USER MOD reduce.3.24.130724 H: found=0, std=0, add=1157, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1157 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 Single : A 1 MET CE :methyl -147:sc= 0 (180deg=-0.169) USER MOD Single : A 1 MET N :NH3+ -129:sc= 0.399 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -108:sc= 1.12 (180deg=-0.891) USER MOD Single : A 8 ASN : amide:sc= -0.058 K(o=-0.058,f=-2.5!) USER MOD Single : A 9 THR OG1 : rot 48:sc= -0.0823 USER MOD Single : A 10 ASN : amide:sc= 0.125 K(o=0.12,f=-0.49) USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ -155:sc= 0.509 (180deg=0.0911) USER MOD Single : A 19 LYS NZ :NH3+ -145:sc= -0.975 (180deg=-2.81!) USER MOD Single : A 20 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00931) USER MOD Single : A 24 ASN : amide:sc= -1.23 K(o=-1.2,f=-0.0075) USER MOD Single : A 25 GLN : amide:sc= -0.274 X(o=-0.27,f=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.268 X(o=-0.27,f=0) USER MOD Single : A 33 ASN : amide:sc= -0.754 K(o=-0.75,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 169:sc= 0.42 (180deg=0.353) USER MOD Single : A 42 MET CE :methyl -131:sc= -0.925 (180deg=-2.33) USER MOD Single : A 43 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0419) USER MOD Single : A 44 LYS NZ :NH3+ 145:sc= 0.949 (180deg=0.329) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc=-0.00602 K(o=-0.006,f=-0.81) USER MOD Single : A 53 LYS NZ :NH3+ -158:sc= 0.746 (180deg=0.318) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 170:sc= 0.0241 USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=-0.064) USER MOD Single : A 61 LYS NZ :NH3+ 147:sc= 0.719 (180deg=-0.265) USER MOD Single : A 62 GLN : amide:sc=-0.00291 K(o=-0.0029,f=-2.1!) USER MOD Single : A 65 LYS NZ :NH3+ 147:sc= -0.707 (180deg=-2.23!) USER MOD Single : A 67 MET CE :methyl -165:sc= -0.498 (180deg=-0.904) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ -132:sc= -0.777 (180deg=-3.03!) USER MOD Single : A 76 TYR OH : rot 172:sc= -1.66 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -0.943 K(o=-0.94,f=-0.025) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 LYS NZ :NH3+ -107:sc= 0.612 (180deg=0.00889) USER MOD Single : A 96 LYS NZ :NH3+ -177:sc= 0.699 (180deg=0.685) USER MOD Single : A 99 SER OG : rot 61:sc= 1.26 USER MOD Single : A 100 GLN : amide:sc= -1.72! K(o=-1.7!,f=-0.005) USER MOD Single : A 102 TYR OH : rot -150:sc= 0.803 USER MOD Single : A 106 LYS NZ :NH3+ -169:sc= -0.753 (180deg=-0.935) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 154:sc= 0.21 (180deg=-0.121) USER MOD Single : A 121 MET CE :methyl -137:sc= -0.615 (180deg=-3.52!) USER MOD Single : A 122 GLN : amide:sc= -0.0131 X(o=-0.013,f=-0.49) USER MOD Single : A 123 LYS NZ :NH3+ 175:sc= 0.356 (180deg=0.343) USER MOD Single : A 126 SER OG : rot 71:sc= 1.01 USER MOD Single : A 129 HIS : no HD1:sc= -0.269 X(o=-0.27,f=-0.75) USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 132 HIS : no HD1:sc= -0.0123 X(o=-0.012,f=0) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.135 9.726 14.328 1.00 55.40 N ATOM 2 CA MET A 1 3.682 9.640 12.955 1.00 14.34 C ATOM 3 C MET A 1 3.853 8.165 12.612 1.00 24.31 C ATOM 4 O MET A 1 4.394 7.426 13.422 1.00 2.51 O ATOM 5 CB MET A 1 5.033 10.398 12.857 1.00 34.14 C ATOM 6 CG MET A 1 5.729 10.286 11.490 1.00 51.11 C ATOM 7 SD MET A 1 4.671 10.823 10.127 1.00 60.13 S ATOM 8 CE MET A 1 5.750 10.559 8.723 1.00 4.05 C ATOM 0 H1 MET A 1 2.299 10.345 14.331 1.00 55.40 H new ATOM 0 H2 MET A 1 2.863 8.776 14.654 1.00 55.40 H new ATOM 0 H3 MET A 1 3.858 10.117 14.966 1.00 55.40 H new ATOM 0 HA MET A 1 3.001 10.108 12.245 1.00 14.34 H new ATOM 0 HB2 MET A 1 4.861 11.451 13.078 1.00 34.14 H new ATOM 0 HB3 MET A 1 5.706 10.017 13.625 1.00 34.14 H new ATOM 0 HG2 MET A 1 6.638 10.888 11.499 1.00 51.11 H new ATOM 0 HG3 MET A 1 6.032 9.252 11.324 1.00 51.11 H new ATOM 0 HE1 MET A 1 5.548 11.313 7.962 1.00 4.05 H new ATOM 0 HE2 MET A 1 6.789 10.636 9.043 1.00 4.05 H new ATOM 0 HE3 MET A 1 5.571 9.567 8.308 1.00 4.05 H new ATOM 20 N LYS A 2 3.403 7.739 11.419 1.00 53.40 N ATOM 21 CA LYS A 2 3.354 6.314 11.073 1.00 50.35 C ATOM 22 C LYS A 2 3.410 6.147 9.538 1.00 25.40 C ATOM 23 O LYS A 2 2.556 6.662 8.819 1.00 11.10 O ATOM 24 CB LYS A 2 2.073 5.703 11.713 1.00 22.33 C ATOM 25 CG LYS A 2 1.994 4.161 11.705 1.00 54.43 C ATOM 26 CD LYS A 2 0.971 3.628 12.742 1.00 33.41 C ATOM 27 CE LYS A 2 0.850 2.100 12.726 1.00 52.42 C ATOM 28 NZ LYS A 2 0.302 1.571 14.006 1.00 20.32 N ATOM 0 H LYS A 2 3.070 8.361 10.683 1.00 53.40 H new ATOM 0 HA LYS A 2 4.215 5.776 11.469 1.00 50.35 H new ATOM 0 HB2 LYS A 2 2.005 6.047 12.745 1.00 22.33 H new ATOM 0 HB3 LYS A 2 1.203 6.096 11.187 1.00 22.33 H new ATOM 0 HG2 LYS A 2 1.714 3.817 10.709 1.00 54.43 H new ATOM 0 HG3 LYS A 2 2.979 3.746 11.920 1.00 54.43 H new ATOM 0 HD2 LYS A 2 1.268 3.954 13.739 1.00 33.41 H new ATOM 0 HD3 LYS A 2 -0.006 4.067 12.541 1.00 33.41 H new ATOM 0 HE2 LYS A 2 0.205 1.796 11.902 1.00 52.42 H new ATOM 0 HE3 LYS A 2 1.830 1.660 12.542 1.00 52.42 H new ATOM 0 HZ1 LYS A 2 1.058 1.093 14.536 1.00 20.32 H new ATOM 0 HZ2 LYS A 2 -0.076 2.357 14.573 1.00 20.32 H new ATOM 0 HZ3 LYS A 2 -0.460 0.893 13.803 1.00 20.32 H new ATOM 42 N ILE A 3 4.454 5.450 9.052 1.00 45.32 N ATOM 43 CA ILE A 3 4.734 5.297 7.612 1.00 43.43 C ATOM 44 C ILE A 3 4.216 3.926 7.126 1.00 1.21 C ATOM 45 O ILE A 3 4.653 2.890 7.607 1.00 12.54 O ATOM 46 CB ILE A 3 6.285 5.431 7.333 1.00 32.32 C ATOM 47 CG1 ILE A 3 6.819 6.817 7.835 1.00 63.53 C ATOM 48 CG2 ILE A 3 6.612 5.211 5.836 1.00 70.13 C ATOM 49 CD1 ILE A 3 8.322 7.018 7.712 1.00 14.42 C ATOM 0 H ILE A 3 5.130 4.975 9.650 1.00 45.32 H new ATOM 0 HA ILE A 3 4.220 6.087 7.064 1.00 43.43 H new ATOM 0 HB ILE A 3 6.796 4.648 7.893 1.00 32.32 H new ATOM 0 HG12 ILE A 3 6.317 7.606 7.275 1.00 63.53 H new ATOM 0 HG13 ILE A 3 6.537 6.939 8.881 1.00 63.53 H new ATOM 0 HG21 ILE A 3 7.686 5.310 5.680 1.00 70.13 H new ATOM 0 HG22 ILE A 3 6.292 4.213 5.537 1.00 70.13 H new ATOM 0 HG23 ILE A 3 6.088 5.955 5.236 1.00 70.13 H new ATOM 0 HD11 ILE A 3 8.589 8.007 8.086 1.00 14.42 H new ATOM 0 HD12 ILE A 3 8.840 6.257 8.296 1.00 14.42 H new ATOM 0 HD13 ILE A 3 8.616 6.934 6.666 1.00 14.42 H new ATOM 61 N LEU A 4 3.249 3.938 6.207 1.00 42.12 N ATOM 62 CA LEU A 4 2.662 2.722 5.609 1.00 53.53 C ATOM 63 C LEU A 4 3.058 2.646 4.128 1.00 64.11 C ATOM 64 O LEU A 4 3.209 3.677 3.474 1.00 15.22 O ATOM 65 CB LEU A 4 1.099 2.735 5.736 1.00 73.42 C ATOM 66 CG LEU A 4 0.460 2.339 7.116 1.00 35.13 C ATOM 67 CD1 LEU A 4 1.002 3.161 8.296 1.00 71.15 C ATOM 68 CD2 LEU A 4 -1.080 2.442 7.036 1.00 71.04 C ATOM 0 H LEU A 4 2.841 4.801 5.847 1.00 42.12 H new ATOM 0 HA LEU A 4 3.042 1.851 6.142 1.00 53.53 H new ATOM 0 HB2 LEU A 4 0.753 3.738 5.485 1.00 73.42 H new ATOM 0 HB3 LEU A 4 0.698 2.061 4.979 1.00 73.42 H new ATOM 0 HG LEU A 4 0.747 1.306 7.312 1.00 35.13 H new ATOM 0 HD11 LEU A 4 0.519 2.837 9.218 1.00 71.15 H new ATOM 0 HD12 LEU A 4 2.079 3.012 8.379 1.00 71.15 H new ATOM 0 HD13 LEU A 4 0.793 4.218 8.130 1.00 71.15 H new ATOM 0 HD21 LEU A 4 -1.514 2.166 7.997 1.00 71.04 H new ATOM 0 HD22 LEU A 4 -1.364 3.465 6.791 1.00 71.04 H new ATOM 0 HD23 LEU A 4 -1.450 1.768 6.264 1.00 71.04 H new ATOM 80 N ILE A 5 3.240 1.421 3.611 1.00 25.32 N ATOM 81 CA ILE A 5 3.333 1.157 2.165 1.00 62.24 C ATOM 82 C ILE A 5 2.246 0.121 1.820 1.00 13.23 C ATOM 83 O ILE A 5 2.366 -1.048 2.169 1.00 11.41 O ATOM 84 CB ILE A 5 4.765 0.645 1.709 1.00 54.23 C ATOM 85 CG1 ILE A 5 5.877 1.695 2.061 1.00 53.23 C ATOM 86 CG2 ILE A 5 4.779 0.314 0.191 1.00 51.20 C ATOM 87 CD1 ILE A 5 7.286 1.341 1.592 1.00 31.22 C ATOM 0 H ILE A 5 3.327 0.582 4.185 1.00 25.32 H new ATOM 0 HA ILE A 5 3.180 2.092 1.626 1.00 62.24 H new ATOM 0 HB ILE A 5 4.982 -0.272 2.257 1.00 54.23 H new ATOM 0 HG12 ILE A 5 5.598 2.654 1.625 1.00 53.23 H new ATOM 0 HG13 ILE A 5 5.896 1.830 3.142 1.00 53.23 H new ATOM 0 HG21 ILE A 5 5.771 -0.034 -0.096 1.00 51.20 H new ATOM 0 HG22 ILE A 5 4.046 -0.465 -0.018 1.00 51.20 H new ATOM 0 HG23 ILE A 5 4.530 1.209 -0.379 1.00 51.20 H new ATOM 0 HD11 ILE A 5 7.977 2.131 1.886 1.00 31.22 H new ATOM 0 HD12 ILE A 5 7.596 0.401 2.048 1.00 31.22 H new ATOM 0 HD13 ILE A 5 7.293 1.238 0.507 1.00 31.22 H new ATOM 99 N LEU A 6 1.182 0.590 1.159 1.00 62.41 N ATOM 100 CA LEU A 6 0.027 -0.223 0.778 1.00 34.14 C ATOM 101 C LEU A 6 0.336 -0.907 -0.567 1.00 74.13 C ATOM 102 O LEU A 6 0.819 -0.265 -1.496 1.00 12.14 O ATOM 103 CB LEU A 6 -1.225 0.716 0.654 1.00 74.21 C ATOM 104 CG LEU A 6 -2.586 0.175 1.181 1.00 1.05 C ATOM 105 CD1 LEU A 6 -3.700 1.231 0.992 1.00 0.31 C ATOM 106 CD2 LEU A 6 -2.970 -1.183 0.549 1.00 1.21 C ATOM 0 H LEU A 6 1.100 1.565 0.869 1.00 62.41 H new ATOM 0 HA LEU A 6 -0.181 -0.989 1.525 1.00 34.14 H new ATOM 0 HB2 LEU A 6 -1.004 1.643 1.184 1.00 74.21 H new ATOM 0 HB3 LEU A 6 -1.350 0.972 -0.398 1.00 74.21 H new ATOM 0 HG LEU A 6 -2.470 -0.012 2.249 1.00 1.05 H new ATOM 0 HD11 LEU A 6 -4.644 0.835 1.366 1.00 0.31 H new ATOM 0 HD12 LEU A 6 -3.442 2.135 1.543 1.00 0.31 H new ATOM 0 HD13 LEU A 6 -3.800 1.468 -0.067 1.00 0.31 H new ATOM 0 HD21 LEU A 6 -3.927 -1.514 0.952 1.00 1.21 H new ATOM 0 HD22 LEU A 6 -3.050 -1.071 -0.532 1.00 1.21 H new ATOM 0 HD23 LEU A 6 -2.203 -1.922 0.781 1.00 1.21 H new ATOM 118 N ILE A 7 0.073 -2.214 -0.650 1.00 2.00 N ATOM 119 CA ILE A 7 0.320 -3.008 -1.862 1.00 44.40 C ATOM 120 C ILE A 7 -0.961 -3.759 -2.237 1.00 54.51 C ATOM 121 O ILE A 7 -1.462 -4.577 -1.458 1.00 64.34 O ATOM 122 CB ILE A 7 1.507 -4.032 -1.654 1.00 22.50 C ATOM 123 CG1 ILE A 7 2.824 -3.297 -1.237 1.00 64.50 C ATOM 124 CG2 ILE A 7 1.735 -4.895 -2.923 1.00 13.14 C ATOM 125 CD1 ILE A 7 3.404 -2.337 -2.270 1.00 0.04 C ATOM 0 H ILE A 7 -0.318 -2.755 0.122 1.00 2.00 H new ATOM 0 HA ILE A 7 0.607 -2.332 -2.667 1.00 44.40 H new ATOM 0 HB ILE A 7 1.224 -4.700 -0.841 1.00 22.50 H new ATOM 0 HG12 ILE A 7 2.632 -2.741 -0.319 1.00 64.50 H new ATOM 0 HG13 ILE A 7 3.578 -4.048 -1.003 1.00 64.50 H new ATOM 0 HG21 ILE A 7 2.557 -5.589 -2.748 1.00 13.14 H new ATOM 0 HG22 ILE A 7 0.828 -5.456 -3.149 1.00 13.14 H new ATOM 0 HG23 ILE A 7 1.980 -4.247 -3.765 1.00 13.14 H new ATOM 0 HD11 ILE A 7 4.314 -1.885 -1.876 1.00 0.04 H new ATOM 0 HD12 ILE A 7 3.637 -2.883 -3.184 1.00 0.04 H new ATOM 0 HD13 ILE A 7 2.676 -1.556 -2.490 1.00 0.04 H new ATOM 137 N ASN A 8 -1.494 -3.447 -3.422 1.00 62.51 N ATOM 138 CA ASN A 8 -2.587 -4.198 -4.042 1.00 72.22 C ATOM 139 C ASN A 8 -2.072 -4.757 -5.366 1.00 64.32 C ATOM 140 O ASN A 8 -1.929 -4.028 -6.351 1.00 52.15 O ATOM 141 CB ASN A 8 -3.818 -3.282 -4.270 1.00 12.45 C ATOM 142 CG ASN A 8 -5.072 -3.995 -4.814 1.00 33.23 C ATOM 143 OD1 ASN A 8 -5.006 -5.028 -5.482 1.00 34.32 O ATOM 144 ND2 ASN A 8 -6.234 -3.428 -4.559 1.00 4.21 N ATOM 0 H ASN A 8 -1.175 -2.657 -3.983 1.00 62.51 H new ATOM 0 HA ASN A 8 -2.907 -5.011 -3.391 1.00 72.22 H new ATOM 0 HB2 ASN A 8 -4.073 -2.801 -3.326 1.00 12.45 H new ATOM 0 HB3 ASN A 8 -3.539 -2.491 -4.965 1.00 12.45 H new ATOM 0 HD21 ASN A 8 -7.094 -3.844 -4.916 1.00 4.21 H new ATOM 0 HD22 ASN A 8 -6.273 -2.573 -4.004 1.00 4.21 H new ATOM 151 N THR A 9 -1.745 -6.044 -5.361 1.00 30.04 N ATOM 152 CA THR A 9 -1.454 -6.800 -6.576 1.00 50.22 C ATOM 153 C THR A 9 -2.242 -8.108 -6.550 1.00 24.41 C ATOM 154 O THR A 9 -2.328 -8.774 -5.510 1.00 75.55 O ATOM 155 CB THR A 9 0.079 -7.045 -6.814 1.00 20.44 C ATOM 156 OG1 THR A 9 0.276 -7.921 -7.947 1.00 71.53 O ATOM 157 CG2 THR A 9 0.810 -7.606 -5.601 1.00 74.21 C ATOM 0 H THR A 9 -1.673 -6.598 -4.507 1.00 30.04 H new ATOM 0 HA THR A 9 -1.772 -6.197 -7.426 1.00 50.22 H new ATOM 0 HB THR A 9 0.511 -6.064 -7.011 1.00 20.44 H new ATOM 0 HG1 THR A 9 -0.276 -7.615 -8.697 1.00 71.53 H new ATOM 0 HG21 THR A 9 1.863 -7.748 -5.844 1.00 74.21 H new ATOM 0 HG22 THR A 9 0.721 -6.909 -4.768 1.00 74.21 H new ATOM 0 HG23 THR A 9 0.370 -8.563 -5.322 1.00 74.21 H new ATOM 165 N ASN A 10 -2.837 -8.450 -7.701 1.00 5.12 N ATOM 166 CA ASN A 10 -3.632 -9.683 -7.874 1.00 42.02 C ATOM 167 C ASN A 10 -2.707 -10.927 -7.955 1.00 71.31 C ATOM 168 O ASN A 10 -3.154 -12.069 -7.801 1.00 75.24 O ATOM 169 CB ASN A 10 -4.538 -9.535 -9.126 1.00 51.04 C ATOM 170 CG ASN A 10 -5.596 -10.637 -9.293 1.00 14.01 C ATOM 171 OD1 ASN A 10 -6.041 -11.255 -8.324 1.00 23.31 O ATOM 172 ND2 ASN A 10 -6.045 -10.859 -10.525 1.00 52.03 N ATOM 0 H ASN A 10 -2.783 -7.879 -8.545 1.00 5.12 H new ATOM 0 HA ASN A 10 -4.276 -9.833 -7.007 1.00 42.02 H new ATOM 0 HB2 ASN A 10 -5.043 -8.570 -9.079 1.00 51.04 H new ATOM 0 HB3 ASN A 10 -3.906 -9.521 -10.014 1.00 51.04 H new ATOM 0 HD21 ASN A 10 -6.774 -11.554 -10.685 1.00 52.03 H new ATOM 0 HD22 ASN A 10 -5.660 -10.334 -11.310 1.00 52.03 H new ATOM 179 N ASN A 11 -1.403 -10.676 -8.186 1.00 50.54 N ATOM 180 CA ASN A 11 -0.357 -11.708 -8.231 1.00 5.44 C ATOM 181 C ASN A 11 0.146 -11.995 -6.809 1.00 51.30 C ATOM 182 O ASN A 11 0.860 -11.169 -6.227 1.00 11.55 O ATOM 183 CB ASN A 11 0.828 -11.241 -9.119 1.00 43.12 C ATOM 184 CG ASN A 11 0.420 -10.884 -10.544 1.00 3.31 C ATOM 185 OD1 ASN A 11 -0.508 -11.469 -11.109 1.00 22.41 O ATOM 186 ND2 ASN A 11 1.100 -9.912 -11.134 1.00 73.54 N ATOM 0 H ASN A 11 -1.045 -9.735 -8.349 1.00 50.54 H new ATOM 0 HA ASN A 11 -0.779 -12.617 -8.660 1.00 5.44 H new ATOM 0 HB2 ASN A 11 1.298 -10.373 -8.656 1.00 43.12 H new ATOM 0 HB3 ASN A 11 1.579 -12.030 -9.152 1.00 43.12 H new ATOM 0 HD21 ASN A 11 0.862 -9.627 -12.084 1.00 73.54 H new ATOM 0 HD22 ASN A 11 1.862 -9.449 -10.638 1.00 73.54 H new ATOM 193 N ASP A 12 -0.234 -13.165 -6.264 1.00 41.01 N ATOM 194 CA ASP A 12 0.180 -13.609 -4.916 1.00 34.34 C ATOM 195 C ASP A 12 1.698 -13.826 -4.832 1.00 23.24 C ATOM 196 O ASP A 12 2.305 -13.565 -3.796 1.00 12.13 O ATOM 197 CB ASP A 12 -0.538 -14.921 -4.514 1.00 23.13 C ATOM 198 CG ASP A 12 -2.066 -14.797 -4.486 1.00 30.30 C ATOM 199 OD1 ASP A 12 -2.601 -14.166 -3.550 1.00 73.30 O ATOM 200 OD2 ASP A 12 -2.739 -15.349 -5.386 1.00 52.24 O ATOM 0 H ASP A 12 -0.838 -13.832 -6.745 1.00 41.01 H new ATOM 0 HA ASP A 12 -0.103 -12.814 -4.226 1.00 34.34 H new ATOM 0 HB2 ASP A 12 -0.258 -15.708 -5.214 1.00 23.13 H new ATOM 0 HB3 ASP A 12 -0.188 -15.230 -3.529 1.00 23.13 H new ATOM 205 N GLU A 13 2.288 -14.304 -5.939 1.00 45.23 N ATOM 206 CA GLU A 13 3.737 -14.536 -6.046 1.00 43.35 C ATOM 207 C GLU A 13 4.516 -13.211 -5.909 1.00 54.15 C ATOM 208 O GLU A 13 5.554 -13.167 -5.248 1.00 32.10 O ATOM 209 CB GLU A 13 4.080 -15.232 -7.387 1.00 63.02 C ATOM 210 CG GLU A 13 3.397 -16.598 -7.596 1.00 33.20 C ATOM 211 CD GLU A 13 3.781 -17.652 -6.535 1.00 33.44 C ATOM 212 OE1 GLU A 13 4.846 -18.291 -6.680 1.00 34.15 O ATOM 213 OE2 GLU A 13 3.021 -17.849 -5.557 1.00 75.24 O ATOM 0 H GLU A 13 1.773 -14.541 -6.787 1.00 45.23 H new ATOM 0 HA GLU A 13 4.037 -15.193 -5.230 1.00 43.35 H new ATOM 0 HB2 GLU A 13 3.798 -14.571 -8.206 1.00 63.02 H new ATOM 0 HB3 GLU A 13 5.160 -15.368 -7.444 1.00 63.02 H new ATOM 0 HG2 GLU A 13 2.316 -16.460 -7.583 1.00 33.20 H new ATOM 0 HG3 GLU A 13 3.658 -16.978 -8.584 1.00 33.20 H new ATOM 220 N LEU A 14 3.965 -12.129 -6.500 1.00 33.41 N ATOM 221 CA LEU A 14 4.558 -10.778 -6.426 1.00 61.43 C ATOM 222 C LEU A 14 4.403 -10.195 -4.999 1.00 61.11 C ATOM 223 O LEU A 14 5.293 -9.487 -4.521 1.00 31.44 O ATOM 224 CB LEU A 14 3.905 -9.851 -7.497 1.00 64.45 C ATOM 225 CG LEU A 14 4.346 -8.345 -7.512 1.00 12.15 C ATOM 226 CD1 LEU A 14 5.879 -8.173 -7.629 1.00 22.01 C ATOM 227 CD2 LEU A 14 3.608 -7.565 -8.624 1.00 24.40 C ATOM 0 H LEU A 14 3.100 -12.168 -7.039 1.00 33.41 H new ATOM 0 HA LEU A 14 5.625 -10.843 -6.640 1.00 61.43 H new ATOM 0 HB2 LEU A 14 4.113 -10.273 -8.480 1.00 64.45 H new ATOM 0 HB3 LEU A 14 2.824 -9.884 -7.358 1.00 64.45 H new ATOM 0 HG LEU A 14 4.061 -7.923 -6.548 1.00 12.15 H new ATOM 0 HD11 LEU A 14 6.127 -7.112 -7.635 1.00 22.01 H new ATOM 0 HD12 LEU A 14 6.365 -8.654 -6.780 1.00 22.01 H new ATOM 0 HD13 LEU A 14 6.227 -8.632 -8.555 1.00 22.01 H new ATOM 0 HD21 LEU A 14 3.931 -6.524 -8.614 1.00 24.40 H new ATOM 0 HD22 LEU A 14 3.839 -8.007 -9.593 1.00 24.40 H new ATOM 0 HD23 LEU A 14 2.533 -7.613 -8.450 1.00 24.40 H new ATOM 239 N ILE A 15 3.281 -10.543 -4.318 1.00 63.22 N ATOM 240 CA ILE A 15 3.035 -10.172 -2.902 1.00 11.14 C ATOM 241 C ILE A 15 4.146 -10.736 -1.999 1.00 21.22 C ATOM 242 O ILE A 15 4.709 -10.005 -1.194 1.00 23.33 O ATOM 243 CB ILE A 15 1.621 -10.687 -2.394 1.00 34.41 C ATOM 244 CG1 ILE A 15 0.479 -10.043 -3.239 1.00 3.23 C ATOM 245 CG2 ILE A 15 1.422 -10.420 -0.879 1.00 50.54 C ATOM 246 CD1 ILE A 15 -0.917 -10.588 -3.020 1.00 25.32 C ATOM 0 H ILE A 15 2.525 -11.087 -4.734 1.00 63.22 H new ATOM 0 HA ILE A 15 3.038 -9.083 -2.847 1.00 11.14 H new ATOM 0 HB ILE A 15 1.586 -11.768 -2.531 1.00 34.41 H new ATOM 0 HG12 ILE A 15 0.463 -8.973 -3.031 1.00 3.23 H new ATOM 0 HG13 ILE A 15 0.729 -10.159 -4.294 1.00 3.23 H new ATOM 0 HG21 ILE A 15 0.443 -10.787 -0.570 1.00 50.54 H new ATOM 0 HG22 ILE A 15 2.198 -10.936 -0.314 1.00 50.54 H new ATOM 0 HG23 ILE A 15 1.485 -9.349 -0.687 1.00 50.54 H new ATOM 0 HD11 ILE A 15 -1.619 -10.059 -3.664 1.00 25.32 H new ATOM 0 HD12 ILE A 15 -0.934 -11.651 -3.260 1.00 25.32 H new ATOM 0 HD13 ILE A 15 -1.204 -10.446 -1.978 1.00 25.32 H new ATOM 258 N LYS A 16 4.479 -12.032 -2.201 1.00 4.11 N ATOM 259 CA LYS A 16 5.508 -12.749 -1.402 1.00 60.32 C ATOM 260 C LYS A 16 6.873 -12.031 -1.473 1.00 50.44 C ATOM 261 O LYS A 16 7.591 -11.930 -0.470 1.00 40.42 O ATOM 262 CB LYS A 16 5.679 -14.214 -1.899 1.00 71.13 C ATOM 263 CG LYS A 16 4.391 -15.056 -1.943 1.00 74.32 C ATOM 264 CD LYS A 16 3.732 -15.274 -0.563 1.00 23.14 C ATOM 265 CE LYS A 16 2.424 -16.079 -0.674 1.00 75.02 C ATOM 266 NZ LYS A 16 1.823 -16.334 0.663 1.00 24.24 N ATOM 0 H LYS A 16 4.045 -12.611 -2.920 1.00 4.11 H new ATOM 0 HA LYS A 16 5.162 -12.756 -0.368 1.00 60.32 H new ATOM 0 HB2 LYS A 16 6.111 -14.191 -2.899 1.00 71.13 H new ATOM 0 HB3 LYS A 16 6.398 -14.716 -1.252 1.00 71.13 H new ATOM 0 HG2 LYS A 16 3.674 -14.569 -2.603 1.00 74.32 H new ATOM 0 HG3 LYS A 16 4.619 -16.027 -2.382 1.00 74.32 H new ATOM 0 HD2 LYS A 16 4.427 -15.799 0.093 1.00 23.14 H new ATOM 0 HD3 LYS A 16 3.526 -14.308 -0.102 1.00 23.14 H new ATOM 0 HE2 LYS A 16 1.713 -15.535 -1.296 1.00 75.02 H new ATOM 0 HE3 LYS A 16 2.621 -17.028 -1.172 1.00 75.02 H new ATOM 0 HZ1 LYS A 16 0.944 -16.878 0.550 1.00 24.24 H new ATOM 0 HZ2 LYS A 16 2.492 -16.875 1.247 1.00 24.24 H new ATOM 0 HZ3 LYS A 16 1.612 -15.428 1.127 1.00 24.24 H new ATOM 280 N LYS A 17 7.186 -11.512 -2.674 1.00 1.23 N ATOM 281 CA LYS A 17 8.476 -10.868 -2.976 1.00 24.52 C ATOM 282 C LYS A 17 8.553 -9.453 -2.388 1.00 52.44 C ATOM 283 O LYS A 17 9.583 -9.081 -1.837 1.00 0.22 O ATOM 284 CB LYS A 17 8.688 -10.822 -4.509 1.00 42.52 C ATOM 285 CG LYS A 17 8.616 -12.209 -5.173 1.00 14.03 C ATOM 286 CD LYS A 17 8.802 -12.152 -6.699 1.00 42.15 C ATOM 287 CE LYS A 17 10.202 -11.674 -7.114 1.00 13.24 C ATOM 288 NZ LYS A 17 10.338 -11.613 -8.592 1.00 10.22 N ATOM 0 H LYS A 17 6.546 -11.528 -3.468 1.00 1.23 H new ATOM 0 HA LYS A 17 9.267 -11.459 -2.514 1.00 24.52 H new ATOM 0 HB2 LYS A 17 7.934 -10.174 -4.954 1.00 42.52 H new ATOM 0 HB3 LYS A 17 9.659 -10.374 -4.722 1.00 42.52 H new ATOM 0 HG2 LYS A 17 9.383 -12.853 -4.742 1.00 14.03 H new ATOM 0 HG3 LYS A 17 7.652 -12.665 -4.946 1.00 14.03 H new ATOM 0 HD2 LYS A 17 8.622 -13.142 -7.119 1.00 42.15 H new ATOM 0 HD3 LYS A 17 8.054 -11.484 -7.126 1.00 42.15 H new ATOM 0 HE2 LYS A 17 10.393 -10.689 -6.689 1.00 13.24 H new ATOM 0 HE3 LYS A 17 10.954 -12.349 -6.705 1.00 13.24 H new ATOM 0 HZ1 LYS A 17 11.340 -11.709 -8.853 1.00 10.22 H new ATOM 0 HZ2 LYS A 17 9.793 -12.387 -9.023 1.00 10.22 H new ATOM 0 HZ3 LYS A 17 9.976 -10.701 -8.937 1.00 10.22 H new ATOM 302 N ILE A 18 7.446 -8.684 -2.508 1.00 21.04 N ATOM 303 CA ILE A 18 7.357 -7.301 -1.987 1.00 13.34 C ATOM 304 C ILE A 18 7.362 -7.315 -0.441 1.00 25.40 C ATOM 305 O ILE A 18 7.939 -6.415 0.196 1.00 61.54 O ATOM 306 CB ILE A 18 6.083 -6.547 -2.544 1.00 71.14 C ATOM 307 CG1 ILE A 18 6.172 -6.402 -4.103 1.00 12.33 C ATOM 308 CG2 ILE A 18 5.904 -5.160 -1.873 1.00 14.41 C ATOM 309 CD1 ILE A 18 4.981 -5.720 -4.762 1.00 71.11 C ATOM 0 H ILE A 18 6.593 -9.004 -2.967 1.00 21.04 H new ATOM 0 HA ILE A 18 8.231 -6.751 -2.336 1.00 13.34 H new ATOM 0 HB ILE A 18 5.206 -7.146 -2.298 1.00 71.14 H new ATOM 0 HG12 ILE A 18 7.073 -5.840 -4.348 1.00 12.33 H new ATOM 0 HG13 ILE A 18 6.288 -7.395 -4.538 1.00 12.33 H new ATOM 0 HG21 ILE A 18 5.019 -4.670 -2.280 1.00 14.41 H new ATOM 0 HG22 ILE A 18 5.785 -5.289 -0.797 1.00 14.41 H new ATOM 0 HG23 ILE A 18 6.782 -4.545 -2.070 1.00 14.41 H new ATOM 0 HD11 ILE A 18 5.141 -5.669 -5.839 1.00 71.11 H new ATOM 0 HD12 ILE A 18 4.075 -6.290 -4.556 1.00 71.11 H new ATOM 0 HD13 ILE A 18 4.873 -4.711 -4.364 1.00 71.11 H new ATOM 321 N LYS A 19 6.755 -8.381 0.142 1.00 64.41 N ATOM 322 CA LYS A 19 6.825 -8.659 1.588 1.00 14.04 C ATOM 323 C LYS A 19 8.297 -8.754 2.019 1.00 60.51 C ATOM 324 O LYS A 19 8.782 -7.882 2.718 1.00 63.21 O ATOM 325 CB LYS A 19 6.064 -9.974 1.962 1.00 44.20 C ATOM 326 CG LYS A 19 4.519 -9.877 1.949 1.00 52.54 C ATOM 327 CD LYS A 19 3.805 -11.217 2.297 1.00 12.05 C ATOM 328 CE LYS A 19 3.894 -11.626 3.785 1.00 51.13 C ATOM 329 NZ LYS A 19 5.281 -11.945 4.257 1.00 73.03 N ATOM 0 H LYS A 19 6.207 -9.065 -0.380 1.00 64.41 H new ATOM 0 HA LYS A 19 6.338 -7.840 2.118 1.00 14.04 H new ATOM 0 HB2 LYS A 19 6.367 -10.758 1.268 1.00 44.20 H new ATOM 0 HB3 LYS A 19 6.383 -10.287 2.956 1.00 44.20 H new ATOM 0 HG2 LYS A 19 4.206 -9.113 2.661 1.00 52.54 H new ATOM 0 HG3 LYS A 19 4.193 -9.547 0.963 1.00 52.54 H new ATOM 0 HD2 LYS A 19 2.754 -11.137 2.018 1.00 12.05 H new ATOM 0 HD3 LYS A 19 4.236 -12.012 1.689 1.00 12.05 H new ATOM 0 HE2 LYS A 19 3.492 -10.818 4.396 1.00 51.13 H new ATOM 0 HE3 LYS A 19 3.258 -12.496 3.949 1.00 51.13 H new ATOM 0 HZ1 LYS A 19 5.241 -12.713 4.957 1.00 73.03 H new ATOM 0 HZ2 LYS A 19 5.863 -12.243 3.448 1.00 73.03 H new ATOM 0 HZ3 LYS A 19 5.702 -11.100 4.694 1.00 73.03 H new ATOM 343 N LYS A 20 9.020 -9.759 1.485 1.00 72.32 N ATOM 344 CA LYS A 20 10.426 -10.033 1.867 1.00 2.22 C ATOM 345 C LYS A 20 11.379 -8.885 1.450 1.00 32.01 C ATOM 346 O LYS A 20 12.432 -8.705 2.055 1.00 41.44 O ATOM 347 CB LYS A 20 10.900 -11.387 1.269 1.00 43.11 C ATOM 348 CG LYS A 20 10.080 -12.611 1.749 1.00 71.43 C ATOM 349 CD LYS A 20 10.165 -12.836 3.283 1.00 33.14 C ATOM 350 CE LYS A 20 9.338 -14.044 3.769 1.00 11.01 C ATOM 351 NZ LYS A 20 9.836 -15.333 3.221 1.00 34.44 N ATOM 0 H LYS A 20 8.652 -10.400 0.782 1.00 72.32 H new ATOM 0 HA LYS A 20 10.460 -10.098 2.955 1.00 2.22 H new ATOM 0 HB2 LYS A 20 10.846 -11.331 0.182 1.00 43.11 H new ATOM 0 HB3 LYS A 20 11.947 -11.540 1.529 1.00 43.11 H new ATOM 0 HG2 LYS A 20 9.036 -12.476 1.465 1.00 71.43 H new ATOM 0 HG3 LYS A 20 10.437 -13.504 1.236 1.00 71.43 H new ATOM 0 HD2 LYS A 20 11.208 -12.981 3.565 1.00 33.14 H new ATOM 0 HD3 LYS A 20 9.819 -11.938 3.795 1.00 33.14 H new ATOM 0 HE2 LYS A 20 9.363 -14.082 4.858 1.00 11.01 H new ATOM 0 HE3 LYS A 20 8.296 -13.908 3.478 1.00 11.01 H new ATOM 0 HZ1 LYS A 20 9.279 -16.117 3.617 1.00 34.44 H new ATOM 0 HZ2 LYS A 20 9.741 -15.330 2.185 1.00 34.44 H new ATOM 0 HZ3 LYS A 20 10.837 -15.455 3.477 1.00 34.44 H new ATOM 365 N GLU A 21 10.969 -8.109 0.431 1.00 14.34 N ATOM 366 CA GLU A 21 11.700 -6.918 -0.046 1.00 22.54 C ATOM 367 C GLU A 21 11.816 -5.885 1.089 1.00 75.12 C ATOM 368 O GLU A 21 12.919 -5.454 1.461 1.00 12.51 O ATOM 369 CB GLU A 21 10.940 -6.295 -1.254 1.00 23.02 C ATOM 370 CG GLU A 21 11.681 -5.187 -2.021 1.00 54.31 C ATOM 371 CD GLU A 21 12.835 -5.727 -2.875 1.00 54.14 C ATOM 372 OE1 GLU A 21 12.565 -6.217 -4.000 1.00 22.31 O ATOM 373 OE2 GLU A 21 14.004 -5.680 -2.426 1.00 20.45 O ATOM 0 H GLU A 21 10.112 -8.292 -0.091 1.00 14.34 H new ATOM 0 HA GLU A 21 12.702 -7.210 -0.360 1.00 22.54 H new ATOM 0 HB2 GLU A 21 10.697 -7.094 -1.955 1.00 23.02 H new ATOM 0 HB3 GLU A 21 9.995 -5.889 -0.893 1.00 23.02 H new ATOM 0 HG2 GLU A 21 10.975 -4.661 -2.663 1.00 54.31 H new ATOM 0 HG3 GLU A 21 12.071 -4.458 -1.311 1.00 54.31 H new ATOM 380 N VAL A 22 10.652 -5.538 1.664 1.00 73.22 N ATOM 381 CA VAL A 22 10.558 -4.546 2.744 1.00 50.21 C ATOM 382 C VAL A 22 10.851 -5.164 4.139 1.00 42.11 C ATOM 383 O VAL A 22 11.245 -4.441 5.047 1.00 33.52 O ATOM 384 CB VAL A 22 9.158 -3.842 2.751 1.00 74.03 C ATOM 385 CG1 VAL A 22 8.882 -3.111 1.421 1.00 61.42 C ATOM 386 CG2 VAL A 22 8.036 -4.840 3.091 1.00 65.44 C ATOM 0 H VAL A 22 9.753 -5.937 1.393 1.00 73.22 H new ATOM 0 HA VAL A 22 11.326 -3.799 2.543 1.00 50.21 H new ATOM 0 HB VAL A 22 9.175 -3.085 3.535 1.00 74.03 H new ATOM 0 HG11 VAL A 22 7.902 -2.635 1.464 1.00 61.42 H new ATOM 0 HG12 VAL A 22 9.647 -2.352 1.257 1.00 61.42 H new ATOM 0 HG13 VAL A 22 8.901 -3.828 0.601 1.00 61.42 H new ATOM 0 HG21 VAL A 22 7.076 -4.323 3.089 1.00 65.44 H new ATOM 0 HG22 VAL A 22 8.021 -5.637 2.348 1.00 65.44 H new ATOM 0 HG23 VAL A 22 8.216 -5.267 4.078 1.00 65.44 H new ATOM 396 N GLU A 23 10.661 -6.499 4.297 1.00 23.12 N ATOM 397 CA GLU A 23 10.922 -7.218 5.581 1.00 33.31 C ATOM 398 C GLU A 23 12.436 -7.337 5.842 1.00 71.42 C ATOM 399 O GLU A 23 12.867 -7.375 6.999 1.00 2.02 O ATOM 400 CB GLU A 23 10.237 -8.624 5.614 1.00 42.41 C ATOM 401 CG GLU A 23 8.700 -8.578 5.747 1.00 42.33 C ATOM 402 CD GLU A 23 8.046 -9.973 5.801 1.00 10.41 C ATOM 403 OE1 GLU A 23 7.875 -10.614 4.741 1.00 53.40 O ATOM 404 OE2 GLU A 23 7.689 -10.439 6.903 1.00 34.52 O ATOM 0 H GLU A 23 10.326 -7.106 3.549 1.00 23.12 H new ATOM 0 HA GLU A 23 10.479 -6.625 6.381 1.00 33.31 H new ATOM 0 HB2 GLU A 23 10.495 -9.163 4.702 1.00 42.41 H new ATOM 0 HB3 GLU A 23 10.645 -9.195 6.448 1.00 42.41 H new ATOM 0 HG2 GLU A 23 8.438 -8.027 6.650 1.00 42.33 H new ATOM 0 HG3 GLU A 23 8.287 -8.024 4.904 1.00 42.33 H new ATOM 411 N ASN A 24 13.235 -7.366 4.754 1.00 2.45 N ATOM 412 CA ASN A 24 14.716 -7.274 4.836 1.00 42.15 C ATOM 413 C ASN A 24 15.157 -5.866 5.280 1.00 2.14 C ATOM 414 O ASN A 24 16.308 -5.664 5.664 1.00 33.50 O ATOM 415 CB ASN A 24 15.379 -7.637 3.472 1.00 52.21 C ATOM 416 CG ASN A 24 15.406 -9.143 3.160 1.00 53.52 C ATOM 417 OD1 ASN A 24 16.332 -9.630 2.507 1.00 0.54 O ATOM 418 ND2 ASN A 24 14.399 -9.898 3.601 1.00 63.23 N ATOM 0 H ASN A 24 12.880 -7.453 3.802 1.00 2.45 H new ATOM 0 HA ASN A 24 15.048 -7.995 5.583 1.00 42.15 H new ATOM 0 HB2 ASN A 24 14.844 -7.122 2.674 1.00 52.21 H new ATOM 0 HB3 ASN A 24 16.401 -7.259 3.467 1.00 52.21 H new ATOM 0 HD21 ASN A 24 14.385 -10.898 3.400 1.00 63.23 H new ATOM 0 HD22 ASN A 24 13.643 -9.476 4.140 1.00 63.23 H new ATOM 425 N GLN A 25 14.236 -4.896 5.182 1.00 40.35 N ATOM 426 CA GLN A 25 14.446 -3.508 5.636 1.00 50.13 C ATOM 427 C GLN A 25 13.559 -3.205 6.877 1.00 1.41 C ATOM 428 O GLN A 25 13.292 -2.045 7.197 1.00 73.25 O ATOM 429 CB GLN A 25 14.138 -2.541 4.464 1.00 64.30 C ATOM 430 CG GLN A 25 14.886 -2.840 3.134 1.00 41.35 C ATOM 431 CD GLN A 25 16.409 -2.691 3.221 1.00 5.15 C ATOM 432 OE1 GLN A 25 16.951 -1.603 3.019 1.00 4.13 O ATOM 433 NE2 GLN A 25 17.114 -3.776 3.500 1.00 40.30 N ATOM 0 H GLN A 25 13.312 -5.053 4.780 1.00 40.35 H new ATOM 0 HA GLN A 25 15.484 -3.369 5.939 1.00 50.13 H new ATOM 0 HB2 GLN A 25 13.066 -2.563 4.270 1.00 64.30 H new ATOM 0 HB3 GLN A 25 14.384 -1.527 4.779 1.00 64.30 H new ATOM 0 HG2 GLN A 25 14.649 -3.856 2.818 1.00 41.35 H new ATOM 0 HG3 GLN A 25 14.510 -2.170 2.361 1.00 41.35 H new ATOM 0 HE21 GLN A 25 16.640 -4.664 3.663 1.00 40.30 H new ATOM 0 HE22 GLN A 25 18.131 -3.724 3.552 1.00 40.30 H new ATOM 442 N GLY A 26 13.085 -4.277 7.552 1.00 22.11 N ATOM 443 CA GLY A 26 12.460 -4.184 8.882 1.00 52.41 C ATOM 444 C GLY A 26 10.990 -3.749 8.902 1.00 44.53 C ATOM 445 O GLY A 26 10.492 -3.347 9.959 1.00 33.42 O ATOM 0 H GLY A 26 13.127 -5.228 7.186 1.00 22.11 H new ATOM 0 HA2 GLY A 26 12.538 -5.157 9.367 1.00 52.41 H new ATOM 0 HA3 GLY A 26 13.035 -3.481 9.484 1.00 52.41 H new ATOM 449 N TYR A 27 10.293 -3.796 7.755 1.00 41.12 N ATOM 450 CA TYR A 27 8.840 -3.498 7.697 1.00 21.04 C ATOM 451 C TYR A 27 8.027 -4.714 8.150 1.00 22.24 C ATOM 452 O TYR A 27 8.284 -5.843 7.711 1.00 44.22 O ATOM 453 CB TYR A 27 8.378 -3.090 6.271 1.00 63.32 C ATOM 454 CG TYR A 27 8.753 -1.672 5.826 1.00 61.01 C ATOM 455 CD1 TYR A 27 10.079 -1.247 5.806 1.00 43.02 C ATOM 456 CD2 TYR A 27 7.772 -0.763 5.402 1.00 60.03 C ATOM 457 CE1 TYR A 27 10.416 0.023 5.386 1.00 71.41 C ATOM 458 CE2 TYR A 27 8.109 0.508 4.984 1.00 63.14 C ATOM 459 CZ TYR A 27 9.432 0.895 4.975 1.00 42.35 C ATOM 460 OH TYR A 27 9.776 2.161 4.558 1.00 1.35 O ATOM 0 H TYR A 27 10.705 -4.036 6.853 1.00 41.12 H new ATOM 0 HA TYR A 27 8.667 -2.656 8.367 1.00 21.04 H new ATOM 0 HB2 TYR A 27 8.800 -3.797 5.557 1.00 63.32 H new ATOM 0 HB3 TYR A 27 7.294 -3.192 6.218 1.00 63.32 H new ATOM 0 HD1 TYR A 27 10.858 -1.924 6.125 1.00 43.02 H new ATOM 0 HD2 TYR A 27 6.735 -1.063 5.403 1.00 60.03 H new ATOM 0 HE1 TYR A 27 11.450 0.333 5.379 1.00 71.41 H new ATOM 0 HE2 TYR A 27 7.340 1.196 4.665 1.00 63.14 H new ATOM 0 HH TYR A 27 8.968 2.651 4.300 1.00 1.35 H new ATOM 470 N GLN A 28 7.045 -4.461 9.019 1.00 61.33 N ATOM 471 CA GLN A 28 6.083 -5.472 9.467 1.00 3.11 C ATOM 472 C GLN A 28 4.929 -5.546 8.449 1.00 13.31 C ATOM 473 O GLN A 28 4.419 -4.509 8.043 1.00 52.13 O ATOM 474 CB GLN A 28 5.535 -5.080 10.861 1.00 20.11 C ATOM 475 CG GLN A 28 4.531 -6.086 11.469 1.00 24.13 C ATOM 476 CD GLN A 28 3.875 -5.615 12.773 1.00 42.43 C ATOM 477 OE1 GLN A 28 2.730 -5.970 13.058 1.00 52.31 O ATOM 478 NE2 GLN A 28 4.585 -4.844 13.588 1.00 50.13 N ATOM 0 H GLN A 28 6.894 -3.542 9.435 1.00 61.33 H new ATOM 0 HA GLN A 28 6.569 -6.445 9.539 1.00 3.11 H new ATOM 0 HB2 GLN A 28 6.374 -4.966 11.547 1.00 20.11 H new ATOM 0 HB3 GLN A 28 5.051 -4.106 10.785 1.00 20.11 H new ATOM 0 HG2 GLN A 28 3.750 -6.289 10.736 1.00 24.13 H new ATOM 0 HG3 GLN A 28 5.047 -7.028 11.655 1.00 24.13 H new ATOM 0 HE21 GLN A 28 5.531 -4.564 13.329 1.00 50.13 H new ATOM 0 HE22 GLN A 28 4.184 -4.532 14.473 1.00 50.13 H new ATOM 487 N VAL A 29 4.537 -6.759 8.024 1.00 32.03 N ATOM 488 CA VAL A 29 3.380 -6.946 7.124 1.00 41.00 C ATOM 489 C VAL A 29 2.079 -7.021 7.954 1.00 35.53 C ATOM 490 O VAL A 29 1.992 -7.780 8.926 1.00 1.40 O ATOM 491 CB VAL A 29 3.529 -8.229 6.216 1.00 30.54 C ATOM 492 CG1 VAL A 29 2.309 -8.390 5.265 1.00 71.13 C ATOM 493 CG2 VAL A 29 4.861 -8.185 5.423 1.00 75.43 C ATOM 0 H VAL A 29 5.003 -7.627 8.288 1.00 32.03 H new ATOM 0 HA VAL A 29 3.339 -6.086 6.455 1.00 41.00 H new ATOM 0 HB VAL A 29 3.553 -9.104 6.866 1.00 30.54 H new ATOM 0 HG11 VAL A 29 2.440 -9.282 4.652 1.00 71.13 H new ATOM 0 HG12 VAL A 29 1.398 -8.486 5.855 1.00 71.13 H new ATOM 0 HG13 VAL A 29 2.233 -7.515 4.620 1.00 71.13 H new ATOM 0 HG21 VAL A 29 4.945 -9.078 4.803 1.00 75.43 H new ATOM 0 HG22 VAL A 29 4.877 -7.299 4.788 1.00 75.43 H new ATOM 0 HG23 VAL A 29 5.698 -8.147 6.120 1.00 75.43 H new ATOM 503 N ARG A 30 1.101 -6.199 7.571 1.00 41.15 N ATOM 504 CA ARG A 30 -0.241 -6.178 8.145 1.00 14.11 C ATOM 505 C ARG A 30 -1.232 -6.199 6.963 1.00 33.32 C ATOM 506 O ARG A 30 -1.349 -5.229 6.216 1.00 34.30 O ATOM 507 CB ARG A 30 -0.379 -4.910 9.041 1.00 64.54 C ATOM 508 CG ARG A 30 -1.722 -4.696 9.767 1.00 31.13 C ATOM 509 CD ARG A 30 -2.190 -5.907 10.599 1.00 33.30 C ATOM 510 NE ARG A 30 -2.903 -6.899 9.776 1.00 41.34 N ATOM 511 CZ ARG A 30 -2.838 -8.233 9.917 1.00 4.34 C ATOM 512 NH1 ARG A 30 -2.066 -8.791 10.848 1.00 25.01 N ATOM 513 NH2 ARG A 30 -3.561 -9.008 9.124 1.00 25.42 N ATOM 0 H ARG A 30 1.227 -5.509 6.830 1.00 41.15 H new ATOM 0 HA ARG A 30 -0.447 -7.037 8.784 1.00 14.11 H new ATOM 0 HB2 ARG A 30 0.409 -4.942 9.793 1.00 64.54 H new ATOM 0 HB3 ARG A 30 -0.190 -4.036 8.418 1.00 64.54 H new ATOM 0 HG2 ARG A 30 -1.633 -3.831 10.424 1.00 31.13 H new ATOM 0 HG3 ARG A 30 -2.488 -4.459 9.029 1.00 31.13 H new ATOM 0 HD2 ARG A 30 -1.327 -6.379 11.069 1.00 33.30 H new ATOM 0 HD3 ARG A 30 -2.843 -5.565 11.402 1.00 33.30 H new ATOM 0 HE ARG A 30 -3.500 -6.540 9.031 1.00 41.34 H new ATOM 0 HH11 ARG A 30 -1.511 -8.203 11.470 1.00 25.01 H new ATOM 0 HH12 ARG A 30 -2.030 -9.806 10.939 1.00 25.01 H new ATOM 0 HH21 ARG A 30 -4.161 -8.591 8.413 1.00 25.42 H new ATOM 0 HH22 ARG A 30 -3.518 -10.022 9.224 1.00 25.42 H new ATOM 527 N ASP A 31 -1.916 -7.341 6.793 1.00 53.40 N ATOM 528 CA ASP A 31 -2.652 -7.681 5.562 1.00 74.34 C ATOM 529 C ASP A 31 -4.169 -7.795 5.807 1.00 32.12 C ATOM 530 O ASP A 31 -4.636 -8.629 6.596 1.00 70.53 O ATOM 531 CB ASP A 31 -2.064 -8.991 4.950 1.00 70.52 C ATOM 532 CG ASP A 31 -1.878 -10.140 5.959 1.00 4.40 C ATOM 533 OD1 ASP A 31 -0.869 -10.132 6.697 1.00 45.24 O ATOM 534 OD2 ASP A 31 -2.715 -11.063 6.010 1.00 23.41 O ATOM 0 H ASP A 31 -1.975 -8.062 7.512 1.00 53.40 H new ATOM 0 HA ASP A 31 -2.523 -6.869 4.846 1.00 74.34 H new ATOM 0 HB2 ASP A 31 -2.722 -9.330 4.150 1.00 70.52 H new ATOM 0 HB3 ASP A 31 -1.100 -8.764 4.496 1.00 70.52 H new ATOM 539 N VAL A 32 -4.922 -6.929 5.110 1.00 64.43 N ATOM 540 CA VAL A 32 -6.394 -6.888 5.144 1.00 33.13 C ATOM 541 C VAL A 32 -6.975 -8.098 4.388 1.00 71.15 C ATOM 542 O VAL A 32 -6.838 -8.185 3.167 1.00 63.41 O ATOM 543 CB VAL A 32 -6.933 -5.560 4.480 1.00 11.24 C ATOM 544 CG1 VAL A 32 -8.470 -5.464 4.581 1.00 33.24 C ATOM 545 CG2 VAL A 32 -6.242 -4.311 5.073 1.00 64.51 C ATOM 0 H VAL A 32 -4.517 -6.223 4.495 1.00 64.43 H new ATOM 0 HA VAL A 32 -6.708 -6.919 6.187 1.00 33.13 H new ATOM 0 HB VAL A 32 -6.680 -5.596 3.420 1.00 11.24 H new ATOM 0 HG11 VAL A 32 -8.808 -4.539 4.115 1.00 33.24 H new ATOM 0 HG12 VAL A 32 -8.922 -6.314 4.070 1.00 33.24 H new ATOM 0 HG13 VAL A 32 -8.767 -5.471 5.630 1.00 33.24 H new ATOM 0 HG21 VAL A 32 -6.636 -3.415 4.594 1.00 64.51 H new ATOM 0 HG22 VAL A 32 -6.434 -4.264 6.145 1.00 64.51 H new ATOM 0 HG23 VAL A 32 -5.168 -4.372 4.899 1.00 64.51 H new ATOM 555 N ASN A 33 -7.600 -9.039 5.115 1.00 74.32 N ATOM 556 CA ASN A 33 -8.221 -10.251 4.511 1.00 53.14 C ATOM 557 C ASN A 33 -9.740 -10.059 4.282 1.00 4.41 C ATOM 558 O ASN A 33 -10.347 -10.765 3.467 1.00 65.21 O ATOM 559 CB ASN A 33 -7.956 -11.512 5.404 1.00 32.24 C ATOM 560 CG ASN A 33 -6.519 -12.062 5.342 1.00 10.41 C ATOM 561 OD1 ASN A 33 -6.301 -13.270 5.446 1.00 42.03 O ATOM 562 ND2 ASN A 33 -5.524 -11.198 5.222 1.00 3.24 N ATOM 0 H ASN A 33 -7.694 -8.991 6.130 1.00 74.32 H new ATOM 0 HA ASN A 33 -7.756 -10.408 3.538 1.00 53.14 H new ATOM 0 HB2 ASN A 33 -8.189 -11.261 6.439 1.00 32.24 H new ATOM 0 HB3 ASN A 33 -8.645 -12.302 5.105 1.00 32.24 H new ATOM 0 HD21 ASN A 33 -4.559 -11.529 5.215 1.00 3.24 H new ATOM 0 HD22 ASN A 33 -5.722 -10.201 5.137 1.00 3.24 H new ATOM 569 N ASP A 34 -10.336 -9.079 4.984 1.00 13.35 N ATOM 570 CA ASP A 34 -11.804 -8.848 4.996 1.00 0.33 C ATOM 571 C ASP A 34 -12.099 -7.423 5.531 1.00 14.33 C ATOM 572 O ASP A 34 -11.177 -6.726 5.958 1.00 74.24 O ATOM 573 CB ASP A 34 -12.494 -9.947 5.868 1.00 71.22 C ATOM 574 CG ASP A 34 -14.034 -9.935 5.815 1.00 34.53 C ATOM 575 OD1 ASP A 34 -14.600 -10.312 4.772 1.00 41.13 O ATOM 576 OD2 ASP A 34 -14.679 -9.534 6.804 1.00 13.44 O ATOM 0 H ASP A 34 -9.817 -8.419 5.563 1.00 13.35 H new ATOM 0 HA ASP A 34 -12.206 -8.917 3.985 1.00 0.33 H new ATOM 0 HB2 ASP A 34 -12.140 -10.925 5.543 1.00 71.22 H new ATOM 0 HB3 ASP A 34 -12.178 -9.822 6.904 1.00 71.22 H new ATOM 581 N SER A 35 -13.377 -6.987 5.457 1.00 35.22 N ATOM 582 CA SER A 35 -13.858 -5.715 6.052 1.00 14.42 C ATOM 583 C SER A 35 -13.667 -5.698 7.583 1.00 43.05 C ATOM 584 O SER A 35 -13.277 -4.673 8.161 1.00 52.03 O ATOM 585 CB SER A 35 -15.346 -5.512 5.697 1.00 73.14 C ATOM 586 OG SER A 35 -15.857 -4.314 6.242 1.00 13.22 O ATOM 0 H SER A 35 -14.111 -7.511 4.979 1.00 35.22 H new ATOM 0 HA SER A 35 -13.267 -4.898 5.639 1.00 14.42 H new ATOM 0 HB2 SER A 35 -15.462 -5.497 4.613 1.00 73.14 H new ATOM 0 HB3 SER A 35 -15.927 -6.357 6.068 1.00 73.14 H new ATOM 0 HG SER A 35 -16.801 -4.219 5.995 1.00 13.22 H new ATOM 592 N ASP A 36 -13.936 -6.861 8.211 1.00 62.42 N ATOM 593 CA ASP A 36 -13.755 -7.085 9.659 1.00 62.25 C ATOM 594 C ASP A 36 -12.271 -6.929 10.032 1.00 14.21 C ATOM 595 O ASP A 36 -11.928 -6.209 10.975 1.00 31.23 O ATOM 596 CB ASP A 36 -14.276 -8.500 10.043 1.00 23.30 C ATOM 597 CG ASP A 36 -14.155 -8.813 11.543 1.00 34.13 C ATOM 598 OD1 ASP A 36 -14.963 -8.281 12.329 1.00 51.33 O ATOM 599 OD2 ASP A 36 -13.254 -9.585 11.946 1.00 23.31 O ATOM 0 H ASP A 36 -14.290 -7.682 7.719 1.00 62.42 H new ATOM 0 HA ASP A 36 -14.329 -6.343 10.215 1.00 62.25 H new ATOM 0 HB2 ASP A 36 -15.321 -8.587 9.745 1.00 23.30 H new ATOM 0 HB3 ASP A 36 -13.720 -9.248 9.478 1.00 23.30 H new ATOM 604 N GLU A 37 -11.400 -7.561 9.211 1.00 32.31 N ATOM 605 CA GLU A 37 -9.938 -7.469 9.356 1.00 62.43 C ATOM 606 C GLU A 37 -9.472 -6.009 9.219 1.00 65.33 C ATOM 607 O GLU A 37 -8.684 -5.537 10.039 1.00 53.30 O ATOM 608 CB GLU A 37 -9.233 -8.346 8.292 1.00 44.45 C ATOM 609 CG GLU A 37 -9.619 -9.837 8.325 1.00 3.02 C ATOM 610 CD GLU A 37 -9.137 -10.572 9.588 1.00 44.01 C ATOM 611 OE1 GLU A 37 -7.951 -10.960 9.637 1.00 31.20 O ATOM 612 OE2 GLU A 37 -9.931 -10.761 10.530 1.00 71.41 O ATOM 0 H GLU A 37 -11.697 -8.148 8.431 1.00 32.31 H new ATOM 0 HA GLU A 37 -9.671 -7.832 10.348 1.00 62.43 H new ATOM 0 HB2 GLU A 37 -9.462 -7.948 7.304 1.00 44.45 H new ATOM 0 HB3 GLU A 37 -8.155 -8.261 8.428 1.00 44.45 H new ATOM 0 HG2 GLU A 37 -10.703 -9.924 8.256 1.00 3.02 H new ATOM 0 HG3 GLU A 37 -9.203 -10.331 7.447 1.00 3.02 H new ATOM 619 N LEU A 38 -10.036 -5.304 8.202 1.00 32.42 N ATOM 620 CA LEU A 38 -9.683 -3.909 7.866 1.00 5.04 C ATOM 621 C LEU A 38 -9.848 -2.996 9.079 1.00 4.40 C ATOM 622 O LEU A 38 -8.875 -2.402 9.532 1.00 61.41 O ATOM 623 CB LEU A 38 -10.556 -3.359 6.689 1.00 25.52 C ATOM 624 CG LEU A 38 -10.263 -1.874 6.256 1.00 22.42 C ATOM 625 CD1 LEU A 38 -8.818 -1.689 5.758 1.00 70.30 C ATOM 626 CD2 LEU A 38 -11.282 -1.370 5.215 1.00 74.43 C ATOM 0 H LEU A 38 -10.753 -5.696 7.591 1.00 32.42 H new ATOM 0 HA LEU A 38 -8.638 -3.915 7.555 1.00 5.04 H new ATOM 0 HB2 LEU A 38 -10.413 -4.005 5.823 1.00 25.52 H new ATOM 0 HB3 LEU A 38 -11.605 -3.434 6.974 1.00 25.52 H new ATOM 0 HG LEU A 38 -10.376 -1.261 7.150 1.00 22.42 H new ATOM 0 HD11 LEU A 38 -8.663 -0.649 5.470 1.00 70.30 H new ATOM 0 HD12 LEU A 38 -8.122 -1.953 6.554 1.00 70.30 H new ATOM 0 HD13 LEU A 38 -8.645 -2.333 4.896 1.00 70.30 H new ATOM 0 HD21 LEU A 38 -11.045 -0.342 4.942 1.00 74.43 H new ATOM 0 HD22 LEU A 38 -11.237 -2.000 4.327 1.00 74.43 H new ATOM 0 HD23 LEU A 38 -12.285 -1.411 5.639 1.00 74.43 H new ATOM 638 N LYS A 39 -11.079 -2.947 9.629 1.00 53.22 N ATOM 639 CA LYS A 39 -11.412 -2.034 10.725 1.00 12.01 C ATOM 640 C LYS A 39 -10.635 -2.400 12.016 1.00 55.21 C ATOM 641 O LYS A 39 -10.182 -1.505 12.727 1.00 22.40 O ATOM 642 CB LYS A 39 -12.963 -1.936 10.925 1.00 20.32 C ATOM 643 CG LYS A 39 -13.731 -3.256 11.216 1.00 25.34 C ATOM 644 CD LYS A 39 -13.725 -3.667 12.705 1.00 43.45 C ATOM 645 CE LYS A 39 -14.540 -4.939 12.979 1.00 64.23 C ATOM 646 NZ LYS A 39 -14.509 -5.309 14.419 1.00 2.44 N ATOM 0 H LYS A 39 -11.856 -3.534 9.326 1.00 53.22 H new ATOM 0 HA LYS A 39 -11.083 -1.030 10.458 1.00 12.01 H new ATOM 0 HB2 LYS A 39 -13.154 -1.247 11.748 1.00 20.32 H new ATOM 0 HB3 LYS A 39 -13.391 -1.488 10.028 1.00 20.32 H new ATOM 0 HG2 LYS A 39 -14.763 -3.145 10.884 1.00 25.34 H new ATOM 0 HG3 LYS A 39 -13.290 -4.059 10.625 1.00 25.34 H new ATOM 0 HD2 LYS A 39 -12.696 -3.824 13.029 1.00 43.45 H new ATOM 0 HD3 LYS A 39 -14.126 -2.849 13.304 1.00 43.45 H new ATOM 0 HE2 LYS A 39 -15.572 -4.785 12.664 1.00 64.23 H new ATOM 0 HE3 LYS A 39 -14.144 -5.761 12.383 1.00 64.23 H new ATOM 0 HZ1 LYS A 39 -15.069 -6.172 14.568 1.00 2.44 H new ATOM 0 HZ2 LYS A 39 -13.526 -5.480 14.713 1.00 2.44 H new ATOM 0 HZ3 LYS A 39 -14.910 -4.534 14.985 1.00 2.44 H new ATOM 660 N LYS A 40 -10.406 -3.721 12.258 1.00 40.11 N ATOM 661 CA LYS A 40 -9.598 -4.198 13.412 1.00 51.51 C ATOM 662 C LYS A 40 -8.161 -3.643 13.372 1.00 32.11 C ATOM 663 O LYS A 40 -7.647 -3.137 14.384 1.00 20.55 O ATOM 664 CB LYS A 40 -9.569 -5.749 13.490 1.00 2.41 C ATOM 665 CG LYS A 40 -10.901 -6.376 13.966 1.00 64.35 C ATOM 666 CD LYS A 40 -10.764 -7.867 14.315 1.00 61.22 C ATOM 667 CE LYS A 40 -10.284 -8.715 13.127 1.00 5.22 C ATOM 668 NZ LYS A 40 -10.267 -10.172 13.441 1.00 3.15 N ATOM 0 H LYS A 40 -10.769 -4.471 11.670 1.00 40.11 H new ATOM 0 HA LYS A 40 -10.085 -3.818 14.310 1.00 51.51 H new ATOM 0 HB2 LYS A 40 -9.321 -6.148 12.506 1.00 2.41 H new ATOM 0 HB3 LYS A 40 -8.772 -6.054 14.168 1.00 2.41 H new ATOM 0 HG2 LYS A 40 -11.261 -5.834 14.841 1.00 64.35 H new ATOM 0 HG3 LYS A 40 -11.653 -6.257 13.186 1.00 64.35 H new ATOM 0 HD2 LYS A 40 -10.063 -7.979 15.142 1.00 61.22 H new ATOM 0 HD3 LYS A 40 -11.727 -8.245 14.660 1.00 61.22 H new ATOM 0 HE2 LYS A 40 -10.935 -8.538 12.271 1.00 5.22 H new ATOM 0 HE3 LYS A 40 -9.283 -8.396 12.837 1.00 5.22 H new ATOM 0 HZ1 LYS A 40 -10.119 -10.714 12.566 1.00 3.15 H new ATOM 0 HZ2 LYS A 40 -9.495 -10.374 14.108 1.00 3.15 H new ATOM 0 HZ3 LYS A 40 -11.175 -10.446 13.868 1.00 3.15 H new ATOM 682 N GLU A 41 -7.526 -3.710 12.186 1.00 51.55 N ATOM 683 CA GLU A 41 -6.132 -3.278 12.008 1.00 32.55 C ATOM 684 C GLU A 41 -6.038 -1.761 11.754 1.00 31.44 C ATOM 685 O GLU A 41 -4.981 -1.177 11.957 1.00 41.24 O ATOM 686 CB GLU A 41 -5.425 -4.126 10.916 1.00 61.43 C ATOM 687 CG GLU A 41 -5.987 -4.035 9.479 1.00 64.14 C ATOM 688 CD GLU A 41 -5.457 -5.160 8.562 1.00 73.25 C ATOM 689 OE1 GLU A 41 -6.009 -6.286 8.594 1.00 64.44 O ATOM 690 OE2 GLU A 41 -4.458 -4.938 7.840 1.00 12.04 O ATOM 0 H GLU A 41 -7.962 -4.062 11.334 1.00 51.55 H new ATOM 0 HA GLU A 41 -5.594 -3.458 12.939 1.00 32.55 H new ATOM 0 HB2 GLU A 41 -4.375 -3.834 10.888 1.00 61.43 H new ATOM 0 HB3 GLU A 41 -5.457 -5.171 11.226 1.00 61.43 H new ATOM 0 HG2 GLU A 41 -7.075 -4.083 9.515 1.00 64.14 H new ATOM 0 HG3 GLU A 41 -5.724 -3.068 9.051 1.00 64.14 H new ATOM 697 N MET A 42 -7.160 -1.131 11.350 1.00 3.55 N ATOM 698 CA MET A 42 -7.277 0.350 11.265 1.00 21.12 C ATOM 699 C MET A 42 -7.242 0.972 12.672 1.00 73.20 C ATOM 700 O MET A 42 -6.740 2.082 12.844 1.00 75.12 O ATOM 701 CB MET A 42 -8.563 0.799 10.502 1.00 65.23 C ATOM 702 CG MET A 42 -8.462 0.686 8.971 1.00 53.53 C ATOM 703 SD MET A 42 -7.190 1.767 8.269 1.00 64.34 S ATOM 704 CE MET A 42 -7.774 3.397 8.734 1.00 20.24 C ATOM 0 H MET A 42 -8.008 -1.625 11.074 1.00 3.55 H new ATOM 0 HA MET A 42 -6.421 0.709 10.693 1.00 21.12 H new ATOM 0 HB2 MET A 42 -9.404 0.196 10.845 1.00 65.23 H new ATOM 0 HB3 MET A 42 -8.785 1.833 10.765 1.00 65.23 H new ATOM 0 HG2 MET A 42 -8.243 -0.347 8.701 1.00 53.53 H new ATOM 0 HG3 MET A 42 -9.427 0.933 8.529 1.00 53.53 H new ATOM 0 HE1 MET A 42 -7.763 4.050 7.861 1.00 20.24 H new ATOM 0 HE2 MET A 42 -8.791 3.323 9.119 1.00 20.24 H new ATOM 0 HE3 MET A 42 -7.124 3.810 9.505 1.00 20.24 H new ATOM 714 N LYS A 43 -7.779 0.238 13.673 1.00 64.13 N ATOM 715 CA LYS A 43 -7.614 0.601 15.100 1.00 23.42 C ATOM 716 C LYS A 43 -6.118 0.528 15.494 1.00 74.12 C ATOM 717 O LYS A 43 -5.638 1.367 16.237 1.00 21.14 O ATOM 718 CB LYS A 43 -8.485 -0.306 16.042 1.00 62.42 C ATOM 719 CG LYS A 43 -9.915 0.213 16.355 1.00 33.23 C ATOM 720 CD LYS A 43 -10.816 0.318 15.110 1.00 1.52 C ATOM 721 CE LYS A 43 -12.244 0.781 15.438 1.00 75.10 C ATOM 722 NZ LYS A 43 -12.261 2.138 16.039 1.00 64.15 N ATOM 0 H LYS A 43 -8.329 -0.607 13.520 1.00 64.13 H new ATOM 0 HA LYS A 43 -7.967 1.624 15.228 1.00 23.42 H new ATOM 0 HB2 LYS A 43 -8.570 -1.293 15.587 1.00 62.42 H new ATOM 0 HB3 LYS A 43 -7.952 -0.434 16.984 1.00 62.42 H new ATOM 0 HG2 LYS A 43 -10.385 -0.453 17.079 1.00 33.23 H new ATOM 0 HG3 LYS A 43 -9.842 1.194 16.825 1.00 33.23 H new ATOM 0 HD2 LYS A 43 -10.368 1.015 14.402 1.00 1.52 H new ATOM 0 HD3 LYS A 43 -10.859 -0.653 14.617 1.00 1.52 H new ATOM 0 HE2 LYS A 43 -12.844 0.779 14.528 1.00 75.10 H new ATOM 0 HE3 LYS A 43 -12.706 0.073 16.126 1.00 75.10 H new ATOM 0 HZ1 LYS A 43 -13.244 2.462 16.136 1.00 64.15 H new ATOM 0 HZ2 LYS A 43 -11.812 2.108 16.977 1.00 64.15 H new ATOM 0 HZ3 LYS A 43 -11.739 2.796 15.426 1.00 64.15 H new ATOM 736 N LYS A 44 -5.382 -0.464 14.952 1.00 54.22 N ATOM 737 CA LYS A 44 -3.930 -0.610 15.222 1.00 73.22 C ATOM 738 C LYS A 44 -3.123 0.549 14.596 1.00 23.03 C ATOM 739 O LYS A 44 -2.076 0.932 15.108 1.00 45.23 O ATOM 740 CB LYS A 44 -3.394 -1.986 14.720 1.00 55.23 C ATOM 741 CG LYS A 44 -4.138 -3.212 15.292 1.00 22.23 C ATOM 742 CD LYS A 44 -4.175 -3.251 16.839 1.00 4.32 C ATOM 743 CE LYS A 44 -2.786 -3.411 17.480 1.00 71.41 C ATOM 744 NZ LYS A 44 -2.854 -3.305 18.967 1.00 0.00 N ATOM 0 H LYS A 44 -5.764 -1.174 14.327 1.00 54.22 H new ATOM 0 HA LYS A 44 -3.796 -0.570 16.303 1.00 73.22 H new ATOM 0 HB2 LYS A 44 -3.460 -2.012 13.632 1.00 55.23 H new ATOM 0 HB3 LYS A 44 -2.338 -2.066 14.977 1.00 55.23 H new ATOM 0 HG2 LYS A 44 -5.160 -3.215 14.913 1.00 22.23 H new ATOM 0 HG3 LYS A 44 -3.659 -4.120 14.926 1.00 22.23 H new ATOM 0 HD2 LYS A 44 -4.633 -2.333 17.207 1.00 4.32 H new ATOM 0 HD3 LYS A 44 -4.812 -4.076 17.159 1.00 4.32 H new ATOM 0 HE2 LYS A 44 -2.365 -4.377 17.202 1.00 71.41 H new ATOM 0 HE3 LYS A 44 -2.114 -2.646 17.090 1.00 71.41 H new ATOM 0 HZ1 LYS A 44 -2.156 -3.948 19.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -2.646 -2.328 19.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -3.808 -3.565 19.290 1.00 0.00 H new ATOM 758 N LEU A 45 -3.627 1.097 13.485 1.00 52.23 N ATOM 759 CA LEU A 45 -2.989 2.216 12.772 1.00 12.11 C ATOM 760 C LEU A 45 -3.352 3.581 13.417 1.00 64.45 C ATOM 761 O LEU A 45 -2.540 4.514 13.398 1.00 32.13 O ATOM 762 CB LEU A 45 -3.421 2.180 11.276 1.00 12.12 C ATOM 763 CG LEU A 45 -3.120 0.857 10.494 1.00 71.35 C ATOM 764 CD1 LEU A 45 -3.762 0.871 9.088 1.00 52.04 C ATOM 765 CD2 LEU A 45 -1.610 0.558 10.428 1.00 52.34 C ATOM 0 H LEU A 45 -4.493 0.777 13.051 1.00 52.23 H new ATOM 0 HA LEU A 45 -1.907 2.106 12.842 1.00 12.11 H new ATOM 0 HB2 LEU A 45 -4.493 2.370 11.226 1.00 12.12 H new ATOM 0 HB3 LEU A 45 -2.927 3.002 10.758 1.00 12.12 H new ATOM 0 HG LEU A 45 -3.580 0.042 11.053 1.00 71.35 H new ATOM 0 HD11 LEU A 45 -3.533 -0.062 8.574 1.00 52.04 H new ATOM 0 HD12 LEU A 45 -4.843 0.977 9.183 1.00 52.04 H new ATOM 0 HD13 LEU A 45 -3.364 1.708 8.515 1.00 52.04 H new ATOM 0 HD21 LEU A 45 -1.446 -0.368 9.877 1.00 52.34 H new ATOM 0 HD22 LEU A 45 -1.099 1.377 9.922 1.00 52.34 H new ATOM 0 HD23 LEU A 45 -1.215 0.454 11.439 1.00 52.34 H new ATOM 777 N ALA A 46 -4.573 3.668 13.996 1.00 40.54 N ATOM 778 CA ALA A 46 -5.154 4.934 14.509 1.00 3.52 C ATOM 779 C ALA A 46 -4.823 5.181 15.998 1.00 61.32 C ATOM 780 O ALA A 46 -4.360 6.274 16.360 1.00 33.24 O ATOM 781 CB ALA A 46 -6.681 4.907 14.299 1.00 55.52 C ATOM 0 H ALA A 46 -5.185 2.861 14.121 1.00 40.54 H new ATOM 0 HA ALA A 46 -4.708 5.757 13.951 1.00 3.52 H new ATOM 0 HB1 ALA A 46 -7.116 5.834 14.673 1.00 55.52 H new ATOM 0 HB2 ALA A 46 -6.900 4.806 13.236 1.00 55.52 H new ATOM 0 HB3 ALA A 46 -7.108 4.062 14.839 1.00 55.52 H new ATOM 787 N GLU A 47 -5.077 4.162 16.849 1.00 62.22 N ATOM 788 CA GLU A 47 -4.922 4.276 18.317 1.00 63.01 C ATOM 789 C GLU A 47 -3.429 4.371 18.673 1.00 40.43 C ATOM 790 O GLU A 47 -2.964 5.401 19.191 1.00 1.55 O ATOM 791 CB GLU A 47 -5.596 3.082 19.057 1.00 32.11 C ATOM 792 CG GLU A 47 -7.055 2.783 18.630 1.00 2.52 C ATOM 793 CD GLU A 47 -8.004 3.981 18.746 1.00 3.41 C ATOM 794 OE1 GLU A 47 -8.375 4.341 19.885 1.00 21.35 O ATOM 795 OE2 GLU A 47 -8.383 4.566 17.704 1.00 71.33 O ATOM 0 H GLU A 47 -5.393 3.243 16.540 1.00 62.22 H new ATOM 0 HA GLU A 47 -5.426 5.184 18.648 1.00 63.01 H new ATOM 0 HB2 GLU A 47 -4.995 2.187 18.893 1.00 32.11 H new ATOM 0 HB3 GLU A 47 -5.581 3.284 20.128 1.00 32.11 H new ATOM 0 HG2 GLU A 47 -7.055 2.433 17.598 1.00 2.52 H new ATOM 0 HG3 GLU A 47 -7.441 1.968 19.243 1.00 2.52 H new ATOM 802 N GLU A 48 -2.676 3.293 18.378 1.00 3.14 N ATOM 803 CA GLU A 48 -1.209 3.305 18.480 1.00 0.14 C ATOM 804 C GLU A 48 -0.630 3.844 17.155 1.00 64.40 C ATOM 805 O GLU A 48 -0.344 3.102 16.209 1.00 74.34 O ATOM 806 CB GLU A 48 -0.592 1.919 18.886 1.00 33.43 C ATOM 807 CG GLU A 48 -1.162 0.659 18.190 1.00 51.03 C ATOM 808 CD GLU A 48 -2.440 0.106 18.862 1.00 34.14 C ATOM 809 OE1 GLU A 48 -2.313 -0.631 19.867 1.00 74.14 O ATOM 810 OE2 GLU A 48 -3.562 0.394 18.401 1.00 53.34 O ATOM 0 H GLU A 48 -3.064 2.402 18.067 1.00 3.14 H new ATOM 0 HA GLU A 48 -0.928 3.967 19.299 1.00 0.14 H new ATOM 0 HB2 GLU A 48 0.480 1.957 18.691 1.00 33.43 H new ATOM 0 HB3 GLU A 48 -0.717 1.796 19.962 1.00 33.43 H new ATOM 0 HG2 GLU A 48 -1.383 0.897 17.149 1.00 51.03 H new ATOM 0 HG3 GLU A 48 -0.399 -0.119 18.184 1.00 51.03 H new ATOM 817 N LYS A 49 -0.513 5.177 17.099 1.00 72.31 N ATOM 818 CA LYS A 49 0.021 5.928 15.942 1.00 24.32 C ATOM 819 C LYS A 49 1.552 6.137 16.099 1.00 54.05 C ATOM 820 O LYS A 49 2.121 7.165 15.690 1.00 62.43 O ATOM 821 CB LYS A 49 -0.768 7.266 15.843 1.00 61.50 C ATOM 822 CG LYS A 49 -0.641 8.182 17.082 1.00 51.45 C ATOM 823 CD LYS A 49 -1.718 9.290 17.146 1.00 21.22 C ATOM 824 CE LYS A 49 -1.741 10.200 15.917 1.00 74.31 C ATOM 825 NZ LYS A 49 -2.785 11.260 16.033 1.00 63.51 N ATOM 0 H LYS A 49 -0.792 5.782 17.871 1.00 72.31 H new ATOM 0 HA LYS A 49 -0.113 5.376 15.012 1.00 24.32 H new ATOM 0 HB2 LYS A 49 -0.421 7.813 14.966 1.00 61.50 H new ATOM 0 HB3 LYS A 49 -1.822 7.040 15.681 1.00 61.50 H new ATOM 0 HG2 LYS A 49 -0.706 7.572 17.983 1.00 51.45 H new ATOM 0 HG3 LYS A 49 0.346 8.646 17.081 1.00 51.45 H new ATOM 0 HD2 LYS A 49 -2.697 8.826 17.261 1.00 21.22 H new ATOM 0 HD3 LYS A 49 -1.548 9.899 18.034 1.00 21.22 H new ATOM 0 HE2 LYS A 49 -0.763 10.665 15.790 1.00 74.31 H new ATOM 0 HE3 LYS A 49 -1.928 9.602 15.025 1.00 74.31 H new ATOM 0 HZ1 LYS A 49 -2.770 11.857 15.181 1.00 63.51 H new ATOM 0 HZ2 LYS A 49 -3.721 10.817 16.129 1.00 63.51 H new ATOM 0 HZ3 LYS A 49 -2.593 11.847 16.870 1.00 63.51 H new ATOM 839 N ASN A 50 2.195 5.091 16.649 1.00 63.33 N ATOM 840 CA ASN A 50 3.631 5.044 16.968 1.00 43.14 C ATOM 841 C ASN A 50 4.491 5.139 15.697 1.00 32.13 C ATOM 842 O ASN A 50 4.040 4.764 14.604 1.00 24.44 O ATOM 843 CB ASN A 50 3.926 3.719 17.738 1.00 74.31 C ATOM 844 CG ASN A 50 5.378 3.561 18.212 1.00 4.44 C ATOM 845 OD1 ASN A 50 6.050 4.536 18.554 1.00 33.13 O ATOM 846 ND2 ASN A 50 5.880 2.333 18.227 1.00 5.24 N ATOM 0 H ASN A 50 1.711 4.226 16.891 1.00 63.33 H new ATOM 0 HA ASN A 50 3.889 5.900 17.591 1.00 43.14 H new ATOM 0 HB2 ASN A 50 3.267 3.664 18.605 1.00 74.31 H new ATOM 0 HB3 ASN A 50 3.675 2.877 17.093 1.00 74.31 H new ATOM 0 HD21 ASN A 50 6.843 2.179 18.526 1.00 5.24 H new ATOM 0 HD22 ASN A 50 5.303 1.543 17.939 1.00 5.24 H new ATOM 853 N PHE A 51 5.727 5.659 15.848 1.00 54.43 N ATOM 854 CA PHE A 51 6.678 5.774 14.738 1.00 20.54 C ATOM 855 C PHE A 51 7.169 4.370 14.336 1.00 64.53 C ATOM 856 O PHE A 51 8.097 3.820 14.937 1.00 44.15 O ATOM 857 CB PHE A 51 7.857 6.716 15.097 1.00 55.12 C ATOM 858 CG PHE A 51 8.763 7.037 13.904 1.00 13.32 C ATOM 859 CD1 PHE A 51 8.352 7.953 12.935 1.00 52.23 C ATOM 860 CD2 PHE A 51 10.002 6.413 13.740 1.00 32.51 C ATOM 861 CE1 PHE A 51 9.150 8.236 11.843 1.00 42.44 C ATOM 862 CE2 PHE A 51 10.795 6.696 12.646 1.00 64.01 C ATOM 863 CZ PHE A 51 10.370 7.608 11.701 1.00 43.51 C ATOM 0 H PHE A 51 6.085 6.006 16.737 1.00 54.43 H new ATOM 0 HA PHE A 51 6.173 6.223 13.883 1.00 20.54 H new ATOM 0 HB2 PHE A 51 7.459 7.646 15.502 1.00 55.12 H new ATOM 0 HB3 PHE A 51 8.454 6.255 15.884 1.00 55.12 H new ATOM 0 HD1 PHE A 51 7.398 8.447 13.040 1.00 52.23 H new ATOM 0 HD2 PHE A 51 10.343 5.701 14.477 1.00 32.51 H new ATOM 0 HE1 PHE A 51 8.819 8.948 11.102 1.00 42.44 H new ATOM 0 HE2 PHE A 51 11.749 6.203 12.529 1.00 64.01 H new ATOM 0 HZ PHE A 51 10.994 7.830 10.848 1.00 43.51 H new ATOM 873 N GLU A 52 6.476 3.796 13.347 1.00 62.33 N ATOM 874 CA GLU A 52 6.741 2.453 12.828 1.00 35.53 C ATOM 875 C GLU A 52 6.379 2.414 11.336 1.00 50.43 C ATOM 876 O GLU A 52 5.451 3.112 10.883 1.00 44.23 O ATOM 877 CB GLU A 52 5.938 1.393 13.640 1.00 74.32 C ATOM 878 CG GLU A 52 4.405 1.579 13.583 1.00 43.23 C ATOM 879 CD GLU A 52 3.619 0.675 14.546 1.00 21.23 C ATOM 880 OE1 GLU A 52 3.703 -0.561 14.409 1.00 14.20 O ATOM 881 OE2 GLU A 52 2.895 1.201 15.429 1.00 60.41 O ATOM 0 H GLU A 52 5.700 4.262 12.877 1.00 62.33 H new ATOM 0 HA GLU A 52 7.799 2.213 12.937 1.00 35.53 H new ATOM 0 HB2 GLU A 52 6.186 0.400 13.265 1.00 74.32 H new ATOM 0 HB3 GLU A 52 6.259 1.430 14.681 1.00 74.32 H new ATOM 0 HG2 GLU A 52 4.169 2.619 13.807 1.00 43.23 H new ATOM 0 HG3 GLU A 52 4.066 1.387 12.565 1.00 43.23 H new ATOM 888 N LYS A 53 7.148 1.624 10.572 1.00 24.31 N ATOM 889 CA LYS A 53 6.993 1.513 9.120 1.00 23.21 C ATOM 890 C LYS A 53 6.418 0.131 8.765 1.00 33.54 C ATOM 891 O LYS A 53 7.126 -0.880 8.794 1.00 15.42 O ATOM 892 CB LYS A 53 8.352 1.781 8.420 1.00 4.14 C ATOM 893 CG LYS A 53 8.982 3.158 8.766 1.00 73.23 C ATOM 894 CD LYS A 53 10.190 3.531 7.878 1.00 64.40 C ATOM 895 CE LYS A 53 11.295 2.471 7.894 1.00 34.53 C ATOM 896 NZ LYS A 53 11.786 2.176 9.261 1.00 1.32 N ATOM 0 H LYS A 53 7.897 1.043 10.949 1.00 24.31 H new ATOM 0 HA LYS A 53 6.290 2.265 8.762 1.00 23.21 H new ATOM 0 HB2 LYS A 53 9.053 0.993 8.696 1.00 4.14 H new ATOM 0 HB3 LYS A 53 8.211 1.718 7.341 1.00 4.14 H new ATOM 0 HG2 LYS A 53 8.219 3.931 8.669 1.00 73.23 H new ATOM 0 HG3 LYS A 53 9.298 3.151 9.809 1.00 73.23 H new ATOM 0 HD2 LYS A 53 9.849 3.677 6.853 1.00 64.40 H new ATOM 0 HD3 LYS A 53 10.602 4.482 8.215 1.00 64.40 H new ATOM 0 HE2 LYS A 53 10.919 1.553 7.442 1.00 34.53 H new ATOM 0 HE3 LYS A 53 12.128 2.811 7.279 1.00 34.53 H new ATOM 0 HZ1 LYS A 53 12.739 1.764 9.206 1.00 1.32 H new ATOM 0 HZ2 LYS A 53 11.820 3.056 9.815 1.00 1.32 H new ATOM 0 HZ3 LYS A 53 11.143 1.501 9.723 1.00 1.32 H new ATOM 910 N ILE A 54 5.108 0.103 8.472 1.00 1.21 N ATOM 911 CA ILE A 54 4.348 -1.131 8.201 1.00 15.23 C ATOM 912 C ILE A 54 4.027 -1.247 6.696 1.00 43.42 C ATOM 913 O ILE A 54 3.571 -0.286 6.079 1.00 24.30 O ATOM 914 CB ILE A 54 2.995 -1.150 9.027 1.00 74.45 C ATOM 915 CG1 ILE A 54 3.265 -1.074 10.567 1.00 51.13 C ATOM 916 CG2 ILE A 54 2.132 -2.390 8.685 1.00 74.22 C ATOM 917 CD1 ILE A 54 2.010 -1.120 11.435 1.00 21.10 C ATOM 0 H ILE A 54 4.538 0.947 8.416 1.00 1.21 H new ATOM 0 HA ILE A 54 4.964 -1.977 8.506 1.00 15.23 H new ATOM 0 HB ILE A 54 2.433 -0.262 8.737 1.00 74.45 H new ATOM 0 HG12 ILE A 54 3.917 -1.901 10.850 1.00 51.13 H new ATOM 0 HG13 ILE A 54 3.807 -0.153 10.783 1.00 51.13 H new ATOM 0 HG21 ILE A 54 1.213 -2.367 9.271 1.00 74.22 H new ATOM 0 HG22 ILE A 54 1.885 -2.380 7.623 1.00 74.22 H new ATOM 0 HG23 ILE A 54 2.689 -3.297 8.919 1.00 74.22 H new ATOM 0 HD11 ILE A 54 2.292 -1.062 12.486 1.00 21.10 H new ATOM 0 HD12 ILE A 54 1.364 -0.278 11.186 1.00 21.10 H new ATOM 0 HD13 ILE A 54 1.476 -2.053 11.254 1.00 21.10 H new ATOM 929 N LEU A 55 4.280 -2.434 6.115 1.00 61.23 N ATOM 930 CA LEU A 55 3.762 -2.796 4.792 1.00 63.15 C ATOM 931 C LEU A 55 2.304 -3.258 4.955 1.00 24.21 C ATOM 932 O LEU A 55 2.053 -4.238 5.652 1.00 54.13 O ATOM 933 CB LEU A 55 4.577 -3.962 4.163 1.00 73.13 C ATOM 934 CG LEU A 55 4.207 -4.300 2.670 1.00 73.50 C ATOM 935 CD1 LEU A 55 4.866 -3.307 1.701 1.00 21.43 C ATOM 936 CD2 LEU A 55 4.525 -5.768 2.300 1.00 11.32 C ATOM 0 H LEU A 55 4.846 -3.162 6.550 1.00 61.23 H new ATOM 0 HA LEU A 55 3.838 -1.927 4.138 1.00 63.15 H new ATOM 0 HB2 LEU A 55 5.637 -3.713 4.212 1.00 73.13 H new ATOM 0 HB3 LEU A 55 4.432 -4.856 4.769 1.00 73.13 H new ATOM 0 HG LEU A 55 3.127 -4.191 2.573 1.00 73.50 H new ATOM 0 HD11 LEU A 55 4.594 -3.563 0.677 1.00 21.43 H new ATOM 0 HD12 LEU A 55 4.523 -2.297 1.926 1.00 21.43 H new ATOM 0 HD13 LEU A 55 5.949 -3.355 1.812 1.00 21.43 H new ATOM 0 HD21 LEU A 55 4.251 -5.949 1.261 1.00 11.32 H new ATOM 0 HD22 LEU A 55 5.591 -5.954 2.432 1.00 11.32 H new ATOM 0 HD23 LEU A 55 3.957 -6.437 2.946 1.00 11.32 H new ATOM 948 N ILE A 56 1.354 -2.547 4.348 1.00 53.01 N ATOM 949 CA ILE A 56 -0.043 -3.006 4.264 1.00 61.10 C ATOM 950 C ILE A 56 -0.227 -3.781 2.943 1.00 41.30 C ATOM 951 O ILE A 56 0.416 -3.470 1.938 1.00 70.34 O ATOM 952 CB ILE A 56 -1.068 -1.809 4.344 1.00 55.25 C ATOM 953 CG1 ILE A 56 -0.810 -0.928 5.605 1.00 51.04 C ATOM 954 CG2 ILE A 56 -2.533 -2.317 4.336 1.00 14.22 C ATOM 955 CD1 ILE A 56 -1.043 -1.617 6.943 1.00 12.25 C ATOM 0 H ILE A 56 1.523 -1.645 3.903 1.00 53.01 H new ATOM 0 HA ILE A 56 -0.248 -3.653 5.117 1.00 61.10 H new ATOM 0 HB ILE A 56 -0.915 -1.194 3.457 1.00 55.25 H new ATOM 0 HG12 ILE A 56 0.220 -0.572 5.574 1.00 51.04 H new ATOM 0 HG13 ILE A 56 -1.453 -0.050 5.551 1.00 51.04 H new ATOM 0 HG21 ILE A 56 -3.213 -1.467 4.392 1.00 14.22 H new ATOM 0 HG22 ILE A 56 -2.721 -2.872 3.417 1.00 14.22 H new ATOM 0 HG23 ILE A 56 -2.696 -2.970 5.194 1.00 14.22 H new ATOM 0 HD11 ILE A 56 -0.836 -0.918 7.753 1.00 12.25 H new ATOM 0 HD12 ILE A 56 -2.079 -1.948 7.006 1.00 12.25 H new ATOM 0 HD13 ILE A 56 -0.381 -2.479 7.029 1.00 12.25 H new ATOM 967 N LYS A 57 -1.099 -4.793 2.963 1.00 42.42 N ATOM 968 CA LYS A 57 -1.378 -5.661 1.810 1.00 52.30 C ATOM 969 C LYS A 57 -2.903 -5.854 1.709 1.00 45.42 C ATOM 970 O LYS A 57 -3.558 -6.111 2.718 1.00 1.52 O ATOM 971 CB LYS A 57 -0.589 -7.000 2.005 1.00 52.10 C ATOM 972 CG LYS A 57 -0.809 -8.128 0.952 1.00 72.44 C ATOM 973 CD LYS A 57 -2.022 -9.046 1.267 1.00 1.24 C ATOM 974 CE LYS A 57 -2.149 -10.235 0.315 1.00 75.05 C ATOM 975 NZ LYS A 57 -3.398 -11.020 0.529 1.00 72.11 N ATOM 0 H LYS A 57 -1.640 -5.038 3.792 1.00 42.42 H new ATOM 0 HA LYS A 57 -1.047 -5.225 0.867 1.00 52.30 H new ATOM 0 HB2 LYS A 57 0.475 -6.763 2.026 1.00 52.10 H new ATOM 0 HB3 LYS A 57 -0.846 -7.401 2.985 1.00 52.10 H new ATOM 0 HG2 LYS A 57 -0.952 -7.675 -0.029 1.00 72.44 H new ATOM 0 HG3 LYS A 57 0.092 -8.738 0.892 1.00 72.44 H new ATOM 0 HD2 LYS A 57 -1.932 -9.416 2.288 1.00 1.24 H new ATOM 0 HD3 LYS A 57 -2.937 -8.455 1.222 1.00 1.24 H new ATOM 0 HE2 LYS A 57 -2.124 -9.875 -0.713 1.00 75.05 H new ATOM 0 HE3 LYS A 57 -1.288 -10.890 0.444 1.00 75.05 H new ATOM 0 HZ1 LYS A 57 -3.430 -11.812 -0.144 1.00 72.11 H new ATOM 0 HZ2 LYS A 57 -3.413 -11.390 1.501 1.00 72.11 H new ATOM 0 HZ3 LYS A 57 -4.224 -10.406 0.380 1.00 72.11 H new ATOM 989 N SER A 58 -3.450 -5.722 0.491 1.00 55.32 N ATOM 990 CA SER A 58 -4.903 -5.823 0.239 1.00 62.13 C ATOM 991 C SER A 58 -5.156 -6.175 -1.246 1.00 3.40 C ATOM 992 O SER A 58 -4.212 -6.224 -2.045 1.00 11.41 O ATOM 993 CB SER A 58 -5.617 -4.505 0.654 1.00 30.33 C ATOM 994 OG SER A 58 -7.029 -4.606 0.537 1.00 53.53 O ATOM 0 H SER A 58 -2.901 -5.542 -0.350 1.00 55.32 H new ATOM 0 HA SER A 58 -5.323 -6.624 0.847 1.00 62.13 H new ATOM 0 HB2 SER A 58 -5.355 -4.259 1.683 1.00 30.33 H new ATOM 0 HB3 SER A 58 -5.259 -3.686 0.030 1.00 30.33 H new ATOM 0 HG SER A 58 -7.449 -3.825 0.955 1.00 53.53 H new ATOM 1000 N ASN A 59 -6.431 -6.424 -1.596 1.00 62.21 N ATOM 1001 CA ASN A 59 -6.840 -6.994 -2.909 1.00 72.31 C ATOM 1002 C ASN A 59 -8.002 -6.191 -3.508 1.00 21.24 C ATOM 1003 O ASN A 59 -7.963 -5.790 -4.678 1.00 43.10 O ATOM 1004 CB ASN A 59 -7.283 -8.476 -2.713 1.00 15.13 C ATOM 1005 CG ASN A 59 -7.767 -9.182 -3.991 1.00 64.14 C ATOM 1006 OD1 ASN A 59 -7.265 -8.939 -5.091 1.00 74.32 O ATOM 1007 ND2 ASN A 59 -8.750 -10.062 -3.848 1.00 13.22 N ATOM 0 H ASN A 59 -7.219 -6.236 -0.976 1.00 62.21 H new ATOM 0 HA ASN A 59 -5.992 -6.945 -3.592 1.00 72.31 H new ATOM 0 HB2 ASN A 59 -6.446 -9.038 -2.300 1.00 15.13 H new ATOM 0 HB3 ASN A 59 -8.083 -8.506 -1.974 1.00 15.13 H new ATOM 0 HD21 ASN A 59 -9.111 -10.560 -4.662 1.00 13.22 H new ATOM 0 HD22 ASN A 59 -9.144 -10.241 -2.924 1.00 13.22 H new ATOM 1014 N ASP A 60 -9.049 -5.973 -2.697 1.00 44.44 N ATOM 1015 CA ASP A 60 -10.306 -5.362 -3.179 1.00 13.21 C ATOM 1016 C ASP A 60 -10.279 -3.837 -2.997 1.00 54.31 C ATOM 1017 O ASP A 60 -9.990 -3.352 -1.901 1.00 22.10 O ATOM 1018 CB ASP A 60 -11.529 -5.964 -2.451 1.00 62.03 C ATOM 1019 CG ASP A 60 -12.856 -5.368 -2.949 1.00 44.25 C ATOM 1020 OD1 ASP A 60 -13.299 -5.724 -4.059 1.00 60.02 O ATOM 1021 OD2 ASP A 60 -13.441 -4.521 -2.254 1.00 33.34 O ATOM 0 H ASP A 60 -9.054 -6.209 -1.705 1.00 44.44 H new ATOM 0 HA ASP A 60 -10.395 -5.583 -4.243 1.00 13.21 H new ATOM 0 HB2 ASP A 60 -11.541 -7.044 -2.597 1.00 62.03 H new ATOM 0 HB3 ASP A 60 -11.434 -5.789 -1.379 1.00 62.03 H new ATOM 1026 N LYS A 61 -10.664 -3.118 -4.073 1.00 54.05 N ATOM 1027 CA LYS A 61 -10.583 -1.642 -4.181 1.00 2.44 C ATOM 1028 C LYS A 61 -11.288 -0.897 -3.018 1.00 5.22 C ATOM 1029 O LYS A 61 -10.796 0.147 -2.575 1.00 23.44 O ATOM 1030 CB LYS A 61 -11.194 -1.167 -5.531 1.00 10.12 C ATOM 1031 CG LYS A 61 -12.692 -1.508 -5.711 1.00 3.43 C ATOM 1032 CD LYS A 61 -13.347 -0.758 -6.890 1.00 61.33 C ATOM 1033 CE LYS A 61 -12.731 -1.100 -8.245 1.00 23.50 C ATOM 1034 NZ LYS A 61 -13.385 -0.329 -9.336 1.00 54.04 N ATOM 0 H LYS A 61 -11.049 -3.555 -4.910 1.00 54.05 H new ATOM 0 HA LYS A 61 -9.523 -1.395 -4.128 1.00 2.44 H new ATOM 0 HB2 LYS A 61 -11.068 -0.087 -5.613 1.00 10.12 H new ATOM 0 HB3 LYS A 61 -10.631 -1.617 -6.349 1.00 10.12 H new ATOM 0 HG2 LYS A 61 -12.798 -2.582 -5.868 1.00 3.43 H new ATOM 0 HG3 LYS A 61 -13.226 -1.266 -4.792 1.00 3.43 H new ATOM 0 HD2 LYS A 61 -14.411 -0.993 -6.914 1.00 61.33 H new ATOM 0 HD3 LYS A 61 -13.261 0.315 -6.721 1.00 61.33 H new ATOM 0 HE2 LYS A 61 -11.663 -0.881 -8.229 1.00 23.50 H new ATOM 0 HE3 LYS A 61 -12.834 -2.168 -8.437 1.00 23.50 H new ATOM 0 HZ1 LYS A 61 -12.687 -0.117 -10.078 1.00 54.04 H new ATOM 0 HZ2 LYS A 61 -14.161 -0.891 -9.741 1.00 54.04 H new ATOM 0 HZ3 LYS A 61 -13.764 0.561 -8.953 1.00 54.04 H new ATOM 1048 N GLN A 62 -12.407 -1.471 -2.512 1.00 4.44 N ATOM 1049 CA GLN A 62 -13.259 -0.813 -1.498 1.00 43.41 C ATOM 1050 C GLN A 62 -12.494 -0.694 -0.178 1.00 13.21 C ATOM 1051 O GLN A 62 -12.510 0.351 0.457 1.00 23.30 O ATOM 1052 CB GLN A 62 -14.583 -1.598 -1.283 1.00 30.13 C ATOM 1053 CG GLN A 62 -15.414 -1.808 -2.566 1.00 71.30 C ATOM 1054 CD GLN A 62 -15.941 -0.512 -3.185 1.00 74.13 C ATOM 1055 OE1 GLN A 62 -15.274 0.127 -4.004 1.00 12.00 O ATOM 1056 NE2 GLN A 62 -17.152 -0.124 -2.807 1.00 73.13 N ATOM 0 H GLN A 62 -12.739 -2.393 -2.793 1.00 4.44 H new ATOM 0 HA GLN A 62 -13.515 0.183 -1.858 1.00 43.41 H new ATOM 0 HB2 GLN A 62 -14.348 -2.572 -0.853 1.00 30.13 H new ATOM 0 HB3 GLN A 62 -15.193 -1.066 -0.553 1.00 30.13 H new ATOM 0 HG2 GLN A 62 -14.801 -2.327 -3.303 1.00 71.30 H new ATOM 0 HG3 GLN A 62 -16.258 -2.459 -2.338 1.00 71.30 H new ATOM 0 HE21 GLN A 62 -17.676 -0.676 -2.128 1.00 73.13 H new ATOM 0 HE22 GLN A 62 -17.559 0.727 -3.196 1.00 73.13 H new ATOM 1065 N LEU A 63 -11.763 -1.771 0.168 1.00 53.14 N ATOM 1066 CA LEU A 63 -10.963 -1.853 1.402 1.00 23.21 C ATOM 1067 C LEU A 63 -9.878 -0.751 1.436 1.00 23.50 C ATOM 1068 O LEU A 63 -9.632 -0.153 2.482 1.00 5.10 O ATOM 1069 CB LEU A 63 -10.315 -3.271 1.517 1.00 4.44 C ATOM 1070 CG LEU A 63 -11.312 -4.477 1.576 1.00 54.31 C ATOM 1071 CD1 LEU A 63 -10.574 -5.833 1.506 1.00 43.21 C ATOM 1072 CD2 LEU A 63 -12.207 -4.394 2.830 1.00 74.41 C ATOM 0 H LEU A 63 -11.712 -2.613 -0.405 1.00 53.14 H new ATOM 0 HA LEU A 63 -11.622 -1.693 2.256 1.00 23.21 H new ATOM 0 HB2 LEU A 63 -9.651 -3.416 0.665 1.00 4.44 H new ATOM 0 HB3 LEU A 63 -9.694 -3.294 2.413 1.00 4.44 H new ATOM 0 HG LEU A 63 -11.955 -4.413 0.698 1.00 54.31 H new ATOM 0 HD11 LEU A 63 -11.300 -6.645 1.550 1.00 43.21 H new ATOM 0 HD12 LEU A 63 -10.015 -5.895 0.572 1.00 43.21 H new ATOM 0 HD13 LEU A 63 -9.885 -5.916 2.347 1.00 43.21 H new ATOM 0 HD21 LEU A 63 -12.890 -5.243 2.846 1.00 74.41 H new ATOM 0 HD22 LEU A 63 -11.583 -4.412 3.724 1.00 74.41 H new ATOM 0 HD23 LEU A 63 -12.781 -3.468 2.807 1.00 74.41 H new ATOM 1084 N LEU A 64 -9.273 -0.470 0.259 1.00 53.34 N ATOM 1085 CA LEU A 64 -8.231 0.573 0.107 1.00 62.25 C ATOM 1086 C LEU A 64 -8.837 1.979 0.191 1.00 4.14 C ATOM 1087 O LEU A 64 -8.236 2.869 0.790 1.00 3.03 O ATOM 1088 CB LEU A 64 -7.451 0.435 -1.233 1.00 43.43 C ATOM 1089 CG LEU A 64 -6.478 -0.778 -1.361 1.00 14.10 C ATOM 1090 CD1 LEU A 64 -7.223 -2.109 -1.509 1.00 74.05 C ATOM 1091 CD2 LEU A 64 -5.496 -0.570 -2.515 1.00 33.31 C ATOM 0 H LEU A 64 -9.492 -0.958 -0.610 1.00 53.34 H new ATOM 0 HA LEU A 64 -7.532 0.427 0.931 1.00 62.25 H new ATOM 0 HB2 LEU A 64 -8.177 0.375 -2.044 1.00 43.43 H new ATOM 0 HB3 LEU A 64 -6.877 1.349 -1.387 1.00 43.43 H new ATOM 0 HG LEU A 64 -5.912 -0.832 -0.431 1.00 14.10 H new ATOM 0 HD11 LEU A 64 -6.502 -2.922 -1.595 1.00 74.05 H new ATOM 0 HD12 LEU A 64 -7.853 -2.273 -0.634 1.00 74.05 H new ATOM 0 HD13 LEU A 64 -7.845 -2.080 -2.404 1.00 74.05 H new ATOM 0 HD21 LEU A 64 -4.828 -1.429 -2.584 1.00 33.31 H new ATOM 0 HD22 LEU A 64 -6.049 -0.464 -3.449 1.00 33.31 H new ATOM 0 HD23 LEU A 64 -4.910 0.332 -2.336 1.00 33.31 H new ATOM 1103 N LYS A 65 -10.024 2.166 -0.428 1.00 52.45 N ATOM 1104 CA LYS A 65 -10.749 3.451 -0.396 1.00 73.40 C ATOM 1105 C LYS A 65 -11.061 3.835 1.055 1.00 1.51 C ATOM 1106 O LYS A 65 -10.577 4.849 1.555 1.00 35.24 O ATOM 1107 CB LYS A 65 -12.064 3.370 -1.235 1.00 64.24 C ATOM 1108 CG LYS A 65 -11.851 3.300 -2.762 1.00 52.23 C ATOM 1109 CD LYS A 65 -11.189 4.572 -3.372 1.00 23.12 C ATOM 1110 CE LYS A 65 -12.148 5.775 -3.532 1.00 61.23 C ATOM 1111 NZ LYS A 65 -12.629 6.348 -2.241 1.00 53.32 N ATOM 0 H LYS A 65 -10.501 1.437 -0.958 1.00 52.45 H new ATOM 0 HA LYS A 65 -10.116 4.219 -0.839 1.00 73.40 H new ATOM 0 HB2 LYS A 65 -12.627 2.491 -0.920 1.00 64.24 H new ATOM 0 HB3 LYS A 65 -12.679 4.241 -1.007 1.00 64.24 H new ATOM 0 HG2 LYS A 65 -11.230 2.435 -2.992 1.00 52.23 H new ATOM 0 HG3 LYS A 65 -12.814 3.138 -3.245 1.00 52.23 H new ATOM 0 HD2 LYS A 65 -10.353 4.871 -2.740 1.00 23.12 H new ATOM 0 HD3 LYS A 65 -10.776 4.319 -4.349 1.00 23.12 H new ATOM 0 HE2 LYS A 65 -11.641 6.557 -4.098 1.00 61.23 H new ATOM 0 HE3 LYS A 65 -13.010 5.463 -4.122 1.00 61.23 H new ATOM 0 HZ1 LYS A 65 -12.764 7.374 -2.345 1.00 53.32 H new ATOM 0 HZ2 LYS A 65 -13.533 5.905 -1.980 1.00 53.32 H new ATOM 0 HZ3 LYS A 65 -11.926 6.165 -1.497 1.00 53.32 H new ATOM 1125 N GLU A 66 -11.788 2.936 1.730 1.00 55.10 N ATOM 1126 CA GLU A 66 -12.279 3.120 3.103 1.00 54.01 C ATOM 1127 C GLU A 66 -11.119 3.302 4.095 1.00 10.11 C ATOM 1128 O GLU A 66 -11.225 4.100 5.028 1.00 60.23 O ATOM 1129 CB GLU A 66 -13.165 1.906 3.500 1.00 24.22 C ATOM 1130 CG GLU A 66 -14.354 1.680 2.549 1.00 71.22 C ATOM 1131 CD GLU A 66 -15.209 0.459 2.896 1.00 31.02 C ATOM 1132 OE1 GLU A 66 -15.962 0.522 3.890 1.00 72.21 O ATOM 1133 OE2 GLU A 66 -15.138 -0.568 2.182 1.00 70.35 O ATOM 0 H GLU A 66 -12.058 2.039 1.328 1.00 55.10 H new ATOM 0 HA GLU A 66 -12.878 4.030 3.142 1.00 54.01 H new ATOM 0 HB2 GLU A 66 -12.549 1.007 3.519 1.00 24.22 H new ATOM 0 HB3 GLU A 66 -13.542 2.056 4.512 1.00 24.22 H new ATOM 0 HG2 GLU A 66 -14.987 2.568 2.558 1.00 71.22 H new ATOM 0 HG3 GLU A 66 -13.976 1.569 1.533 1.00 71.22 H new ATOM 1140 N MET A 67 -10.009 2.577 3.848 1.00 2.34 N ATOM 1141 CA MET A 67 -8.761 2.703 4.626 1.00 11.22 C ATOM 1142 C MET A 67 -8.230 4.153 4.548 1.00 64.12 C ATOM 1143 O MET A 67 -8.149 4.853 5.558 1.00 22.40 O ATOM 1144 CB MET A 67 -7.691 1.715 4.058 1.00 43.42 C ATOM 1145 CG MET A 67 -6.430 1.533 4.914 1.00 73.12 C ATOM 1146 SD MET A 67 -5.106 0.653 4.046 1.00 23.01 S ATOM 1147 CE MET A 67 -5.928 -0.843 3.487 1.00 34.31 C ATOM 0 H MET A 67 -9.954 1.885 3.100 1.00 2.34 H new ATOM 0 HA MET A 67 -8.963 2.459 5.669 1.00 11.22 H new ATOM 0 HB2 MET A 67 -8.159 0.740 3.923 1.00 43.42 H new ATOM 0 HB3 MET A 67 -7.390 2.064 3.070 1.00 43.42 H new ATOM 0 HG2 MET A 67 -6.065 2.512 5.226 1.00 73.12 H new ATOM 0 HG3 MET A 67 -6.689 0.986 5.821 1.00 73.12 H new ATOM 0 HE1 MET A 67 -5.181 -1.576 3.182 1.00 34.31 H new ATOM 0 HE2 MET A 67 -6.529 -1.253 4.299 1.00 34.31 H new ATOM 0 HE3 MET A 67 -6.573 -0.609 2.640 1.00 34.31 H new ATOM 1157 N LEU A 68 -7.973 4.602 3.305 1.00 11.43 N ATOM 1158 CA LEU A 68 -7.274 5.868 3.003 1.00 75.43 C ATOM 1159 C LEU A 68 -8.135 7.120 3.278 1.00 53.00 C ATOM 1160 O LEU A 68 -7.594 8.199 3.497 1.00 54.10 O ATOM 1161 CB LEU A 68 -6.779 5.845 1.527 1.00 22.05 C ATOM 1162 CG LEU A 68 -5.675 4.784 1.203 1.00 21.34 C ATOM 1163 CD1 LEU A 68 -5.350 4.743 -0.304 1.00 42.42 C ATOM 1164 CD2 LEU A 68 -4.410 5.034 2.040 1.00 22.02 C ATOM 0 H LEU A 68 -8.249 4.088 2.468 1.00 11.43 H new ATOM 0 HA LEU A 68 -6.422 5.941 3.679 1.00 75.43 H new ATOM 0 HB2 LEU A 68 -7.635 5.663 0.878 1.00 22.05 H new ATOM 0 HB3 LEU A 68 -6.393 6.833 1.276 1.00 22.05 H new ATOM 0 HG LEU A 68 -6.070 3.805 1.474 1.00 21.34 H new ATOM 0 HD11 LEU A 68 -4.579 3.995 -0.490 1.00 42.42 H new ATOM 0 HD12 LEU A 68 -6.249 4.485 -0.863 1.00 42.42 H new ATOM 0 HD13 LEU A 68 -4.991 5.721 -0.626 1.00 42.42 H new ATOM 0 HD21 LEU A 68 -3.658 4.283 1.796 1.00 22.02 H new ATOM 0 HD22 LEU A 68 -4.017 6.026 1.818 1.00 22.02 H new ATOM 0 HD23 LEU A 68 -4.656 4.970 3.100 1.00 22.02 H new ATOM 1176 N GLU A 69 -9.468 6.966 3.268 1.00 3.45 N ATOM 1177 CA GLU A 69 -10.409 8.069 3.590 1.00 2.44 C ATOM 1178 C GLU A 69 -10.417 8.349 5.103 1.00 64.32 C ATOM 1179 O GLU A 69 -10.625 9.488 5.539 1.00 31.43 O ATOM 1180 CB GLU A 69 -11.831 7.733 3.058 1.00 40.30 C ATOM 1181 CG GLU A 69 -11.905 7.687 1.517 1.00 23.41 C ATOM 1182 CD GLU A 69 -13.266 7.265 0.967 1.00 73.22 C ATOM 1183 OE1 GLU A 69 -14.178 8.111 0.878 1.00 33.44 O ATOM 1184 OE2 GLU A 69 -13.425 6.083 0.599 1.00 70.32 O ATOM 0 H GLU A 69 -9.928 6.085 3.040 1.00 3.45 H new ATOM 0 HA GLU A 69 -10.074 8.979 3.093 1.00 2.44 H new ATOM 0 HB2 GLU A 69 -12.145 6.770 3.460 1.00 40.30 H new ATOM 0 HB3 GLU A 69 -12.536 8.477 3.428 1.00 40.30 H new ATOM 0 HG2 GLU A 69 -11.656 8.672 1.123 1.00 23.41 H new ATOM 0 HG3 GLU A 69 -11.147 6.996 1.149 1.00 23.41 H new ATOM 1191 N LEU A 70 -10.156 7.296 5.897 1.00 34.40 N ATOM 1192 CA LEU A 70 -10.004 7.407 7.358 1.00 61.22 C ATOM 1193 C LEU A 70 -8.586 7.907 7.713 1.00 65.44 C ATOM 1194 O LEU A 70 -8.420 8.740 8.604 1.00 33.15 O ATOM 1195 CB LEU A 70 -10.301 6.035 8.023 1.00 14.24 C ATOM 1196 CG LEU A 70 -11.742 5.475 7.812 1.00 12.15 C ATOM 1197 CD1 LEU A 70 -11.889 4.053 8.400 1.00 71.35 C ATOM 1198 CD2 LEU A 70 -12.807 6.437 8.375 1.00 44.34 C ATOM 0 H LEU A 70 -10.045 6.345 5.544 1.00 34.40 H new ATOM 0 HA LEU A 70 -10.719 8.135 7.741 1.00 61.22 H new ATOM 0 HB2 LEU A 70 -9.588 5.305 7.639 1.00 14.24 H new ATOM 0 HB3 LEU A 70 -10.120 6.125 9.094 1.00 14.24 H new ATOM 0 HG LEU A 70 -11.910 5.398 6.738 1.00 12.15 H new ATOM 0 HD11 LEU A 70 -12.905 3.694 8.235 1.00 71.35 H new ATOM 0 HD12 LEU A 70 -11.183 3.382 7.910 1.00 71.35 H new ATOM 0 HD13 LEU A 70 -11.682 4.079 9.470 1.00 71.35 H new ATOM 0 HD21 LEU A 70 -13.799 6.017 8.212 1.00 44.34 H new ATOM 0 HD22 LEU A 70 -12.643 6.576 9.444 1.00 44.34 H new ATOM 0 HD23 LEU A 70 -12.732 7.399 7.868 1.00 44.34 H new ATOM 1210 N ILE A 71 -7.573 7.414 6.960 1.00 30.11 N ATOM 1211 CA ILE A 71 -6.152 7.798 7.137 1.00 53.44 C ATOM 1212 C ILE A 71 -5.943 9.282 6.756 1.00 3.14 C ATOM 1213 O ILE A 71 -5.100 9.964 7.342 1.00 30.52 O ATOM 1214 CB ILE A 71 -5.192 6.863 6.290 1.00 35.11 C ATOM 1215 CG1 ILE A 71 -5.255 5.393 6.820 1.00 43.42 C ATOM 1216 CG2 ILE A 71 -3.732 7.390 6.270 1.00 33.34 C ATOM 1217 CD1 ILE A 71 -4.397 4.388 6.072 1.00 12.13 C ATOM 0 H ILE A 71 -7.719 6.737 6.211 1.00 30.11 H new ATOM 0 HA ILE A 71 -5.898 7.668 8.189 1.00 53.44 H new ATOM 0 HB ILE A 71 -5.545 6.876 5.259 1.00 35.11 H new ATOM 0 HG12 ILE A 71 -4.955 5.391 7.868 1.00 43.42 H new ATOM 0 HG13 ILE A 71 -6.291 5.057 6.784 1.00 43.42 H new ATOM 0 HG21 ILE A 71 -3.111 6.718 5.678 1.00 33.34 H new ATOM 0 HG22 ILE A 71 -3.711 8.386 5.829 1.00 33.34 H new ATOM 0 HG23 ILE A 71 -3.348 7.436 7.289 1.00 33.34 H new ATOM 0 HD11 ILE A 71 -4.516 3.402 6.522 1.00 12.13 H new ATOM 0 HD12 ILE A 71 -4.708 4.350 5.028 1.00 12.13 H new ATOM 0 HD13 ILE A 71 -3.351 4.689 6.129 1.00 12.13 H new ATOM 1229 N SER A 72 -6.750 9.769 5.792 1.00 54.21 N ATOM 1230 CA SER A 72 -6.731 11.178 5.347 1.00 21.11 C ATOM 1231 C SER A 72 -7.088 12.130 6.507 1.00 65.53 C ATOM 1232 O SER A 72 -6.642 13.277 6.546 1.00 55.41 O ATOM 1233 CB SER A 72 -7.706 11.366 4.157 1.00 42.11 C ATOM 1234 OG SER A 72 -7.581 12.654 3.570 1.00 61.33 O ATOM 0 H SER A 72 -7.435 9.196 5.299 1.00 54.21 H new ATOM 0 HA SER A 72 -5.722 11.426 5.017 1.00 21.11 H new ATOM 0 HB2 SER A 72 -7.511 10.603 3.404 1.00 42.11 H new ATOM 0 HB3 SER A 72 -8.730 11.221 4.500 1.00 42.11 H new ATOM 0 HG SER A 72 -8.210 12.735 2.823 1.00 61.33 H new ATOM 1240 N LYS A 73 -7.890 11.609 7.456 1.00 14.13 N ATOM 1241 CA LYS A 73 -8.276 12.321 8.682 1.00 2.42 C ATOM 1242 C LYS A 73 -7.216 12.136 9.785 1.00 73.44 C ATOM 1243 O LYS A 73 -6.919 13.079 10.522 1.00 75.04 O ATOM 1244 CB LYS A 73 -9.653 11.804 9.166 1.00 14.25 C ATOM 1245 CG LYS A 73 -10.797 12.010 8.148 1.00 51.43 C ATOM 1246 CD LYS A 73 -12.172 11.476 8.622 1.00 13.01 C ATOM 1247 CE LYS A 73 -12.754 12.220 9.841 1.00 4.04 C ATOM 1248 NZ LYS A 73 -12.078 11.879 11.130 1.00 54.34 N ATOM 0 H LYS A 73 -8.290 10.673 7.389 1.00 14.13 H new ATOM 0 HA LYS A 73 -8.346 13.386 8.462 1.00 2.42 H new ATOM 0 HB2 LYS A 73 -9.571 10.741 9.394 1.00 14.25 H new ATOM 0 HB3 LYS A 73 -9.913 12.310 10.096 1.00 14.25 H new ATOM 0 HG2 LYS A 73 -10.888 13.074 7.931 1.00 51.43 H new ATOM 0 HG3 LYS A 73 -10.530 11.516 7.214 1.00 51.43 H new ATOM 0 HD2 LYS A 73 -12.880 11.545 7.796 1.00 13.01 H new ATOM 0 HD3 LYS A 73 -12.073 10.419 8.869 1.00 13.01 H new ATOM 0 HE2 LYS A 73 -12.675 13.294 9.672 1.00 4.04 H new ATOM 0 HE3 LYS A 73 -13.816 11.988 9.925 1.00 4.04 H new ATOM 0 HZ1 LYS A 73 -12.795 11.668 11.853 1.00 54.34 H new ATOM 0 HZ2 LYS A 73 -11.469 11.047 10.993 1.00 54.34 H new ATOM 0 HZ3 LYS A 73 -11.499 12.685 11.442 1.00 54.34 H new ATOM 1262 N LEU A 74 -6.644 10.912 9.878 1.00 63.21 N ATOM 1263 CA LEU A 74 -5.652 10.548 10.922 1.00 33.11 C ATOM 1264 C LEU A 74 -4.339 11.342 10.744 1.00 52.12 C ATOM 1265 O LEU A 74 -3.703 11.739 11.726 1.00 51.24 O ATOM 1266 CB LEU A 74 -5.363 9.020 10.884 1.00 73.03 C ATOM 1267 CG LEU A 74 -6.568 8.080 11.195 1.00 31.12 C ATOM 1268 CD1 LEU A 74 -6.196 6.596 10.960 1.00 73.50 C ATOM 1269 CD2 LEU A 74 -7.110 8.322 12.622 1.00 0.24 C ATOM 0 H LEU A 74 -6.855 10.150 9.234 1.00 63.21 H new ATOM 0 HA LEU A 74 -6.076 10.805 11.893 1.00 33.11 H new ATOM 0 HB2 LEU A 74 -4.980 8.769 9.895 1.00 73.03 H new ATOM 0 HB3 LEU A 74 -4.568 8.804 11.598 1.00 73.03 H new ATOM 0 HG LEU A 74 -7.372 8.322 10.500 1.00 31.12 H new ATOM 0 HD11 LEU A 74 -7.056 5.965 11.185 1.00 73.50 H new ATOM 0 HD12 LEU A 74 -5.905 6.454 9.919 1.00 73.50 H new ATOM 0 HD13 LEU A 74 -5.365 6.322 11.610 1.00 73.50 H new ATOM 0 HD21 LEU A 74 -7.949 7.653 12.811 1.00 0.24 H new ATOM 0 HD22 LEU A 74 -6.321 8.128 13.349 1.00 0.24 H new ATOM 0 HD23 LEU A 74 -7.442 9.356 12.714 1.00 0.24 H new ATOM 1281 N GLY A 75 -3.974 11.584 9.477 1.00 43.31 N ATOM 1282 CA GLY A 75 -2.810 12.386 9.123 1.00 30.12 C ATOM 1283 C GLY A 75 -1.484 11.647 9.281 1.00 3.12 C ATOM 1284 O GLY A 75 -0.739 11.898 10.232 1.00 31.21 O ATOM 0 H GLY A 75 -4.485 11.224 8.671 1.00 43.31 H new ATOM 0 HA2 GLY A 75 -2.910 12.718 8.090 1.00 30.12 H new ATOM 0 HA3 GLY A 75 -2.793 13.281 9.745 1.00 30.12 H new ATOM 1288 N TYR A 76 -1.201 10.722 8.349 1.00 62.44 N ATOM 1289 CA TYR A 76 0.127 10.093 8.207 1.00 31.03 C ATOM 1290 C TYR A 76 0.330 9.582 6.762 1.00 3.21 C ATOM 1291 O TYR A 76 -0.572 9.692 5.916 1.00 4.11 O ATOM 1292 CB TYR A 76 0.380 8.985 9.280 1.00 13.24 C ATOM 1293 CG TYR A 76 -0.650 7.841 9.346 1.00 52.01 C ATOM 1294 CD1 TYR A 76 -0.629 6.791 8.425 1.00 73.52 C ATOM 1295 CD2 TYR A 76 -1.631 7.804 10.344 1.00 15.21 C ATOM 1296 CE1 TYR A 76 -1.545 5.765 8.488 1.00 3.43 C ATOM 1297 CE2 TYR A 76 -2.548 6.773 10.405 1.00 12.42 C ATOM 1298 CZ TYR A 76 -2.499 5.760 9.478 1.00 13.34 C ATOM 1299 OH TYR A 76 -3.432 4.749 9.519 1.00 62.44 O ATOM 0 H TYR A 76 -1.886 10.387 7.671 1.00 62.44 H new ATOM 0 HA TYR A 76 0.882 10.856 8.396 1.00 31.03 H new ATOM 0 HB2 TYR A 76 1.362 8.549 9.095 1.00 13.24 H new ATOM 0 HB3 TYR A 76 0.422 9.462 10.259 1.00 13.24 H new ATOM 0 HD1 TYR A 76 0.121 6.784 7.648 1.00 73.52 H new ATOM 0 HD2 TYR A 76 -1.671 8.595 11.078 1.00 15.21 H new ATOM 0 HE1 TYR A 76 -1.514 4.966 7.762 1.00 3.43 H new ATOM 0 HE2 TYR A 76 -3.301 6.763 11.179 1.00 12.42 H new ATOM 0 HH TYR A 76 -3.952 4.817 10.347 1.00 62.44 H new ATOM 1309 N LYS A 77 1.530 9.031 6.502 1.00 12.03 N ATOM 1310 CA LYS A 77 1.995 8.668 5.149 1.00 52.12 C ATOM 1311 C LYS A 77 1.580 7.240 4.775 1.00 74.34 C ATOM 1312 O LYS A 77 1.697 6.325 5.589 1.00 3.52 O ATOM 1313 CB LYS A 77 3.543 8.805 5.088 1.00 51.40 C ATOM 1314 CG LYS A 77 4.057 10.237 5.332 1.00 54.01 C ATOM 1315 CD LYS A 77 3.670 11.223 4.208 1.00 55.52 C ATOM 1316 CE LYS A 77 4.168 12.643 4.495 1.00 34.31 C ATOM 1317 NZ LYS A 77 3.773 13.599 3.428 1.00 65.40 N ATOM 0 H LYS A 77 2.211 8.823 7.232 1.00 12.03 H new ATOM 0 HA LYS A 77 1.531 9.345 4.431 1.00 52.12 H new ATOM 0 HB2 LYS A 77 3.986 8.140 5.830 1.00 51.40 H new ATOM 0 HB3 LYS A 77 3.889 8.468 4.111 1.00 51.40 H new ATOM 0 HG2 LYS A 77 3.660 10.602 6.279 1.00 54.01 H new ATOM 0 HG3 LYS A 77 5.142 10.215 5.429 1.00 54.01 H new ATOM 0 HD2 LYS A 77 4.087 10.877 3.262 1.00 55.52 H new ATOM 0 HD3 LYS A 77 2.586 11.235 4.093 1.00 55.52 H new ATOM 0 HE2 LYS A 77 3.768 12.981 5.451 1.00 34.31 H new ATOM 0 HE3 LYS A 77 5.254 12.634 4.590 1.00 34.31 H new ATOM 0 HZ1 LYS A 77 4.130 14.547 3.662 1.00 65.40 H new ATOM 0 HZ2 LYS A 77 4.176 13.292 2.520 1.00 65.40 H new ATOM 0 HZ3 LYS A 77 2.736 13.628 3.354 1.00 65.40 H new ATOM 1331 N VAL A 78 1.065 7.082 3.536 1.00 52.31 N ATOM 1332 CA VAL A 78 0.796 5.769 2.909 1.00 63.11 C ATOM 1333 C VAL A 78 1.237 5.823 1.430 1.00 61.45 C ATOM 1334 O VAL A 78 0.887 6.765 0.707 1.00 72.20 O ATOM 1335 CB VAL A 78 -0.721 5.331 2.985 1.00 74.12 C ATOM 1336 CG1 VAL A 78 -0.916 3.916 2.390 1.00 51.41 C ATOM 1337 CG2 VAL A 78 -1.264 5.396 4.428 1.00 64.24 C ATOM 0 H VAL A 78 0.822 7.871 2.937 1.00 52.31 H new ATOM 0 HA VAL A 78 1.363 5.025 3.469 1.00 63.11 H new ATOM 0 HB VAL A 78 -1.294 6.039 2.387 1.00 74.12 H new ATOM 0 HG11 VAL A 78 -1.968 3.636 2.453 1.00 51.41 H new ATOM 0 HG12 VAL A 78 -0.602 3.914 1.346 1.00 51.41 H new ATOM 0 HG13 VAL A 78 -0.316 3.200 2.951 1.00 51.41 H new ATOM 0 HG21 VAL A 78 -2.309 5.087 4.438 1.00 64.24 H new ATOM 0 HG22 VAL A 78 -0.683 4.730 5.066 1.00 64.24 H new ATOM 0 HG23 VAL A 78 -1.184 6.417 4.801 1.00 64.24 H new ATOM 1347 N PHE A 79 2.000 4.803 0.996 1.00 20.24 N ATOM 1348 CA PHE A 79 2.533 4.699 -0.374 1.00 5.53 C ATOM 1349 C PHE A 79 1.888 3.485 -1.056 1.00 32.53 C ATOM 1350 O PHE A 79 2.207 2.350 -0.712 1.00 33.31 O ATOM 1351 CB PHE A 79 4.077 4.528 -0.314 1.00 70.31 C ATOM 1352 CG PHE A 79 4.802 5.642 0.442 1.00 55.22 C ATOM 1353 CD1 PHE A 79 5.108 6.845 -0.186 1.00 72.14 C ATOM 1354 CD2 PHE A 79 5.167 5.489 1.781 1.00 21.42 C ATOM 1355 CE1 PHE A 79 5.744 7.861 0.499 1.00 52.55 C ATOM 1356 CE2 PHE A 79 5.808 6.505 2.462 1.00 10.33 C ATOM 1357 CZ PHE A 79 6.097 7.689 1.819 1.00 42.14 C ATOM 0 H PHE A 79 2.266 4.020 1.593 1.00 20.24 H new ATOM 0 HA PHE A 79 2.304 5.600 -0.942 1.00 5.53 H new ATOM 0 HB2 PHE A 79 4.307 3.573 0.159 1.00 70.31 H new ATOM 0 HB3 PHE A 79 4.466 4.482 -1.331 1.00 70.31 H new ATOM 0 HD1 PHE A 79 4.844 6.986 -1.224 1.00 72.14 H new ATOM 0 HD2 PHE A 79 4.945 4.563 2.291 1.00 21.42 H new ATOM 0 HE1 PHE A 79 5.965 8.792 -0.001 1.00 52.55 H new ATOM 0 HE2 PHE A 79 6.083 6.372 3.498 1.00 10.33 H new ATOM 0 HZ PHE A 79 6.601 8.483 2.351 1.00 42.14 H new ATOM 1367 N LEU A 80 0.994 3.723 -2.024 1.00 43.50 N ATOM 1368 CA LEU A 80 0.203 2.650 -2.659 1.00 50.35 C ATOM 1369 C LEU A 80 0.803 2.240 -4.017 1.00 63.01 C ATOM 1370 O LEU A 80 1.164 3.083 -4.831 1.00 61.20 O ATOM 1371 CB LEU A 80 -1.286 3.083 -2.815 1.00 54.03 C ATOM 1372 CG LEU A 80 -2.237 2.077 -3.566 1.00 14.40 C ATOM 1373 CD1 LEU A 80 -2.201 0.661 -2.953 1.00 10.54 C ATOM 1374 CD2 LEU A 80 -3.683 2.622 -3.639 1.00 4.15 C ATOM 0 H LEU A 80 0.796 4.654 -2.390 1.00 43.50 H new ATOM 0 HA LEU A 80 0.239 1.777 -2.007 1.00 50.35 H new ATOM 0 HB2 LEU A 80 -1.695 3.261 -1.821 1.00 54.03 H new ATOM 0 HB3 LEU A 80 -1.310 4.035 -3.345 1.00 54.03 H new ATOM 0 HG LEU A 80 -1.858 1.986 -4.584 1.00 14.40 H new ATOM 0 HD11 LEU A 80 -2.874 0.007 -3.508 1.00 10.54 H new ATOM 0 HD12 LEU A 80 -1.186 0.267 -3.007 1.00 10.54 H new ATOM 0 HD13 LEU A 80 -2.517 0.707 -1.911 1.00 10.54 H new ATOM 0 HD21 LEU A 80 -4.316 1.906 -4.163 1.00 4.15 H new ATOM 0 HD22 LEU A 80 -4.066 2.774 -2.630 1.00 4.15 H new ATOM 0 HD23 LEU A 80 -3.688 3.571 -4.176 1.00 4.15 H new ATOM 1386 N LEU A 81 0.902 0.920 -4.229 1.00 52.45 N ATOM 1387 CA LEU A 81 1.300 0.314 -5.506 1.00 4.43 C ATOM 1388 C LEU A 81 0.168 -0.603 -5.991 1.00 33.12 C ATOM 1389 O LEU A 81 -0.415 -1.344 -5.199 1.00 40.33 O ATOM 1390 CB LEU A 81 2.620 -0.486 -5.340 1.00 73.34 C ATOM 1391 CG LEU A 81 3.174 -1.203 -6.619 1.00 41.50 C ATOM 1392 CD1 LEU A 81 3.375 -0.211 -7.782 1.00 34.45 C ATOM 1393 CD2 LEU A 81 4.473 -1.984 -6.295 1.00 45.20 C ATOM 0 H LEU A 81 0.704 0.231 -3.503 1.00 52.45 H new ATOM 0 HA LEU A 81 1.477 1.096 -6.244 1.00 4.43 H new ATOM 0 HB2 LEU A 81 3.387 0.196 -4.973 1.00 73.34 H new ATOM 0 HB3 LEU A 81 2.467 -1.239 -4.567 1.00 73.34 H new ATOM 0 HG LEU A 81 2.428 -1.927 -6.947 1.00 41.50 H new ATOM 0 HD11 LEU A 81 3.760 -0.743 -8.652 1.00 34.45 H new ATOM 0 HD12 LEU A 81 2.421 0.253 -8.033 1.00 34.45 H new ATOM 0 HD13 LEU A 81 4.086 0.560 -7.484 1.00 34.45 H new ATOM 0 HD21 LEU A 81 4.838 -2.473 -7.198 1.00 45.20 H new ATOM 0 HD22 LEU A 81 5.230 -1.293 -5.925 1.00 45.20 H new ATOM 0 HD23 LEU A 81 4.265 -2.736 -5.534 1.00 45.20 H new ATOM 1405 N LEU A 82 -0.134 -0.528 -7.293 1.00 5.12 N ATOM 1406 CA LEU A 82 -1.202 -1.310 -7.942 1.00 34.10 C ATOM 1407 C LEU A 82 -0.588 -2.158 -9.073 1.00 5.11 C ATOM 1408 O LEU A 82 0.162 -1.620 -9.884 1.00 62.03 O ATOM 1409 CB LEU A 82 -2.267 -0.322 -8.502 1.00 4.34 C ATOM 1410 CG LEU A 82 -2.982 0.581 -7.445 1.00 52.55 C ATOM 1411 CD1 LEU A 82 -3.822 1.677 -8.124 1.00 52.34 C ATOM 1412 CD2 LEU A 82 -3.832 -0.257 -6.469 1.00 24.12 C ATOM 0 H LEU A 82 0.363 0.086 -7.938 1.00 5.12 H new ATOM 0 HA LEU A 82 -1.681 -1.981 -7.229 1.00 34.10 H new ATOM 0 HB2 LEU A 82 -1.785 0.323 -9.237 1.00 4.34 H new ATOM 0 HB3 LEU A 82 -3.026 -0.898 -9.032 1.00 4.34 H new ATOM 0 HG LEU A 82 -2.208 1.076 -6.859 1.00 52.55 H new ATOM 0 HD11 LEU A 82 -4.307 2.288 -7.363 1.00 52.34 H new ATOM 0 HD12 LEU A 82 -3.174 2.305 -8.736 1.00 52.34 H new ATOM 0 HD13 LEU A 82 -4.581 1.215 -8.755 1.00 52.34 H new ATOM 0 HD21 LEU A 82 -4.315 0.403 -5.748 1.00 24.12 H new ATOM 0 HD22 LEU A 82 -4.593 -0.804 -7.026 1.00 24.12 H new ATOM 0 HD23 LEU A 82 -3.190 -0.963 -5.942 1.00 24.12 H new ATOM 1424 N ALA A 83 -0.894 -3.474 -9.120 1.00 54.21 N ATOM 1425 CA ALA A 83 -0.372 -4.385 -10.168 1.00 71.44 C ATOM 1426 C ALA A 83 -1.390 -5.497 -10.495 1.00 13.24 C ATOM 1427 O ALA A 83 -1.622 -6.399 -9.684 1.00 55.54 O ATOM 1428 CB ALA A 83 0.971 -4.991 -9.722 1.00 62.31 C ATOM 0 H ALA A 83 -1.503 -3.932 -8.442 1.00 54.21 H new ATOM 0 HA ALA A 83 -0.211 -3.805 -11.077 1.00 71.44 H new ATOM 0 HB1 ALA A 83 1.345 -5.658 -10.499 1.00 62.31 H new ATOM 0 HB2 ALA A 83 1.692 -4.192 -9.552 1.00 62.31 H new ATOM 0 HB3 ALA A 83 0.828 -5.553 -8.799 1.00 62.31 H new ATOM 1434 N ASP A 84 -1.977 -5.426 -11.696 1.00 2.21 N ATOM 1435 CA ASP A 84 -2.979 -6.402 -12.185 1.00 62.13 C ATOM 1436 C ASP A 84 -3.133 -6.247 -13.709 1.00 53.14 C ATOM 1437 O ASP A 84 -2.775 -5.201 -14.273 1.00 21.03 O ATOM 1438 CB ASP A 84 -4.347 -6.214 -11.442 1.00 12.41 C ATOM 1439 CG ASP A 84 -5.507 -7.076 -11.983 1.00 61.10 C ATOM 1440 OD1 ASP A 84 -5.336 -8.308 -12.127 1.00 13.21 O ATOM 1441 OD2 ASP A 84 -6.579 -6.524 -12.296 1.00 30.01 O ATOM 0 H ASP A 84 -1.773 -4.686 -12.367 1.00 2.21 H new ATOM 0 HA ASP A 84 -2.638 -7.415 -11.971 1.00 62.13 H new ATOM 0 HB2 ASP A 84 -4.205 -6.445 -10.386 1.00 12.41 H new ATOM 0 HB3 ASP A 84 -4.635 -5.165 -11.503 1.00 12.41 H new ATOM 1446 N GLN A 85 -3.621 -7.326 -14.349 1.00 64.44 N ATOM 1447 CA GLN A 85 -3.906 -7.391 -15.795 1.00 50.52 C ATOM 1448 C GLN A 85 -4.843 -6.249 -16.247 1.00 35.00 C ATOM 1449 O GLN A 85 -4.635 -5.647 -17.306 1.00 33.32 O ATOM 1450 CB GLN A 85 -4.548 -8.772 -16.103 1.00 11.14 C ATOM 1451 CG GLN A 85 -5.008 -8.978 -17.564 1.00 11.44 C ATOM 1452 CD GLN A 85 -5.907 -10.210 -17.780 1.00 63.22 C ATOM 1453 OE1 GLN A 85 -5.899 -10.825 -18.848 1.00 34.33 O ATOM 1454 NE2 GLN A 85 -6.739 -10.549 -16.798 1.00 4.51 N ATOM 0 H GLN A 85 -3.833 -8.198 -13.864 1.00 64.44 H new ATOM 0 HA GLN A 85 -2.974 -7.272 -16.347 1.00 50.52 H new ATOM 0 HB2 GLN A 85 -3.829 -9.552 -15.853 1.00 11.14 H new ATOM 0 HB3 GLN A 85 -5.407 -8.909 -15.447 1.00 11.14 H new ATOM 0 HG2 GLN A 85 -5.546 -8.089 -17.891 1.00 11.44 H new ATOM 0 HG3 GLN A 85 -4.127 -9.070 -18.200 1.00 11.44 H new ATOM 0 HE21 GLN A 85 -6.732 -10.029 -15.921 1.00 4.51 H new ATOM 0 HE22 GLN A 85 -7.384 -11.329 -16.923 1.00 4.51 H new ATOM 1463 N ASP A 86 -5.866 -5.964 -15.422 1.00 61.33 N ATOM 1464 CA ASP A 86 -6.854 -4.909 -15.704 1.00 55.23 C ATOM 1465 C ASP A 86 -6.242 -3.541 -15.307 1.00 0.51 C ATOM 1466 O ASP A 86 -6.531 -2.981 -14.242 1.00 14.22 O ATOM 1467 CB ASP A 86 -8.204 -5.215 -14.968 1.00 25.44 C ATOM 1468 CG ASP A 86 -9.444 -4.697 -15.718 1.00 54.54 C ATOM 1469 OD1 ASP A 86 -9.574 -4.982 -16.923 1.00 52.40 O ATOM 1470 OD2 ASP A 86 -10.308 -4.044 -15.114 1.00 63.41 O ATOM 0 H ASP A 86 -6.030 -6.457 -14.544 1.00 61.33 H new ATOM 0 HA ASP A 86 -7.091 -4.875 -16.767 1.00 55.23 H new ATOM 0 HB2 ASP A 86 -8.297 -6.292 -14.829 1.00 25.44 H new ATOM 0 HB3 ASP A 86 -8.177 -4.767 -13.975 1.00 25.44 H new ATOM 1475 N GLU A 87 -5.335 -3.057 -16.181 1.00 32.24 N ATOM 1476 CA GLU A 87 -4.458 -1.889 -15.920 1.00 22.35 C ATOM 1477 C GLU A 87 -5.246 -0.568 -15.786 1.00 43.15 C ATOM 1478 O GLU A 87 -4.952 0.238 -14.917 1.00 51.54 O ATOM 1479 CB GLU A 87 -3.357 -1.763 -17.032 1.00 52.41 C ATOM 1480 CG GLU A 87 -3.824 -1.299 -18.439 1.00 1.10 C ATOM 1481 CD GLU A 87 -4.853 -2.222 -19.113 1.00 52.32 C ATOM 1482 OE1 GLU A 87 -4.476 -3.331 -19.533 1.00 42.42 O ATOM 1483 OE2 GLU A 87 -6.045 -1.851 -19.213 1.00 71.43 O ATOM 0 H GLU A 87 -5.187 -3.470 -17.102 1.00 32.24 H new ATOM 0 HA GLU A 87 -3.976 -2.068 -14.959 1.00 22.35 H new ATOM 0 HB2 GLU A 87 -2.598 -1.064 -16.680 1.00 52.41 H new ATOM 0 HB3 GLU A 87 -2.872 -2.733 -17.139 1.00 52.41 H new ATOM 0 HG2 GLU A 87 -4.253 -0.301 -18.353 1.00 1.10 H new ATOM 0 HG3 GLU A 87 -2.952 -1.216 -19.087 1.00 1.10 H new ATOM 1490 N ASN A 88 -6.279 -0.393 -16.627 1.00 63.41 N ATOM 1491 CA ASN A 88 -7.016 0.884 -16.740 1.00 44.41 C ATOM 1492 C ASN A 88 -7.973 1.056 -15.542 1.00 52.43 C ATOM 1493 O ASN A 88 -8.343 2.175 -15.191 1.00 40.31 O ATOM 1494 CB ASN A 88 -7.763 0.961 -18.093 1.00 61.14 C ATOM 1495 CG ASN A 88 -8.313 2.354 -18.395 1.00 63.41 C ATOM 1496 OD1 ASN A 88 -9.462 2.661 -18.083 1.00 71.11 O ATOM 1497 ND2 ASN A 88 -7.489 3.217 -18.976 1.00 2.42 N ATOM 0 H ASN A 88 -6.628 -1.125 -17.245 1.00 63.41 H new ATOM 0 HA ASN A 88 -6.305 1.710 -16.715 1.00 44.41 H new ATOM 0 HB2 ASN A 88 -7.085 0.663 -18.893 1.00 61.14 H new ATOM 0 HB3 ASN A 88 -8.585 0.245 -18.089 1.00 61.14 H new ATOM 0 HD21 ASN A 88 -7.803 4.167 -19.176 1.00 2.42 H new ATOM 0 HD22 ASN A 88 -6.541 2.931 -19.222 1.00 2.42 H new ATOM 1504 N GLU A 89 -8.337 -0.085 -14.916 1.00 22.41 N ATOM 1505 CA GLU A 89 -9.080 -0.125 -13.640 1.00 2.34 C ATOM 1506 C GLU A 89 -8.236 0.515 -12.526 1.00 64.20 C ATOM 1507 O GLU A 89 -8.716 1.355 -11.756 1.00 21.12 O ATOM 1508 CB GLU A 89 -9.388 -1.602 -13.265 1.00 41.41 C ATOM 1509 CG GLU A 89 -10.160 -1.826 -11.947 1.00 61.20 C ATOM 1510 CD GLU A 89 -11.626 -1.364 -12.017 1.00 0.54 C ATOM 1511 OE1 GLU A 89 -11.897 -0.162 -11.821 1.00 31.02 O ATOM 1512 OE2 GLU A 89 -12.520 -2.204 -12.250 1.00 12.21 O ATOM 0 H GLU A 89 -8.121 -1.011 -15.286 1.00 22.41 H new ATOM 0 HA GLU A 89 -10.013 0.428 -13.751 1.00 2.34 H new ATOM 0 HB2 GLU A 89 -9.961 -2.049 -14.077 1.00 41.41 H new ATOM 0 HB3 GLU A 89 -8.444 -2.144 -13.205 1.00 41.41 H new ATOM 0 HG2 GLU A 89 -10.132 -2.885 -11.692 1.00 61.20 H new ATOM 0 HG3 GLU A 89 -9.655 -1.291 -11.142 1.00 61.20 H new ATOM 1519 N LEU A 90 -6.959 0.090 -12.479 1.00 22.53 N ATOM 1520 CA LEU A 90 -5.977 0.564 -11.495 1.00 12.31 C ATOM 1521 C LEU A 90 -5.533 2.001 -11.805 1.00 40.33 C ATOM 1522 O LEU A 90 -5.200 2.756 -10.900 1.00 64.43 O ATOM 1523 CB LEU A 90 -4.738 -0.357 -11.481 1.00 61.33 C ATOM 1524 CG LEU A 90 -4.981 -1.855 -11.159 1.00 50.02 C ATOM 1525 CD1 LEU A 90 -3.653 -2.626 -11.264 1.00 20.43 C ATOM 1526 CD2 LEU A 90 -5.652 -2.046 -9.775 1.00 53.10 C ATOM 0 H LEU A 90 -6.580 -0.598 -13.130 1.00 22.53 H new ATOM 0 HA LEU A 90 -6.457 0.545 -10.516 1.00 12.31 H new ATOM 0 HB2 LEU A 90 -4.257 -0.293 -12.457 1.00 61.33 H new ATOM 0 HB3 LEU A 90 -4.031 0.037 -10.751 1.00 61.33 H new ATOM 0 HG LEU A 90 -5.678 -2.261 -11.892 1.00 50.02 H new ATOM 0 HD11 LEU A 90 -3.824 -3.678 -11.038 1.00 20.43 H new ATOM 0 HD12 LEU A 90 -3.257 -2.532 -12.275 1.00 20.43 H new ATOM 0 HD13 LEU A 90 -2.936 -2.214 -10.554 1.00 20.43 H new ATOM 0 HD21 LEU A 90 -5.805 -3.109 -9.588 1.00 53.10 H new ATOM 0 HD22 LEU A 90 -5.010 -1.630 -8.999 1.00 53.10 H new ATOM 0 HD23 LEU A 90 -6.614 -1.534 -9.763 1.00 53.10 H new ATOM 1538 N GLU A 91 -5.520 2.346 -13.103 1.00 41.32 N ATOM 1539 CA GLU A 91 -5.151 3.684 -13.582 1.00 3.01 C ATOM 1540 C GLU A 91 -6.206 4.701 -13.133 1.00 12.42 C ATOM 1541 O GLU A 91 -5.873 5.786 -12.674 1.00 12.51 O ATOM 1542 CB GLU A 91 -5.003 3.690 -15.126 1.00 64.30 C ATOM 1543 CG GLU A 91 -4.619 5.056 -15.721 1.00 14.25 C ATOM 1544 CD GLU A 91 -4.377 5.014 -17.232 1.00 50.35 C ATOM 1545 OE1 GLU A 91 -5.361 5.085 -17.995 1.00 72.22 O ATOM 1546 OE2 GLU A 91 -3.210 4.913 -17.657 1.00 1.33 O ATOM 0 H GLU A 91 -5.767 1.699 -13.852 1.00 41.32 H new ATOM 0 HA GLU A 91 -4.188 3.962 -13.153 1.00 3.01 H new ATOM 0 HB2 GLU A 91 -4.247 2.958 -15.409 1.00 64.30 H new ATOM 0 HB3 GLU A 91 -5.944 3.365 -15.571 1.00 64.30 H new ATOM 0 HG2 GLU A 91 -5.412 5.773 -15.507 1.00 14.25 H new ATOM 0 HG3 GLU A 91 -3.718 5.419 -15.226 1.00 14.25 H new ATOM 1553 N GLU A 92 -7.479 4.295 -13.231 1.00 60.21 N ATOM 1554 CA GLU A 92 -8.628 5.109 -12.804 1.00 71.14 C ATOM 1555 C GLU A 92 -8.624 5.246 -11.260 1.00 24.42 C ATOM 1556 O GLU A 92 -8.900 6.319 -10.712 1.00 65.11 O ATOM 1557 CB GLU A 92 -9.946 4.435 -13.314 1.00 2.23 C ATOM 1558 CG GLU A 92 -11.066 5.397 -13.768 1.00 10.40 C ATOM 1559 CD GLU A 92 -11.560 6.348 -12.671 1.00 20.31 C ATOM 1560 OE1 GLU A 92 -12.309 5.902 -11.784 1.00 70.51 O ATOM 1561 OE2 GLU A 92 -11.184 7.535 -12.678 1.00 23.44 O ATOM 0 H GLU A 92 -7.744 3.386 -13.611 1.00 60.21 H new ATOM 0 HA GLU A 92 -8.563 6.110 -13.229 1.00 71.14 H new ATOM 0 HB2 GLU A 92 -9.696 3.780 -14.149 1.00 2.23 H new ATOM 0 HB3 GLU A 92 -10.338 3.802 -12.518 1.00 2.23 H new ATOM 0 HG2 GLU A 92 -10.703 5.988 -14.609 1.00 10.40 H new ATOM 0 HG3 GLU A 92 -11.909 4.810 -14.131 1.00 10.40 H new ATOM 1568 N PHE A 93 -8.293 4.126 -10.594 1.00 62.32 N ATOM 1569 CA PHE A 93 -8.222 4.023 -9.124 1.00 33.43 C ATOM 1570 C PHE A 93 -7.172 4.987 -8.538 1.00 3.01 C ATOM 1571 O PHE A 93 -7.477 5.770 -7.626 1.00 71.01 O ATOM 1572 CB PHE A 93 -7.891 2.558 -8.719 1.00 12.42 C ATOM 1573 CG PHE A 93 -8.077 2.256 -7.230 1.00 60.02 C ATOM 1574 CD1 PHE A 93 -9.352 2.282 -6.666 1.00 30.25 C ATOM 1575 CD2 PHE A 93 -6.998 1.950 -6.397 1.00 62.40 C ATOM 1576 CE1 PHE A 93 -9.537 2.010 -5.330 1.00 23.30 C ATOM 1577 CE2 PHE A 93 -7.191 1.676 -5.056 1.00 43.34 C ATOM 1578 CZ PHE A 93 -8.459 1.711 -4.525 1.00 52.14 C ATOM 0 H PHE A 93 -8.064 3.253 -11.068 1.00 62.32 H new ATOM 0 HA PHE A 93 -9.192 4.306 -8.716 1.00 33.43 H new ATOM 0 HB2 PHE A 93 -8.523 1.883 -9.296 1.00 12.42 H new ATOM 0 HB3 PHE A 93 -6.859 2.342 -8.995 1.00 12.42 H new ATOM 0 HD1 PHE A 93 -10.205 2.518 -7.285 1.00 30.25 H new ATOM 0 HD2 PHE A 93 -5.999 1.927 -6.807 1.00 62.40 H new ATOM 0 HE1 PHE A 93 -10.532 2.031 -4.910 1.00 23.30 H new ATOM 0 HE2 PHE A 93 -6.347 1.435 -4.426 1.00 43.34 H new ATOM 0 HZ PHE A 93 -8.610 1.504 -3.476 1.00 52.14 H new ATOM 1588 N LYS A 94 -5.947 4.949 -9.113 1.00 24.52 N ATOM 1589 CA LYS A 94 -4.785 5.714 -8.608 1.00 51.23 C ATOM 1590 C LYS A 94 -4.988 7.226 -8.767 1.00 54.34 C ATOM 1591 O LYS A 94 -4.330 8.005 -8.092 1.00 2.54 O ATOM 1592 CB LYS A 94 -3.433 5.222 -9.253 1.00 1.32 C ATOM 1593 CG LYS A 94 -3.240 5.362 -10.792 1.00 22.12 C ATOM 1594 CD LYS A 94 -2.889 6.796 -11.280 1.00 33.03 C ATOM 1595 CE LYS A 94 -1.616 7.370 -10.630 1.00 62.14 C ATOM 1596 NZ LYS A 94 -1.409 8.795 -11.008 1.00 43.11 N ATOM 0 H LYS A 94 -5.738 4.388 -9.939 1.00 24.52 H new ATOM 0 HA LYS A 94 -4.710 5.518 -7.538 1.00 51.23 H new ATOM 0 HB2 LYS A 94 -2.620 5.763 -8.768 1.00 1.32 H new ATOM 0 HB3 LYS A 94 -3.311 4.169 -9.000 1.00 1.32 H new ATOM 0 HG2 LYS A 94 -2.448 4.683 -11.107 1.00 22.12 H new ATOM 0 HG3 LYS A 94 -4.154 5.038 -11.289 1.00 22.12 H new ATOM 0 HD2 LYS A 94 -2.760 6.782 -12.362 1.00 33.03 H new ATOM 0 HD3 LYS A 94 -3.727 7.459 -11.067 1.00 33.03 H new ATOM 0 HE2 LYS A 94 -1.690 7.287 -9.546 1.00 62.14 H new ATOM 0 HE3 LYS A 94 -0.752 6.781 -10.937 1.00 62.14 H new ATOM 0 HZ1 LYS A 94 -0.620 8.864 -11.682 1.00 43.11 H new ATOM 0 HZ2 LYS A 94 -2.275 9.167 -11.449 1.00 43.11 H new ATOM 0 HZ3 LYS A 94 -1.187 9.351 -10.158 1.00 43.11 H new ATOM 1610 N ARG A 95 -5.889 7.623 -9.688 1.00 61.12 N ATOM 1611 CA ARG A 95 -6.295 9.032 -9.865 1.00 21.14 C ATOM 1612 C ARG A 95 -6.989 9.543 -8.590 1.00 24.10 C ATOM 1613 O ARG A 95 -6.661 10.608 -8.088 1.00 40.15 O ATOM 1614 CB ARG A 95 -7.255 9.176 -11.084 1.00 10.11 C ATOM 1615 CG ARG A 95 -6.629 8.794 -12.438 1.00 74.44 C ATOM 1616 CD ARG A 95 -7.642 8.817 -13.592 1.00 11.14 C ATOM 1617 NE ARG A 95 -7.139 8.115 -14.784 1.00 71.22 N ATOM 1618 CZ ARG A 95 -7.905 7.491 -15.687 1.00 44.33 C ATOM 1619 NH1 ARG A 95 -9.234 7.489 -15.557 1.00 5.32 N ATOM 1620 NH2 ARG A 95 -7.351 6.855 -16.721 1.00 15.22 N ATOM 0 H ARG A 95 -6.354 6.979 -10.328 1.00 61.12 H new ATOM 0 HA ARG A 95 -5.402 9.629 -10.052 1.00 21.14 H new ATOM 0 HB2 ARG A 95 -8.133 8.552 -10.915 1.00 10.11 H new ATOM 0 HB3 ARG A 95 -7.603 10.208 -11.137 1.00 10.11 H new ATOM 0 HG2 ARG A 95 -5.814 9.482 -12.663 1.00 74.44 H new ATOM 0 HG3 ARG A 95 -6.194 7.798 -12.363 1.00 74.44 H new ATOM 0 HD2 ARG A 95 -8.573 8.355 -13.265 1.00 11.14 H new ATOM 0 HD3 ARG A 95 -7.873 9.850 -13.851 1.00 11.14 H new ATOM 0 HE ARG A 95 -6.130 8.103 -14.933 1.00 71.22 H new ATOM 0 HH11 ARG A 95 -9.670 7.964 -14.767 1.00 5.32 H new ATOM 0 HH12 ARG A 95 -9.813 7.012 -16.248 1.00 5.32 H new ATOM 0 HH21 ARG A 95 -6.337 6.842 -16.828 1.00 15.22 H new ATOM 0 HH22 ARG A 95 -7.942 6.382 -17.405 1.00 15.22 H new ATOM 1634 N LYS A 96 -7.924 8.729 -8.074 1.00 72.22 N ATOM 1635 CA LYS A 96 -8.745 9.051 -6.887 1.00 43.23 C ATOM 1636 C LYS A 96 -7.914 8.970 -5.595 1.00 11.34 C ATOM 1637 O LYS A 96 -8.189 9.689 -4.629 1.00 42.23 O ATOM 1638 CB LYS A 96 -9.995 8.102 -6.816 1.00 51.11 C ATOM 1639 CG LYS A 96 -11.198 8.532 -7.703 1.00 23.43 C ATOM 1640 CD LYS A 96 -10.821 8.766 -9.185 1.00 54.10 C ATOM 1641 CE LYS A 96 -11.994 9.289 -10.030 1.00 12.41 C ATOM 1642 NZ LYS A 96 -13.040 8.256 -10.217 1.00 40.32 N ATOM 0 H LYS A 96 -8.137 7.815 -8.473 1.00 72.22 H new ATOM 0 HA LYS A 96 -9.097 10.078 -6.984 1.00 43.23 H new ATOM 0 HB2 LYS A 96 -9.687 7.098 -7.109 1.00 51.11 H new ATOM 0 HB3 LYS A 96 -10.329 8.043 -5.780 1.00 51.11 H new ATOM 0 HG2 LYS A 96 -11.971 7.765 -7.650 1.00 23.43 H new ATOM 0 HG3 LYS A 96 -11.629 9.447 -7.297 1.00 23.43 H new ATOM 0 HD2 LYS A 96 -9.998 9.479 -9.236 1.00 54.10 H new ATOM 0 HD3 LYS A 96 -10.460 7.831 -9.614 1.00 54.10 H new ATOM 0 HE2 LYS A 96 -12.429 10.164 -9.546 1.00 12.41 H new ATOM 0 HE3 LYS A 96 -11.625 9.613 -11.003 1.00 12.41 H new ATOM 0 HZ1 LYS A 96 -13.790 8.629 -10.834 1.00 40.32 H new ATOM 0 HZ2 LYS A 96 -12.620 7.412 -10.655 1.00 40.32 H new ATOM 0 HZ3 LYS A 96 -13.446 8.002 -9.294 1.00 40.32 H new ATOM 1656 N ILE A 97 -6.891 8.098 -5.592 1.00 15.12 N ATOM 1657 CA ILE A 97 -5.959 7.959 -4.457 1.00 52.01 C ATOM 1658 C ILE A 97 -4.995 9.170 -4.415 1.00 22.02 C ATOM 1659 O ILE A 97 -4.667 9.692 -3.338 1.00 72.31 O ATOM 1660 CB ILE A 97 -5.160 6.605 -4.551 1.00 43.33 C ATOM 1661 CG1 ILE A 97 -6.137 5.384 -4.675 1.00 52.21 C ATOM 1662 CG2 ILE A 97 -4.194 6.427 -3.355 1.00 33.52 C ATOM 1663 CD1 ILE A 97 -7.174 5.237 -3.561 1.00 31.41 C ATOM 0 H ILE A 97 -6.687 7.472 -6.371 1.00 15.12 H new ATOM 0 HA ILE A 97 -6.534 7.940 -3.531 1.00 52.01 H new ATOM 0 HB ILE A 97 -4.553 6.645 -5.455 1.00 43.33 H new ATOM 0 HG12 ILE A 97 -6.664 5.461 -5.626 1.00 52.21 H new ATOM 0 HG13 ILE A 97 -5.542 4.471 -4.713 1.00 52.21 H new ATOM 0 HG21 ILE A 97 -3.661 5.482 -3.455 1.00 33.52 H new ATOM 0 HG22 ILE A 97 -3.477 7.248 -3.341 1.00 33.52 H new ATOM 0 HG23 ILE A 97 -4.763 6.426 -2.425 1.00 33.52 H new ATOM 0 HD11 ILE A 97 -7.792 4.360 -3.753 1.00 31.41 H new ATOM 0 HD12 ILE A 97 -6.666 5.120 -2.604 1.00 31.41 H new ATOM 0 HD13 ILE A 97 -7.804 6.126 -3.531 1.00 31.41 H new ATOM 1675 N GLU A 98 -4.588 9.623 -5.613 1.00 55.21 N ATOM 1676 CA GLU A 98 -3.736 10.814 -5.804 1.00 0.22 C ATOM 1677 C GLU A 98 -4.541 12.107 -5.517 1.00 61.42 C ATOM 1678 O GLU A 98 -3.987 13.096 -5.032 1.00 32.24 O ATOM 1679 CB GLU A 98 -3.179 10.813 -7.256 1.00 44.30 C ATOM 1680 CG GLU A 98 -2.146 11.904 -7.571 1.00 55.51 C ATOM 1681 CD GLU A 98 -1.706 11.878 -9.041 1.00 42.12 C ATOM 1682 OE1 GLU A 98 -0.774 11.117 -9.388 1.00 30.12 O ATOM 1683 OE2 GLU A 98 -2.317 12.592 -9.867 1.00 62.01 O ATOM 0 H GLU A 98 -4.844 9.168 -6.489 1.00 55.21 H new ATOM 0 HA GLU A 98 -2.901 10.783 -5.104 1.00 0.22 H new ATOM 0 HB2 GLU A 98 -2.726 9.841 -7.451 1.00 44.30 H new ATOM 0 HB3 GLU A 98 -4.015 10.919 -7.947 1.00 44.30 H new ATOM 0 HG2 GLU A 98 -2.569 12.881 -7.337 1.00 55.51 H new ATOM 0 HG3 GLU A 98 -1.274 11.773 -6.930 1.00 55.51 H new ATOM 1690 N SER A 99 -5.862 12.064 -5.802 1.00 72.33 N ATOM 1691 CA SER A 99 -6.792 13.172 -5.506 1.00 23.53 C ATOM 1692 C SER A 99 -6.976 13.333 -3.983 1.00 43.23 C ATOM 1693 O SER A 99 -7.142 14.451 -3.488 1.00 10.43 O ATOM 1694 CB SER A 99 -8.156 12.947 -6.200 1.00 63.33 C ATOM 1695 OG SER A 99 -8.021 12.933 -7.618 1.00 74.31 O ATOM 0 H SER A 99 -6.311 11.261 -6.243 1.00 72.33 H new ATOM 0 HA SER A 99 -6.360 14.092 -5.899 1.00 23.53 H new ATOM 0 HB2 SER A 99 -8.585 12.003 -5.864 1.00 63.33 H new ATOM 0 HB3 SER A 99 -8.850 13.735 -5.907 1.00 63.33 H new ATOM 0 HG SER A 99 -7.430 12.197 -7.883 1.00 74.31 H new ATOM 1701 N GLN A 100 -6.946 12.195 -3.248 1.00 34.50 N ATOM 1702 CA GLN A 100 -6.932 12.199 -1.767 1.00 71.14 C ATOM 1703 C GLN A 100 -5.612 12.805 -1.237 1.00 71.12 C ATOM 1704 O GLN A 100 -5.585 13.400 -0.158 1.00 52.41 O ATOM 1705 CB GLN A 100 -7.110 10.759 -1.201 1.00 24.21 C ATOM 1706 CG GLN A 100 -8.504 10.132 -1.401 1.00 62.21 C ATOM 1707 CD GLN A 100 -8.607 8.725 -0.806 1.00 42.32 C ATOM 1708 OE1 GLN A 100 -8.959 8.552 0.354 1.00 44.35 O ATOM 1709 NE2 GLN A 100 -8.272 7.713 -1.590 1.00 5.22 N ATOM 0 H GLN A 100 -6.931 11.262 -3.659 1.00 34.50 H new ATOM 0 HA GLN A 100 -7.768 12.812 -1.431 1.00 71.14 H new ATOM 0 HB2 GLN A 100 -6.369 10.110 -1.668 1.00 24.21 H new ATOM 0 HB3 GLN A 100 -6.890 10.778 -0.134 1.00 24.21 H new ATOM 0 HG2 GLN A 100 -9.256 10.773 -0.941 1.00 62.21 H new ATOM 0 HG3 GLN A 100 -8.730 10.089 -2.466 1.00 62.21 H new ATOM 0 HE21 GLN A 100 -7.983 7.888 -2.552 1.00 5.22 H new ATOM 0 HE22 GLN A 100 -8.303 6.758 -1.232 1.00 5.22 H new ATOM 1718 N GLY A 101 -4.535 12.682 -2.033 1.00 2.53 N ATOM 1719 CA GLY A 101 -3.221 13.233 -1.691 1.00 1.44 C ATOM 1720 C GLY A 101 -2.251 12.169 -1.195 1.00 43.22 C ATOM 1721 O GLY A 101 -1.467 12.420 -0.272 1.00 61.35 O ATOM 0 H GLY A 101 -4.556 12.197 -2.930 1.00 2.53 H new ATOM 0 HA2 GLY A 101 -2.798 13.725 -2.567 1.00 1.44 H new ATOM 0 HA3 GLY A 101 -3.340 13.997 -0.923 1.00 1.44 H new ATOM 1725 N TYR A 102 -2.314 10.964 -1.791 1.00 71.24 N ATOM 1726 CA TYR A 102 -1.371 9.865 -1.484 1.00 73.44 C ATOM 1727 C TYR A 102 -0.430 9.614 -2.660 1.00 53.05 C ATOM 1728 O TYR A 102 -0.818 9.776 -3.830 1.00 21.31 O ATOM 1729 CB TYR A 102 -2.127 8.558 -1.135 1.00 34.32 C ATOM 1730 CG TYR A 102 -2.895 8.645 0.180 1.00 51.35 C ATOM 1731 CD1 TYR A 102 -2.228 8.507 1.402 1.00 71.42 C ATOM 1732 CD2 TYR A 102 -4.266 8.904 0.205 1.00 51.01 C ATOM 1733 CE1 TYR A 102 -2.903 8.618 2.593 1.00 74.23 C ATOM 1734 CE2 TYR A 102 -4.939 9.025 1.401 1.00 62.12 C ATOM 1735 CZ TYR A 102 -4.253 8.880 2.585 1.00 4.31 C ATOM 1736 OH TYR A 102 -4.916 9.012 3.771 1.00 41.32 O ATOM 0 H TYR A 102 -3.013 10.723 -2.494 1.00 71.24 H new ATOM 0 HA TYR A 102 -0.785 10.171 -0.617 1.00 73.44 H new ATOM 0 HB2 TYR A 102 -2.822 8.321 -1.940 1.00 34.32 H new ATOM 0 HB3 TYR A 102 -1.413 7.736 -1.078 1.00 34.32 H new ATOM 0 HD1 TYR A 102 -1.166 8.310 1.409 1.00 71.42 H new ATOM 0 HD2 TYR A 102 -4.806 9.011 -0.724 1.00 51.01 H new ATOM 0 HE1 TYR A 102 -2.377 8.500 3.529 1.00 74.23 H new ATOM 0 HE2 TYR A 102 -5.999 9.232 1.409 1.00 62.12 H new ATOM 0 HH TYR A 102 -5.846 8.722 3.660 1.00 41.32 H new ATOM 1746 N GLU A 103 0.805 9.202 -2.321 1.00 4.45 N ATOM 1747 CA GLU A 103 1.801 8.789 -3.299 1.00 42.21 C ATOM 1748 C GLU A 103 1.440 7.385 -3.805 1.00 53.55 C ATOM 1749 O GLU A 103 1.542 6.405 -3.063 1.00 51.42 O ATOM 1750 CB GLU A 103 3.218 8.810 -2.669 1.00 50.45 C ATOM 1751 CG GLU A 103 4.350 8.336 -3.604 1.00 75.44 C ATOM 1752 CD GLU A 103 4.476 9.179 -4.888 1.00 4.32 C ATOM 1753 OE1 GLU A 103 5.205 10.190 -4.873 1.00 10.03 O ATOM 1754 OE2 GLU A 103 3.853 8.828 -5.909 1.00 53.34 O ATOM 0 H GLU A 103 1.131 9.150 -1.356 1.00 4.45 H new ATOM 0 HA GLU A 103 1.807 9.482 -4.140 1.00 42.21 H new ATOM 0 HB2 GLU A 103 3.439 9.826 -2.340 1.00 50.45 H new ATOM 0 HB3 GLU A 103 3.214 8.181 -1.779 1.00 50.45 H new ATOM 0 HG2 GLU A 103 5.296 8.368 -3.063 1.00 75.44 H new ATOM 0 HG3 GLU A 103 4.174 7.296 -3.877 1.00 75.44 H new ATOM 1761 N VAL A 104 1.002 7.311 -5.067 1.00 75.43 N ATOM 1762 CA VAL A 104 0.465 6.079 -5.663 1.00 22.34 C ATOM 1763 C VAL A 104 0.991 5.896 -7.097 1.00 25.02 C ATOM 1764 O VAL A 104 1.022 6.845 -7.889 1.00 61.30 O ATOM 1765 CB VAL A 104 -1.107 6.078 -5.641 1.00 3.10 C ATOM 1766 CG1 VAL A 104 -1.698 7.320 -6.345 1.00 53.01 C ATOM 1767 CG2 VAL A 104 -1.691 4.751 -6.200 1.00 23.21 C ATOM 0 H VAL A 104 1.009 8.105 -5.707 1.00 75.43 H new ATOM 0 HA VAL A 104 0.808 5.237 -5.062 1.00 22.34 H new ATOM 0 HB VAL A 104 -1.411 6.140 -4.596 1.00 3.10 H new ATOM 0 HG11 VAL A 104 -2.786 7.277 -6.306 1.00 53.01 H new ATOM 0 HG12 VAL A 104 -1.352 8.223 -5.842 1.00 53.01 H new ATOM 0 HG13 VAL A 104 -1.373 7.338 -7.385 1.00 53.01 H new ATOM 0 HG21 VAL A 104 -2.780 4.790 -6.168 1.00 23.21 H new ATOM 0 HG22 VAL A 104 -1.363 4.615 -7.231 1.00 23.21 H new ATOM 0 HG23 VAL A 104 -1.340 3.915 -5.594 1.00 23.21 H new ATOM 1777 N ARG A 105 1.426 4.663 -7.405 1.00 12.43 N ATOM 1778 CA ARG A 105 1.917 4.277 -8.739 1.00 40.35 C ATOM 1779 C ARG A 105 1.217 2.981 -9.189 1.00 2.33 C ATOM 1780 O ARG A 105 0.748 2.192 -8.360 1.00 43.32 O ATOM 1781 CB ARG A 105 3.464 4.085 -8.719 1.00 51.42 C ATOM 1782 CG ARG A 105 4.271 5.337 -8.286 1.00 71.03 C ATOM 1783 CD ARG A 105 4.166 6.516 -9.283 1.00 63.41 C ATOM 1784 NE ARG A 105 4.354 7.812 -8.609 1.00 61.44 N ATOM 1785 CZ ARG A 105 4.405 9.014 -9.207 1.00 1.21 C ATOM 1786 NH1 ARG A 105 4.311 9.130 -10.527 1.00 14.21 N ATOM 1787 NH2 ARG A 105 4.463 10.114 -8.462 1.00 3.11 N ATOM 0 H ARG A 105 1.447 3.899 -6.729 1.00 12.43 H new ATOM 0 HA ARG A 105 1.686 5.072 -9.448 1.00 40.35 H new ATOM 0 HB2 ARG A 105 3.705 3.264 -8.044 1.00 51.42 H new ATOM 0 HB3 ARG A 105 3.791 3.786 -9.715 1.00 51.42 H new ATOM 0 HG2 ARG A 105 3.919 5.666 -7.308 1.00 71.03 H new ATOM 0 HG3 ARG A 105 5.319 5.062 -8.171 1.00 71.03 H new ATOM 0 HD2 ARG A 105 4.916 6.400 -10.066 1.00 63.41 H new ATOM 0 HD3 ARG A 105 3.191 6.496 -9.770 1.00 63.41 H new ATOM 0 HE ARG A 105 4.455 7.795 -7.594 1.00 61.44 H new ATOM 0 HH11 ARG A 105 4.198 8.297 -11.105 1.00 14.21 H new ATOM 0 HH12 ARG A 105 4.352 10.052 -10.962 1.00 14.21 H new ATOM 0 HH21 ARG A 105 4.469 10.041 -7.445 1.00 3.11 H new ATOM 0 HH22 ARG A 105 4.502 11.031 -8.908 1.00 3.11 H new ATOM 1801 N LYS A 106 1.157 2.788 -10.515 1.00 45.54 N ATOM 1802 CA LYS A 106 0.575 1.598 -11.149 1.00 61.20 C ATOM 1803 C LYS A 106 1.627 0.948 -12.060 1.00 62.02 C ATOM 1804 O LYS A 106 2.300 1.641 -12.832 1.00 61.20 O ATOM 1805 CB LYS A 106 -0.662 1.983 -12.003 1.00 30.44 C ATOM 1806 CG LYS A 106 -1.387 0.765 -12.655 1.00 72.15 C ATOM 1807 CD LYS A 106 -2.121 1.109 -13.978 1.00 32.41 C ATOM 1808 CE LYS A 106 -1.211 1.112 -15.226 1.00 35.41 C ATOM 1809 NZ LYS A 106 -0.096 2.088 -15.140 1.00 23.43 N ATOM 0 H LYS A 106 1.517 3.466 -11.187 1.00 45.54 H new ATOM 0 HA LYS A 106 0.264 0.902 -10.370 1.00 61.20 H new ATOM 0 HB2 LYS A 106 -1.371 2.521 -11.374 1.00 30.44 H new ATOM 0 HB3 LYS A 106 -0.348 2.670 -12.789 1.00 30.44 H new ATOM 0 HG2 LYS A 106 -0.656 -0.020 -12.849 1.00 72.15 H new ATOM 0 HG3 LYS A 106 -2.108 0.360 -11.945 1.00 72.15 H new ATOM 0 HD2 LYS A 106 -2.926 0.390 -14.131 1.00 32.41 H new ATOM 0 HD3 LYS A 106 -2.585 2.090 -13.878 1.00 32.41 H new ATOM 0 HE2 LYS A 106 -0.799 0.113 -15.369 1.00 35.41 H new ATOM 0 HE3 LYS A 106 -1.814 1.337 -16.106 1.00 35.41 H new ATOM 0 HZ1 LYS A 106 0.361 2.175 -16.070 1.00 23.43 H new ATOM 0 HZ2 LYS A 106 -0.467 3.015 -14.849 1.00 23.43 H new ATOM 0 HZ3 LYS A 106 0.600 1.759 -14.441 1.00 23.43 H new ATOM 1823 N VAL A 107 1.718 -0.385 -11.997 1.00 74.44 N ATOM 1824 CA VAL A 107 2.671 -1.193 -12.778 1.00 33.24 C ATOM 1825 C VAL A 107 1.947 -2.375 -13.439 1.00 35.31 C ATOM 1826 O VAL A 107 0.806 -2.711 -13.080 1.00 60.43 O ATOM 1827 CB VAL A 107 3.856 -1.720 -11.887 1.00 4.02 C ATOM 1828 CG1 VAL A 107 4.727 -0.560 -11.374 1.00 75.21 C ATOM 1829 CG2 VAL A 107 3.344 -2.581 -10.720 1.00 74.12 C ATOM 0 H VAL A 107 1.121 -0.947 -11.390 1.00 74.44 H new ATOM 0 HA VAL A 107 3.094 -0.549 -13.549 1.00 33.24 H new ATOM 0 HB VAL A 107 4.479 -2.354 -12.517 1.00 4.02 H new ATOM 0 HG11 VAL A 107 5.537 -0.956 -10.762 1.00 75.21 H new ATOM 0 HG12 VAL A 107 5.145 -0.017 -12.221 1.00 75.21 H new ATOM 0 HG13 VAL A 107 4.117 0.116 -10.775 1.00 75.21 H new ATOM 0 HG21 VAL A 107 4.189 -2.928 -10.126 1.00 74.12 H new ATOM 0 HG22 VAL A 107 2.680 -1.986 -10.093 1.00 74.12 H new ATOM 0 HG23 VAL A 107 2.800 -3.440 -11.113 1.00 74.12 H new ATOM 1839 N THR A 108 2.621 -2.975 -14.431 1.00 30.21 N ATOM 1840 CA THR A 108 2.135 -4.159 -15.162 1.00 75.33 C ATOM 1841 C THR A 108 3.174 -5.305 -15.125 1.00 25.13 C ATOM 1842 O THR A 108 2.834 -6.458 -15.425 1.00 74.43 O ATOM 1843 CB THR A 108 1.768 -3.791 -16.645 1.00 74.11 C ATOM 1844 OG1 THR A 108 2.834 -3.035 -17.241 1.00 71.31 O ATOM 1845 CG2 THR A 108 0.446 -2.992 -16.739 1.00 52.15 C ATOM 0 H THR A 108 3.532 -2.649 -14.754 1.00 30.21 H new ATOM 0 HA THR A 108 1.231 -4.509 -14.663 1.00 75.33 H new ATOM 0 HB THR A 108 1.627 -4.726 -17.187 1.00 74.11 H new ATOM 0 HG1 THR A 108 2.599 -2.811 -18.166 1.00 71.31 H new ATOM 0 HG21 THR A 108 0.234 -2.761 -17.783 1.00 52.15 H new ATOM 0 HG22 THR A 108 -0.369 -3.587 -16.327 1.00 52.15 H new ATOM 0 HG23 THR A 108 0.540 -2.065 -16.174 1.00 52.15 H new ATOM 1853 N ASP A 109 4.437 -4.990 -14.758 1.00 5.43 N ATOM 1854 CA ASP A 109 5.512 -6.001 -14.629 1.00 14.13 C ATOM 1855 C ASP A 109 5.891 -6.221 -13.157 1.00 42.20 C ATOM 1856 O ASP A 109 5.749 -5.325 -12.311 1.00 41.25 O ATOM 1857 CB ASP A 109 6.773 -5.599 -15.446 1.00 32.22 C ATOM 1858 CG ASP A 109 6.546 -5.631 -16.965 1.00 62.14 C ATOM 1859 OD1 ASP A 109 6.540 -6.730 -17.549 1.00 31.23 O ATOM 1860 OD2 ASP A 109 6.367 -4.567 -17.577 1.00 41.31 O ATOM 0 H ASP A 109 4.738 -4.039 -14.545 1.00 5.43 H new ATOM 0 HA ASP A 109 5.123 -6.935 -15.034 1.00 14.13 H new ATOM 0 HB2 ASP A 109 7.083 -4.596 -15.153 1.00 32.22 H new ATOM 0 HB3 ASP A 109 7.592 -6.273 -15.193 1.00 32.22 H new ATOM 1865 N ASP A 110 6.382 -7.442 -12.886 1.00 24.31 N ATOM 1866 CA ASP A 110 6.883 -7.865 -11.562 1.00 53.12 C ATOM 1867 C ASP A 110 8.183 -7.113 -11.222 1.00 73.03 C ATOM 1868 O ASP A 110 8.306 -6.516 -10.149 1.00 74.23 O ATOM 1869 CB ASP A 110 7.104 -9.417 -11.561 1.00 74.20 C ATOM 1870 CG ASP A 110 8.033 -9.952 -10.446 1.00 64.54 C ATOM 1871 OD1 ASP A 110 9.269 -9.988 -10.655 1.00 21.21 O ATOM 1872 OD2 ASP A 110 7.542 -10.381 -9.379 1.00 45.02 O ATOM 0 H ASP A 110 6.444 -8.177 -13.591 1.00 24.31 H new ATOM 0 HA ASP A 110 6.148 -7.620 -10.795 1.00 53.12 H new ATOM 0 HB2 ASP A 110 6.134 -9.905 -11.468 1.00 74.20 H new ATOM 0 HB3 ASP A 110 7.517 -9.709 -12.526 1.00 74.20 H new ATOM 1877 N GLU A 111 9.145 -7.160 -12.170 1.00 3.33 N ATOM 1878 CA GLU A 111 10.462 -6.503 -12.039 1.00 54.23 C ATOM 1879 C GLU A 111 10.328 -4.972 -11.922 1.00 45.03 C ATOM 1880 O GLU A 111 11.164 -4.317 -11.300 1.00 10.22 O ATOM 1881 CB GLU A 111 11.397 -6.935 -13.219 1.00 21.10 C ATOM 1882 CG GLU A 111 10.850 -6.727 -14.667 1.00 61.24 C ATOM 1883 CD GLU A 111 11.167 -5.351 -15.289 1.00 15.25 C ATOM 1884 OE1 GLU A 111 12.317 -5.147 -15.743 1.00 52.42 O ATOM 1885 OE2 GLU A 111 10.294 -4.463 -15.305 1.00 10.22 O ATOM 0 H GLU A 111 9.028 -7.658 -13.052 1.00 3.33 H new ATOM 0 HA GLU A 111 10.925 -6.834 -11.109 1.00 54.23 H new ATOM 0 HB2 GLU A 111 12.334 -6.385 -13.128 1.00 21.10 H new ATOM 0 HB3 GLU A 111 11.634 -7.992 -13.095 1.00 21.10 H new ATOM 0 HG2 GLU A 111 11.262 -7.504 -15.311 1.00 61.24 H new ATOM 0 HG3 GLU A 111 9.769 -6.864 -14.655 1.00 61.24 H new ATOM 1892 N GLU A 112 9.247 -4.433 -12.507 1.00 32.33 N ATOM 1893 CA GLU A 112 8.904 -3.001 -12.462 1.00 12.04 C ATOM 1894 C GLU A 112 8.289 -2.634 -11.100 1.00 3.15 C ATOM 1895 O GLU A 112 8.565 -1.561 -10.563 1.00 10.13 O ATOM 1896 CB GLU A 112 7.919 -2.689 -13.614 1.00 13.24 C ATOM 1897 CG GLU A 112 7.444 -1.226 -13.712 1.00 3.43 C ATOM 1898 CD GLU A 112 6.381 -1.002 -14.798 1.00 61.33 C ATOM 1899 OE1 GLU A 112 5.506 -1.883 -14.981 1.00 64.43 O ATOM 1900 OE2 GLU A 112 6.402 0.045 -15.468 1.00 43.52 O ATOM 0 H GLU A 112 8.574 -4.989 -13.034 1.00 32.33 H new ATOM 0 HA GLU A 112 9.807 -2.403 -12.586 1.00 12.04 H new ATOM 0 HB2 GLU A 112 8.394 -2.961 -14.557 1.00 13.24 H new ATOM 0 HB3 GLU A 112 7.044 -3.329 -13.502 1.00 13.24 H new ATOM 0 HG2 GLU A 112 7.039 -0.918 -12.748 1.00 3.43 H new ATOM 0 HG3 GLU A 112 8.302 -0.586 -13.916 1.00 3.43 H new ATOM 1907 N ALA A 113 7.456 -3.541 -10.560 1.00 54.24 N ATOM 1908 CA ALA A 113 6.838 -3.382 -9.227 1.00 52.50 C ATOM 1909 C ALA A 113 7.902 -3.277 -8.125 1.00 20.32 C ATOM 1910 O ALA A 113 7.795 -2.429 -7.238 1.00 34.13 O ATOM 1911 CB ALA A 113 5.886 -4.549 -8.929 1.00 63.12 C ATOM 0 H ALA A 113 7.191 -4.405 -11.033 1.00 54.24 H new ATOM 0 HA ALA A 113 6.267 -2.453 -9.238 1.00 52.50 H new ATOM 0 HB1 ALA A 113 5.441 -4.413 -7.943 1.00 63.12 H new ATOM 0 HB2 ALA A 113 5.098 -4.577 -9.682 1.00 63.12 H new ATOM 0 HB3 ALA A 113 6.442 -5.486 -8.950 1.00 63.12 H new ATOM 1917 N LEU A 114 8.943 -4.130 -8.229 1.00 64.32 N ATOM 1918 CA LEU A 114 10.077 -4.164 -7.278 1.00 43.41 C ATOM 1919 C LEU A 114 10.886 -2.841 -7.322 1.00 44.25 C ATOM 1920 O LEU A 114 11.432 -2.402 -6.298 1.00 54.21 O ATOM 1921 CB LEU A 114 10.989 -5.391 -7.580 1.00 50.32 C ATOM 1922 CG LEU A 114 10.302 -6.799 -7.496 1.00 50.41 C ATOM 1923 CD1 LEU A 114 11.266 -7.926 -7.941 1.00 24.41 C ATOM 1924 CD2 LEU A 114 9.724 -7.071 -6.083 1.00 52.01 C ATOM 0 H LEU A 114 9.022 -4.818 -8.978 1.00 64.32 H new ATOM 0 HA LEU A 114 9.679 -4.267 -6.268 1.00 43.41 H new ATOM 0 HB2 LEU A 114 11.405 -5.271 -8.580 1.00 50.32 H new ATOM 0 HB3 LEU A 114 11.827 -5.376 -6.883 1.00 50.32 H new ATOM 0 HG LEU A 114 9.463 -6.792 -8.192 1.00 50.41 H new ATOM 0 HD11 LEU A 114 10.758 -8.888 -7.871 1.00 24.41 H new ATOM 0 HD12 LEU A 114 11.576 -7.754 -8.972 1.00 24.41 H new ATOM 0 HD13 LEU A 114 12.143 -7.931 -7.294 1.00 24.41 H new ATOM 0 HD21 LEU A 114 9.256 -8.055 -6.064 1.00 52.01 H new ATOM 0 HD22 LEU A 114 10.528 -7.037 -5.348 1.00 52.01 H new ATOM 0 HD23 LEU A 114 8.980 -6.312 -5.842 1.00 52.01 H new ATOM 1936 N LYS A 115 10.936 -2.208 -8.519 1.00 61.51 N ATOM 1937 CA LYS A 115 11.549 -0.870 -8.709 1.00 14.22 C ATOM 1938 C LYS A 115 10.779 0.191 -7.897 1.00 1.43 C ATOM 1939 O LYS A 115 11.381 0.986 -7.169 1.00 74.30 O ATOM 1940 CB LYS A 115 11.557 -0.456 -10.213 1.00 60.24 C ATOM 1941 CG LYS A 115 12.409 -1.352 -11.134 1.00 43.32 C ATOM 1942 CD LYS A 115 12.306 -0.938 -12.624 1.00 24.12 C ATOM 1943 CE LYS A 115 13.167 -1.815 -13.551 1.00 44.22 C ATOM 1944 NZ LYS A 115 12.740 -3.241 -13.541 1.00 34.34 N ATOM 0 H LYS A 115 10.555 -2.608 -9.376 1.00 61.51 H new ATOM 0 HA LYS A 115 12.579 -0.929 -8.358 1.00 14.22 H new ATOM 0 HB2 LYS A 115 10.530 -0.457 -10.579 1.00 60.24 H new ATOM 0 HB3 LYS A 115 11.922 0.568 -10.290 1.00 60.24 H new ATOM 0 HG2 LYS A 115 13.451 -1.305 -10.818 1.00 43.32 H new ATOM 0 HG3 LYS A 115 12.089 -2.388 -11.025 1.00 43.32 H new ATOM 0 HD2 LYS A 115 11.265 -0.997 -12.941 1.00 24.12 H new ATOM 0 HD3 LYS A 115 12.613 0.103 -12.729 1.00 24.12 H new ATOM 0 HE2 LYS A 115 13.110 -1.429 -14.569 1.00 44.22 H new ATOM 0 HE3 LYS A 115 14.211 -1.749 -13.243 1.00 44.22 H new ATOM 0 HZ1 LYS A 115 13.008 -3.690 -14.440 1.00 34.34 H new ATOM 0 HZ2 LYS A 115 13.205 -3.737 -12.754 1.00 34.34 H new ATOM 0 HZ3 LYS A 115 11.708 -3.294 -13.422 1.00 34.34 H new ATOM 1958 N ILE A 116 9.437 0.158 -8.008 1.00 53.45 N ATOM 1959 CA ILE A 116 8.547 1.160 -7.385 1.00 25.04 C ATOM 1960 C ILE A 116 8.535 1.027 -5.850 1.00 24.43 C ATOM 1961 O ILE A 116 8.428 2.035 -5.141 1.00 74.32 O ATOM 1962 CB ILE A 116 7.084 1.066 -7.944 1.00 3.12 C ATOM 1963 CG1 ILE A 116 7.078 1.178 -9.499 1.00 22.11 C ATOM 1964 CG2 ILE A 116 6.170 2.140 -7.315 1.00 42.21 C ATOM 1965 CD1 ILE A 116 7.673 2.449 -10.080 1.00 70.31 C ATOM 0 H ILE A 116 8.939 -0.562 -8.531 1.00 53.45 H new ATOM 0 HA ILE A 116 8.949 2.139 -7.645 1.00 25.04 H new ATOM 0 HB ILE A 116 6.686 0.089 -7.668 1.00 3.12 H new ATOM 0 HG12 ILE A 116 7.623 0.327 -9.906 1.00 22.11 H new ATOM 0 HG13 ILE A 116 6.048 1.092 -9.845 1.00 22.11 H new ATOM 0 HG21 ILE A 116 5.164 2.047 -7.724 1.00 42.21 H new ATOM 0 HG22 ILE A 116 6.136 2.002 -6.234 1.00 42.21 H new ATOM 0 HG23 ILE A 116 6.563 3.131 -7.542 1.00 42.21 H new ATOM 0 HD11 ILE A 116 7.614 2.414 -11.168 1.00 70.31 H new ATOM 0 HD12 ILE A 116 7.117 3.312 -9.714 1.00 70.31 H new ATOM 0 HD13 ILE A 116 8.716 2.534 -9.776 1.00 70.31 H new ATOM 1977 N VAL A 117 8.654 -0.226 -5.355 1.00 63.41 N ATOM 1978 CA VAL A 117 8.852 -0.499 -3.918 1.00 22.42 C ATOM 1979 C VAL A 117 10.072 0.295 -3.409 1.00 14.25 C ATOM 1980 O VAL A 117 9.960 1.058 -2.459 1.00 13.23 O ATOM 1981 CB VAL A 117 9.051 -2.038 -3.623 1.00 44.03 C ATOM 1982 CG1 VAL A 117 9.389 -2.294 -2.132 1.00 32.33 C ATOM 1983 CG2 VAL A 117 7.806 -2.850 -4.047 1.00 72.45 C ATOM 0 H VAL A 117 8.616 -1.065 -5.934 1.00 63.41 H new ATOM 0 HA VAL A 117 7.951 -0.183 -3.392 1.00 22.42 H new ATOM 0 HB VAL A 117 9.899 -2.375 -4.218 1.00 44.03 H new ATOM 0 HG11 VAL A 117 9.519 -3.364 -1.967 1.00 32.33 H new ATOM 0 HG12 VAL A 117 10.310 -1.772 -1.873 1.00 32.33 H new ATOM 0 HG13 VAL A 117 8.576 -1.926 -1.506 1.00 32.33 H new ATOM 0 HG21 VAL A 117 7.970 -3.906 -3.833 1.00 72.45 H new ATOM 0 HG22 VAL A 117 6.936 -2.498 -3.493 1.00 72.45 H new ATOM 0 HG23 VAL A 117 7.633 -2.719 -5.115 1.00 72.45 H new ATOM 1993 N ARG A 118 11.195 0.173 -4.149 1.00 43.42 N ATOM 1994 CA ARG A 118 12.468 0.844 -3.817 1.00 5.42 C ATOM 1995 C ARG A 118 12.351 2.388 -3.887 1.00 22.35 C ATOM 1996 O ARG A 118 13.024 3.089 -3.122 1.00 41.02 O ATOM 1997 CB ARG A 118 13.609 0.339 -4.741 1.00 62.43 C ATOM 1998 CG ARG A 118 14.070 -1.107 -4.463 1.00 13.43 C ATOM 1999 CD ARG A 118 15.112 -1.601 -5.486 1.00 5.23 C ATOM 2000 NE ARG A 118 15.614 -2.959 -5.192 1.00 44.35 N ATOM 2001 CZ ARG A 118 14.904 -4.099 -5.292 1.00 62.33 C ATOM 2002 NH1 ARG A 118 13.634 -4.101 -5.679 1.00 23.20 N ATOM 2003 NH2 ARG A 118 15.490 -5.253 -5.026 1.00 32.44 N ATOM 0 H ARG A 118 11.243 -0.395 -4.995 1.00 43.42 H new ATOM 0 HA ARG A 118 12.709 0.586 -2.786 1.00 5.42 H new ATOM 0 HB2 ARG A 118 13.277 0.407 -5.777 1.00 62.43 H new ATOM 0 HB3 ARG A 118 14.465 1.006 -4.636 1.00 62.43 H new ATOM 0 HG2 ARG A 118 14.495 -1.163 -3.461 1.00 13.43 H new ATOM 0 HG3 ARG A 118 13.205 -1.770 -4.481 1.00 13.43 H new ATOM 0 HD2 ARG A 118 14.668 -1.592 -6.481 1.00 5.23 H new ATOM 0 HD3 ARG A 118 15.951 -0.906 -5.505 1.00 5.23 H new ATOM 0 HE ARG A 118 16.584 -3.040 -4.886 1.00 44.35 H new ATOM 0 HH11 ARG A 118 13.170 -3.223 -5.910 1.00 23.20 H new ATOM 0 HH12 ARG A 118 13.122 -4.981 -5.745 1.00 23.20 H new ATOM 0 HH21 ARG A 118 16.471 -5.275 -4.748 1.00 32.44 H new ATOM 0 HH22 ARG A 118 14.961 -6.122 -5.099 1.00 32.44 H new ATOM 2017 N GLU A 119 11.491 2.902 -4.795 1.00 41.14 N ATOM 2018 CA GLU A 119 11.166 4.345 -4.863 1.00 35.33 C ATOM 2019 C GLU A 119 10.479 4.799 -3.558 1.00 22.42 C ATOM 2020 O GLU A 119 10.856 5.813 -2.966 1.00 43.41 O ATOM 2021 CB GLU A 119 10.251 4.658 -6.089 1.00 2.21 C ATOM 2022 CG GLU A 119 10.863 4.312 -7.462 1.00 20.14 C ATOM 2023 CD GLU A 119 12.197 5.034 -7.738 1.00 23.43 C ATOM 2024 OE1 GLU A 119 12.176 6.235 -8.075 1.00 21.52 O ATOM 2025 OE2 GLU A 119 13.272 4.406 -7.608 1.00 35.32 O ATOM 0 H GLU A 119 11.008 2.337 -5.493 1.00 41.14 H new ATOM 0 HA GLU A 119 12.098 4.896 -4.985 1.00 35.33 H new ATOM 0 HB2 GLU A 119 9.316 4.109 -5.976 1.00 2.21 H new ATOM 0 HB3 GLU A 119 10.001 5.719 -6.076 1.00 2.21 H new ATOM 0 HG2 GLU A 119 11.023 3.235 -7.519 1.00 20.14 H new ATOM 0 HG3 GLU A 119 10.150 4.571 -8.245 1.00 20.14 H new ATOM 2032 N PHE A 120 9.484 4.002 -3.118 1.00 43.43 N ATOM 2033 CA PHE A 120 8.745 4.213 -1.853 1.00 21.13 C ATOM 2034 C PHE A 120 9.659 4.081 -0.615 1.00 2.12 C ATOM 2035 O PHE A 120 9.406 4.715 0.411 1.00 33.55 O ATOM 2036 CB PHE A 120 7.559 3.212 -1.751 1.00 41.21 C ATOM 2037 CG PHE A 120 6.433 3.386 -2.784 1.00 14.44 C ATOM 2038 CD1 PHE A 120 6.248 4.584 -3.489 1.00 32.11 C ATOM 2039 CD2 PHE A 120 5.531 2.345 -3.015 1.00 4.10 C ATOM 2040 CE1 PHE A 120 5.204 4.728 -4.388 1.00 3.41 C ATOM 2041 CE2 PHE A 120 4.488 2.499 -3.908 1.00 61.15 C ATOM 2042 CZ PHE A 120 4.325 3.687 -4.593 1.00 53.11 C ATOM 0 H PHE A 120 9.166 3.183 -3.636 1.00 43.43 H new ATOM 0 HA PHE A 120 8.361 5.233 -1.868 1.00 21.13 H new ATOM 0 HB2 PHE A 120 7.955 2.201 -1.843 1.00 41.21 H new ATOM 0 HB3 PHE A 120 7.125 3.295 -0.754 1.00 41.21 H new ATOM 0 HD1 PHE A 120 6.929 5.406 -3.329 1.00 32.11 H new ATOM 0 HD2 PHE A 120 5.650 1.409 -2.490 1.00 4.10 H new ATOM 0 HE1 PHE A 120 5.079 5.655 -4.928 1.00 3.41 H new ATOM 0 HE2 PHE A 120 3.796 1.686 -4.071 1.00 61.15 H new ATOM 0 HZ PHE A 120 3.508 3.800 -5.290 1.00 53.11 H new ATOM 2052 N MET A 121 10.718 3.258 -0.731 1.00 14.32 N ATOM 2053 CA MET A 121 11.725 3.070 0.339 1.00 24.34 C ATOM 2054 C MET A 121 12.590 4.332 0.505 1.00 65.55 C ATOM 2055 O MET A 121 12.999 4.674 1.619 1.00 60.02 O ATOM 2056 CB MET A 121 12.639 1.852 0.034 1.00 31.31 C ATOM 2057 CG MET A 121 11.902 0.511 -0.095 1.00 4.10 C ATOM 2058 SD MET A 121 10.983 0.051 1.383 1.00 72.42 S ATOM 2059 CE MET A 121 12.325 -0.205 2.524 1.00 61.24 C ATOM 0 H MET A 121 10.903 2.704 -1.567 1.00 14.32 H new ATOM 0 HA MET A 121 11.186 2.884 1.268 1.00 24.34 H new ATOM 0 HB2 MET A 121 13.180 2.044 -0.893 1.00 31.31 H new ATOM 0 HB3 MET A 121 13.384 1.767 0.826 1.00 31.31 H new ATOM 0 HG2 MET A 121 11.214 0.563 -0.939 1.00 4.10 H new ATOM 0 HG3 MET A 121 12.626 -0.272 -0.321 1.00 4.10 H new ATOM 0 HE1 MET A 121 12.139 -1.107 3.107 1.00 61.24 H new ATOM 0 HE2 MET A 121 13.257 -0.316 1.970 1.00 61.24 H new ATOM 0 HE3 MET A 121 12.401 0.651 3.194 1.00 61.24 H new ATOM 2069 N GLN A 122 12.851 5.017 -0.628 1.00 61.51 N ATOM 2070 CA GLN A 122 13.625 6.275 -0.647 1.00 65.04 C ATOM 2071 C GLN A 122 12.781 7.430 -0.077 1.00 41.42 C ATOM 2072 O GLN A 122 13.300 8.298 0.610 1.00 3.22 O ATOM 2073 CB GLN A 122 14.099 6.611 -2.094 1.00 3.31 C ATOM 2074 CG GLN A 122 15.218 5.697 -2.638 1.00 0.22 C ATOM 2075 CD GLN A 122 16.567 5.874 -1.922 1.00 34.33 C ATOM 2076 OE1 GLN A 122 16.896 6.954 -1.428 1.00 71.42 O ATOM 2077 NE2 GLN A 122 17.368 4.827 -1.879 1.00 42.42 N ATOM 0 H GLN A 122 12.533 4.716 -1.549 1.00 61.51 H new ATOM 0 HA GLN A 122 14.508 6.144 -0.021 1.00 65.04 H new ATOM 0 HB2 GLN A 122 13.242 6.551 -2.765 1.00 3.31 H new ATOM 0 HB3 GLN A 122 14.449 7.643 -2.116 1.00 3.31 H new ATOM 0 HG2 GLN A 122 14.902 4.658 -2.546 1.00 0.22 H new ATOM 0 HG3 GLN A 122 15.353 5.897 -3.701 1.00 0.22 H new ATOM 0 HE21 GLN A 122 17.075 3.943 -2.295 1.00 42.42 H new ATOM 0 HE22 GLN A 122 18.281 4.901 -1.430 1.00 42.42 H new ATOM 2086 N LYS A 123 11.469 7.396 -0.371 1.00 22.03 N ATOM 2087 CA LYS A 123 10.480 8.387 0.106 1.00 33.41 C ATOM 2088 C LYS A 123 10.304 8.283 1.628 1.00 5.51 C ATOM 2089 O LYS A 123 10.381 9.286 2.337 1.00 22.32 O ATOM 2090 CB LYS A 123 9.129 8.158 -0.628 1.00 3.43 C ATOM 2091 CG LYS A 123 9.197 8.425 -2.147 1.00 34.23 C ATOM 2092 CD LYS A 123 7.997 7.850 -2.926 1.00 54.20 C ATOM 2093 CE LYS A 123 8.116 8.089 -4.440 1.00 25.13 C ATOM 2094 NZ LYS A 123 8.097 9.538 -4.775 1.00 41.41 N ATOM 0 H LYS A 123 11.057 6.669 -0.956 1.00 22.03 H new ATOM 0 HA LYS A 123 10.838 9.392 -0.117 1.00 33.41 H new ATOM 0 HB2 LYS A 123 8.805 7.131 -0.462 1.00 3.43 H new ATOM 0 HB3 LYS A 123 8.371 8.806 -0.187 1.00 3.43 H new ATOM 0 HG2 LYS A 123 9.249 9.500 -2.317 1.00 34.23 H new ATOM 0 HG3 LYS A 123 10.117 7.995 -2.543 1.00 34.23 H new ATOM 0 HD2 LYS A 123 7.921 6.780 -2.734 1.00 54.20 H new ATOM 0 HD3 LYS A 123 7.077 8.305 -2.560 1.00 54.20 H new ATOM 0 HE2 LYS A 123 9.041 7.644 -4.806 1.00 25.13 H new ATOM 0 HE3 LYS A 123 7.295 7.587 -4.953 1.00 25.13 H new ATOM 0 HZ1 LYS A 123 8.264 9.661 -5.794 1.00 41.41 H new ATOM 0 HZ2 LYS A 123 7.171 9.940 -4.525 1.00 41.41 H new ATOM 0 HZ3 LYS A 123 8.843 10.028 -4.240 1.00 41.41 H new ATOM 2108 N ALA A 124 10.132 7.035 2.109 1.00 3.14 N ATOM 2109 CA ALA A 124 10.000 6.713 3.543 1.00 14.45 C ATOM 2110 C ALA A 124 11.309 7.017 4.292 1.00 50.30 C ATOM 2111 O ALA A 124 11.291 7.412 5.463 1.00 1.11 O ATOM 2112 CB ALA A 124 9.611 5.237 3.711 1.00 54.54 C ATOM 0 H ALA A 124 10.080 6.214 1.506 1.00 3.14 H new ATOM 0 HA ALA A 124 9.215 7.336 3.972 1.00 14.45 H new ATOM 0 HB1 ALA A 124 9.515 5.005 4.772 1.00 54.54 H new ATOM 0 HB2 ALA A 124 8.660 5.052 3.211 1.00 54.54 H new ATOM 0 HB3 ALA A 124 10.382 4.605 3.269 1.00 54.54 H new ATOM 2118 N GLY A 125 12.441 6.837 3.575 1.00 1.55 N ATOM 2119 CA GLY A 125 13.770 7.185 4.081 1.00 5.21 C ATOM 2120 C GLY A 125 13.965 8.690 4.193 1.00 21.12 C ATOM 2121 O GLY A 125 14.559 9.168 5.151 1.00 21.23 O ATOM 0 H GLY A 125 12.450 6.447 2.633 1.00 1.55 H new ATOM 0 HA2 GLY A 125 13.916 6.727 5.059 1.00 5.21 H new ATOM 0 HA3 GLY A 125 14.530 6.770 3.419 1.00 5.21 H new ATOM 2125 N SER A 126 13.408 9.440 3.221 1.00 11.44 N ATOM 2126 CA SER A 126 13.439 10.923 3.212 1.00 74.10 C ATOM 2127 C SER A 126 12.631 11.514 4.395 1.00 75.33 C ATOM 2128 O SER A 126 12.867 12.652 4.812 1.00 33.50 O ATOM 2129 CB SER A 126 12.905 11.456 1.861 1.00 30.30 C ATOM 2130 OG SER A 126 13.751 11.073 0.785 1.00 3.03 O ATOM 0 H SER A 126 12.923 9.038 2.419 1.00 11.44 H new ATOM 0 HA SER A 126 14.474 11.243 3.333 1.00 74.10 H new ATOM 0 HB2 SER A 126 11.899 11.074 1.689 1.00 30.30 H new ATOM 0 HB3 SER A 126 12.831 12.543 1.900 1.00 30.30 H new ATOM 0 HG SER A 126 13.661 10.110 0.625 1.00 3.03 H new ATOM 2136 N LEU A 127 11.685 10.715 4.918 1.00 14.34 N ATOM 2137 CA LEU A 127 10.892 11.064 6.108 1.00 21.43 C ATOM 2138 C LEU A 127 11.671 10.715 7.395 1.00 2.12 C ATOM 2139 O LEU A 127 11.748 11.523 8.332 1.00 30.32 O ATOM 2140 CB LEU A 127 9.541 10.295 6.083 1.00 53.22 C ATOM 2141 CG LEU A 127 8.700 10.430 4.773 1.00 72.12 C ATOM 2142 CD1 LEU A 127 7.533 9.426 4.752 1.00 35.23 C ATOM 2143 CD2 LEU A 127 8.211 11.872 4.544 1.00 42.53 C ATOM 0 H LEU A 127 11.448 9.804 4.524 1.00 14.34 H new ATOM 0 HA LEU A 127 10.697 12.136 6.098 1.00 21.43 H new ATOM 0 HB2 LEU A 127 9.744 9.238 6.253 1.00 53.22 H new ATOM 0 HB3 LEU A 127 8.933 10.641 6.919 1.00 53.22 H new ATOM 0 HG LEU A 127 9.361 10.186 3.941 1.00 72.12 H new ATOM 0 HD11 LEU A 127 6.967 9.545 3.828 1.00 35.23 H new ATOM 0 HD12 LEU A 127 7.925 8.411 4.809 1.00 35.23 H new ATOM 0 HD13 LEU A 127 6.879 9.610 5.604 1.00 35.23 H new ATOM 0 HD21 LEU A 127 7.631 11.917 3.622 1.00 42.53 H new ATOM 0 HD22 LEU A 127 7.586 12.182 5.382 1.00 42.53 H new ATOM 0 HD23 LEU A 127 9.069 12.539 4.466 1.00 42.53 H new ATOM 2155 N GLU A 128 12.243 9.496 7.417 1.00 73.21 N ATOM 2156 CA GLU A 128 12.880 8.916 8.611 1.00 25.55 C ATOM 2157 C GLU A 128 14.353 9.375 8.774 1.00 25.42 C ATOM 2158 O GLU A 128 14.660 10.128 9.700 1.00 73.53 O ATOM 2159 CB GLU A 128 12.779 7.368 8.571 1.00 15.21 C ATOM 2160 CG GLU A 128 13.452 6.682 9.773 1.00 1.20 C ATOM 2161 CD GLU A 128 13.275 5.163 9.796 1.00 33.35 C ATOM 2162 OE1 GLU A 128 13.917 4.471 8.975 1.00 54.20 O ATOM 2163 OE2 GLU A 128 12.501 4.649 10.633 1.00 3.12 O ATOM 0 H GLU A 128 12.275 8.884 6.602 1.00 73.21 H new ATOM 0 HA GLU A 128 12.341 9.283 9.484 1.00 25.55 H new ATOM 0 HB2 GLU A 128 11.728 7.080 8.539 1.00 15.21 H new ATOM 0 HB3 GLU A 128 13.237 7.005 7.651 1.00 15.21 H new ATOM 0 HG2 GLU A 128 14.517 6.914 9.762 1.00 1.20 H new ATOM 0 HG3 GLU A 128 13.044 7.100 10.693 1.00 1.20 H new ATOM 2170 N HIS A 129 15.259 8.895 7.893 1.00 24.55 N ATOM 2171 CA HIS A 129 16.710 9.202 7.952 1.00 24.43 C ATOM 2172 C HIS A 129 17.164 9.771 6.602 1.00 5.24 C ATOM 2173 O HIS A 129 17.475 9.007 5.679 1.00 20.30 O ATOM 2174 CB HIS A 129 17.544 7.926 8.290 1.00 53.41 C ATOM 2175 CG HIS A 129 17.234 7.288 9.617 1.00 13.23 C ATOM 2176 ND1 HIS A 129 16.935 5.951 9.765 1.00 63.43 N ATOM 2177 CD2 HIS A 129 17.216 7.808 10.861 1.00 63.45 C ATOM 2178 CE1 HIS A 129 16.754 5.682 11.039 1.00 71.52 C ATOM 2179 NE2 HIS A 129 16.917 6.791 11.727 1.00 74.20 N ATOM 0 H HIS A 129 15.006 8.282 7.118 1.00 24.55 H new ATOM 0 HA HIS A 129 16.875 9.935 8.742 1.00 24.43 H new ATOM 0 HB2 HIS A 129 17.383 7.188 7.504 1.00 53.41 H new ATOM 0 HB3 HIS A 129 18.602 8.188 8.270 1.00 53.41 H new ATOM 0 HD2 HIS A 129 17.403 8.838 11.126 1.00 63.45 H new ATOM 0 HE1 HIS A 129 16.512 4.714 11.451 1.00 71.52 H new ATOM 0 HE2 HIS A 129 16.834 6.879 12.740 1.00 74.20 H new ATOM 2188 N HIS A 130 17.162 11.109 6.467 1.00 21.34 N ATOM 2189 CA HIS A 130 17.568 11.784 5.220 1.00 24.02 C ATOM 2190 C HIS A 130 18.868 12.572 5.442 1.00 63.54 C ATOM 2191 O HIS A 130 18.983 13.351 6.396 1.00 72.33 O ATOM 2192 CB HIS A 130 16.430 12.699 4.680 1.00 52.12 C ATOM 2193 CG HIS A 130 16.019 13.851 5.568 1.00 43.44 C ATOM 2194 ND1 HIS A 130 16.472 15.139 5.380 1.00 75.24 N ATOM 2195 CD2 HIS A 130 15.169 13.914 6.627 1.00 71.23 C ATOM 2196 CE1 HIS A 130 15.930 15.934 6.276 1.00 73.33 C ATOM 2197 NE2 HIS A 130 15.133 15.222 7.045 1.00 43.44 N ATOM 0 H HIS A 130 16.882 11.748 7.211 1.00 21.34 H new ATOM 0 HA HIS A 130 17.757 11.025 4.461 1.00 24.02 H new ATOM 0 HB2 HIS A 130 16.744 13.104 3.718 1.00 52.12 H new ATOM 0 HB3 HIS A 130 15.552 12.080 4.494 1.00 52.12 H new ATOM 0 HD2 HIS A 130 14.623 13.089 7.060 1.00 71.23 H new ATOM 0 HE1 HIS A 130 16.109 16.995 6.366 1.00 73.33 H new ATOM 0 HE2 HIS A 130 14.580 15.582 7.823 1.00 43.44 H new ATOM 2206 N HIS A 131 19.861 12.316 4.578 1.00 11.21 N ATOM 2207 CA HIS A 131 21.156 13.024 4.578 1.00 12.05 C ATOM 2208 C HIS A 131 21.353 13.669 3.198 1.00 11.21 C ATOM 2209 O HIS A 131 21.756 14.831 3.097 1.00 44.14 O ATOM 2210 CB HIS A 131 22.311 12.047 4.926 1.00 1.43 C ATOM 2211 CG HIS A 131 22.179 11.405 6.289 1.00 22.34 C ATOM 2212 ND1 HIS A 131 22.088 10.040 6.475 1.00 0.12 N ATOM 2213 CD2 HIS A 131 22.115 11.950 7.531 1.00 31.44 C ATOM 2214 CE1 HIS A 131 21.980 9.777 7.761 1.00 2.32 C ATOM 2215 NE2 HIS A 131 21.992 10.916 8.422 1.00 50.32 N ATOM 0 H HIS A 131 19.790 11.605 3.851 1.00 11.21 H new ATOM 0 HA HIS A 131 21.162 13.803 5.340 1.00 12.05 H new ATOM 0 HB2 HIS A 131 22.353 11.264 4.169 1.00 1.43 H new ATOM 0 HB3 HIS A 131 23.257 12.586 4.879 1.00 1.43 H new ATOM 0 HD2 HIS A 131 22.154 13.002 7.772 1.00 31.44 H new ATOM 0 HE1 HIS A 131 21.896 8.794 8.199 1.00 2.32 H new ATOM 0 HE2 HIS A 131 21.921 11.013 9.435 1.00 50.32 H new ATOM 2224 N HIS A 132 21.045 12.897 2.138 1.00 14.21 N ATOM 2225 CA HIS A 132 20.955 13.412 0.766 1.00 52.25 C ATOM 2226 C HIS A 132 19.579 14.079 0.585 1.00 62.41 C ATOM 2227 O HIS A 132 18.558 13.401 0.417 1.00 32.02 O ATOM 2228 CB HIS A 132 21.165 12.267 -0.266 1.00 73.22 C ATOM 2229 CG HIS A 132 21.085 12.680 -1.727 1.00 43.41 C ATOM 2230 ND1 HIS A 132 22.193 12.820 -2.536 1.00 31.41 N ATOM 2231 CD2 HIS A 132 20.017 12.937 -2.531 1.00 62.11 C ATOM 2232 CE1 HIS A 132 21.806 13.133 -3.758 1.00 63.15 C ATOM 2233 NE2 HIS A 132 20.496 13.210 -3.779 1.00 13.35 N ATOM 0 H HIS A 132 20.852 11.898 2.213 1.00 14.21 H new ATOM 0 HA HIS A 132 21.740 14.148 0.593 1.00 52.25 H new ATOM 0 HB2 HIS A 132 22.141 11.815 -0.087 1.00 73.22 H new ATOM 0 HB3 HIS A 132 20.417 11.495 -0.083 1.00 73.22 H new ATOM 0 HD2 HIS A 132 18.979 12.927 -2.235 1.00 62.11 H new ATOM 0 HE1 HIS A 132 22.459 13.299 -4.602 1.00 63.15 H new ATOM 0 HE2 HIS A 132 19.928 13.437 -4.595 1.00 13.35 H new ATOM 2242 N HIS A 133 19.566 15.406 0.673 1.00 1.13 N ATOM 2243 CA HIS A 133 18.374 16.218 0.404 1.00 72.22 C ATOM 2244 C HIS A 133 18.199 16.360 -1.116 1.00 62.00 C ATOM 2245 O HIS A 133 19.189 16.396 -1.858 1.00 5.52 O ATOM 2246 CB HIS A 133 18.521 17.613 1.067 1.00 4.02 C ATOM 2247 CG HIS A 133 17.290 18.475 0.997 1.00 52.12 C ATOM 2248 ND1 HIS A 133 17.048 19.383 -0.013 1.00 24.53 N ATOM 2249 CD2 HIS A 133 16.229 18.555 1.826 1.00 20.12 C ATOM 2250 CE1 HIS A 133 15.896 19.981 0.207 1.00 3.34 C ATOM 2251 NE2 HIS A 133 15.376 19.497 1.312 1.00 63.33 N ATOM 0 H HIS A 133 20.385 15.955 0.934 1.00 1.13 H new ATOM 0 HA HIS A 133 17.494 15.732 0.824 1.00 72.22 H new ATOM 0 HB2 HIS A 133 18.793 17.476 2.114 1.00 4.02 H new ATOM 0 HB3 HIS A 133 19.346 18.142 0.590 1.00 4.02 H new ATOM 0 HD2 HIS A 133 16.079 17.982 2.729 1.00 20.12 H new ATOM 0 HE1 HIS A 133 15.452 20.743 -0.417 1.00 3.34 H new ATOM 0 HE2 HIS A 133 14.484 19.776 1.720 1.00 63.33 H new ATOM 2260 N HIS A 134 16.947 16.401 -1.576 1.00 32.42 N ATOM 2261 CA HIS A 134 16.616 16.697 -2.977 1.00 52.14 C ATOM 2262 C HIS A 134 16.053 18.137 -3.046 1.00 70.45 C ATOM 2263 O HIS A 134 14.895 18.352 -2.655 1.00 24.33 O ATOM 2264 CB HIS A 134 15.622 15.645 -3.554 1.00 22.23 C ATOM 2265 CG HIS A 134 15.193 15.931 -4.975 1.00 13.11 C ATOM 2266 ND1 HIS A 134 16.036 15.795 -6.057 1.00 33.42 N ATOM 2267 CD2 HIS A 134 14.024 16.400 -5.479 1.00 63.44 C ATOM 2268 CE1 HIS A 134 15.409 16.167 -7.155 1.00 75.42 C ATOM 2269 NE2 HIS A 134 14.190 16.538 -6.830 1.00 0.14 N ATOM 2270 OXT HIS A 134 16.783 19.052 -3.461 1.00 38.33 O ATOM 0 H HIS A 134 16.131 16.230 -0.989 1.00 32.42 H new ATOM 0 HA HIS A 134 17.510 16.635 -3.597 1.00 52.14 H new ATOM 0 HB2 HIS A 134 16.086 14.660 -3.515 1.00 22.23 H new ATOM 0 HB3 HIS A 134 14.738 15.606 -2.918 1.00 22.23 H new ATOM 0 HD2 HIS A 134 13.129 16.623 -4.918 1.00 63.44 H new ATOM 0 HE1 HIS A 134 15.825 16.167 -8.152 1.00 75.42 H new ATOM 0 HE2 HIS A 134 13.481 16.875 -7.481 1.00 0.14 H new TER 2279 HIS A 134