C ATOM 1760 OE1 GLU A 113 10.411 -6.619 -10.438 1.00 0.51 O ATOM 1761 OE2 GLU A 113 12.469 -6.262 -9.750 1.00 0.50 O ATOM 0 H GLU A 113 9.401 -9.629 -7.940 1.00 0.22 H new ATOM 0 HA GLU A 113 10.547 -11.503 -9.674 1.00 0.25 H new ATOM 0 HB2 GLU A 113 11.841 -9.562 -10.509 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.128 -9.224 -10.350 1.00 0.29 H new ATOM 0 HG2 GLU A 113 10.602 -8.093 -8.158 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.314 -8.350 -8.433 1.00 0.30 H new ATOM 1768 N SER A 114 12.372 -10.817 -7.090 1.00 0.23 N ATOM 1769 CA SER A 114 13.580 -11.219 -6.396 1.00 0.28 C ATOM 1770 C SER A 114 13.549 -12.714 -6.095 1.00 0.27 C ATOM 1771 O SER A 114 14.479 -13.442 -6.437 1.00 0.31 O ATOM 1772 CB SER A 114 13.769 -10.402 -5.116 1.00 0.33 C ATOM 1773 OG SER A 114 12.574 -10.340 -4.366 1.00 0.99 O ATOM 0 H SER A 114 11.713 -10.281 -6.526 1.00 0.23 H new ATOM 0 HA SER A 114 14.433 -11.021 -7.045 1.00 0.28 H new ATOM 0 HB2 SER A 114 14.558 -10.848 -4.511 1.00 0.33 H new ATOM 0 HB3 SER A 114 14.094 -9.393 -5.371 1.00 0.33 H new ATOM 0 HG SER A 114 12.010 -9.616 -4.709 1.00 0.99 H new ATOM 1779 N VAL A 115 12.461 -13.174 -5.487 1.00 0.28 N ATOM 1780 CA VAL A 115 12.308 -14.586 -5.161 1.00 0.33 C ATOM 1781 C VAL A 115 12.301 -15.428 -6.430 1.00 0.37 C ATOM 1782 O VAL A 115 12.935 -16.481 -6.496 1.00 0.42 O ATOM 1783 CB VAL A 115 11.009 -14.839 -4.375 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.835 -16.320 -4.084 1.00 0.45 C ATOM 1785 CG2 VAL A 115 11.010 -14.041 -3.085 1.00 0.41 C ATOM 0 H VAL A 115 11.672 -12.589 -5.210 1.00 0.28 H new ATOM 0 HA VAL A 115 13.155 -14.873 -4.538 1.00 0.33 H new ATOM 0 HB VAL A 115 10.168 -14.512 -4.987 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.911 -16.475 -3.528 1.00 0.45 H new ATOM 0 HG12 VAL A 115 10.791 -16.873 -5.023 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.678 -16.676 -3.493 1.00 0.45 H new ATOM 0 HG21 VAL A 115 10.085 -14.230 -2.540 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.860 -14.341 -2.472 1.00 0.41 H new ATOM 0 HG23 VAL A 115 11.085 -12.978 -3.315 1.00 0.41 H new ATOM 1795 N ASP A 116 11.591 -14.939 -7.437 1.00 0.38 N ATOM 1796 CA ASP A 116 11.491 -15.615 -8.729 1.00 0.46 C ATOM 1797 C ASP A 116 12.865 -15.817 -9.371 1.00 0.47 C ATOM 1798 O ASP A 116 13.077 -16.775 -10.113 1.00 0.56 O ATOM 1799 CB ASP A 116 10.586 -14.807 -9.665 1.00 0.49 C ATOM 1800 CG ASP A 116 10.542 -15.366 -11.070 1.00 1.08 C ATOM 1801 OD1 ASP A 116 9.791 -16.336 -11.305 1.00 1.23 O ATOM 1802 OD2 ASP A 116 11.245 -14.827 -11.947 1.00 1.89 O ATOM 0 H ASP A 116 11.068 -14.065 -7.385 1.00 0.38 H new ATOM 0 HA ASP A 116 11.059 -16.601 -8.561 1.00 0.46 H new ATOM 0 HB2 ASP A 116 9.576 -14.786 -9.256 1.00 0.49 H new ATOM 0 HB3 ASP A 116 10.937 -13.776 -9.701 1.00 0.49 H new ATOM 1807 N LYS A 117 13.799 -14.925 -9.073 1.00 0.43 N ATOM 1808 CA LYS A 117 15.147 -15.023 -9.624 1.00 0.49 C ATOM 1809 C LYS A 117 16.114 -15.631 -8.613 1.00 0.47 C ATOM 1810 O LYS A 117 17.326 -15.449 -8.722 1.00 0.52 O ATOM 1811 CB LYS A 117 15.651 -13.645 -10.062 1.00 0.53 C ATOM 1812 CG LYS A 117 14.810 -13.005 -11.154 1.00 0.61 C ATOM 1813 CD LYS A 117 15.371 -11.654 -11.557 1.00 1.20 C ATOM 1814 CE LYS A 117 14.463 -10.940 -12.545 1.00 1.32 C ATOM 1815 NZ LYS A 117 14.239 -11.733 -13.783 1.00 1.90 N ATOM 0 H LYS A 117 13.651 -14.127 -8.455 1.00 0.43 H new ATOM 0 HA LYS A 117 15.101 -15.678 -10.494 1.00 0.49 H new ATOM 0 HB2 LYS A 117 15.671 -12.983 -9.196 1.00 0.53 H new ATOM 0 HB3 LYS A 117 16.678 -13.739 -10.415 1.00 0.53 H new ATOM 0 HG2 LYS A 117 14.777 -13.662 -12.023 1.00 0.61 H new ATOM 0 HG3 LYS A 117 13.784 -12.886 -10.805 1.00 0.61 H new ATOM 0 HD2 LYS A 117 15.501 -11.035 -10.670 1.00 1.20 H new ATOM 0 HD3 LYS A 117 16.358 -11.787 -12.000 1.00 1.20 H new ATOM 0 HE2 LYS A 117 13.504 -10.734 -12.070 1.00 1.32 H new ATOM 0 HE3 LYS A 117 14.902 -9.977 -12.808 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 13.729 -11.153 -14.479 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 15.155 -12.024 -14.180 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 13.676 -12.578 -13.557 1.00 1.90 H new ATOM 1829 N GLU A 118 15.566 -16.352 -7.633 1.00 0.45 N ATOM 1830 CA GLU A 118 16.366 -17.057 -6.627 1.00 0.49 C ATOM 1831 C GLU A 118 17.164 -16.077 -5.772 1.00 0.45 C ATOM 1832 O GLU A 118 18.248 -16.395 -5.283 1.00 0.55 O ATOM 1833 CB GLU A 118 17.311 -18.067 -7.291 1.00 0.59 C ATOM 1834 CG GLU A 118 16.600 -19.107 -8.142 1.00 1.07 C ATOM 1835 CD GLU A 118 15.627 -19.953 -7.350 1.00 1.72 C ATOM 1836 OE1 GLU A 118 16.069 -20.923 -6.703 1.00 1.89 O ATOM 1837 OE2 GLU A 118 14.413 -19.659 -7.378 1.00 2.54 O ATOM 0 H GLU A 118 14.559 -16.464 -7.514 1.00 0.45 H new ATOM 0 HA GLU A 118 15.677 -17.597 -5.978 1.00 0.49 H new ATOM 0 HB2 GLU A 118 18.024 -17.527 -7.914 1.00 0.59 H new ATOM 0 HB3 GLU A 118 17.885 -18.576 -6.517 1.00 0.59 H new ATOM 0 HG2 GLU A 118 16.064 -18.605 -8.948 1.00 1.07 H new ATOM 0 HG3 GLU A 118 17.341 -19.756 -8.608 1.00 1.07 H new ATOM 1844 N MET A 119 16.617 -14.887 -5.587 1.00 0.35 N ATOM 1845 CA MET A 119 17.243 -13.874 -4.753 1.00 0.33 C ATOM 1846 C MET A 119 16.450 -13.725 -3.460 1.00 0.31 C ATOM 1847 O MET A 119 15.882 -12.671 -3.170 1.00 0.27 O ATOM 1848 CB MET A 119 17.328 -12.534 -5.494 1.00 0.34 C ATOM 1849 CG MET A 119 18.064 -12.620 -6.823 1.00 0.41 C ATOM 1850 SD MET A 119 18.229 -11.023 -7.646 1.00 0.47 S ATOM 1851 CE MET A 119 16.518 -10.523 -7.785 1.00 0.44 C ATOM 0 H MET A 119 15.734 -14.597 -6.007 1.00 0.35 H new ATOM 0 HA MET A 119 18.260 -14.186 -4.516 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.319 -12.161 -5.670 1.00 0.34 H new ATOM 0 HB3 MET A 119 17.830 -11.807 -4.856 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.056 -13.040 -6.656 1.00 0.41 H new ATOM 0 HG3 MET A 119 17.534 -13.308 -7.481 1.00 0.41 H new ATOM 0 HE1 MET A 119 16.370 -9.991 -8.724 1.00 0.44 H new ATOM 0 HE2 MET A 119 15.878 -11.405 -7.763 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.262 -9.868 -6.952 1.00 0.44 H new ATOM 1861 N GLN A 120 16.424 -14.801 -2.685 1.00 0.36 N ATOM 1862 CA GLN A 120 15.616 -14.875 -1.472 1.00 0.39 C ATOM 1863 C GLN A 120 16.200 -14.030 -0.345 1.00 0.41 C ATOM 1864 O GLN A 120 15.530 -13.766 0.651 1.00 0.47 O ATOM 1865 CB GLN A 120 15.481 -16.325 -1.013 1.00 0.49 C ATOM 1866 CG GLN A 120 14.641 -17.189 -1.944 1.00 0.53 C ATOM 1867 CD GLN A 120 14.631 -18.648 -1.529 1.00 0.65 C ATOM 1868 OE1 GLN A 120 14.808 -18.970 -0.353 1.00 0.71 O ATOM 1869 NE2 GLN A 120 14.405 -19.537 -2.483 1.00 0.70 N ATOM 0 H GLN A 120 16.961 -15.647 -2.878 1.00 0.36 H new ATOM 0 HA GLN A 120 14.631 -14.475 -1.714 1.00 0.39 H new ATOM 0 HB2 GLN A 120 16.475 -16.763 -0.925 1.00 0.49 H new ATOM 0 HB3 GLN A 120 15.037 -16.341 -0.018 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.618 -16.812 -1.961 1.00 0.53 H new ATOM 0 HG3 GLN A 120 15.028 -17.106 -2.960 1.00 0.53 H new ATOM 0 HE21 GLN A 120 14.263 -19.228 -3.445 1.00 0.70 H new ATOM 0 HE22 GLN A 120 14.372 -20.531 -2.256 1.00 0.70 H new ATOM 1878 N VAL A 121 17.448 -13.620 -0.488 1.00 0.39 N ATOM 1879 CA VAL A 121 18.053 -12.727 0.486 1.00 0.44 C ATOM 1880 C VAL A 121 17.674 -11.279 0.190 1.00 0.38 C ATOM 1881 O VAL A 121 17.692 -10.425 1.075 1.00 0.47 O ATOM 1882 CB VAL A 121 19.588 -12.862 0.523 1.00 0.52 C ATOM 1883 CG1 VAL A 121 19.989 -14.261 0.967 1.00 0.98 C ATOM 1884 CG2 VAL A 121 20.193 -12.536 -0.833 1.00 0.92 C ATOM 0 H VAL A 121 18.058 -13.887 -1.261 1.00 0.39 H new ATOM 0 HA VAL A 121 17.667 -13.015 1.464 1.00 0.44 H new ATOM 0 HB VAL A 121 19.976 -12.146 1.247 1.00 0.52 H new ATOM 0 HG11 VAL A 121 21.076 -14.339 0.987 1.00 0.98 H new ATOM 0 HG12 VAL A 121 19.593 -14.454 1.964 1.00 0.98 H new ATOM 0 HG13 VAL A 121 19.586 -14.994 0.268 1.00 0.98 H new ATOM 0 HG21 VAL A 121 21.277 -12.638 -0.782 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.799 -13.223 -1.582 1.00 0.92 H new ATOM 0 HG23 VAL A 121 19.938 -11.513 -1.109 1.00 0.92 H new ATOM 1894 N LEU A 122 17.299 -11.021 -1.057 1.00 0.30 N ATOM 1895 CA LEU A 122 16.930 -9.681 -1.482 1.00 0.27 C ATOM 1896 C LEU A 122 15.506 -9.339 -1.074 1.00 0.23 C ATOM 1897 O LEU A 122 15.231 -8.208 -0.686 1.00 0.23 O ATOM 1898 CB LEU A 122 17.095 -9.517 -2.992 1.00 0.28 C ATOM 1899 CG LEU A 122 18.461 -9.001 -3.442 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.569 -9.941 -3.006 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.480 -8.818 -4.945 1.00 0.41 C ATOM 0 H LEU A 122 17.243 -11.726 -1.792 1.00 0.30 H new ATOM 0 HA LEU A 122 17.605 -8.988 -0.980 1.00 0.27 H new ATOM 0 HB2 LEU A 122 16.913 -10.480 -3.469 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.328 -8.832 -3.354 1.00 0.28 H new ATOM 0 HG LEU A 122 18.635 -8.035 -2.968 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.530 -9.550 -3.339 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.568 -10.025 -1.919 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.406 -10.925 -3.446 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.458 -8.450 -5.254 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.282 -9.774 -5.430 1.00 0.41 H new ATOM 0 HD23 LEU A 122 17.714 -8.099 -5.234 1.00 0.41 H new ATOM 1913 N VAL A 123 14.606 -10.317 -1.147 1.00 0.23 N ATOM 1914 CA VAL A 123 13.207 -10.091 -0.795 1.00 0.25 C ATOM 1915 C VAL A 123 13.079 -9.593 0.643 1.00 0.27 C ATOM 1916 O VAL A 123 12.285 -8.698 0.939 1.00 0.31 O ATOM 1917 CB VAL A 123 12.347 -11.361 -1.000 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.874 -12.528 -0.181 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.893 -11.079 -0.656 1.00 0.31 C ATOM 0 H VAL A 123 14.819 -11.269 -1.445 1.00 0.23 H new ATOM 0 HA VAL A 123 12.830 -9.321 -1.468 1.00 0.25 H new ATOM 0 HB VAL A 123 12.410 -11.640 -2.052 1.00 0.28 H new ATOM 0 HG11 VAL A 123 12.246 -13.403 -0.349 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.897 -12.752 -0.483 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.857 -12.267 0.877 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.302 -11.982 -0.806 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.820 -10.766 0.385 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.514 -10.286 -1.301 1.00 0.31 H new ATOM 1929 N SER A 124 13.891 -10.156 1.523 1.00 0.29 N ATOM 1930 CA SER A 124 13.895 -9.762 2.920 1.00 0.35 C ATOM 1931 C SER A 124 14.426 -8.337 3.069 1.00 0.34 C ATOM 1932 O SER A 124 13.932 -7.557 3.885 1.00 0.44 O ATOM 1933 CB SER A 124 14.756 -10.738 3.719 1.00 0.43 C ATOM 1934 OG SER A 124 14.421 -12.083 3.410 1.00 1.32 O ATOM 0 H SER A 124 14.559 -10.891 1.291 1.00 0.29 H new ATOM 0 HA SER A 124 12.875 -9.787 3.304 1.00 0.35 H new ATOM 0 HB2 SER A 124 15.809 -10.562 3.500 1.00 0.43 H new ATOM 0 HB3 SER A 124 14.618 -10.561 4.786 1.00 0.43 H new ATOM 0 HG SER A 124 14.986 -12.689 3.933 1.00 1.32 H new ATOM 1940 N ARG A 125 15.414 -7.993 2.249 1.00 0.28 N ATOM 1941 CA ARG A 125 16.031 -6.675 2.308 1.00 0.31 C ATOM 1942 C ARG A 125 15.102 -5.621 1.716 1.00 0.24 C ATOM 1943 O ARG A 125 15.157 -4.457 2.100 1.00 0.24 O ATOM 1944 CB ARG A 125 17.381 -6.677 1.576 1.00 0.41 C ATOM 1945 CG ARG A 125 18.438 -7.551 2.252 1.00 0.91 C ATOM 1946 CD ARG A 125 19.744 -7.613 1.463 1.00 0.74 C ATOM 1947 NE ARG A 125 20.732 -8.461 2.130 1.00 1.01 N ATOM 1948 CZ ARG A 125 22.013 -8.551 1.772 1.00 1.24 C ATOM 1949 NH1 ARG A 125 22.472 -7.871 0.729 1.00 1.28 N ATOM 1950 NH2 ARG A 125 22.839 -9.329 2.460 1.00 1.84 N ATOM 0 H ARG A 125 15.804 -8.610 1.536 1.00 0.28 H new ATOM 0 HA ARG A 125 16.209 -6.427 3.354 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.231 -7.026 0.554 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.753 -5.654 1.512 1.00 0.41 H new ATOM 0 HG2 ARG A 125 18.640 -7.163 3.251 1.00 0.91 H new ATOM 0 HG3 ARG A 125 18.045 -8.560 2.375 1.00 0.91 H new ATOM 0 HD2 ARG A 125 19.548 -7.998 0.462 1.00 0.74 H new ATOM 0 HD3 ARG A 125 20.147 -6.607 1.344 1.00 0.74 H new ATOM 0 HE ARG A 125 20.420 -9.021 2.923 1.00 1.01 H new ATOM 0 HH11 ARG A 125 21.843 -7.273 0.193 1.00 1.28 H new ATOM 0 HH12 ARG A 125 23.454 -7.946 0.463 1.00 1.28 H new ATOM 0 HH21 ARG A 125 22.493 -9.857 3.261 1.00 1.84 H new ATOM 0 HH22 ARG A 125 23.819 -9.399 2.187 1.00 1.84 H new ATOM 1964 N ILE A 126 14.244 -6.045 0.796 1.00 0.21 N ATOM 1965 CA ILE A 126 13.247 -5.162 0.203 1.00 0.19 C ATOM 1966 C ILE A 126 12.358 -4.555 1.281 1.00 0.19 C ATOM 1967 O ILE A 126 12.200 -3.334 1.354 1.00 0.19 O ATOM 1968 CB ILE A 126 12.390 -5.928 -0.823 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.236 -6.253 -2.051 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.154 -5.133 -1.215 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.529 -7.108 -3.067 1.00 0.23 C ATOM 0 H ILE A 126 14.219 -7.001 0.443 1.00 0.21 H new ATOM 0 HA ILE A 126 13.769 -4.355 -0.311 1.00 0.19 H new ATOM 0 HB ILE A 126 12.047 -6.857 -0.367 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.544 -5.321 -2.525 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.144 -6.763 -1.730 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.571 -5.701 -1.940 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.547 -4.944 -0.330 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.457 -4.184 -1.657 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.194 -7.296 -3.910 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.245 -8.056 -2.610 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.635 -6.592 -3.418 1.00 0.23 H new ATOM 1983 N ALA A 127 11.789 -5.413 2.119 1.00 0.22 N ATOM 1984 CA ALA A 127 10.966 -4.961 3.230 1.00 0.25 C ATOM 1985 C ALA A 127 11.742 -4.010 4.130 1.00 0.24 C ATOM 1986 O ALA A 127 11.193 -3.037 4.647 1.00 0.26 O ATOM 1987 CB ALA A 127 10.462 -6.150 4.028 1.00 0.30 C ATOM 0 H ALA A 127 11.884 -6.426 2.049 1.00 0.22 H new ATOM 0 HA ALA A 127 10.111 -4.421 2.824 1.00 0.25 H new ATOM 0 HB1 ALA A 127 9.847 -5.798 4.857 1.00 0.30 H new ATOM 0 HB2 ALA A 127 9.866 -6.795 3.383 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.310 -6.712 4.419 1.00 0.30 H new ATOM 1993 N ALA A 128 13.028 -4.288 4.292 1.00 0.22 N ATOM 1994 CA ALA A 128 13.896 -3.457 5.110 1.00 0.23 C ATOM 1995 C ALA A 128 14.069 -2.075 4.492 1.00 0.19 C ATOM 1996 O ALA A 128 13.925 -1.060 5.173 1.00 0.19 O ATOM 1997 CB ALA A 128 15.245 -4.129 5.295 1.00 0.27 C ATOM 0 H ALA A 128 13.494 -5.088 3.864 1.00 0.22 H new ATOM 0 HA ALA A 128 13.429 -3.333 6.087 1.00 0.23 H new ATOM 0 HB1 ALA A 128 15.885 -3.496 5.909 1.00 0.27 H new ATOM 0 HB2 ALA A 128 15.107 -5.092 5.787 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.712 -4.282 4.322 1.00 0.27 H new ATOM 2003 N TRP A 129 14.361 -2.039 3.193 1.00 0.17 N ATOM 2004 CA TRP A 129 14.557 -0.772 2.489 1.00 0.17 C ATOM 2005 C TRP A 129 13.276 0.051 2.495 1.00 0.15 C ATOM 2006 O TRP A 129 13.312 1.267 2.693 1.00 0.18 O ATOM 2007 CB TRP A 129 15.011 -1.000 1.042 1.00 0.20 C ATOM 2008 CG TRP A 129 16.298 -1.757 0.923 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.382 -1.665 1.747 1.00 0.27 C ATOM 2010 CD2 TRP A 129 16.640 -2.709 -0.090 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.373 -2.514 1.316 1.00 0.33 N ATOM 2012 CE2 TRP A 129 17.942 -3.163 0.188 1.00 0.36 C ATOM 2013 CE3 TRP A 129 15.969 -3.225 -1.203 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 18.587 -4.108 -0.606 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 16.609 -4.163 -1.990 1.00 0.47 C ATOM 2016 CH2 TRP A 129 17.907 -4.597 -1.689 1.00 0.50 C ATOM 0 H TRP A 129 14.467 -2.868 2.609 1.00 0.17 H new ATOM 0 HA TRP A 129 15.339 -0.226 3.017 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.231 -1.542 0.508 1.00 0.20 H new ATOM 0 HB3 TRP A 129 15.122 -0.034 0.550 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.451 -1.020 2.611 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.281 -2.641 1.763 1.00 0.33 H new ATOM 0 HE3 TRP A 129 14.969 -2.896 -1.443 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.588 -4.443 -0.376 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 16.100 -4.569 -2.852 1.00 0.47 H new ATOM 0 HH2 TRP A 129 18.380 -5.332 -2.324 1.00 0.50 H new ATOM 2027 N MET A 130 12.145 -0.618 2.297 1.00 0.16 N ATOM 2028 CA MET A 130 10.859 0.067 2.261 1.00 0.21 C ATOM 2029 C MET A 130 10.513 0.645 3.625 1.00 0.19 C ATOM 2030 O MET A 130 10.107 1.800 3.730 1.00 0.21 O ATOM 2031 CB MET A 130 9.741 -0.870 1.800 1.00 0.29 C ATOM 2032 CG MET A 130 9.813 -1.257 0.332 1.00 0.33 C ATOM 2033 SD MET A 130 8.418 -2.279 -0.172 1.00 0.71 S ATOM 2034 CE MET A 130 7.053 -1.223 0.305 1.00 0.29 C ATOM 0 H MET A 130 12.093 -1.627 2.160 1.00 0.16 H new ATOM 0 HA MET A 130 10.947 0.882 1.542 1.00 0.21 H new ATOM 0 HB2 MET A 130 9.771 -1.777 2.404 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.780 -0.391 1.991 1.00 0.29 H new ATOM 0 HG2 MET A 130 9.839 -0.355 -0.279 1.00 0.33 H new ATOM 0 HG3 MET A 130 10.742 -1.796 0.145 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.118 -1.654 -0.052 1.00 0.29 H new ATOM 0 HE2 MET A 130 7.022 -1.137 1.391 1.00 0.29 H new ATOM 0 HE3 MET A 130 7.187 -0.234 -0.134 1.00 0.29 H new ATOM 2044 N ALA A 131 10.691 -0.161 4.669 1.00 0.18 N ATOM 2045 CA ALA A 131 10.410 0.277 6.029 1.00 0.20 C ATOM 2046 C ALA A 131 11.303 1.450 6.406 1.00 0.21 C ATOM 2047 O ALA A 131 10.864 2.398 7.057 1.00 0.23 O ATOM 2048 CB ALA A 131 10.601 -0.874 7.004 1.00 0.23 C ATOM 0 H ALA A 131 11.029 -1.121 4.597 1.00 0.18 H new ATOM 0 HA ALA A 131 9.372 0.606 6.081 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.388 -0.532 8.017 1.00 0.23 H new ATOM 0 HB2 ALA A 131 9.923 -1.687 6.745 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.630 -1.229 6.950 1.00 0.23 H new ATOM 2054 N THR A 132 12.554 1.381 5.971 1.00 0.22 N ATOM 2055 CA THR A 132 13.507 2.453 6.205 1.00 0.25 C ATOM 2056 C THR A 132 13.042 3.743 5.532 1.00 0.24 C ATOM 2057 O THR A 132 12.874 4.764 6.198 1.00 0.25 O ATOM 2058 CB THR A 132 14.909 2.074 5.682 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.344 0.853 6.297 1.00 0.33 O ATOM 2060 CG2 THR A 132 15.915 3.176 5.974 1.00 0.37 C ATOM 0 H THR A 132 12.932 0.589 5.452 1.00 0.22 H new ATOM 0 HA THR A 132 13.566 2.612 7.282 1.00 0.25 H new ATOM 0 HB THR A 132 14.845 1.940 4.602 1.00 0.31 H new ATOM 0 HG1 THR A 132 14.857 0.098 5.906 1.00 0.33 H new ATOM 0 HG21 THR A 132 16.895 2.884 5.595 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.597 4.097 5.486 1.00 0.37 H new ATOM 0 HG23 THR A 132 15.975 3.338 7.050 1.00 0.37 H new ATOM 2068 N TYR A 133 12.824 3.689 4.217 1.00 0.23 N ATOM 2069 CA TYR A 133 12.398 4.868 3.464 1.00 0.24 C ATOM 2070 C TYR A 133 11.095 5.425 4.024 1.00 0.21 C ATOM 2071 O TYR A 133 10.941 6.638 4.166 1.00 0.23 O ATOM 2072 CB TYR A 133 12.227 4.532 1.978 1.00 0.27 C ATOM 2073 CG TYR A 133 11.706 5.692 1.153 1.00 0.33 C ATOM 2074 CD1 TYR A 133 12.555 6.704 0.729 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.365 5.771 0.801 1.00 0.36 C ATOM 2076 CE1 TYR A 133 12.082 7.763 -0.025 1.00 0.50 C ATOM 2077 CE2 TYR A 133 9.886 6.823 0.046 1.00 0.45 C ATOM 2078 CZ TYR A 133 10.748 7.817 -0.364 1.00 0.51 C ATOM 2079 OH TYR A 133 10.275 8.863 -1.122 1.00 0.61 O ATOM 0 H TYR A 133 12.935 2.846 3.654 1.00 0.23 H new ATOM 0 HA TYR A 133 13.174 5.627 3.564 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.187 4.211 1.573 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.542 3.690 1.880 1.00 0.27 H new ATOM 0 HD1 TYR A 133 13.602 6.664 0.992 1.00 0.42 H new ATOM 0 HD2 TYR A 133 9.685 4.996 1.123 1.00 0.36 H new ATOM 0 HE1 TYR A 133 12.755 8.544 -0.346 1.00 0.50 H new ATOM 0 HE2 TYR A 133 8.841 6.867 -0.222 1.00 0.45 H new ATOM 0 HH TYR A 133 10.738 8.877 -1.985 1.00 0.61 H new ATOM 2089 N LEU A 134 10.170 4.535 4.355 1.00 0.20 N ATOM 2090 CA LEU A 134 8.887 4.937 4.903 1.00 0.20 C ATOM 2091 C LEU A 134 9.071 5.688 6.218 1.00 0.21 C ATOM 2092 O LEU A 134 8.602 6.807 6.364 1.00 0.24 O ATOM 2093 CB LEU A 134 7.987 3.717 5.103 1.00 0.20 C ATOM 2094 CG LEU A 134 6.724 3.961 5.933 1.00 0.22 C ATOM 2095 CD1 LEU A 134 5.853 5.018 5.285 1.00 0.26 C ATOM 2096 CD2 LEU A 134 5.948 2.666 6.119 1.00 0.26 C ATOM 0 H LEU A 134 10.287 3.527 4.252 1.00 0.20 H new ATOM 0 HA LEU A 134 8.407 5.610 4.192 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.691 3.341 4.124 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.570 2.931 5.583 1.00 0.20 H new ATOM 0 HG LEU A 134 7.025 4.324 6.916 1.00 0.22 H new ATOM 0 HD11 LEU A 134 4.961 5.176 5.891 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.410 5.952 5.209 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.561 4.688 4.288 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.054 2.860 6.711 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.660 2.272 5.145 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.574 1.938 6.634 1.00 0.26 H new ATOM 2108 N ASN A 135 9.787 5.087 7.154 1.00 0.24 N ATOM 2109 CA ASN A 135 9.945 5.673 8.483 1.00 0.29 C ATOM 2110 C ASN A 135 10.853 6.904 8.463 1.00 0.30 C ATOM 2111 O ASN A 135 10.650 7.847 9.226 1.00 0.33 O ATOM 2112 CB ASN A 135 10.498 4.624 9.452 1.00 0.37 C ATOM 2113 CG ASN A 135 10.784 5.187 10.836 1.00 0.92 C ATOM 2114 OD1 ASN A 135 9.894 5.268 11.678 1.00 1.17 O ATOM 2115 ND2 ASN A 135 12.035 5.539 11.093 1.00 1.46 N ATOM 0 H ASN A 135 10.268 4.197 7.023 1.00 0.24 H new ATOM 0 HA ASN A 135 8.961 6.000 8.820 1.00 0.29 H new ATOM 0 HB2 ASN A 135 9.784 3.805 9.539 1.00 0.37 H new ATOM 0 HB3 ASN A 135 11.415 4.204 9.040 1.00 0.37 H new ATOM 0 HD21 ASN A 135 12.286 5.892 12.017 1.00 1.46 H new ATOM 0 HD22 ASN A 135 12.747 5.457 10.367 1.00 1.46 H new ATOM 2122 N ASP A 136 11.842 6.900 7.585 1.00 0.32 N ATOM 2123 CA ASP A 136 12.841 7.966 7.562 1.00 0.37 C ATOM 2124 C ASP A 136 12.442 9.119 6.639 1.00 0.34 C ATOM 2125 O ASP A 136 12.408 10.274 7.061 1.00 0.36 O ATOM 2126 CB ASP A 136 14.204 7.407 7.141 1.00 0.46 C ATOM 2127 CG ASP A 136 15.236 8.494 6.938 1.00 1.19 C ATOM 2128 OD1 ASP A 136 15.782 8.998 7.941 1.00 1.27 O ATOM 2129 OD2 ASP A 136 15.507 8.841 5.774 1.00 2.07 O ATOM 0 H ASP A 136 11.978 6.176 6.880 1.00 0.32 H new ATOM 0 HA ASP A 136 12.905 8.366 8.574 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.558 6.711 7.901 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.091 6.840 6.217 1.00 0.46 H new ATOM 2134 N HIS A 137 12.158 8.809 5.382 1.00 0.33 N ATOM 2135 CA HIS A 137 11.886 9.843 4.378 1.00 0.35 C ATOM 2136 C HIS A 137 10.403 10.174 4.278 1.00 0.29 C ATOM 2137 O HIS A 137 10.017 11.340 4.264 1.00 0.32 O ATOM 2138 CB HIS A 137 12.388 9.404 2.998 1.00 0.45 C ATOM 2139 CG HIS A 137 13.748 9.912 2.641 1.00 0.63 C ATOM 2140 ND1 HIS A 137 14.860 9.749 3.435 1.00 1.07 N ATOM 2141 CD2 HIS A 137 14.170 10.583 1.547 1.00 1.53 C ATOM 2142 CE1 HIS A 137 15.902 10.294 2.842 1.00 0.95 C ATOM 2143 NE2 HIS A 137 15.513 10.807 1.693 1.00 1.34 N ATOM 0 H HIS A 137 12.109 7.854 5.028 1.00 0.33 H new ATOM 0 HA HIS A 137 12.418 10.737 4.703 1.00 0.35 H new ATOM 0 HB2 HIS A 137 12.400 8.315 2.959 1.00 0.45 H new ATOM 0 HB3 HIS A 137 11.678 9.742 2.243 1.00 0.45 H new ATOM 0 HD1 HIS A 137 14.875 9.280 4.341 1.00 1.07 H new ATOM 0 HD2 HIS A 137 13.559 10.887 0.710 1.00 1.53 H new ATOM 0 HE1 HIS A 137 16.908 10.317 3.233 1.00 0.95 H new ATOM 2152 N LEU A 138 9.581 9.141 4.216 1.00 0.26 N ATOM 2153 CA LEU A 138 8.175 9.295 3.871 1.00 0.25 C ATOM 2154 C LEU A 138 7.351 9.789 5.061 1.00 0.24 C ATOM 2155 O LEU A 138 6.494 10.662 4.914 1.00 0.25 O ATOM 2156 CB LEU A 138 7.646 7.953 3.370 1.00 0.23 C ATOM 2157 CG LEU A 138 6.332 8.004 2.600 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.473 8.891 1.375 1.00 0.26 C ATOM 2159 CD2 LEU A 138 5.908 6.600 2.202 1.00 0.22 C ATOM 0 H LEU A 138 9.864 8.179 4.401 1.00 0.26 H new ATOM 0 HA LEU A 138 8.083 10.048 3.089 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.403 7.502 2.729 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.518 7.292 4.227 1.00 0.23 H new ATOM 0 HG LEU A 138 5.561 8.430 3.242 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.527 8.918 0.835 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.742 9.900 1.686 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.251 8.492 0.724 1.00 0.26 H new ATOM 0 HD21 LEU A 138 4.968 6.646 1.652 1.00 0.22 H new ATOM 0 HD22 LEU A 138 6.676 6.153 1.571 1.00 0.22 H new ATOM 0 HD23 LEU A 138 5.775 5.992 3.097 1.00 0.22 H new ATOM 2171 N GLU A 139 7.628 9.221 6.229 1.00 0.26 N ATOM 2172 CA GLU A 139 6.933 9.558 7.475 1.00 0.29 C ATOM 2173 C GLU A 139 6.835 11.075 7.709 1.00 0.30 C ATOM 2174 O GLU A 139 5.751 11.569 8.021 1.00 0.30 O ATOM 2175 CB GLU A 139 7.634 8.873 8.656 1.00 0.36 C ATOM 2176 CG GLU A 139 6.957 9.081 10.002 1.00 0.52 C ATOM 2177 CD GLU A 139 5.569 8.481 10.059 1.00 1.00 C ATOM 2178 OE1 GLU A 139 5.437 7.254 9.885 1.00 1.46 O ATOM 2179 OE2 GLU A 139 4.601 9.235 10.286 1.00 1.74 O ATOM 0 H GLU A 139 8.347 8.507 6.343 1.00 0.26 H new ATOM 0 HA GLU A 139 5.910 9.192 7.390 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.693 7.803 8.455 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.657 9.243 8.718 1.00 0.36 H new ATOM 0 HG2 GLU A 139 7.572 8.638 10.785 1.00 0.52 H new ATOM 0 HG3 GLU A 139 6.895 10.149 10.211 1.00 0.52 H new ATOM 2186 N PRO A 140 7.949 11.844 7.577 1.00 0.33 N ATOM 2187 CA PRO A 140 7.918 13.307 7.734 1.00 0.36 C ATOM 2188 C PRO A 140 6.807 13.976 6.928 1.00 0.31 C ATOM 2189 O PRO A 140 6.144 14.891 7.420 1.00 0.36 O ATOM 2190 CB PRO A 140 9.287 13.749 7.217 1.00 0.42 C ATOM 2191 CG PRO A 140 10.175 12.595 7.498 1.00 0.42 C ATOM 2192 CD PRO A 140 9.325 11.364 7.314 1.00 0.35 C ATOM 0 HA PRO A 140 7.717 13.590 8.767 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.255 13.976 6.151 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.632 14.650 7.725 1.00 0.42 H new ATOM 0 HG2 PRO A 140 11.028 12.585 6.820 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.573 12.647 8.511 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.422 10.958 6.307 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.612 10.572 8.006 1.00 0.35 H new ATOM 2200 N TRP A 141 6.595 13.520 5.697 1.00 0.28 N ATOM 2201 CA TRP A 141 5.561 14.102 4.854 1.00 0.25 C ATOM 2202 C TRP A 141 4.189 13.592 5.279 1.00 0.22 C ATOM 2203 O TRP A 141 3.231 14.362 5.383 1.00 0.22 O ATOM 2204 CB TRP A 141 5.801 13.782 3.370 1.00 0.29 C ATOM 2205 CG TRP A 141 4.822 14.478 2.474 1.00 0.29 C ATOM 2206 CD1 TRP A 141 4.952 15.724 1.934 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.553 13.977 2.033 1.00 0.30 C ATOM 2208 NE1 TRP A 141 3.842 16.029 1.184 1.00 0.35 N ATOM 2209 CE2 TRP A 141 2.969 14.973 1.232 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.856 12.782 2.240 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 1.717 14.811 0.639 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.617 12.623 1.651 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.057 13.632 0.860 1.00 0.36 C ATOM 0 H TRP A 141 7.119 12.758 5.267 1.00 0.28 H new ATOM 0 HA TRP A 141 5.600 15.184 4.977 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.814 14.076 3.096 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.729 12.705 3.216 1.00 0.29 H new ATOM 0 HD1 TRP A 141 5.802 16.375 2.075 1.00 0.32 H new ATOM 0 HE1 TRP A 141 3.692 16.900 0.674 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.279 11.997 2.850 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.283 15.588 0.027 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 1.071 11.704 1.804 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.085 13.478 0.415 1.00 0.36 H new ATOM 2224 N ILE A 142 4.109 12.294 5.539 1.00 0.20 N ATOM 2225 CA ILE A 142 2.852 11.655 5.903 1.00 0.19 C ATOM 2226 C ILE A 142 2.279 12.272 7.175 1.00 0.20 C ATOM 2227 O ILE A 142 1.153 12.770 7.180 1.00 0.20 O ATOM 2228 CB ILE A 142 3.045 10.138 6.113 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.517 9.471 4.824 1.00 0.21 C ATOM 2230 CG2 ILE A 142 1.751 9.495 6.585 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.852 8.011 5.003 1.00 0.23 C ATOM 0 H ILE A 142 4.906 11.659 5.504 1.00 0.20 H new ATOM 0 HA ILE A 142 2.153 11.814 5.082 1.00 0.19 H new ATOM 0 HB ILE A 142 3.808 9.998 6.879 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.741 9.569 4.065 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.396 9.996 4.451 1.00 0.21 H new ATOM 0 HG21 ILE A 142 1.907 8.426 6.727 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.444 9.946 7.529 1.00 0.25 H new ATOM 0 HG23 ILE A 142 0.973 9.652 5.838 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.181 7.594 4.051 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.649 7.908 5.739 1.00 0.23 H new ATOM 0 HD13 ILE A 142 2.968 7.475 5.348 1.00 0.23 H new ATOM 2243 N GLN A 143 3.070 12.246 8.243 1.00 0.25 N ATOM 2244 CA GLN A 143 2.636 12.737 9.545 1.00 0.30 C ATOM 2245 C GLN A 143 2.241 14.210 9.472 1.00 0.29 C ATOM 2246 O GLN A 143 1.271 14.630 10.103 1.00 0.31 O ATOM 2247 CB GLN A 143 3.750 12.544 10.576 1.00 0.40 C ATOM 2248 CG GLN A 143 3.319 12.818 12.011 1.00 0.51 C ATOM 2249 CD GLN A 143 2.226 11.872 12.483 1.00 0.95 C ATOM 2250 OE1 GLN A 143 2.512 10.796 13.011 1.00 1.51 O ATOM 2251 NE2 GLN A 143 0.970 12.259 12.302 1.00 1.60 N ATOM 0 H GLN A 143 4.024 11.886 8.230 1.00 0.25 H new ATOM 0 HA GLN A 143 1.760 12.164 9.850 1.00 0.30 H new ATOM 0 HB2 GLN A 143 4.121 11.521 10.508 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.582 13.202 10.325 1.00 0.40 H new ATOM 0 HG2 GLN A 143 4.183 12.727 12.670 1.00 0.51 H new ATOM 0 HG3 GLN A 143 2.964 13.846 12.090 1.00 0.51 H new ATOM 0 HE21 GLN A 143 0.772 13.157 11.861 1.00 1.60 H new ATOM 0 HE22 GLN A 143 0.203 11.658 12.604 1.00 1.60 H new ATOM 2260 N GLU A 144 2.986 14.979 8.684 1.00 0.29 N ATOM 2261 CA GLU A 144 2.725 16.408 8.531 1.00 0.33 C ATOM 2262 C GLU A 144 1.334 16.651 7.953 1.00 0.29 C ATOM 2263 O GLU A 144 0.642 17.593 8.338 1.00 0.35 O ATOM 2264 CB GLU A 144 3.781 17.045 7.626 1.00 0.41 C ATOM 2265 CG GLU A 144 3.611 18.543 7.458 1.00 0.64 C ATOM 2266 CD GLU A 144 3.784 19.290 8.763 1.00 1.09 C ATOM 2267 OE1 GLU A 144 4.939 19.573 9.135 1.00 1.25 O ATOM 2268 OE2 GLU A 144 2.769 19.590 9.423 1.00 1.75 O ATOM 0 H GLU A 144 3.778 14.636 8.140 1.00 0.29 H new ATOM 0 HA GLU A 144 2.774 16.867 9.518 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.770 16.844 8.038 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.741 16.571 6.645 1.00 0.41 H new ATOM 0 HG2 GLU A 144 4.337 18.910 6.733 1.00 0.64 H new ATOM 0 HG3 GLU A 144 2.621 18.751 7.051 1.00 0.64 H new ATOM 2275 N ASN A 145 0.918 15.788 7.040 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.383 15.931 6.397 1.00 0.28 C ATOM 2277 C ASN A 145 -1.473 15.238 7.202 1.00 0.30 C ATOM 2278 O ASN A 145 -2.609 15.121 6.751 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.346 15.391 4.962 1.00 0.32 C ATOM 2280 CG ASN A 145 0.359 16.344 4.012 1.00 0.34 C ATOM 2281 OD1 ASN A 145 -0.276 17.201 3.396 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.670 16.207 3.879 1.00 0.33 N ATOM 0 H ASN A 145 1.459 14.982 6.726 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.618 16.995 6.357 1.00 0.28 H new ATOM 0 HB2 ASN A 145 0.162 14.427 4.951 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.364 15.219 4.613 1.00 0.32 H new ATOM 0 HD21 ASN A 145 2.186 16.823 3.250 1.00 0.33 H new ATOM 0 HD22 ASN A 145 2.163 15.486 4.405 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.123 14.790 8.398 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.104 14.203 9.285 1.00 0.30 C ATOM 2291 C GLY A 146 -1.749 12.794 9.689 1.00 0.30 C ATOM 2292 O GLY A 146 -2.049 12.365 10.801 1.00 0.41 O ATOM 0 H GLY A 146 -0.174 14.823 8.771 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -2.197 14.821 10.178 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.078 14.202 8.795 1.00 0.30 H new ATOM 2296 N GLY A 147 -1.081 12.083 8.801 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.724 10.712 9.072 1.00 0.22 C ATOM 2298 C GLY A 147 -1.487 9.750 8.188 1.00 0.19 C ATOM 2299 O GLY A 147 -2.171 10.167 7.249 1.00 0.20 O ATOM 0 H GLY A 147 -0.778 12.433 7.892 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.347 10.577 8.917 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -0.926 10.483 10.118 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.377 8.466 8.489 1.00 0.20 N ATOM 2304 CA TRP A 148 -2.037 7.435 7.703 1.00 0.21 C ATOM 2305 C TRP A 148 -3.556 7.553 7.761 1.00 0.23 C ATOM 2306 O TRP A 148 -4.234 7.231 6.787 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.610 6.046 8.173 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.218 5.681 7.758 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.847 5.412 8.572 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.259 5.547 6.415 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.950 5.104 7.814 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.614 5.181 6.490 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.331 5.694 5.156 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.387 4.958 5.358 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.442 5.475 4.032 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.789 5.109 4.141 1.00 0.24 C ATOM 0 H TRP A 148 -0.834 8.111 9.276 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.730 7.579 6.667 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.681 6.000 9.260 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.305 5.306 7.776 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.824 5.438 9.651 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.870 4.858 8.179 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.370 5.973 5.064 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.426 4.675 5.438 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 -0.000 5.588 3.053 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.366 4.943 3.244 1.00 0.24 H new ATOM 2327 N ASP A 149 -4.085 8.029 8.888 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.538 8.167 9.058 1.00 0.31 C ATOM 2329 C ASP A 149 -6.139 9.013 7.940 1.00 0.30 C ATOM 2330 O ASP A 149 -7.281 8.804 7.531 1.00 0.37 O ATOM 2331 CB ASP A 149 -5.886 8.789 10.420 1.00 0.40 C ATOM 2332 CG ASP A 149 -5.416 10.226 10.557 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -6.175 11.145 10.175 1.00 1.96 O ATOM 2334 OD2 ASP A 149 -4.291 10.440 11.047 1.00 1.94 O ATOM 0 H ASP A 149 -3.536 8.325 9.695 1.00 0.26 H new ATOM 0 HA ASP A 149 -5.965 7.165 9.015 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -6.966 8.751 10.565 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -5.437 8.189 11.212 1.00 0.40 H new ATOM 2339 N THR A 150 -5.348 9.948 7.433 1.00 0.27 N ATOM 2340 CA THR A 150 -5.772 10.817 6.352 1.00 0.29 C ATOM 2341 C THR A 150 -5.873 10.040 5.039 1.00 0.28 C ATOM 2342 O THR A 150 -6.854 10.163 4.303 1.00 0.33 O ATOM 2343 CB THR A 150 -4.782 11.983 6.198 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.674 12.683 7.445 1.00 0.38 O ATOM 2345 CG2 THR A 150 -5.223 12.944 5.108 1.00 0.37 C ATOM 0 H THR A 150 -4.398 10.123 7.760 1.00 0.27 H new ATOM 0 HA THR A 150 -6.758 11.212 6.594 1.00 0.29 H new ATOM 0 HB THR A 150 -3.813 11.574 5.914 1.00 0.33 H new ATOM 0 HG1 THR A 150 -4.629 13.647 7.276 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.501 13.756 5.025 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.283 12.414 4.158 1.00 0.37 H new ATOM 0 HG23 THR A 150 -6.202 13.353 5.358 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.858 9.230 4.760 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.819 8.447 3.532 1.00 0.25 C ATOM 2355 C PHE A 151 -5.857 7.328 3.561 1.00 0.26 C ATOM 2356 O PHE A 151 -6.524 7.064 2.560 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.419 7.862 3.316 1.00 0.25 C ATOM 2358 CG PHE A 151 -3.317 6.990 2.096 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -3.441 7.534 0.827 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -3.103 5.629 2.217 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -3.353 6.735 -0.295 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -3.014 4.825 1.099 1.00 0.28 C ATOM 2363 CZ PHE A 151 -3.141 5.377 -0.159 1.00 0.34 C ATOM 0 H PHE A 151 -4.050 9.099 5.369 1.00 0.24 H new ATOM 0 HA PHE A 151 -5.057 9.112 2.702 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.702 8.678 3.231 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.137 7.280 4.194 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -3.608 8.595 0.715 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -3.004 5.190 3.199 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -3.450 7.171 -1.278 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -2.845 3.764 1.209 1.00 0.28 H new ATOM 0 HZ PHE A 151 -3.075 4.749 -1.035 1.00 0.34 H new ATOM 2373 N VAL A 152 -6.001 6.682 4.712 1.00 0.25 N ATOM 2374 CA VAL A 152 -6.947 5.583 4.859 1.00 0.29 C ATOM 2375 C VAL A 152 -8.373 6.063 4.621 1.00 0.35 C ATOM 2376 O VAL A 152 -9.188 5.347 4.046 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.841 4.933 6.254 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.829 3.788 6.399 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.425 4.442 6.496 1.00 0.28 C ATOM 0 H VAL A 152 -5.474 6.901 5.558 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.694 4.833 4.110 1.00 0.29 H new ATOM 0 HB VAL A 152 -7.087 5.687 7.001 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.733 3.348 7.392 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.843 4.164 6.265 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.621 3.030 5.644 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.362 3.985 7.484 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -5.161 3.705 5.738 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.734 5.283 6.441 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.651 7.293 5.037 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.972 7.888 4.865 1.00 0.46 C ATOM 2391 C GLU A 153 -10.348 7.984 3.382 1.00 0.51 C ATOM 2392 O GLU A 153 -11.524 7.879 3.021 1.00 0.62 O ATOM 2393 CB GLU A 153 -10.003 9.274 5.514 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.359 9.954 5.454 1.00 0.70 C ATOM 2395 CD GLU A 153 -11.363 11.287 6.169 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -10.892 12.280 5.583 1.00 2.17 O ATOM 2397 OE2 GLU A 153 -11.838 11.349 7.323 1.00 1.42 O ATOM 0 H GLU A 153 -7.975 7.901 5.499 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.705 7.246 5.353 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.700 9.182 6.557 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -9.267 9.910 5.023 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -11.643 10.102 4.412 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -12.110 9.302 5.900 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.339 8.144 2.528 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.560 8.274 1.088 1.00 0.59 C ATOM 2406 C LEU A 154 -10.163 6.996 0.507 1.00 0.68 C ATOM 2407 O LEU A 154 -10.980 7.047 -0.409 1.00 0.74 O ATOM 2408 CB LEU A 154 -8.248 8.612 0.366 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.596 9.933 0.780 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.251 10.103 0.090 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.513 11.102 0.452 1.00 0.67 C ATOM 0 H LEU A 154 -8.359 8.187 2.808 1.00 0.50 H new ATOM 0 HA LEU A 154 -10.267 9.089 0.933 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.537 7.804 0.541 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -8.440 8.641 -0.707 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.430 9.914 1.857 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -5.802 11.048 0.396 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.592 9.281 0.369 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.394 10.103 -0.991 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.035 12.035 0.752 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.707 11.123 -0.620 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.455 10.987 0.989 1.00 0.67 H new ATOM 2423 N TYR A 155 -9.767 5.851 1.049 1.00 0.75 N ATOM 2424 CA TYR A 155 -10.308 4.573 0.592 1.00 0.90 C ATOM 2425 C TYR A 155 -11.341 4.031 1.579 1.00 0.97 C ATOM 2426 O TYR A 155 -12.040 3.057 1.290 1.00 1.15 O ATOM 2427 CB TYR A 155 -9.185 3.544 0.366 1.00 0.98 C ATOM 2428 CG TYR A 155 -8.350 3.824 -0.866 1.00 0.98 C ATOM 2429 CD1 TYR A 155 -8.780 3.414 -2.122 1.00 1.05 C ATOM 2430 CD2 TYR A 155 -7.137 4.497 -0.778 1.00 0.98 C ATOM 2431 CE1 TYR A 155 -8.029 3.667 -3.253 1.00 1.10 C ATOM 2432 CE2 TYR A 155 -6.381 4.755 -1.906 1.00 1.03 C ATOM 2433 CZ TYR A 155 -6.832 4.338 -3.141 1.00 1.08 C ATOM 2434 OH TYR A 155 -6.080 4.595 -4.268 1.00 1.17 O ATOM 0 H TYR A 155 -9.079 5.779 1.799 1.00 0.75 H new ATOM 0 HA TYR A 155 -10.806 4.747 -0.362 1.00 0.90 H new ATOM 0 HB2 TYR A 155 -8.535 3.529 1.241 1.00 0.98 H new ATOM 0 HB3 TYR A 155 -9.625 2.551 0.279 1.00 0.98 H new ATOM 0 HD1 TYR A 155 -9.719 2.888 -2.215 1.00 1.05 H new ATOM 0 HD2 TYR A 155 -6.779 4.824 0.187 1.00 0.98 H new ATOM 0 HE1 TYR A 155 -8.379 3.340 -4.221 1.00 1.10 H new ATOM 0 HE2 TYR A 155 -5.441 5.281 -1.821 1.00 1.03 H new ATOM 0 HH TYR A 155 -6.670 4.880 -4.997 1.00 1.17 H new ATOM 2444 N GLY A 156 -11.450 4.683 2.732 1.00 0.89 N ATOM 2445 CA GLY A 156 -12.376 4.237 3.757 1.00 1.02 C ATOM 2446 C GLY A 156 -13.815 4.496 3.377 1.00 1.11 C ATOM 2447 O GLY A 156 -14.689 3.675 3.647 1.00 1.68 O ATOM 0 H GLY A 156 -10.912 5.515 2.975 1.00 0.89 H new ATOM 0 HA2 GLY A 156 -12.235 3.171 3.933 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -12.152 4.747 4.694 1.00 1.02 H new ATOM 2451 N ASN A 157 -14.061 5.628 2.723 1.00 1.62 N ATOM 2452 CA ASN A 157 -15.415 5.979 2.296 1.00 2.05 C ATOM 2453 C ASN A 157 -15.895 5.026 1.206 1.00 2.33 C ATOM 2454 O ASN A 157 -17.094 4.803 1.042 1.00 2.52 O ATOM 2455 CB ASN A 157 -15.497 7.435 1.803 1.00 3.21 C ATOM 2456 CG ASN A 157 -14.625 7.711 0.592 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -15.041 7.507 -0.548 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -13.414 8.194 0.826 1.00 4.60 N ATOM 0 H ASN A 157 -13.347 6.314 2.478 1.00 1.62 H new ATOM 0 HA ASN A 157 -16.067 5.884 3.164 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -16.533 7.670 1.557 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -15.203 8.102 2.613 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -12.792 8.410 0.047 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -13.104 8.350 1.785 1.00 4.60 H new ATOM 2465 N ASN A 158 -14.953 4.450 0.468 1.00 2.99 N ATOM 2466 CA ASN A 158 -15.292 3.473 -0.558 1.00 4.03 C ATOM 2467 C ASN A 158 -15.640 2.145 0.098 1.00 4.18 C ATOM 2468 O ASN A 158 -16.670 1.541 -0.201 1.00 4.81 O ATOM 2469 CB ASN A 158 -14.134 3.283 -1.542 1.00 5.08 C ATOM 2470 CG ASN A 158 -14.532 2.445 -2.745 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -15.687 2.462 -3.173 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -13.582 1.713 -3.305 1.00 6.76 N ATOM 0 H ASN A 158 -13.955 4.641 0.560 1.00 2.99 H new ATOM 0 HA ASN A 158 -16.152 3.842 -1.116 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -13.784 4.258 -1.881 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -13.299 2.805 -1.029 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -13.795 1.137 -4.119 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -12.637 1.725 -2.922 1.00 6.76 H new ATOM 2479 N ALA A 159 -14.785 1.717 1.022 1.00 3.95 N ATOM 2480 CA ALA A 159 -14.981 0.459 1.728 1.00 4.72 C ATOM 2481 C ALA A 159 -16.260 0.484 2.558 1.00 4.66 C ATOM 2482 O ALA A 159 -17.015 -0.485 2.568 1.00 5.63 O ATOM 2483 CB ALA A 159 -13.784 0.163 2.615 1.00 4.78 C ATOM 0 H ALA A 159 -13.946 2.227 1.299 1.00 3.95 H new ATOM 0 HA ALA A 159 -15.078 -0.333 0.985 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -13.943 -0.780 3.138 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -12.886 0.091 2.002 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -13.663 0.965 3.343 1.00 4.78 H new ATOM 2489 N ALA A 160 -16.500 1.598 3.244 1.00 3.75 N ATOM 2490 CA ALA A 160 -17.703 1.765 4.059 1.00 4.08 C ATOM 2491 C ALA A 160 -18.968 1.549 3.234 1.00 4.33 C ATOM 2492 O ALA A 160 -19.940 0.957 3.709 1.00 5.11 O ATOM 2493 CB ALA A 160 -17.723 3.147 4.695 1.00 3.59 C ATOM 0 H ALA A 160 -15.874 2.404 3.252 1.00 3.75 H new ATOM 0 HA ALA A 160 -17.680 1.010 4.845 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -18.624 3.257 5.298 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -16.845 3.269 5.329 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -17.715 3.907 3.914 1.00 3.59 H new ATOM 2499 N ALA A 161 -18.945 2.025 1.995 1.00 3.93 N ATOM 2500 CA ALA A 161 -20.081 1.880 1.095 1.00 4.43 C ATOM 2501 C ALA A 161 -20.203 0.444 0.593 1.00 5.54 C ATOM 2502 O ALA A 161 -21.296 -0.018 0.266 1.00 6.11 O ATOM 2503 CB ALA A 161 -19.956 2.844 -0.073 1.00 4.39 C ATOM 0 H ALA A 161 -18.148 2.517 1.590 1.00 3.93 H new ATOM 0 HA ALA A 161 -20.987 2.120 1.651 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -20.812 2.724 -0.737 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -19.928 3.867 0.301 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -19.038 2.633 -0.622 1.00 4.39 H new ATOM 2509 N GLU A 162 -19.081 -0.260 0.535 1.00 5.98 N ATOM 2510 CA GLU A 162 -19.079 -1.659 0.123 1.00 7.23 C ATOM 2511 C GLU A 162 -19.607 -2.546 1.241 1.00 7.80 C ATOM 2512 O GLU A 162 -20.140 -3.627 0.991 1.00 8.75 O ATOM 2513 CB GLU A 162 -17.672 -2.100 -0.280 1.00 7.72 C ATOM 2514 CG GLU A 162 -17.169 -1.418 -1.539 1.00 7.99 C ATOM 2515 CD GLU A 162 -18.093 -1.643 -2.716 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -18.017 -2.721 -3.339 1.00 9.03 O ATOM 2517 OE2 GLU A 162 -18.905 -0.746 -3.026 1.00 9.09 O ATOM 0 H GLU A 162 -18.161 0.113 0.768 1.00 5.98 H new ATOM 0 HA GLU A 162 -19.735 -1.760 -0.741 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -16.984 -1.890 0.539 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -17.666 -3.179 -0.432 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -17.069 -0.348 -1.356 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -16.175 -1.794 -1.782 1.00 7.99 H new ATOM 2524 N SER A 163 -19.482 -2.068 2.474 1.00 7.39 N ATOM 2525 CA SER A 163 -19.977 -2.794 3.638 1.00 8.21 C ATOM 2526 C SER A 163 -21.506 -2.835 3.648 1.00 8.28 C ATOM 2527 O SER A 163 -22.119 -3.507 4.481 1.00 9.15 O ATOM 2528 CB SER A 163 -19.457 -2.138 4.917 1.00 8.03 C ATOM 2529 OG SER A 163 -18.050 -1.967 4.860 1.00 7.86 O ATOM 0 H SER A 163 -19.039 -1.176 2.694 1.00 7.39 H new ATOM 0 HA SER A 163 -19.612 -3.820 3.587 1.00 8.21 H new ATOM 0 HB2 SER A 163 -19.940 -1.171 5.057 1.00 8.03 H new ATOM 0 HB3 SER A 163 -19.718 -2.753 5.778 1.00 8.03 H new ATOM 0 HG SER A 163 -17.826 -1.331 4.149 1.00 7.86 H new ATOM 2535 N ARG A 164 -22.121 -2.113 2.718 1.00 7.47 N ATOM 2536 CA ARG A 164 -23.568 -2.130 2.575 1.00 7.60 C ATOM 2537 C ARG A 164 -24.025 -3.468 2.011 1.00 8.33 C ATOM 2538 O ARG A 164 -25.157 -3.884 2.232 1.00 8.87 O ATOM 2539 CB ARG A 164 -24.045 -0.991 1.671 1.00 6.69 C ATOM 2540 CG ARG A 164 -23.767 0.396 2.228 1.00 6.19 C ATOM 2541 CD ARG A 164 -24.275 1.481 1.295 1.00 5.74 C ATOM 2542 NE ARG A 164 -23.655 1.403 -0.029 1.00 5.66 N ATOM 2543 CZ ARG A 164 -24.212 1.877 -1.142 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -25.402 2.468 -1.092 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -23.579 1.768 -2.303 1.00 6.02 N ATOM 0 H ARG A 164 -21.638 -1.509 2.053 1.00 7.47 H new ATOM 0 HA ARG A 164 -24.007 -1.989 3.563 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -23.561 -1.085 0.699 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -25.117 -1.097 1.505 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -24.243 0.500 3.203 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -22.695 0.519 2.382 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -25.357 1.394 1.194 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -24.073 2.459 1.733 1.00 5.74 H new ATOM 0 HE ARG A 164 -22.740 0.958 -0.104 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -25.889 2.559 -0.201 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -25.828 2.831 -1.945 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -22.663 1.320 -2.345 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -24.008 2.132 -3.154 1.00 6.02 H new ATOM 2559 N LYS A 165 -23.129 -4.152 1.301 1.00 8.52 N ATOM 2560 CA LYS A 165 -23.442 -5.450 0.710 1.00 9.41 C ATOM 2561 C LYS A 165 -23.846 -6.457 1.787 1.00 10.47 C ATOM 2562 O LYS A 165 -24.733 -7.290 1.573 1.00 11.24 O ATOM 2563 CB LYS A 165 -22.245 -5.979 -0.085 1.00 9.61 C ATOM 2564 CG LYS A 165 -21.992 -5.231 -1.384 1.00 9.69 C ATOM 2565 CD LYS A 165 -20.750 -5.756 -2.092 1.00 10.12 C ATOM 2566 CE LYS A 165 -20.642 -5.219 -3.513 1.00 10.34 C ATOM 2567 NZ LYS A 165 -20.454 -3.743 -3.553 1.00 10.42 N ATOM 0 H LYS A 165 -22.179 -3.827 1.121 1.00 8.52 H new ATOM 0 HA LYS A 165 -24.284 -5.317 0.031 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -21.352 -5.919 0.538 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -22.407 -7.033 -0.309 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -22.857 -5.333 -2.039 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -21.873 -4.168 -1.177 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -19.862 -5.472 -1.527 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -20.778 -6.845 -2.116 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -19.805 -5.702 -4.018 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -21.543 -5.482 -4.067 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -21.117 -3.327 -4.238 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -20.635 -3.344 -2.610 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -19.478 -3.525 -3.839 1.00 10.42 H new ATOM 2581 N GLY A 166 -23.195 -6.372 2.942 1.00 10.61 N ATOM 2582 CA GLY A 166 -23.561 -7.214 4.065 1.00 11.72 C ATOM 2583 C GLY A 166 -24.824 -6.726 4.742 1.00 12.02 C ATOM 2584 O GLY A 166 -25.652 -7.524 5.184 1.00 13.02 O ATOM 0 H GLY A 166 -22.419 -5.734 3.120 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -23.705 -8.238 3.720 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -22.745 -7.233 4.787 1.00 11.72 H new ATOM 2588 N GLN A 167 -24.979 -5.407 4.798 1.00 11.25 N ATOM 2589 CA GLN A 167 -26.154 -4.788 5.411 1.00 11.64 C ATOM 2590 C GLN A 167 -27.420 -5.131 4.629 1.00 12.01 C ATOM 2591 O GLN A 167 -28.488 -5.327 5.210 1.00 12.84 O ATOM 2592 CB GLN A 167 -25.979 -3.263 5.482 1.00 10.86 C ATOM 2593 CG GLN A 167 -27.208 -2.525 5.994 1.00 11.50 C ATOM 2594 CD GLN A 167 -27.035 -1.021 5.967 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -26.301 -0.483 5.140 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -27.718 -0.331 6.864 1.00 12.41 N ATOM 0 H GLN A 167 -24.303 -4.741 4.425 1.00 11.25 H new ATOM 0 HA GLN A 167 -26.255 -5.182 6.422 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -25.133 -3.034 6.130 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -25.730 -2.889 4.489 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -28.071 -2.799 5.387 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -27.421 -2.845 7.014 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -28.316 -0.816 7.533 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -27.647 0.686 6.887 1.00 12.41 H new ATOM 2605 N GLU A 168 -27.294 -5.216 3.308 1.00 11.51 N ATOM 2606 CA GLU A 168 -28.429 -5.529 2.444 1.00 11.94 C ATOM 2607 C GLU A 168 -28.968 -6.931 2.716 1.00 13.03 C ATOM 2608 O GLU A 168 -30.096 -7.245 2.344 1.00 13.73 O ATOM 2609 CB GLU A 168 -28.039 -5.414 0.968 1.00 11.38 C ATOM 2610 CG GLU A 168 -27.625 -4.016 0.545 1.00 10.85 C ATOM 2611 CD GLU A 168 -27.316 -3.923 -0.936 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -26.311 -4.517 -1.383 1.00 10.74 O ATOM 2613 OE2 GLU A 168 -28.075 -3.252 -1.661 1.00 10.98 O ATOM 0 H GLU A 168 -26.415 -5.072 2.811 1.00 11.51 H new ATOM 0 HA GLU A 168 -29.211 -4.804 2.668 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -27.218 -6.102 0.765 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -28.881 -5.733 0.354 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -28.423 -3.315 0.791 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -26.747 -3.713 1.115 1.00 10.85 H new ATOM 2620 N ARG A 169 -28.166 -7.765 3.368 1.00 13.26 N ATOM 2621 CA ARG A 169 -28.562 -9.142 3.643 1.00 14.38 C ATOM 2622 C ARG A 169 -29.505 -9.207 4.842 1.00 15.16 C ATOM 2623 O ARG A 169 -30.207 -10.200 5.035 1.00 16.19 O ATOM 2624 CB ARG A 169 -27.332 -10.017 3.915 1.00 14.52 C ATOM 2625 CG ARG A 169 -26.237 -9.897 2.868 1.00 14.72 C ATOM 2626 CD ARG A 169 -25.044 -10.780 3.208 1.00 14.96 C ATOM 2627 NE ARG A 169 -23.866 -10.448 2.405 1.00 14.97 N ATOM 2628 CZ ARG A 169 -22.892 -11.313 2.112 1.00 15.22 C ATOM 2629 NH1 ARG A 169 -22.988 -12.582 2.485 1.00 15.46 N ATOM 2630 NH2 ARG A 169 -21.821 -10.902 1.445 1.00 15.37 N ATOM 0 H ARG A 169 -27.241 -7.513 3.715 1.00 13.26 H new ATOM 0 HA ARG A 169 -29.081 -9.519 2.762 1.00 14.38 H new ATOM 0 HB2 ARG A 169 -26.919 -9.751 4.888 1.00 14.52 H new ATOM 0 HB3 ARG A 169 -27.648 -11.058 3.976 1.00 14.52 H new ATOM 0 HG2 ARG A 169 -26.633 -10.177 1.892 1.00 14.72 H new ATOM 0 HG3 ARG A 169 -25.914 -8.859 2.795 1.00 14.72 H new ATOM 0 HD2 ARG A 169 -24.803 -10.672 4.266 1.00 14.96 H new ATOM 0 HD3 ARG A 169 -25.309 -11.825 3.047 1.00 14.96 H new ATOM 0 HE ARG A 169 -23.784 -9.496 2.047 1.00 14.97 H new ATOM 0 HH11 ARG A 169 -23.809 -12.902 2.999 1.00 15.46 H new ATOM 0 HH12 ARG A 169 -22.241 -13.238 2.258 1.00 15.46 H new ATOM 0 HH21 ARG A 169 -21.743 -9.927 1.157 1.00 15.37 H new ATOM 0 HH22 ARG A 169 -21.076 -11.561 1.220 1.00 15.37 H new ATOM 2644 N LEU A 170 -29.521 -8.139 5.636 1.00 14.77 N ATOM 2645 CA LEU A 170 -30.313 -8.097 6.864 1.00 15.59 C ATOM 2646 C LEU A 170 -31.800 -8.269 6.567 1.00 16.06 C ATOM 2647 O LEU A 170 -32.464 -9.126 7.154 1.00 17.05 O ATOM 2648 CB LEU A 170 -30.076 -6.777 7.603 1.00 15.16 C ATOM 2649 CG LEU A 170 -30.797 -6.641 8.946 1.00 15.47 C ATOM 2650 CD1 LEU A 170 -30.297 -7.684 9.933 1.00 16.05 C ATOM 2651 CD2 LEU A 170 -30.609 -5.242 9.507 1.00 15.45 C ATOM 0 H LEU A 170 -28.992 -7.287 5.450 1.00 14.77 H new ATOM 0 HA LEU A 170 -29.994 -8.924 7.498 1.00 15.59 H new ATOM 0 HB2 LEU A 170 -29.005 -6.661 7.771 1.00 15.16 H new ATOM 0 HB3 LEU A 170 -30.388 -5.957 6.957 1.00 15.16 H new ATOM 0 HG LEU A 170 -31.862 -6.810 8.784 1.00 15.47 H new ATOM 0 HD11 LEU A 170 -30.823 -7.569 10.881 1.00 16.05 H new ATOM 0 HD12 LEU A 170 -30.482 -8.681 9.534 1.00 16.05 H new ATOM 0 HD13 LEU A 170 -29.227 -7.550 10.093 1.00 16.05 H new ATOM 0 HD21 LEU A 170 -31.127 -5.160 10.462 1.00 15.45 H new ATOM 0 HD22 LEU A 170 -29.546 -5.048 9.653 1.00 15.45 H new ATOM 0 HD23 LEU A 170 -31.018 -4.512 8.809 1.00 15.45 H new ATOM 2663 N GLU A 171 -32.321 -7.447 5.668 1.00 15.42 N ATOM 2664 CA GLU A 171 -33.708 -7.560 5.246 1.00 15.90 C ATOM 2665 C GLU A 171 -33.871 -8.777 4.343 1.00 16.52 C ATOM 2666 O GLU A 171 -34.616 -9.706 4.655 1.00 17.29 O ATOM 2667 CB GLU A 171 -34.138 -6.288 4.513 1.00 15.17 C ATOM 2668 CG GLU A 171 -35.551 -6.341 3.965 1.00 15.22 C ATOM 2669 CD GLU A 171 -35.914 -5.092 3.195 1.00 14.93 C ATOM 2670 OE1 GLU A 171 -35.552 -4.995 2.004 1.00 14.68 O ATOM 2671 OE2 GLU A 171 -36.562 -4.199 3.774 1.00 15.07 O ATOM 0 H GLU A 171 -31.803 -6.693 5.216 1.00 15.42 H new ATOM 0 HA GLU A 171 -34.343 -7.684 6.123 1.00 15.90 H new ATOM 0 HB2 GLU A 171 -34.055 -5.442 5.195 1.00 15.17 H new ATOM 0 HB3 GLU A 171 -33.447 -6.103 3.691 1.00 15.17 H new ATOM 0 HG2 GLU A 171 -35.654 -7.209 3.314 1.00 15.22 H new ATOM 0 HG3 GLU A 171 -36.253 -6.475 4.788 1.00 15.22 H new ATOM 2678 N HIS A 172 -33.155 -8.751 3.229 1.00 16.27 N ATOM 2679 CA HIS A 172 -33.108 -9.864 2.291 1.00 16.96 C ATOM 2680 C HIS A 172 -32.083 -9.555 1.211 1.00 17.80 C ATOM 2681 O HIS A 172 -30.907 -9.858 1.381 1.00 18.06 O ATOM 2682 CB HIS A 172 -34.484 -10.143 1.663 1.00 16.71 C ATOM 2683 CG HIS A 172 -34.500 -11.340 0.757 1.00 16.63 C ATOM 2684 ND1 HIS A 172 -34.524 -11.243 -0.619 1.00 16.51 N ATOM 2685 CD2 HIS A 172 -34.492 -12.664 1.036 1.00 16.83 C ATOM 2686 CE1 HIS A 172 -34.530 -12.453 -1.144 1.00 16.61 C ATOM 2687 NE2 HIS A 172 -34.510 -13.332 -0.163 1.00 16.80 N ATOM 0 H HIS A 172 -32.586 -7.952 2.948 1.00 16.27 H new ATOM 0 HA HIS A 172 -32.819 -10.764 2.834 1.00 16.96 H new ATOM 0 HB2 HIS A 172 -35.214 -10.290 2.459 1.00 16.71 H new ATOM 0 HB3 HIS A 172 -34.801 -9.266 1.098 1.00 16.71 H new ATOM 0 HD2 HIS A 172 -34.475 -13.112 2.019 1.00 16.83 H new ATOM 0 HE1 HIS A 172 -34.548 -12.684 -2.199 1.00 16.61 H new ATOM 0 HE2 HIS A 172 -34.508 -14.346 -0.276 1.00 16.80 H new ATOM 2696 N HIS A 173 -32.540 -8.889 0.145 1.00 18.31 N ATOM 2697 CA HIS A 173 -31.703 -8.514 -1.004 1.00 19.22 C ATOM 2698 C HIS A 173 -30.814 -9.664 -1.488 1.00 19.76 C ATOM 2699 O HIS A 173 -31.202 -10.429 -2.371 1.00 19.79 O ATOM 2700 CB HIS A 173 -30.847 -7.284 -0.684 1.00 19.61 C ATOM 2701 CG HIS A 173 -31.644 -6.050 -0.387 1.00 20.05 C ATOM 2702 ND1 HIS A 173 -31.786 -5.531 0.884 1.00 20.25 N ATOM 2703 CD2 HIS A 173 -32.341 -5.226 -1.205 1.00 20.44 C ATOM 2704 CE1 HIS A 173 -32.534 -4.444 0.833 1.00 20.74 C ATOM 2705 NE2 HIS A 173 -32.883 -4.237 -0.421 1.00 20.87 N ATOM 0 H HIS A 173 -33.511 -8.591 0.053 1.00 18.31 H new ATOM 0 HA HIS A 173 -32.388 -8.270 -1.816 1.00 19.22 H new ATOM 0 HB2 HIS A 173 -30.211 -7.509 0.172 1.00 19.61 H new ATOM 0 HB3 HIS A 173 -30.186 -7.084 -1.528 1.00 19.61 H new ATOM 0 HD1 HIS A 173 -31.377 -5.926 1.731 1.00 20.25 H new ATOM 0 HD2 HIS A 173 -32.450 -5.328 -2.275 1.00 20.44 H new ATOM 0 HE1 HIS A 173 -32.813 -3.829 1.676 1.00 20.74 H new ATOM 2714 N HIS A 174 -29.636 -9.792 -0.888 1.00 20.30 N ATOM 2715 CA HIS A 174 -28.666 -10.801 -1.296 1.00 20.96 C ATOM 2716 C HIS A 174 -29.127 -12.184 -0.848 1.00 21.59 C ATOM 2717 O HIS A 174 -29.642 -12.348 0.256 1.00 21.97 O ATOM 2718 CB HIS A 174 -27.281 -10.496 -0.705 1.00 21.33 C ATOM 2719 CG HIS A 174 -26.670 -9.212 -1.188 1.00 21.43 C ATOM 2720 ND1 HIS A 174 -25.376 -9.120 -1.649 1.00 21.76 N ATOM 2721 CD2 HIS A 174 -27.175 -7.957 -1.250 1.00 21.37 C ATOM 2722 CE1 HIS A 174 -25.112 -7.868 -1.970 1.00 21.89 C ATOM 2723 NE2 HIS A 174 -26.187 -7.140 -1.739 1.00 21.66 N ATOM 0 H HIS A 174 -29.328 -9.205 -0.112 1.00 20.30 H new ATOM 0 HA HIS A 174 -28.591 -10.783 -2.383 1.00 20.96 H new ATOM 0 HB2 HIS A 174 -27.363 -10.459 0.381 1.00 21.33 H new ATOM 0 HB3 HIS A 174 -26.607 -11.318 -0.946 1.00 21.33 H new ATOM 0 HD2 HIS A 174 -28.172 -7.655 -0.967 1.00 21.37 H new ATOM 0 HE1 HIS A 174 -24.173 -7.501 -2.357 1.00 21.89 H new ATOM 0 HE2 HIS A 174 -26.270 -6.136 -1.898 1.00 21.66 H new ATOM 2732 N HIS A 175 -28.935 -13.173 -1.706 1.00 21.78 N ATOM 2733 CA HIS A 175 -29.383 -14.528 -1.412 1.00 22.46 C ATOM 2734 C HIS A 175 -28.469 -15.196 -0.395 1.00 23.08 C ATOM 2735 O HIS A 175 -27.262 -15.311 -0.605 1.00 23.17 O ATOM 2736 CB HIS A 175 -29.459 -15.365 -2.691 1.00 22.43 C ATOM 2737 CG HIS A 175 -30.586 -14.964 -3.590 1.00 22.30 C ATOM 2738 ND1 HIS A 175 -30.402 -14.416 -4.840 1.00 22.32 N ATOM 2739 CD2 HIS A 175 -31.924 -15.026 -3.404 1.00 22.27 C ATOM 2740 CE1 HIS A 175 -31.578 -14.157 -5.380 1.00 22.31 C ATOM 2741 NE2 HIS A 175 -32.519 -14.519 -4.529 1.00 22.28 N ATOM 0 H HIS A 175 -28.474 -13.065 -2.609 1.00 21.78 H new ATOM 0 HA HIS A 175 -30.383 -14.463 -0.982 1.00 22.46 H new ATOM 0 HB2 HIS A 175 -28.519 -15.273 -3.234 1.00 22.43 H new ATOM 0 HB3 HIS A 175 -29.572 -16.416 -2.424 1.00 22.43 H new ATOM 0 HD2 HIS A 175 -32.431 -15.406 -2.529 1.00 22.27 H new ATOM 0 HE1 HIS A 175 -31.742 -13.722 -6.355 1.00 22.31 H new ATOM 0 HE2 HIS A 175 -33.524 -14.435 -4.683 1.00 22.28 H new ATOM 2750 N HIS A 176 -29.058 -15.630 0.709 1.00 23.60 N ATOM 2751 CA HIS A 176 -28.307 -16.257 1.788 1.00 24.32 C ATOM 2752 C HIS A 176 -27.995 -17.706 1.448 1.00 24.96 C ATOM 2753 O HIS A 176 -26.908 -18.202 1.756 1.00 25.33 O ATOM 2754 CB HIS A 176 -29.098 -16.209 3.101 1.00 24.63 C ATOM 2755 CG HIS A 176 -29.304 -14.829 3.648 1.00 24.68 C ATOM 2756 ND1 HIS A 176 -28.623 -14.347 4.743 1.00 24.97 N ATOM 2757 CD2 HIS A 176 -30.134 -13.833 3.257 1.00 24.59 C ATOM 2758 CE1 HIS A 176 -29.025 -13.120 5.003 1.00 25.05 C ATOM 2759 NE2 HIS A 176 -29.939 -12.782 4.117 1.00 24.83 N ATOM 0 H HIS A 176 -30.061 -15.559 0.882 1.00 23.60 H new ATOM 0 HA HIS A 176 -27.376 -15.704 1.910 1.00 24.32 H new ATOM 0 HB2 HIS A 176 -30.071 -16.673 2.942 1.00 24.63 H new ATOM 0 HB3 HIS A 176 -28.577 -16.809 3.847 1.00 24.63 H new ATOM 0 HD2 HIS A 176 -30.821 -13.861 2.424 1.00 24.59 H new ATOM 0 HE1 HIS A 176 -28.665 -12.496 5.808 1.00 25.05 H new ATOM 0 HE2 HIS A 176 -30.423 -11.885 4.077 1.00 24.83 H new ATOM 2768 N HIS A 177 -28.954 -18.362 0.801 1.00 25.19 N ATOM 2769 CA HIS A 177 -28.873 -19.788 0.491 1.00 25.89 C ATOM 2770 C HIS A 177 -28.796 -20.600 1.781 1.00 26.38 C ATOM 2771 O HIS A 177 -27.711 -20.924 2.273 1.00 26.64 O ATOM 2772 CB HIS A 177 -27.682 -20.098 -0.431 1.00 26.07 C ATOM 2773 CG HIS A 177 -27.560 -21.547 -0.807 1.00 26.41 C ATOM 2774 ND1 HIS A 177 -26.373 -22.239 -0.742 1.00 26.57 N ATOM 2775 CD2 HIS A 177 -28.482 -22.431 -1.260 1.00 26.71 C ATOM 2776 CE1 HIS A 177 -26.566 -23.482 -1.136 1.00 26.95 C ATOM 2777 NE2 HIS A 177 -27.838 -23.632 -1.455 1.00 27.04 N ATOM 0 H HIS A 177 -29.813 -17.919 0.475 1.00 25.19 H new ATOM 0 HA HIS A 177 -29.777 -20.072 -0.047 1.00 25.89 H new ATOM 0 HB2 HIS A 177 -27.776 -19.504 -1.340 1.00 26.07 H new ATOM 0 HB3 HIS A 177 -26.763 -19.783 0.062 1.00 26.07 H new ATOM 0 HD2 HIS A 177 -29.529 -22.230 -1.436 1.00 26.71 H new ATOM 0 HE1 HIS A 177 -25.809 -24.250 -1.189 1.00 26.95 H new ATOM 0 HE2 HIS A 177 -28.271 -24.493 -1.790 1.00 27.04 H new ATOM 2786 N LEU A 178 -29.959 -20.899 2.334 1.00 26.60 N ATOM 2787 CA LEU A 178 -30.050 -21.657 3.568 1.00 27.15 C ATOM 2788 C LEU A 178 -29.911 -23.140 3.272 1.00 27.42 C ATOM 2789 O LEU A 178 -30.698 -23.694 2.498 1.00 27.57 O ATOM 2790 CB LEU A 178 -31.385 -21.382 4.267 1.00 27.23 C ATOM 2791 CG LEU A 178 -31.583 -22.097 5.606 1.00 27.46 C ATOM 2792 CD1 LEU A 178 -30.559 -21.622 6.625 1.00 27.88 C ATOM 2793 CD2 LEU A 178 -32.997 -21.875 6.123 1.00 27.61 C ATOM 0 H LEU A 178 -30.860 -20.625 1.943 1.00 26.60 H new ATOM 0 HA LEU A 178 -29.242 -21.348 4.231 1.00 27.15 H new ATOM 0 HB2 LEU A 178 -31.476 -20.308 4.431 1.00 27.23 H new ATOM 0 HB3 LEU A 178 -32.194 -21.672 3.596 1.00 27.23 H new ATOM 0 HG LEU A 178 -31.437 -23.166 5.450 1.00 27.46 H new ATOM 0 HD11 LEU A 178 -30.717 -22.142 7.570 1.00 27.88 H new ATOM 0 HD12 LEU A 178 -29.555 -21.834 6.258 1.00 27.88 H new ATOM 0 HD13 LEU A 178 -30.670 -20.549 6.779 1.00 27.88 H new ATOM 0 HD21 LEU A 178 -33.121 -22.390 7.076 1.00 27.61 H new ATOM 0 HD22 LEU A 178 -33.170 -20.808 6.262 1.00 27.61 H new ATOM 0 HD23 LEU A 178 -33.714 -22.268 5.402 1.00 27.61 H new ATOM 2805 N GLU A 179 -28.895 -23.763 3.874 1.00 27.58 N ATOM 2806 CA GLU A 179 -28.615 -25.188 3.685 1.00 27.93 C ATOM 2807 C GLU A 179 -28.065 -25.473 2.290 1.00 28.01 C ATOM 2808 O GLU A 179 -28.482 -24.871 1.299 1.00 27.88 O ATOM 2809 CB GLU A 179 -29.865 -26.034 3.944 1.00 28.15 C ATOM 2810 CG GLU A 179 -30.109 -26.341 5.408 1.00 28.46 C ATOM 2811 CD GLU A 179 -29.148 -27.382 5.941 1.00 28.92 C ATOM 2812 OE1 GLU A 179 -29.428 -28.590 5.780 1.00 29.20 O ATOM 2813 OE2 GLU A 179 -28.104 -27.002 6.506 1.00 29.07 O ATOM 0 H GLU A 179 -28.245 -23.295 4.505 1.00 27.58 H new ATOM 0 HA GLU A 179 -27.851 -25.464 4.412 1.00 27.93 H new ATOM 0 HB2 GLU A 179 -30.734 -25.512 3.543 1.00 28.15 H new ATOM 0 HB3 GLU A 179 -29.776 -26.972 3.396 1.00 28.15 H new ATOM 0 HG2 GLU A 179 -30.010 -25.425 5.991 1.00 28.46 H new ATOM 0 HG3 GLU A 179 -31.132 -26.693 5.538 1.00 28.46 H new ATOM 2820 N HIS A 180 -27.112 -26.390 2.219 1.00 28.32 N ATOM 2821 CA HIS A 180 -26.551 -26.803 0.941 1.00 28.53 C ATOM 2822 C HIS A 180 -26.564 -28.322 0.827 1.00 28.95 C ATOM 2823 O HIS A 180 -25.844 -28.902 0.019 1.00 29.23 O ATOM 2824 CB HIS A 180 -25.128 -26.245 0.749 1.00 28.74 C ATOM 2825 CG HIS A 180 -24.095 -26.792 1.692 1.00 28.72 C ATOM 2826 ND1 HIS A 180 -23.854 -26.263 2.941 1.00 28.77 N ATOM 2827 CD2 HIS A 180 -23.223 -27.819 1.550 1.00 28.77 C ATOM 2828 CE1 HIS A 180 -22.883 -26.939 3.524 1.00 28.84 C ATOM 2829 NE2 HIS A 180 -22.484 -27.889 2.703 1.00 28.84 N ATOM 0 H HIS A 180 -26.711 -26.862 3.030 1.00 28.32 H new ATOM 0 HA HIS A 180 -27.172 -26.391 0.145 1.00 28.53 H new ATOM 0 HB2 HIS A 180 -24.809 -26.450 -0.273 1.00 28.74 H new ATOM 0 HB3 HIS A 180 -25.162 -25.161 0.861 1.00 28.74 H new ATOM 0 HD2 HIS A 180 -23.128 -28.463 0.688 1.00 28.77 H new ATOM 0 HE1 HIS A 180 -22.483 -26.746 4.508 1.00 28.84 H new ATOM 0 HE2 HIS A 180 -21.746 -28.566 2.894 1.00 28.84 H new ATOM 2838 N HIS A 181 -27.406 -28.958 1.635 1.00 29.09 N ATOM 2839 CA HIS A 181 -27.550 -30.410 1.602 1.00 29.57 C ATOM 2840 C HIS A 181 -28.313 -30.837 0.358 1.00 29.91 C ATOM 2841 O HIS A 181 -27.881 -31.724 -0.379 1.00 30.13 O ATOM 2842 CB HIS A 181 -28.279 -30.918 2.850 1.00 29.72 C ATOM 2843 CG HIS A 181 -27.399 -31.070 4.050 1.00 29.81 C ATOM 2844 ND1 HIS A 181 -27.493 -30.265 5.165 1.00 29.72 N ATOM 2845 CD2 HIS A 181 -26.412 -31.958 4.314 1.00 30.08 C ATOM 2846 CE1 HIS A 181 -26.600 -30.648 6.058 1.00 29.92 C ATOM 2847 NE2 HIS A 181 -25.933 -31.673 5.566 1.00 30.14 N ATOM 0 H HIS A 181 -27.999 -28.491 2.321 1.00 29.09 H new ATOM 0 HA HIS A 181 -26.551 -30.845 1.580 1.00 29.57 H new ATOM 0 HB2 HIS A 181 -29.088 -30.229 3.091 1.00 29.72 H new ATOM 0 HB3 HIS A 181 -28.737 -31.881 2.624 1.00 29.72 H new ATOM 0 HD1 HIS A 181 -28.150 -29.494 5.282 1.00 29.72 H new ATOM 0 HD2 HIS A 181 -26.066 -32.745 3.660 1.00 30.08 H new ATOM 0 HE1 HIS A 181 -26.442 -30.198 7.027 1.00 29.92 H new ATOM 2856 N HIS A 182 -29.440 -30.187 0.120 1.00 30.03 N ATOM 2857 CA HIS A 182 -30.286 -30.511 -1.016 1.00 30.43 C ATOM 2858 C HIS A 182 -29.839 -29.752 -2.253 1.00 30.87 C ATOM 2859 O HIS A 182 -30.076 -28.549 -2.381 1.00 31.02 O ATOM 2860 CB HIS A 182 -31.754 -30.195 -0.714 1.00 30.52 C ATOM 2861 CG HIS A 182 -32.416 -31.183 0.196 1.00 30.37 C ATOM 2862 ND1 HIS A 182 -33.662 -31.709 -0.050 1.00 30.34 N ATOM 2863 CD2 HIS A 182 -32.002 -31.737 1.359 1.00 30.33 C ATOM 2864 CE1 HIS A 182 -33.987 -32.540 0.918 1.00 30.28 C ATOM 2865 NE2 HIS A 182 -32.996 -32.581 1.789 1.00 30.28 N ATOM 0 H HIS A 182 -29.792 -29.427 0.703 1.00 30.03 H new ATOM 0 HA HIS A 182 -30.192 -31.580 -1.205 1.00 30.43 H new ATOM 0 HB2 HIS A 182 -31.816 -29.204 -0.264 1.00 30.52 H new ATOM 0 HB3 HIS A 182 -32.307 -30.154 -1.653 1.00 30.52 H new ATOM 0 HD2 HIS A 182 -31.062 -31.550 1.857 1.00 30.33 H new ATOM 0 HE1 HIS A 182 -34.911 -33.096 0.988 1.00 30.28 H new ATOM 0 HE2 HIS A 182 -32.973 -33.145 2.639 1.00 30.28 H new ATOM 2874 N HIS A 183 -29.155 -30.455 -3.137 1.00 31.15 N ATOM 2875 CA HIS A 183 -28.772 -29.906 -4.426 1.00 31.67 C ATOM 2876 C HIS A 183 -29.730 -30.429 -5.488 1.00 32.06 C ATOM 2877 O HIS A 183 -30.041 -29.744 -6.460 1.00 32.12 O ATOM 2878 CB HIS A 183 -27.328 -30.293 -4.761 1.00 31.92 C ATOM 2879 CG HIS A 183 -26.805 -29.683 -6.025 1.00 31.89 C ATOM 2880 ND1 HIS A 183 -25.942 -30.339 -6.872 1.00 31.92 N ATOM 2881 CD2 HIS A 183 -27.011 -28.463 -6.573 1.00 31.92 C ATOM 2882 CE1 HIS A 183 -25.640 -29.551 -7.886 1.00 31.97 C ATOM 2883 NE2 HIS A 183 -26.275 -28.407 -7.729 1.00 31.97 N ATOM 0 H HIS A 183 -28.851 -31.416 -2.984 1.00 31.15 H new ATOM 0 HA HIS A 183 -28.828 -28.818 -4.394 1.00 31.67 H new ATOM 0 HB2 HIS A 183 -26.683 -29.996 -3.934 1.00 31.92 H new ATOM 0 HB3 HIS A 183 -27.264 -31.378 -4.841 1.00 31.92 H new ATOM 0 HD2 HIS A 183 -27.638 -27.679 -6.174 1.00 31.92 H new ATOM 0 HE1 HIS A 183 -24.983 -29.801 -8.706 1.00 31.97 H new ATOM 0 HE2 HIS A 183 -26.227 -27.610 -8.364 1.00 31.97 H new ATOM 2892 N HIS A 184 -30.189 -31.657 -5.287 1.00 32.40 N ATOM 2893 CA HIS A 184 -31.200 -32.250 -6.149 1.00 32.88 C ATOM 2894 C HIS A 184 -32.531 -32.311 -5.404 1.00 33.44 C ATOM 2895 O HIS A 184 -33.310 -31.359 -5.441 1.00 33.70 O ATOM 2896 CB HIS A 184 -30.781 -33.651 -6.605 1.00 33.08 C ATOM 2897 CG HIS A 184 -29.470 -33.695 -7.327 1.00 32.98 C ATOM 2898 ND1 HIS A 184 -28.406 -34.464 -6.909 1.00 33.08 N ATOM 2899 CD2 HIS A 184 -29.058 -33.073 -8.457 1.00 32.87 C ATOM 2900 CE1 HIS A 184 -27.401 -34.314 -7.748 1.00 33.03 C ATOM 2901 NE2 HIS A 184 -27.770 -33.476 -8.695 1.00 32.91 N ATOM 0 H HIS A 184 -29.875 -32.264 -4.530 1.00 32.40 H new ATOM 0 HA HIS A 184 -31.310 -31.629 -7.038 1.00 32.88 H new ATOM 0 HB2 HIS A 184 -30.725 -34.303 -5.733 1.00 33.08 H new ATOM 0 HB3 HIS A 184 -31.556 -34.056 -7.256 1.00 33.08 H new ATOM 0 HD2 HIS A 184 -29.636 -32.387 -9.058 1.00 32.87 H new ATOM 0 HE1 HIS A 184 -26.438 -34.796 -7.672 1.00 33.03 H new ATOM 0 HE2 HIS A 184 -27.191 -33.176 -9.479 1.00 32.91 H new ATOM 2910 N HIS A 185 -32.771 -33.421 -4.711 1.00 33.68 N ATOM 2911 CA HIS A 185 -33.951 -33.570 -3.861 1.00 34.28 C ATOM 2912 C HIS A 185 -33.625 -34.473 -2.678 1.00 34.40 C ATOM 2913 O HIS A 185 -34.209 -35.572 -2.574 1.00 34.51 O ATOM 2914 CB HIS A 185 -35.141 -34.151 -4.640 1.00 34.66 C ATOM 2915 CG HIS A 185 -35.817 -33.174 -5.551 1.00 35.20 C ATOM 2916 ND1 HIS A 185 -36.738 -32.248 -5.110 1.00 35.58 N ATOM 2917 CD2 HIS A 185 -35.705 -32.983 -6.885 1.00 35.50 C ATOM 2918 CE1 HIS A 185 -37.160 -31.531 -6.134 1.00 36.07 C ATOM 2919 NE2 HIS A 185 -36.549 -31.956 -7.221 1.00 36.03 N ATOM 2920 OXT HIS A 185 -32.748 -34.098 -1.876 1.00 34.44 O ATOM 0 H HIS A 185 -32.159 -34.237 -4.721 1.00 33.68 H new ATOM 0 HA HIS A 185 -34.232 -32.579 -3.505 1.00 34.28 H new ATOM 0 HB2 HIS A 185 -34.795 -35.000 -5.229 1.00 34.66 H new ATOM 0 HB3 HIS A 185 -35.873 -34.534 -3.929 1.00 34.66 H new ATOM 0 HD2 HIS A 185 -35.069 -33.536 -7.560 1.00 35.50 H new ATOM 0 HE1 HIS A 185 -37.884 -30.731 -6.089 1.00 36.07 H new ATOM 0 HE2 HIS A 185 -36.682 -31.582 -8.160 1.00 36.03 H new TER 2929 HIS A 185