USER MOD reduce.3.24.130724 H: found=0, std=0, add=1156, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1151 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 58 TYR OH : rot 165:sc= 0.245 USER MOD Set 1.2: A 141 ASN : amide:sc= 1.55 K(o=1.8,f=0.3) USER MOD Set 2.1: A 108 ASN : amide:sc= -0.875 X(o=-0.37,f=-0.42) USER MOD Set 2.2: A 110 TYR OH : rot 30:sc=-0.00374 USER MOD Set 2.3: A 115 TYR OH : rot 24:sc= 0.513 USER MOD Set 3.1: A 40 SER OG : rot -103:sc= 1.24 USER MOD Set 3.2: A 41 CYS SG : rot 180:sc= 0 USER MOD Set 3.3: A 72 SER OG : rot 64:sc= 1.93 USER MOD Set 4.1: A 35 HIS : no HE2:sc= -0.322 K(o=-1,f=-5.8!) USER MOD Set 4.2: A 92 GLN : amide:sc= -0.471 K(o=-1,f=-1.9) USER MOD Set 4.3: A 133 MET CE :methyl -172:sc= -0.225 (180deg=-0.613) USER MOD Set 5.1: A 32 THR OG1 : rot -170:sc= 0 USER MOD Set 5.2: A 63 ASN : amide:sc= 0.463 X(o=0.46,f=0) USER MOD Set 6.1: A 22 THR OG1 : rot 180:sc= 0.851 USER MOD Set 6.2: A 25 GLN : amide:sc= 0.924 K(o=1.8,f=0.04) USER MOD Set 7.1: A 18 ASN : amide:sc= 1.58 K(o=2.1,f=-2.9) USER MOD Set 7.2: A 82 LYS NZ :NH3+ -176:sc= 0.521 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -0.0617 X(o=-0.062,f=0) USER MOD Single : A 7 MET CE :methyl 150:sc= -0.52 (180deg=-2.69) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 164:sc= 1.12 (180deg=0.934) USER MOD Single : A 30 LYS NZ :NH3+ 145:sc= 1.23 (180deg=0.527) USER MOD Single : A 38 SER OG : rot -68:sc= 0.96 USER MOD Single : A 42 HIS : no HD1:sc= -0.0049 X(o=-0.0049,f=-0.0049) USER MOD Single : A 44 CYS SG : rot 61:sc= -0.255 USER MOD Single : A 45 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.0022) USER MOD Single : A 48 MET CE :methyl 179:sc= -0.687 (180deg=-0.687) USER MOD Single : A 50 GLN : amide:sc= -0.649 K(o=-0.65,f=-3.8!) USER MOD Single : A 52 ASN : amide:sc= 0.787 K(o=0.79,f=-3.1!) USER MOD Single : A 57 LYS NZ :NH3+ -159:sc= 2.43 (180deg=0.899) USER MOD Single : A 59 GLN : amide:sc= 0.624 K(o=0.62,f=-0.21) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 HIS : no HE2:sc= -2.75! C(o=-2.7!,f=-10!) USER MOD Single : A 69 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 86:sc= 1.16 USER MOD Single : A 88 HIS : no HE2:sc= -1.79 K(o=-1.8,f=-2.4) USER MOD Single : A 91 THR OG1 : rot 170:sc= 0.878 USER MOD Single : A 98 SER OG : rot 180:sc=0.000473 USER MOD Single : A 100 HIS : no HE2:sc= -0.915 K(o=-0.92,f=-2.8!) USER MOD Single : A 103 THR OG1 : rot -59:sc= 1.26 USER MOD Single : A 114 TYR OH : rot -137:sc= 1 USER MOD Single : A 119 LYS NZ :NH3+ 141:sc= 0.885 (180deg=0.172) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= 2.12 K(o=2.1,f=-4.3!) USER MOD Single : A 125 HIS : no HD1:sc= -1.18 K(o=-1.2,f=-2.4!) USER MOD Single : A 127 GLN : amide:sc= 0.92 K(o=0.92,f=-2.2!) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 167:sc= 1.28 (180deg=1.1) USER MOD Single : A 135 MET CE :methyl -179:sc= -0.285 (180deg=-0.294) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 THR OG1 : rot 70:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 20 N LYS A 2 5.221 -1.621 -4.103 1.00 0.00 N ATOM 21 CA LYS A 2 6.407 -2.405 -4.437 1.00 0.00 C ATOM 22 C LYS A 2 7.558 -1.437 -4.697 1.00 0.00 C ATOM 23 O LYS A 2 7.343 -0.228 -4.829 1.00 0.00 O ATOM 24 CB LYS A 2 6.131 -3.380 -5.587 1.00 0.00 C ATOM 25 CG LYS A 2 5.849 -2.713 -6.940 1.00 0.00 C ATOM 26 CD LYS A 2 5.579 -3.816 -7.960 1.00 0.00 C ATOM 27 CE LYS A 2 5.302 -3.219 -9.347 1.00 0.00 C ATOM 28 NZ LYS A 2 5.037 -4.264 -10.366 1.00 0.00 N ATOM 0 HA LYS A 2 6.693 -3.048 -3.605 1.00 0.00 H new ATOM 0 HB2 LYS A 2 6.989 -4.044 -5.696 1.00 0.00 H new ATOM 0 HB3 LYS A 2 5.278 -4.003 -5.320 1.00 0.00 H new ATOM 0 HG2 LYS A 2 4.991 -2.045 -6.864 1.00 0.00 H new ATOM 0 HG3 LYS A 2 6.699 -2.106 -7.251 1.00 0.00 H new ATOM 0 HD2 LYS A 2 6.436 -4.487 -8.012 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.726 -4.414 -7.639 1.00 0.00 H new ATOM 0 HE2 LYS A 2 4.445 -2.548 -9.287 1.00 0.00 H new ATOM 0 HE3 LYS A 2 6.156 -2.618 -9.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 4.856 -3.814 -11.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 5.864 -4.890 -10.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 4.206 -4.822 -10.083 1.00 0.00 H new ATOM 42 N LEU A 3 8.780 -1.949 -4.732 1.00 0.00 N ATOM 43 CA LEU A 3 9.977 -1.133 -4.895 1.00 0.00 C ATOM 44 C LEU A 3 10.136 -0.674 -6.339 1.00 0.00 C ATOM 45 O LEU A 3 9.527 -1.210 -7.266 1.00 0.00 O ATOM 46 CB LEU A 3 11.222 -1.878 -4.379 1.00 0.00 C ATOM 47 CG LEU A 3 11.131 -2.282 -2.893 1.00 0.00 C ATOM 48 CD1 LEU A 3 12.480 -2.832 -2.426 1.00 0.00 C ATOM 49 CD2 LEU A 3 10.693 -1.118 -1.990 1.00 0.00 C ATOM 0 H LEU A 3 8.971 -2.947 -4.648 1.00 0.00 H new ATOM 0 HA LEU A 3 9.866 -0.234 -4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 3 11.374 -2.774 -4.981 1.00 0.00 H new ATOM 0 HB3 LEU A 3 12.098 -1.245 -4.521 1.00 0.00 H new ATOM 0 HG LEU A 3 10.365 -3.053 -2.811 1.00 0.00 H new ATOM 0 HD11 LEU A 3 12.413 -3.117 -1.376 1.00 0.00 H new ATOM 0 HD12 LEU A 3 12.743 -3.705 -3.023 1.00 0.00 H new ATOM 0 HD13 LEU A 3 13.246 -2.066 -2.546 1.00 0.00 H new ATOM 0 HD21 LEU A 3 10.646 -1.458 -0.955 1.00 0.00 H new ATOM 0 HD22 LEU A 3 11.413 -0.303 -2.072 1.00 0.00 H new ATOM 0 HD23 LEU A 3 9.710 -0.766 -2.302 1.00 0.00 H new ATOM 61 N ARG A 4 10.982 0.346 -6.498 1.00 0.00 N ATOM 62 CA ARG A 4 11.270 1.081 -7.727 1.00 0.00 C ATOM 63 C ARG A 4 10.024 1.691 -8.376 1.00 0.00 C ATOM 64 O ARG A 4 10.082 2.084 -9.540 1.00 0.00 O ATOM 65 CB ARG A 4 12.133 0.234 -8.683 1.00 0.00 C ATOM 66 CG ARG A 4 13.367 -0.357 -7.978 1.00 0.00 C ATOM 67 CD ARG A 4 14.315 -1.007 -8.991 1.00 0.00 C ATOM 68 NE ARG A 4 15.475 -1.634 -8.332 1.00 0.00 N ATOM 69 CZ ARG A 4 16.650 -1.054 -8.055 1.00 0.00 C ATOM 70 NH1 ARG A 4 16.856 0.238 -8.304 1.00 0.00 N ATOM 71 NH2 ARG A 4 17.626 -1.777 -7.513 1.00 0.00 N ATOM 0 H ARG A 4 11.523 0.705 -5.711 1.00 0.00 H new ATOM 0 HA ARG A 4 11.869 1.951 -7.458 1.00 0.00 H new ATOM 0 HB2 ARG A 4 11.530 -0.575 -9.095 1.00 0.00 H new ATOM 0 HB3 ARG A 4 12.456 0.851 -9.522 1.00 0.00 H new ATOM 0 HG2 ARG A 4 13.892 0.429 -7.435 1.00 0.00 H new ATOM 0 HG3 ARG A 4 13.051 -1.097 -7.242 1.00 0.00 H new ATOM 0 HD2 ARG A 4 13.773 -1.759 -9.565 1.00 0.00 H new ATOM 0 HD3 ARG A 4 14.662 -0.254 -9.699 1.00 0.00 H new ATOM 0 HE ARG A 4 15.372 -2.611 -8.059 1.00 0.00 H new ATOM 0 HH11 ARG A 4 16.112 0.804 -8.713 1.00 0.00 H new ATOM 0 HH12 ARG A 4 17.758 0.662 -8.086 1.00 0.00 H new ATOM 0 HH21 ARG A 4 17.477 -2.766 -7.311 1.00 0.00 H new ATOM 0 HH22 ARG A 4 18.524 -1.343 -7.299 1.00 0.00 H new ATOM 85 N GLN A 5 8.908 1.805 -7.643 1.00 0.00 N ATOM 86 CA GLN A 5 7.769 2.578 -8.127 1.00 0.00 C ATOM 87 C GLN A 5 8.155 4.050 -8.053 1.00 0.00 C ATOM 88 O GLN A 5 8.798 4.432 -7.077 1.00 0.00 O ATOM 89 CB GLN A 5 6.546 2.372 -7.234 1.00 0.00 C ATOM 90 CG GLN A 5 5.908 0.994 -7.422 1.00 0.00 C ATOM 91 CD GLN A 5 4.652 0.944 -6.566 1.00 0.00 C ATOM 92 OE1 GLN A 5 3.538 0.762 -7.046 1.00 0.00 O ATOM 93 NE2 GLN A 5 4.811 1.191 -5.276 1.00 0.00 N ATOM 0 H GLN A 5 8.775 1.377 -6.727 1.00 0.00 H new ATOM 0 HA GLN A 5 7.523 2.261 -9.141 1.00 0.00 H new ATOM 0 HB2 GLN A 5 6.837 2.495 -6.191 1.00 0.00 H new ATOM 0 HB3 GLN A 5 5.807 3.143 -7.452 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.663 0.826 -8.471 1.00 0.00 H new ATOM 0 HG3 GLN A 5 6.603 0.208 -7.127 1.00 0.00 H new ATOM 0 HE21 GLN A 5 5.746 1.339 -4.897 1.00 0.00 H new ATOM 0 HE22 GLN A 5 3.998 1.233 -4.661 1.00 0.00 H new ATOM 102 N PRO A 6 7.751 4.903 -8.999 1.00 0.00 N ATOM 103 CA PRO A 6 7.928 6.330 -8.826 1.00 0.00 C ATOM 104 C PRO A 6 6.956 6.841 -7.754 1.00 0.00 C ATOM 105 O PRO A 6 5.817 6.370 -7.665 1.00 0.00 O ATOM 106 CB PRO A 6 7.666 6.919 -10.204 1.00 0.00 C ATOM 107 CG PRO A 6 6.647 5.959 -10.823 1.00 0.00 C ATOM 108 CD PRO A 6 7.017 4.602 -10.217 1.00 0.00 C ATOM 0 HA PRO A 6 8.921 6.614 -8.476 1.00 0.00 H new ATOM 0 HB2 PRO A 6 7.271 7.933 -10.137 1.00 0.00 H new ATOM 0 HB3 PRO A 6 8.579 6.971 -10.797 1.00 0.00 H new ATOM 0 HG2 PRO A 6 5.625 6.244 -10.574 1.00 0.00 H new ATOM 0 HG3 PRO A 6 6.718 5.945 -11.911 1.00 0.00 H new ATOM 0 HD2 PRO A 6 6.125 4.013 -10.002 1.00 0.00 H new ATOM 0 HD3 PRO A 6 7.626 4.018 -10.907 1.00 0.00 H new ATOM 116 N MET A 7 7.393 7.817 -6.954 1.00 0.00 N ATOM 117 CA MET A 7 6.521 8.536 -6.023 1.00 0.00 C ATOM 118 C MET A 7 5.262 9.046 -6.763 1.00 0.00 C ATOM 119 O MET A 7 5.399 9.646 -7.834 1.00 0.00 O ATOM 120 CB MET A 7 7.266 9.647 -5.276 1.00 0.00 C ATOM 121 CG MET A 7 7.962 10.680 -6.170 1.00 0.00 C ATOM 122 SD MET A 7 8.756 12.044 -5.276 1.00 0.00 S ATOM 123 CE MET A 7 9.724 11.124 -4.059 1.00 0.00 C ATOM 0 H MET A 7 8.363 8.131 -6.934 1.00 0.00 H new ATOM 0 HA MET A 7 6.191 7.841 -5.251 1.00 0.00 H new ATOM 0 HB2 MET A 7 6.558 10.167 -4.630 1.00 0.00 H new ATOM 0 HB3 MET A 7 8.013 9.189 -4.627 1.00 0.00 H new ATOM 0 HG2 MET A 7 8.715 10.171 -6.772 1.00 0.00 H new ATOM 0 HG3 MET A 7 7.229 11.095 -6.861 1.00 0.00 H new ATOM 0 HE1 MET A 7 10.622 11.688 -3.807 1.00 0.00 H new ATOM 0 HE2 MET A 7 9.127 10.971 -3.160 1.00 0.00 H new ATOM 0 HE3 MET A 7 10.008 10.157 -4.475 1.00 0.00 H new ATOM 133 N PRO A 8 4.048 8.783 -6.244 1.00 0.00 N ATOM 134 CA PRO A 8 2.795 9.012 -6.952 1.00 0.00 C ATOM 135 C PRO A 8 2.247 10.441 -6.754 1.00 0.00 C ATOM 136 O PRO A 8 2.971 11.435 -6.834 1.00 0.00 O ATOM 137 CB PRO A 8 1.879 7.878 -6.452 1.00 0.00 C ATOM 138 CG PRO A 8 2.300 7.735 -4.994 1.00 0.00 C ATOM 139 CD PRO A 8 3.801 7.995 -5.045 1.00 0.00 C ATOM 0 HA PRO A 8 2.899 8.974 -8.036 1.00 0.00 H new ATOM 0 HB2 PRO A 8 0.824 8.136 -6.547 1.00 0.00 H new ATOM 0 HB3 PRO A 8 2.033 6.955 -7.011 1.00 0.00 H new ATOM 0 HG2 PRO A 8 1.787 8.453 -4.353 1.00 0.00 H new ATOM 0 HG3 PRO A 8 2.075 6.742 -4.604 1.00 0.00 H new ATOM 0 HD2 PRO A 8 4.132 8.530 -4.155 1.00 0.00 H new ATOM 0 HD3 PRO A 8 4.355 7.057 -5.077 1.00 0.00 H new ATOM 147 N GLU A 9 0.932 10.543 -6.586 1.00 0.00 N ATOM 148 CA GLU A 9 0.079 11.720 -6.586 1.00 0.00 C ATOM 149 C GLU A 9 0.171 12.524 -5.284 1.00 0.00 C ATOM 150 O GLU A 9 -0.828 12.696 -4.591 1.00 0.00 O ATOM 151 CB GLU A 9 -1.352 11.206 -6.831 1.00 0.00 C ATOM 152 CG GLU A 9 -1.535 10.473 -8.164 1.00 0.00 C ATOM 153 CD GLU A 9 -1.282 11.377 -9.385 1.00 0.00 C ATOM 154 OE1 GLU A 9 -0.106 11.550 -9.783 1.00 0.00 O ATOM 155 OE2 GLU A 9 -2.257 11.912 -9.963 1.00 0.00 O ATOM 0 H GLU A 9 0.377 9.702 -6.428 1.00 0.00 H new ATOM 0 HA GLU A 9 0.397 12.416 -7.362 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -1.629 10.534 -6.019 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -2.041 12.050 -6.796 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.855 9.622 -8.201 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -2.548 10.074 -8.217 1.00 0.00 H new ATOM 162 N LEU A 10 1.369 12.981 -4.918 1.00 0.00 N ATOM 163 CA LEU A 10 1.609 13.840 -3.755 1.00 0.00 C ATOM 164 C LEU A 10 0.796 15.136 -3.904 1.00 0.00 C ATOM 165 O LEU A 10 1.269 16.079 -4.544 1.00 0.00 O ATOM 166 CB LEU A 10 3.120 14.118 -3.599 1.00 0.00 C ATOM 167 CG LEU A 10 3.952 12.982 -2.965 1.00 0.00 C ATOM 168 CD1 LEU A 10 3.979 11.674 -3.773 1.00 0.00 C ATOM 169 CD2 LEU A 10 5.396 13.471 -2.796 1.00 0.00 C ATOM 0 H LEU A 10 2.221 12.760 -5.434 1.00 0.00 H new ATOM 0 HA LEU A 10 1.280 13.337 -2.846 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.533 14.339 -4.583 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.244 15.015 -2.993 1.00 0.00 H new ATOM 0 HG LEU A 10 3.469 12.748 -2.016 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.587 10.936 -3.250 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.963 11.294 -3.885 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.406 11.863 -4.758 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.998 12.680 -2.349 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.808 13.734 -3.771 1.00 0.00 H new ATOM 0 HD23 LEU A 10 5.410 14.348 -2.148 1.00 0.00 H new ATOM 181 N THR A 11 -0.435 15.175 -3.375 1.00 0.00 N ATOM 182 CA THR A 11 -1.360 16.287 -3.542 1.00 0.00 C ATOM 183 C THR A 11 -2.506 16.125 -2.530 1.00 0.00 C ATOM 184 O THR A 11 -2.858 14.999 -2.158 1.00 0.00 O ATOM 185 CB THR A 11 -1.841 16.350 -5.016 1.00 0.00 C ATOM 186 OG1 THR A 11 -2.257 17.670 -5.312 1.00 0.00 O ATOM 187 CG2 THR A 11 -2.979 15.387 -5.375 1.00 0.00 C ATOM 0 H THR A 11 -0.816 14.416 -2.810 1.00 0.00 H new ATOM 0 HA THR A 11 -0.876 17.242 -3.338 1.00 0.00 H new ATOM 0 HB THR A 11 -0.984 16.038 -5.614 1.00 0.00 H new ATOM 0 HG1 THR A 11 -2.560 17.716 -6.243 1.00 0.00 H new ATOM 0 HG21 THR A 11 -3.241 15.509 -6.426 1.00 0.00 H new ATOM 0 HG22 THR A 11 -2.657 14.361 -5.198 1.00 0.00 H new ATOM 0 HG23 THR A 11 -3.849 15.605 -4.756 1.00 0.00 H new ATOM 195 N GLY A 12 -3.106 17.236 -2.098 1.00 0.00 N ATOM 196 CA GLY A 12 -4.177 17.271 -1.110 1.00 0.00 C ATOM 197 C GLY A 12 -4.551 18.706 -0.742 1.00 0.00 C ATOM 198 O GLY A 12 -3.870 19.646 -1.160 1.00 0.00 O ATOM 0 H GLY A 12 -2.849 18.163 -2.439 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -5.053 16.755 -1.503 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -3.865 16.734 -0.214 1.00 0.00 H new ATOM 202 N GLU A 13 -5.624 18.878 0.041 1.00 0.00 N ATOM 203 CA GLU A 13 -6.232 20.186 0.293 1.00 0.00 C ATOM 204 C GLU A 13 -6.666 20.434 1.751 1.00 0.00 C ATOM 205 O GLU A 13 -6.926 21.591 2.086 1.00 0.00 O ATOM 206 CB GLU A 13 -7.462 20.339 -0.626 1.00 0.00 C ATOM 207 CG GLU A 13 -7.111 20.416 -2.120 1.00 0.00 C ATOM 208 CD GLU A 13 -8.355 20.709 -2.977 1.00 0.00 C ATOM 209 OE1 GLU A 13 -8.667 21.898 -3.221 1.00 0.00 O ATOM 210 OE2 GLU A 13 -9.027 19.758 -3.439 1.00 0.00 O ATOM 0 H GLU A 13 -6.095 18.109 0.518 1.00 0.00 H new ATOM 0 HA GLU A 13 -5.458 20.925 0.085 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -8.134 19.496 -0.463 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -8.006 21.240 -0.343 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -6.366 21.195 -2.280 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -6.662 19.475 -2.438 1.00 0.00 H new ATOM 217 N LYS A 14 -6.775 19.417 2.627 1.00 0.00 N ATOM 218 CA LYS A 14 -7.312 19.636 3.984 1.00 0.00 C ATOM 219 C LYS A 14 -6.373 20.550 4.777 1.00 0.00 C ATOM 220 O LYS A 14 -6.849 21.529 5.354 1.00 0.00 O ATOM 221 CB LYS A 14 -7.640 18.312 4.695 1.00 0.00 C ATOM 222 CG LYS A 14 -8.244 18.486 6.094 1.00 0.00 C ATOM 223 CD LYS A 14 -8.762 17.143 6.636 1.00 0.00 C ATOM 224 CE LYS A 14 -9.060 17.267 8.137 1.00 0.00 C ATOM 225 NZ LYS A 14 -9.720 16.061 8.697 1.00 0.00 N ATOM 0 H LYS A 14 -6.505 18.454 2.426 1.00 0.00 H new ATOM 0 HA LYS A 14 -8.269 20.153 3.908 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -8.336 17.744 4.078 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -6.729 17.720 4.775 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.493 18.891 6.772 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.061 19.207 6.055 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.664 16.848 6.100 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.021 16.362 6.467 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.128 17.447 8.673 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -9.698 18.135 8.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.654 16.079 9.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.721 16.050 8.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -9.248 15.208 8.335 1.00 0.00 H new ATOM 239 N ALA A 15 -5.066 20.272 4.791 1.00 0.00 N ATOM 240 CA ALA A 15 -4.056 21.195 5.304 1.00 0.00 C ATOM 241 C ALA A 15 -2.729 20.901 4.609 1.00 0.00 C ATOM 242 O ALA A 15 -2.494 19.787 4.140 1.00 0.00 O ATOM 243 CB ALA A 15 -3.916 21.128 6.835 1.00 0.00 C ATOM 0 H ALA A 15 -4.679 19.394 4.444 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.372 22.214 5.083 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -3.152 21.834 7.162 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.869 21.383 7.299 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -3.628 20.119 7.130 1.00 0.00 H new ATOM 249 N TRP A 16 -1.858 21.905 4.583 1.00 0.00 N ATOM 250 CA TRP A 16 -0.557 21.903 3.920 1.00 0.00 C ATOM 251 C TRP A 16 0.429 22.652 4.821 1.00 0.00 C ATOM 252 O TRP A 16 0.979 23.702 4.487 1.00 0.00 O ATOM 253 CB TRP A 16 -0.670 22.441 2.489 1.00 0.00 C ATOM 254 CG TRP A 16 -1.761 23.413 2.137 1.00 0.00 C ATOM 255 CD1 TRP A 16 -2.462 23.354 0.984 1.00 0.00 C ATOM 256 CD2 TRP A 16 -2.314 24.555 2.873 1.00 0.00 C ATOM 257 NE1 TRP A 16 -3.400 24.359 0.946 1.00 0.00 N ATOM 258 CE2 TRP A 16 -3.365 25.127 2.090 1.00 0.00 C ATOM 259 CE3 TRP A 16 -2.056 25.164 4.123 1.00 0.00 C ATOM 260 CZ2 TRP A 16 -4.114 26.232 2.523 1.00 0.00 C ATOM 261 CZ3 TRP A 16 -2.802 26.272 4.569 1.00 0.00 C ATOM 262 CH2 TRP A 16 -3.830 26.807 3.773 1.00 0.00 C ATOM 0 H TRP A 16 -2.051 22.791 5.050 1.00 0.00 H new ATOM 0 HA TRP A 16 -0.172 20.892 3.789 1.00 0.00 H new ATOM 0 HB2 TRP A 16 0.280 22.917 2.245 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -0.775 21.582 1.827 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -2.308 22.623 0.204 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -4.041 24.516 0.169 1.00 0.00 H new ATOM 0 HE3 TRP A 16 -1.269 24.771 4.750 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -4.900 26.636 1.902 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 -2.583 26.714 5.530 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -4.399 27.656 4.121 1.00 0.00 H new ATOM 273 N LEU A 17 0.501 22.158 6.055 1.00 0.00 N ATOM 274 CA LEU A 17 1.233 22.741 7.164 1.00 0.00 C ATOM 275 C LEU A 17 2.708 22.855 6.793 1.00 0.00 C ATOM 276 O LEU A 17 3.307 21.902 6.296 1.00 0.00 O ATOM 277 CB LEU A 17 1.055 21.868 8.415 1.00 0.00 C ATOM 278 CG LEU A 17 -0.409 21.624 8.834 1.00 0.00 C ATOM 279 CD1 LEU A 17 -0.420 20.729 10.069 1.00 0.00 C ATOM 280 CD2 LEU A 17 -1.177 22.925 9.095 1.00 0.00 C ATOM 0 H LEU A 17 0.024 21.295 6.316 1.00 0.00 H new ATOM 0 HA LEU A 17 0.847 23.738 7.379 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.532 20.904 8.238 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.582 22.337 9.246 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.924 21.134 8.008 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.450 20.547 10.378 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.061 19.780 9.835 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.120 21.220 10.879 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -2.201 22.691 9.386 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.690 23.481 9.896 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -1.187 23.530 8.188 1.00 0.00 H new ATOM 292 N ASN A 18 3.283 24.034 7.035 1.00 0.00 N ATOM 293 CA ASN A 18 4.652 24.455 6.713 1.00 0.00 C ATOM 294 C ASN A 18 4.828 24.698 5.211 1.00 0.00 C ATOM 295 O ASN A 18 5.614 25.563 4.821 1.00 0.00 O ATOM 296 CB ASN A 18 5.731 23.485 7.207 1.00 0.00 C ATOM 297 CG ASN A 18 5.674 23.171 8.694 1.00 0.00 C ATOM 298 OD1 ASN A 18 5.200 23.956 9.514 1.00 0.00 O ATOM 299 ND2 ASN A 18 6.166 22.008 9.065 1.00 0.00 N ATOM 0 H ASN A 18 2.764 24.780 7.498 1.00 0.00 H new ATOM 0 HA ASN A 18 4.792 25.391 7.253 1.00 0.00 H new ATOM 0 HB2 ASN A 18 5.644 22.552 6.649 1.00 0.00 H new ATOM 0 HB3 ASN A 18 6.710 23.904 6.976 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.159 21.742 10.050 1.00 0.00 H new ATOM 0 HD22 ASN A 18 6.554 21.373 8.368 1.00 0.00 H new ATOM 306 N GLY A 19 4.093 23.968 4.374 1.00 0.00 N ATOM 307 CA GLY A 19 4.052 24.125 2.930 1.00 0.00 C ATOM 308 C GLY A 19 3.479 22.875 2.265 1.00 0.00 C ATOM 309 O GLY A 19 3.148 21.893 2.933 1.00 0.00 O ATOM 0 H GLY A 19 3.484 23.219 4.703 1.00 0.00 H new ATOM 0 HA2 GLY A 19 3.444 24.992 2.671 1.00 0.00 H new ATOM 0 HA3 GLY A 19 5.056 24.316 2.552 1.00 0.00 H new ATOM 313 N GLU A 20 3.422 22.897 0.936 1.00 0.00 N ATOM 314 CA GLU A 20 3.095 21.765 0.081 1.00 0.00 C ATOM 315 C GLU A 20 4.087 21.777 -1.083 1.00 0.00 C ATOM 316 O GLU A 20 4.598 22.842 -1.447 1.00 0.00 O ATOM 317 CB GLU A 20 1.645 21.888 -0.430 1.00 0.00 C ATOM 318 CG GLU A 20 0.812 20.650 -0.092 1.00 0.00 C ATOM 319 CD GLU A 20 1.233 19.416 -0.908 1.00 0.00 C ATOM 320 OE1 GLU A 20 2.302 18.838 -0.613 1.00 0.00 O ATOM 321 OE2 GLU A 20 0.498 19.039 -1.849 1.00 0.00 O ATOM 0 H GLU A 20 3.612 23.746 0.403 1.00 0.00 H new ATOM 0 HA GLU A 20 3.168 20.826 0.629 1.00 0.00 H new ATOM 0 HB2 GLU A 20 1.179 22.770 0.010 1.00 0.00 H new ATOM 0 HB3 GLU A 20 1.652 22.036 -1.510 1.00 0.00 H new ATOM 0 HG2 GLU A 20 0.910 20.429 0.971 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -0.241 20.863 -0.278 1.00 0.00 H new ATOM 328 N VAL A 21 4.365 20.612 -1.669 1.00 0.00 N ATOM 329 CA VAL A 21 5.352 20.466 -2.733 1.00 0.00 C ATOM 330 C VAL A 21 5.043 19.199 -3.538 1.00 0.00 C ATOM 331 O VAL A 21 4.533 18.211 -3.006 1.00 0.00 O ATOM 332 CB VAL A 21 6.771 20.489 -2.115 1.00 0.00 C ATOM 333 CG1 VAL A 21 7.047 19.326 -1.150 1.00 0.00 C ATOM 334 CG2 VAL A 21 7.875 20.572 -3.172 1.00 0.00 C ATOM 0 H VAL A 21 3.906 19.737 -1.415 1.00 0.00 H new ATOM 0 HA VAL A 21 5.307 21.297 -3.437 1.00 0.00 H new ATOM 0 HB VAL A 21 6.791 21.406 -1.525 1.00 0.00 H new ATOM 0 HG11 VAL A 21 8.061 19.411 -0.758 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.335 19.361 -0.325 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.941 18.380 -1.681 1.00 0.00 H new ATOM 0 HG21 VAL A 21 8.848 20.585 -2.681 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.813 19.707 -3.832 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.751 21.484 -3.757 1.00 0.00 H new ATOM 344 N THR A 22 5.354 19.234 -4.830 1.00 0.00 N ATOM 345 CA THR A 22 5.146 18.129 -5.758 1.00 0.00 C ATOM 346 C THR A 22 6.409 17.304 -5.902 1.00 0.00 C ATOM 347 O THR A 22 7.515 17.794 -5.655 1.00 0.00 O ATOM 348 CB THR A 22 4.701 18.675 -7.122 1.00 0.00 C ATOM 349 OG1 THR A 22 5.399 19.863 -7.463 1.00 0.00 O ATOM 350 CG2 THR A 22 3.208 18.967 -7.078 1.00 0.00 C ATOM 0 H THR A 22 5.769 20.054 -5.272 1.00 0.00 H new ATOM 0 HA THR A 22 4.364 17.480 -5.363 1.00 0.00 H new ATOM 0 HB THR A 22 4.924 17.923 -7.879 1.00 0.00 H new ATOM 0 HG1 THR A 22 5.093 20.183 -8.337 1.00 0.00 H new ATOM 0 HG21 THR A 22 2.885 19.355 -8.044 1.00 0.00 H new ATOM 0 HG22 THR A 22 2.664 18.049 -6.855 1.00 0.00 H new ATOM 0 HG23 THR A 22 3.005 19.706 -6.303 1.00 0.00 H new ATOM 358 N ARG A 23 6.244 16.066 -6.387 1.00 0.00 N ATOM 359 CA ARG A 23 7.351 15.221 -6.797 1.00 0.00 C ATOM 360 C ARG A 23 8.289 16.024 -7.684 1.00 0.00 C ATOM 361 O ARG A 23 9.472 16.092 -7.398 1.00 0.00 O ATOM 362 CB ARG A 23 6.842 13.917 -7.450 1.00 0.00 C ATOM 363 CG ARG A 23 5.950 14.068 -8.697 1.00 0.00 C ATOM 364 CD ARG A 23 5.436 12.700 -9.166 1.00 0.00 C ATOM 365 NE ARG A 23 4.630 12.821 -10.398 1.00 0.00 N ATOM 366 CZ ARG A 23 3.321 12.561 -10.540 1.00 0.00 C ATOM 367 NH1 ARG A 23 2.576 12.165 -9.515 1.00 0.00 N ATOM 368 NH2 ARG A 23 2.742 12.701 -11.727 1.00 0.00 N ATOM 0 H ARG A 23 5.330 15.629 -6.503 1.00 0.00 H new ATOM 0 HA ARG A 23 7.923 14.901 -5.926 1.00 0.00 H new ATOM 0 HB2 ARG A 23 7.707 13.313 -7.722 1.00 0.00 H new ATOM 0 HB3 ARG A 23 6.285 13.356 -6.700 1.00 0.00 H new ATOM 0 HG2 ARG A 23 5.107 14.720 -8.470 1.00 0.00 H new ATOM 0 HG3 ARG A 23 6.515 14.544 -9.499 1.00 0.00 H new ATOM 0 HD2 ARG A 23 6.280 12.034 -9.346 1.00 0.00 H new ATOM 0 HD3 ARG A 23 4.834 12.246 -8.379 1.00 0.00 H new ATOM 0 HE ARG A 23 5.123 13.137 -11.233 1.00 0.00 H new ATOM 0 HH11 ARG A 23 2.996 12.052 -8.593 1.00 0.00 H new ATOM 0 HH12 ARG A 23 1.583 11.974 -9.650 1.00 0.00 H new ATOM 0 HH21 ARG A 23 3.292 13.006 -12.530 1.00 0.00 H new ATOM 0 HH22 ARG A 23 1.747 12.504 -11.836 1.00 0.00 H new ATOM 382 N GLU A 24 7.783 16.755 -8.673 1.00 0.00 N ATOM 383 CA GLU A 24 8.680 17.352 -9.667 1.00 0.00 C ATOM 384 C GLU A 24 9.498 18.533 -9.112 1.00 0.00 C ATOM 385 O GLU A 24 10.471 18.946 -9.745 1.00 0.00 O ATOM 386 CB GLU A 24 7.889 17.739 -10.928 1.00 0.00 C ATOM 387 CG GLU A 24 6.841 18.837 -10.688 1.00 0.00 C ATOM 388 CD GLU A 24 6.099 19.200 -11.987 1.00 0.00 C ATOM 389 OE1 GLU A 24 6.554 20.105 -12.723 1.00 0.00 O ATOM 390 OE2 GLU A 24 5.043 18.594 -12.281 1.00 0.00 O ATOM 0 H GLU A 24 6.790 16.946 -8.810 1.00 0.00 H new ATOM 0 HA GLU A 24 9.417 16.595 -9.938 1.00 0.00 H new ATOM 0 HB2 GLU A 24 8.587 18.077 -11.694 1.00 0.00 H new ATOM 0 HB3 GLU A 24 7.390 16.852 -11.319 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.124 18.500 -9.940 1.00 0.00 H new ATOM 0 HG3 GLU A 24 7.328 19.725 -10.285 1.00 0.00 H new ATOM 397 N GLN A 25 9.138 19.065 -7.936 1.00 0.00 N ATOM 398 CA GLN A 25 9.939 20.050 -7.214 1.00 0.00 C ATOM 399 C GLN A 25 10.859 19.356 -6.194 1.00 0.00 C ATOM 400 O GLN A 25 11.972 19.825 -5.951 1.00 0.00 O ATOM 401 CB GLN A 25 8.999 21.032 -6.501 1.00 0.00 C ATOM 402 CG GLN A 25 8.231 21.947 -7.463 1.00 0.00 C ATOM 403 CD GLN A 25 7.301 22.885 -6.692 1.00 0.00 C ATOM 404 OE1 GLN A 25 7.689 23.981 -6.289 1.00 0.00 O ATOM 405 NE2 GLN A 25 6.065 22.479 -6.451 1.00 0.00 N ATOM 0 H GLN A 25 8.272 18.817 -7.458 1.00 0.00 H new ATOM 0 HA GLN A 25 10.567 20.592 -7.921 1.00 0.00 H new ATOM 0 HB2 GLN A 25 8.285 20.469 -5.900 1.00 0.00 H new ATOM 0 HB3 GLN A 25 9.581 21.646 -5.814 1.00 0.00 H new ATOM 0 HG2 GLN A 25 8.934 22.531 -8.056 1.00 0.00 H new ATOM 0 HG3 GLN A 25 7.650 21.344 -8.161 1.00 0.00 H new ATOM 0 HE21 GLN A 25 5.752 21.569 -6.789 1.00 0.00 H new ATOM 0 HE22 GLN A 25 5.425 23.076 -5.927 1.00 0.00 H new ATOM 414 N LEU A 26 10.406 18.246 -5.604 1.00 0.00 N ATOM 415 CA LEU A 26 11.145 17.429 -4.647 1.00 0.00 C ATOM 416 C LEU A 26 12.358 16.771 -5.306 1.00 0.00 C ATOM 417 O LEU A 26 13.486 16.937 -4.836 1.00 0.00 O ATOM 418 CB LEU A 26 10.200 16.339 -4.094 1.00 0.00 C ATOM 419 CG LEU A 26 9.305 16.794 -2.936 1.00 0.00 C ATOM 420 CD1 LEU A 26 8.207 15.751 -2.703 1.00 0.00 C ATOM 421 CD2 LEU A 26 10.105 16.996 -1.647 1.00 0.00 C ATOM 0 H LEU A 26 9.473 17.879 -5.791 1.00 0.00 H new ATOM 0 HA LEU A 26 11.505 18.067 -3.840 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.567 15.981 -4.906 1.00 0.00 H new ATOM 0 HB3 LEU A 26 10.800 15.492 -3.760 1.00 0.00 H new ATOM 0 HG LEU A 26 8.863 17.753 -3.207 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.569 16.072 -1.880 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.607 15.646 -3.607 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.663 14.792 -2.456 1.00 0.00 H new ATOM 0 HD21 LEU A 26 9.435 17.318 -0.850 1.00 0.00 H new ATOM 0 HD22 LEU A 26 10.581 16.057 -1.363 1.00 0.00 H new ATOM 0 HD23 LEU A 26 10.869 17.756 -1.808 1.00 0.00 H new ATOM 433 N ILE A 27 12.133 16.021 -6.386 1.00 0.00 N ATOM 434 CA ILE A 27 13.143 15.184 -7.018 1.00 0.00 C ATOM 435 C ILE A 27 13.830 15.898 -8.185 1.00 0.00 C ATOM 436 O ILE A 27 13.393 16.953 -8.649 1.00 0.00 O ATOM 437 CB ILE A 27 12.558 13.814 -7.439 1.00 0.00 C ATOM 438 CG1 ILE A 27 11.125 13.838 -8.004 1.00 0.00 C ATOM 439 CG2 ILE A 27 12.661 12.867 -6.234 1.00 0.00 C ATOM 440 CD1 ILE A 27 10.750 12.611 -8.837 1.00 0.00 C ATOM 0 H ILE A 27 11.226 15.981 -6.851 1.00 0.00 H new ATOM 0 HA ILE A 27 13.915 14.990 -6.274 1.00 0.00 H new ATOM 0 HB ILE A 27 13.152 13.466 -8.284 1.00 0.00 H new ATOM 0 HG12 ILE A 27 10.423 13.927 -7.175 1.00 0.00 H new ATOM 0 HG13 ILE A 27 11.006 14.730 -8.620 1.00 0.00 H new ATOM 0 HG21 ILE A 27 12.255 11.892 -6.502 1.00 0.00 H new ATOM 0 HG22 ILE A 27 13.706 12.758 -5.945 1.00 0.00 H new ATOM 0 HG23 ILE A 27 12.095 13.278 -5.398 1.00 0.00 H new ATOM 0 HD11 ILE A 27 9.725 12.713 -9.194 1.00 0.00 H new ATOM 0 HD12 ILE A 27 11.425 12.530 -9.689 1.00 0.00 H new ATOM 0 HD13 ILE A 27 10.833 11.715 -8.222 1.00 0.00 H new ATOM 452 N GLY A 28 14.931 15.292 -8.637 1.00 0.00 N ATOM 453 CA GLY A 28 15.764 15.738 -9.743 1.00 0.00 C ATOM 454 C GLY A 28 17.215 15.948 -9.311 1.00 0.00 C ATOM 455 O GLY A 28 18.077 16.122 -10.173 1.00 0.00 O ATOM 0 H GLY A 28 15.279 14.431 -8.214 1.00 0.00 H new ATOM 0 HA2 GLY A 28 15.727 15.002 -10.546 1.00 0.00 H new ATOM 0 HA3 GLY A 28 15.366 16.670 -10.145 1.00 0.00 H new ATOM 459 N GLU A 29 17.522 15.876 -8.008 1.00 0.00 N ATOM 460 CA GLU A 29 18.824 16.297 -7.491 1.00 0.00 C ATOM 461 C GLU A 29 19.331 15.447 -6.322 1.00 0.00 C ATOM 462 O GLU A 29 20.487 15.025 -6.339 1.00 0.00 O ATOM 463 CB GLU A 29 18.645 17.761 -7.051 1.00 0.00 C ATOM 464 CG GLU A 29 19.944 18.483 -6.666 1.00 0.00 C ATOM 465 CD GLU A 29 20.874 18.704 -7.874 1.00 0.00 C ATOM 466 OE1 GLU A 29 20.699 19.704 -8.608 1.00 0.00 O ATOM 467 OE2 GLU A 29 21.805 17.896 -8.091 1.00 0.00 O ATOM 0 H GLU A 29 16.882 15.529 -7.294 1.00 0.00 H new ATOM 0 HA GLU A 29 19.579 16.176 -8.268 1.00 0.00 H new ATOM 0 HB2 GLU A 29 18.166 18.312 -7.860 1.00 0.00 H new ATOM 0 HB3 GLU A 29 17.965 17.789 -6.200 1.00 0.00 H new ATOM 0 HG2 GLU A 29 19.702 19.446 -6.217 1.00 0.00 H new ATOM 0 HG3 GLU A 29 20.469 17.901 -5.909 1.00 0.00 H new ATOM 474 N LYS A 30 18.488 15.164 -5.323 1.00 0.00 N ATOM 475 CA LYS A 30 18.878 14.427 -4.118 1.00 0.00 C ATOM 476 C LYS A 30 17.699 13.558 -3.659 1.00 0.00 C ATOM 477 O LYS A 30 16.565 13.891 -4.015 1.00 0.00 O ATOM 478 CB LYS A 30 19.367 15.424 -3.041 1.00 0.00 C ATOM 479 CG LYS A 30 18.243 16.271 -2.418 1.00 0.00 C ATOM 480 CD LYS A 30 18.760 17.471 -1.611 1.00 0.00 C ATOM 481 CE LYS A 30 17.562 18.185 -0.960 1.00 0.00 C ATOM 482 NZ LYS A 30 17.913 19.497 -0.361 1.00 0.00 N ATOM 0 H LYS A 30 17.507 15.443 -5.329 1.00 0.00 H new ATOM 0 HA LYS A 30 19.711 13.753 -4.319 1.00 0.00 H new ATOM 0 HB2 LYS A 30 19.872 14.870 -2.250 1.00 0.00 H new ATOM 0 HB3 LYS A 30 20.106 16.090 -3.486 1.00 0.00 H new ATOM 0 HG2 LYS A 30 17.587 16.631 -3.211 1.00 0.00 H new ATOM 0 HG3 LYS A 30 17.639 15.638 -1.768 1.00 0.00 H new ATOM 0 HD2 LYS A 30 19.461 17.137 -0.846 1.00 0.00 H new ATOM 0 HD3 LYS A 30 19.301 18.158 -2.262 1.00 0.00 H new ATOM 0 HE2 LYS A 30 16.785 18.332 -1.710 1.00 0.00 H new ATOM 0 HE3 LYS A 30 17.141 17.542 -0.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 17.118 20.157 -0.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 18.113 19.374 0.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 18.755 19.881 -0.835 1.00 0.00 H new ATOM 496 N PRO A 31 17.938 12.447 -2.933 1.00 0.00 N ATOM 497 CA PRO A 31 16.899 11.578 -2.384 1.00 0.00 C ATOM 498 C PRO A 31 15.757 12.307 -1.671 1.00 0.00 C ATOM 499 O PRO A 31 15.876 13.468 -1.267 1.00 0.00 O ATOM 500 CB PRO A 31 17.632 10.624 -1.434 1.00 0.00 C ATOM 501 CG PRO A 31 18.991 10.470 -2.103 1.00 0.00 C ATOM 502 CD PRO A 31 19.251 11.869 -2.659 1.00 0.00 C ATOM 0 HA PRO A 31 16.390 11.063 -3.199 1.00 0.00 H new ATOM 0 HB2 PRO A 31 17.719 11.039 -0.430 1.00 0.00 H new ATOM 0 HB3 PRO A 31 17.115 9.669 -1.340 1.00 0.00 H new ATOM 0 HG2 PRO A 31 19.760 10.167 -1.393 1.00 0.00 H new ATOM 0 HG3 PRO A 31 18.971 9.718 -2.892 1.00 0.00 H new ATOM 0 HD2 PRO A 31 19.802 12.477 -1.942 1.00 0.00 H new ATOM 0 HD3 PRO A 31 19.853 11.822 -3.566 1.00 0.00 H new ATOM 510 N THR A 32 14.661 11.588 -1.448 1.00 0.00 N ATOM 511 CA THR A 32 13.472 12.096 -0.769 1.00 0.00 C ATOM 512 C THR A 32 12.929 11.055 0.223 1.00 0.00 C ATOM 513 O THR A 32 13.152 9.854 0.069 1.00 0.00 O ATOM 514 CB THR A 32 12.439 12.499 -1.836 1.00 0.00 C ATOM 515 OG1 THR A 32 12.976 13.499 -2.681 1.00 0.00 O ATOM 516 CG2 THR A 32 11.124 13.052 -1.268 1.00 0.00 C ATOM 0 H THR A 32 14.572 10.615 -1.740 1.00 0.00 H new ATOM 0 HA THR A 32 13.715 12.978 -0.176 1.00 0.00 H new ATOM 0 HB THR A 32 12.216 11.576 -2.371 1.00 0.00 H new ATOM 0 HG1 THR A 32 12.266 13.861 -3.252 1.00 0.00 H new ATOM 0 HG21 THR A 32 10.454 13.311 -2.088 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.653 12.296 -0.639 1.00 0.00 H new ATOM 0 HG23 THR A 32 11.330 13.942 -0.673 1.00 0.00 H new ATOM 524 N LEU A 33 12.194 11.519 1.234 1.00 0.00 N ATOM 525 CA LEU A 33 11.556 10.726 2.280 1.00 0.00 C ATOM 526 C LEU A 33 10.106 11.193 2.415 1.00 0.00 C ATOM 527 O LEU A 33 9.877 12.403 2.460 1.00 0.00 O ATOM 528 CB LEU A 33 12.300 11.008 3.599 1.00 0.00 C ATOM 529 CG LEU A 33 12.097 10.028 4.766 1.00 0.00 C ATOM 530 CD1 LEU A 33 10.661 9.765 5.193 1.00 0.00 C ATOM 531 CD2 LEU A 33 12.837 8.722 4.497 1.00 0.00 C ATOM 0 H LEU A 33 12.019 12.517 1.350 1.00 0.00 H new ATOM 0 HA LEU A 33 11.585 9.662 2.045 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.367 11.048 3.379 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.008 12.001 3.942 1.00 0.00 H new ATOM 0 HG LEU A 33 12.526 10.543 5.626 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.652 9.058 6.023 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.198 10.700 5.507 1.00 0.00 H new ATOM 0 HD13 LEU A 33 10.103 9.347 4.355 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.684 8.038 5.332 1.00 0.00 H new ATOM 0 HD22 LEU A 33 12.455 8.269 3.582 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.902 8.924 4.384 1.00 0.00 H new ATOM 543 N ILE A 34 9.153 10.265 2.532 1.00 0.00 N ATOM 544 CA ILE A 34 7.767 10.557 2.891 1.00 0.00 C ATOM 545 C ILE A 34 7.461 9.774 4.180 1.00 0.00 C ATOM 546 O ILE A 34 7.561 8.543 4.181 1.00 0.00 O ATOM 547 CB ILE A 34 6.792 10.188 1.747 1.00 0.00 C ATOM 548 CG1 ILE A 34 7.228 10.754 0.372 1.00 0.00 C ATOM 549 CG2 ILE A 34 5.383 10.699 2.102 1.00 0.00 C ATOM 550 CD1 ILE A 34 6.352 10.256 -0.783 1.00 0.00 C ATOM 0 H ILE A 34 9.328 9.272 2.377 1.00 0.00 H new ATOM 0 HA ILE A 34 7.632 11.626 3.057 1.00 0.00 H new ATOM 0 HB ILE A 34 6.796 9.102 1.652 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.192 11.843 0.405 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.264 10.475 0.182 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.690 10.443 1.300 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.051 10.235 3.031 1.00 0.00 H new ATOM 0 HG23 ILE A 34 5.409 11.782 2.226 1.00 0.00 H new ATOM 0 HD11 ILE A 34 6.706 10.686 -1.720 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.407 9.169 -0.839 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.319 10.558 -0.612 1.00 0.00 H new ATOM 562 N HIS A 35 7.108 10.462 5.275 1.00 0.00 N ATOM 563 CA HIS A 35 6.589 9.811 6.486 1.00 0.00 C ATOM 564 C HIS A 35 5.057 9.793 6.455 1.00 0.00 C ATOM 565 O HIS A 35 4.433 10.647 5.823 1.00 0.00 O ATOM 566 CB HIS A 35 7.016 10.521 7.784 1.00 0.00 C ATOM 567 CG HIS A 35 8.471 10.883 7.901 1.00 0.00 C ATOM 568 ND1 HIS A 35 9.471 10.163 8.521 1.00 0.00 N ATOM 569 CD2 HIS A 35 9.017 12.064 7.488 1.00 0.00 C ATOM 570 CE1 HIS A 35 10.601 10.883 8.443 1.00 0.00 C ATOM 571 NE2 HIS A 35 10.373 12.058 7.836 1.00 0.00 N ATOM 0 H HIS A 35 7.173 11.477 5.346 1.00 0.00 H new ATOM 0 HA HIS A 35 7.006 8.804 6.488 1.00 0.00 H new ATOM 0 HB2 HIS A 35 6.428 11.433 7.884 1.00 0.00 H new ATOM 0 HB3 HIS A 35 6.755 9.880 8.626 1.00 0.00 H new ATOM 0 HD1 HIS A 35 9.370 9.248 8.960 1.00 0.00 H new ATOM 0 HD2 HIS A 35 8.495 12.862 6.982 1.00 0.00 H new ATOM 0 HE1 HIS A 35 11.562 10.561 8.817 1.00 0.00 H new ATOM 579 N PHE A 36 4.461 8.901 7.242 1.00 0.00 N ATOM 580 CA PHE A 36 3.031 8.726 7.443 1.00 0.00 C ATOM 581 C PHE A 36 2.851 8.547 8.945 1.00 0.00 C ATOM 582 O PHE A 36 3.490 7.665 9.514 1.00 0.00 O ATOM 583 CB PHE A 36 2.544 7.493 6.672 1.00 0.00 C ATOM 584 CG PHE A 36 2.706 7.637 5.172 1.00 0.00 C ATOM 585 CD1 PHE A 36 3.929 7.304 4.557 1.00 0.00 C ATOM 586 CD2 PHE A 36 1.656 8.170 4.401 1.00 0.00 C ATOM 587 CE1 PHE A 36 4.107 7.527 3.182 1.00 0.00 C ATOM 588 CE2 PHE A 36 1.830 8.377 3.024 1.00 0.00 C ATOM 589 CZ PHE A 36 3.059 8.065 2.417 1.00 0.00 C ATOM 0 H PHE A 36 5.005 8.237 7.793 1.00 0.00 H new ATOM 0 HA PHE A 36 2.452 9.574 7.078 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.097 6.617 7.010 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.494 7.316 6.904 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.730 6.877 5.143 1.00 0.00 H new ATOM 0 HD2 PHE A 36 0.716 8.420 4.870 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.049 7.285 2.713 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.020 8.776 2.431 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.198 8.239 1.360 1.00 0.00 H new ATOM 599 N TRP A 37 2.063 9.386 9.612 1.00 0.00 N ATOM 600 CA TRP A 37 2.000 9.404 11.080 1.00 0.00 C ATOM 601 C TRP A 37 0.658 9.966 11.559 1.00 0.00 C ATOM 602 O TRP A 37 -0.072 10.570 10.772 1.00 0.00 O ATOM 603 CB TRP A 37 3.182 10.221 11.636 1.00 0.00 C ATOM 604 CG TRP A 37 3.245 11.643 11.175 1.00 0.00 C ATOM 605 CD1 TRP A 37 3.494 12.034 9.908 1.00 0.00 C ATOM 606 CD2 TRP A 37 3.070 12.873 11.941 1.00 0.00 C ATOM 607 NE1 TRP A 37 3.349 13.403 9.809 1.00 0.00 N ATOM 608 CE2 TRP A 37 3.115 13.977 11.038 1.00 0.00 C ATOM 609 CE3 TRP A 37 2.907 13.176 13.309 1.00 0.00 C ATOM 610 CZ2 TRP A 37 2.936 15.302 11.463 1.00 0.00 C ATOM 611 CZ3 TRP A 37 2.809 14.509 13.753 1.00 0.00 C ATOM 612 CH2 TRP A 37 2.789 15.569 12.833 1.00 0.00 C ATOM 0 H TRP A 37 1.454 10.068 9.160 1.00 0.00 H new ATOM 0 HA TRP A 37 2.076 8.383 11.455 1.00 0.00 H new ATOM 0 HB2 TRP A 37 3.130 10.211 12.725 1.00 0.00 H new ATOM 0 HB3 TRP A 37 4.111 9.723 11.356 1.00 0.00 H new ATOM 0 HD1 TRP A 37 3.765 11.376 9.095 1.00 0.00 H new ATOM 0 HE1 TRP A 37 3.408 13.924 8.934 1.00 0.00 H new ATOM 0 HE3 TRP A 37 2.856 12.372 14.028 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 2.912 16.108 10.744 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 2.749 14.718 14.811 1.00 0.00 H new ATOM 0 HH2 TRP A 37 2.661 16.585 13.178 1.00 0.00 H new ATOM 623 N SER A 38 0.349 9.775 12.844 1.00 0.00 N ATOM 624 CA SER A 38 -0.910 10.142 13.478 1.00 0.00 C ATOM 625 C SER A 38 -0.595 10.638 14.893 1.00 0.00 C ATOM 626 O SER A 38 0.016 9.899 15.666 1.00 0.00 O ATOM 627 CB SER A 38 -1.826 8.913 13.533 1.00 0.00 C ATOM 628 OG SER A 38 -2.184 8.474 12.237 1.00 0.00 O ATOM 0 H SER A 38 1.002 9.341 13.496 1.00 0.00 H new ATOM 0 HA SER A 38 -1.418 10.925 12.915 1.00 0.00 H new ATOM 0 HB2 SER A 38 -1.322 8.106 14.065 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.726 9.154 14.098 1.00 0.00 H new ATOM 0 HG SER A 38 -2.762 9.142 11.813 1.00 0.00 H new ATOM 634 N ILE A 39 -0.987 11.868 15.260 1.00 0.00 N ATOM 635 CA ILE A 39 -0.680 12.428 16.586 1.00 0.00 C ATOM 636 C ILE A 39 -1.280 11.590 17.731 1.00 0.00 C ATOM 637 O ILE A 39 -0.838 11.696 18.871 1.00 0.00 O ATOM 638 CB ILE A 39 -1.068 13.925 16.719 1.00 0.00 C ATOM 639 CG1 ILE A 39 -2.571 14.223 16.558 1.00 0.00 C ATOM 640 CG2 ILE A 39 -0.266 14.798 15.745 1.00 0.00 C ATOM 641 CD1 ILE A 39 -2.926 15.678 16.881 1.00 0.00 C ATOM 0 H ILE A 39 -1.518 12.495 14.656 1.00 0.00 H new ATOM 0 HA ILE A 39 0.405 12.377 16.678 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.815 14.177 17.749 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.874 13.998 15.535 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.140 13.561 17.211 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.561 15.841 15.863 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.798 14.696 15.957 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.465 14.478 14.722 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.998 15.829 16.750 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.652 15.899 17.913 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.382 16.343 16.210 1.00 0.00 H new ATOM 653 N SER A 40 -2.260 10.740 17.443 1.00 0.00 N ATOM 654 CA SER A 40 -2.877 9.834 18.398 1.00 0.00 C ATOM 655 C SER A 40 -1.938 8.729 18.906 1.00 0.00 C ATOM 656 O SER A 40 -2.222 8.135 19.950 1.00 0.00 O ATOM 657 CB SER A 40 -4.093 9.209 17.712 1.00 0.00 C ATOM 658 OG SER A 40 -3.775 8.818 16.384 1.00 0.00 O ATOM 0 H SER A 40 -2.658 10.662 16.507 1.00 0.00 H new ATOM 0 HA SER A 40 -3.152 10.410 19.282 1.00 0.00 H new ATOM 0 HB2 SER A 40 -4.432 8.343 18.280 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.916 9.923 17.699 1.00 0.00 H new ATOM 0 HG SER A 40 -4.150 9.468 15.753 1.00 0.00 H new ATOM 664 N CYS A 41 -0.837 8.433 18.202 1.00 0.00 N ATOM 665 CA CYS A 41 -0.003 7.266 18.468 1.00 0.00 C ATOM 666 C CYS A 41 1.317 7.697 19.111 1.00 0.00 C ATOM 667 O CYS A 41 2.023 8.546 18.565 1.00 0.00 O ATOM 668 CB CYS A 41 0.241 6.546 17.134 1.00 0.00 C ATOM 669 SG CYS A 41 -1.336 6.027 16.388 1.00 0.00 S ATOM 0 H CYS A 41 -0.502 9.005 17.427 1.00 0.00 H new ATOM 0 HA CYS A 41 -0.499 6.590 19.164 1.00 0.00 H new ATOM 0 HB2 CYS A 41 0.773 7.207 16.450 1.00 0.00 H new ATOM 0 HB3 CYS A 41 0.877 5.676 17.295 1.00 0.00 H new ATOM 0 HG CYS A 41 -1.105 5.423 15.260 1.00 0.00 H new ATOM 675 N HIS A 42 1.686 7.102 20.250 1.00 0.00 N ATOM 676 CA HIS A 42 2.856 7.553 21.007 1.00 0.00 C ATOM 677 C HIS A 42 4.166 7.383 20.228 1.00 0.00 C ATOM 678 O HIS A 42 5.053 8.232 20.310 1.00 0.00 O ATOM 679 CB HIS A 42 2.921 6.881 22.391 1.00 0.00 C ATOM 680 CG HIS A 42 3.461 5.467 22.411 1.00 0.00 C ATOM 681 ND1 HIS A 42 4.685 5.078 22.912 1.00 0.00 N ATOM 682 CD2 HIS A 42 2.833 4.331 21.967 1.00 0.00 C ATOM 683 CE1 HIS A 42 4.786 3.744 22.780 1.00 0.00 C ATOM 684 NE2 HIS A 42 3.678 3.240 22.207 1.00 0.00 N ATOM 0 H HIS A 42 1.194 6.311 20.666 1.00 0.00 H new ATOM 0 HA HIS A 42 2.734 8.625 21.165 1.00 0.00 H new ATOM 0 HB2 HIS A 42 3.540 7.496 23.044 1.00 0.00 H new ATOM 0 HB3 HIS A 42 1.918 6.873 22.818 1.00 0.00 H new ATOM 0 HD2 HIS A 42 1.855 4.286 21.511 1.00 0.00 H new ATOM 0 HE1 HIS A 42 5.638 3.158 23.091 1.00 0.00 H new ATOM 0 HE2 HIS A 42 3.491 2.261 21.991 1.00 0.00 H new ATOM 692 N LEU A 43 4.275 6.328 19.414 1.00 0.00 N ATOM 693 CA LEU A 43 5.465 6.112 18.589 1.00 0.00 C ATOM 694 C LEU A 43 5.593 7.208 17.536 1.00 0.00 C ATOM 695 O LEU A 43 6.716 7.580 17.202 1.00 0.00 O ATOM 696 CB LEU A 43 5.458 4.729 17.914 1.00 0.00 C ATOM 697 CG LEU A 43 5.515 3.539 18.891 1.00 0.00 C ATOM 698 CD1 LEU A 43 5.498 2.225 18.104 1.00 0.00 C ATOM 699 CD2 LEU A 43 6.737 3.573 19.819 1.00 0.00 C ATOM 0 H LEU A 43 3.555 5.613 19.310 1.00 0.00 H new ATOM 0 HA LEU A 43 6.328 6.150 19.254 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.558 4.640 17.306 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.308 4.666 17.235 1.00 0.00 H new ATOM 0 HG LEU A 43 4.635 3.613 19.530 1.00 0.00 H new ATOM 0 HD11 LEU A 43 5.538 1.385 18.797 1.00 0.00 H new ATOM 0 HD12 LEU A 43 4.583 2.166 17.515 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.361 2.188 17.439 1.00 0.00 H new ATOM 0 HD21 LEU A 43 6.716 2.707 20.481 1.00 0.00 H new ATOM 0 HD22 LEU A 43 7.648 3.551 19.221 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.716 4.486 20.415 1.00 0.00 H new ATOM 711 N CYS A 44 4.477 7.777 17.055 1.00 0.00 N ATOM 712 CA CYS A 44 4.540 8.968 16.219 1.00 0.00 C ATOM 713 C CYS A 44 5.157 10.108 17.023 1.00 0.00 C ATOM 714 O CYS A 44 6.084 10.739 16.535 1.00 0.00 O ATOM 715 CB CYS A 44 3.170 9.350 15.646 1.00 0.00 C ATOM 716 SG CYS A 44 2.554 8.029 14.560 1.00 0.00 S ATOM 0 H CYS A 44 3.534 7.431 17.232 1.00 0.00 H new ATOM 0 HA CYS A 44 5.171 8.756 15.356 1.00 0.00 H new ATOM 0 HB2 CYS A 44 2.463 9.523 16.458 1.00 0.00 H new ATOM 0 HB3 CYS A 44 3.248 10.283 15.088 1.00 0.00 H new ATOM 0 HG CYS A 44 2.421 6.932 15.244 1.00 0.00 H new ATOM 722 N LYS A 45 4.734 10.338 18.269 1.00 0.00 N ATOM 723 CA LYS A 45 5.294 11.425 19.076 1.00 0.00 C ATOM 724 C LYS A 45 6.774 11.258 19.408 1.00 0.00 C ATOM 725 O LYS A 45 7.379 12.229 19.850 1.00 0.00 O ATOM 726 CB LYS A 45 4.572 11.592 20.412 1.00 0.00 C ATOM 727 CG LYS A 45 3.040 11.685 20.369 1.00 0.00 C ATOM 728 CD LYS A 45 2.538 12.734 19.363 1.00 0.00 C ATOM 729 CE LYS A 45 1.277 13.454 19.874 1.00 0.00 C ATOM 730 NZ LYS A 45 1.565 14.429 20.960 1.00 0.00 N ATOM 0 H LYS A 45 4.012 9.791 18.738 1.00 0.00 H new ATOM 0 HA LYS A 45 5.159 12.299 18.439 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.843 10.751 21.051 1.00 0.00 H new ATOM 0 HB3 LYS A 45 4.953 12.493 20.893 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.628 10.710 20.108 1.00 0.00 H new ATOM 0 HG3 LYS A 45 2.667 11.933 21.363 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.324 13.465 19.177 1.00 0.00 H new ATOM 0 HD3 LYS A 45 2.320 12.250 18.411 1.00 0.00 H new ATOM 0 HE2 LYS A 45 0.800 13.974 19.043 1.00 0.00 H new ATOM 0 HE3 LYS A 45 0.564 12.714 20.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 0.704 14.589 21.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 2.314 14.052 21.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 1.879 15.329 20.544 1.00 0.00 H new ATOM 744 N GLU A 46 7.349 10.068 19.259 1.00 0.00 N ATOM 745 CA GLU A 46 8.778 9.828 19.474 1.00 0.00 C ATOM 746 C GLU A 46 9.537 9.936 18.140 1.00 0.00 C ATOM 747 O GLU A 46 10.629 10.516 18.045 1.00 0.00 O ATOM 748 CB GLU A 46 8.941 8.434 20.098 1.00 0.00 C ATOM 749 CG GLU A 46 8.303 8.325 21.496 1.00 0.00 C ATOM 750 CD GLU A 46 9.148 9.026 22.576 1.00 0.00 C ATOM 751 OE1 GLU A 46 10.103 8.412 23.103 1.00 0.00 O ATOM 752 OE2 GLU A 46 8.854 10.190 22.929 1.00 0.00 O ATOM 0 H GLU A 46 6.833 9.233 18.983 1.00 0.00 H new ATOM 0 HA GLU A 46 9.195 10.576 20.148 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.490 7.692 19.439 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.002 8.195 20.169 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.306 8.765 21.474 1.00 0.00 H new ATOM 0 HG3 GLU A 46 8.181 7.274 21.757 1.00 0.00 H new ATOM 759 N ALA A 47 8.916 9.450 17.063 1.00 0.00 N ATOM 760 CA ALA A 47 9.443 9.654 15.736 1.00 0.00 C ATOM 761 C ALA A 47 9.490 11.142 15.438 1.00 0.00 C ATOM 762 O ALA A 47 10.481 11.576 14.888 1.00 0.00 O ATOM 763 CB ALA A 47 8.597 8.910 14.699 1.00 0.00 C ATOM 0 H ALA A 47 8.049 8.914 17.096 1.00 0.00 H new ATOM 0 HA ALA A 47 10.455 9.252 15.683 1.00 0.00 H new ATOM 0 HB1 ALA A 47 9.011 9.077 13.705 1.00 0.00 H new ATOM 0 HB2 ALA A 47 8.605 7.843 14.921 1.00 0.00 H new ATOM 0 HB3 ALA A 47 7.572 9.280 14.732 1.00 0.00 H new ATOM 769 N MET A 48 8.500 11.938 15.834 1.00 0.00 N ATOM 770 CA MET A 48 8.429 13.351 15.498 1.00 0.00 C ATOM 771 C MET A 48 9.627 14.194 15.980 1.00 0.00 C ATOM 772 O MET A 48 10.186 14.923 15.159 1.00 0.00 O ATOM 773 CB MET A 48 7.077 13.934 15.934 1.00 0.00 C ATOM 774 CG MET A 48 5.860 13.459 15.118 1.00 0.00 C ATOM 775 SD MET A 48 6.148 12.578 13.548 1.00 0.00 S ATOM 776 CE MET A 48 6.459 13.995 12.465 1.00 0.00 C ATOM 0 H MET A 48 7.718 11.613 16.403 1.00 0.00 H new ATOM 0 HA MET A 48 8.501 13.411 14.412 1.00 0.00 H new ATOM 0 HB2 MET A 48 6.912 13.681 16.981 1.00 0.00 H new ATOM 0 HB3 MET A 48 7.132 15.021 15.873 1.00 0.00 H new ATOM 0 HG2 MET A 48 5.267 12.807 15.759 1.00 0.00 H new ATOM 0 HG3 MET A 48 5.247 14.334 14.899 1.00 0.00 H new ATOM 0 HE1 MET A 48 6.674 13.642 11.456 1.00 0.00 H new ATOM 0 HE2 MET A 48 5.579 14.637 12.444 1.00 0.00 H new ATOM 0 HE3 MET A 48 7.312 14.560 12.841 1.00 0.00 H new ATOM 786 N PRO A 49 10.110 14.108 17.232 1.00 0.00 N ATOM 787 CA PRO A 49 11.363 14.742 17.610 1.00 0.00 C ATOM 788 C PRO A 49 12.532 14.158 16.820 1.00 0.00 C ATOM 789 O PRO A 49 13.431 14.915 16.440 1.00 0.00 O ATOM 790 CB PRO A 49 11.529 14.534 19.117 1.00 0.00 C ATOM 791 CG PRO A 49 10.558 13.413 19.466 1.00 0.00 C ATOM 792 CD PRO A 49 9.480 13.524 18.391 1.00 0.00 C ATOM 0 HA PRO A 49 11.349 15.807 17.378 1.00 0.00 H new ATOM 0 HB2 PRO A 49 12.554 14.261 19.368 1.00 0.00 H new ATOM 0 HB3 PRO A 49 11.297 15.444 19.670 1.00 0.00 H new ATOM 0 HG2 PRO A 49 11.046 12.439 19.445 1.00 0.00 H new ATOM 0 HG3 PRO A 49 10.142 13.540 20.466 1.00 0.00 H new ATOM 0 HD2 PRO A 49 9.067 12.543 18.154 1.00 0.00 H new ATOM 0 HD3 PRO A 49 8.652 14.144 18.735 1.00 0.00 H new ATOM 800 N GLN A 50 12.524 12.853 16.513 1.00 0.00 N ATOM 801 CA GLN A 50 13.570 12.338 15.635 1.00 0.00 C ATOM 802 C GLN A 50 13.487 12.935 14.229 1.00 0.00 C ATOM 803 O GLN A 50 14.533 13.258 13.677 1.00 0.00 O ATOM 804 CB GLN A 50 13.612 10.811 15.598 1.00 0.00 C ATOM 805 CG GLN A 50 14.165 10.276 16.923 1.00 0.00 C ATOM 806 CD GLN A 50 14.627 8.830 16.787 1.00 0.00 C ATOM 807 OE1 GLN A 50 14.094 7.912 17.397 1.00 0.00 O ATOM 808 NE2 GLN A 50 15.596 8.562 15.930 1.00 0.00 N ATOM 0 H GLN A 50 11.841 12.170 16.842 1.00 0.00 H new ATOM 0 HA GLN A 50 14.515 12.664 16.069 1.00 0.00 H new ATOM 0 HB2 GLN A 50 12.612 10.414 15.424 1.00 0.00 H new ATOM 0 HB3 GLN A 50 14.237 10.475 14.770 1.00 0.00 H new ATOM 0 HG2 GLN A 50 14.999 10.897 17.249 1.00 0.00 H new ATOM 0 HG3 GLN A 50 13.397 10.344 17.694 1.00 0.00 H new ATOM 0 HE21 GLN A 50 16.047 9.319 15.417 1.00 0.00 H new ATOM 0 HE22 GLN A 50 15.893 7.598 15.782 1.00 0.00 H new ATOM 817 N VAL A 51 12.291 13.150 13.674 1.00 0.00 N ATOM 818 CA VAL A 51 12.081 13.825 12.400 1.00 0.00 C ATOM 819 C VAL A 51 12.750 15.191 12.490 1.00 0.00 C ATOM 820 O VAL A 51 13.406 15.564 11.526 1.00 0.00 O ATOM 821 CB VAL A 51 10.580 13.911 12.001 1.00 0.00 C ATOM 822 CG1 VAL A 51 10.353 14.734 10.724 1.00 0.00 C ATOM 823 CG2 VAL A 51 9.921 12.551 11.728 1.00 0.00 C ATOM 0 H VAL A 51 11.421 12.849 14.114 1.00 0.00 H new ATOM 0 HA VAL A 51 12.534 13.245 11.596 1.00 0.00 H new ATOM 0 HB VAL A 51 10.129 14.381 12.875 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.288 14.761 10.493 1.00 0.00 H new ATOM 0 HG12 VAL A 51 10.717 15.750 10.877 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.893 14.276 9.895 1.00 0.00 H new ATOM 0 HG21 VAL A 51 8.876 12.701 11.457 1.00 0.00 H new ATOM 0 HG22 VAL A 51 10.441 12.053 10.910 1.00 0.00 H new ATOM 0 HG23 VAL A 51 9.978 11.933 12.624 1.00 0.00 H new ATOM 833 N ASN A 52 12.682 15.904 13.625 1.00 0.00 N ATOM 834 CA ASN A 52 13.351 17.198 13.750 1.00 0.00 C ATOM 835 C ASN A 52 14.864 17.080 13.536 1.00 0.00 C ATOM 836 O ASN A 52 15.419 17.825 12.719 1.00 0.00 O ATOM 837 CB ASN A 52 12.988 17.887 15.078 1.00 0.00 C ATOM 838 CG ASN A 52 14.186 18.257 15.958 1.00 0.00 C ATOM 839 OD1 ASN A 52 14.831 19.279 15.754 1.00 0.00 O ATOM 840 ND2 ASN A 52 14.534 17.428 16.928 1.00 0.00 N ATOM 0 H ASN A 52 12.175 15.606 14.458 1.00 0.00 H new ATOM 0 HA ASN A 52 12.983 17.842 12.952 1.00 0.00 H new ATOM 0 HB2 ASN A 52 12.423 18.793 14.859 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.329 17.229 15.644 1.00 0.00 H new ATOM 0 HD21 ASN A 52 15.344 17.637 17.512 1.00 0.00 H new ATOM 0 HD22 ASN A 52 13.993 16.579 17.092 1.00 0.00 H new ATOM 847 N GLU A 53 15.549 16.169 14.231 1.00 0.00 N ATOM 848 CA GLU A 53 17.009 16.129 14.116 1.00 0.00 C ATOM 849 C GLU A 53 17.431 15.514 12.779 1.00 0.00 C ATOM 850 O GLU A 53 18.405 15.949 12.176 1.00 0.00 O ATOM 851 CB GLU A 53 17.676 15.445 15.320 1.00 0.00 C ATOM 852 CG GLU A 53 17.281 13.981 15.550 1.00 0.00 C ATOM 853 CD GLU A 53 18.188 13.326 16.604 1.00 0.00 C ATOM 854 OE1 GLU A 53 19.288 12.858 16.227 1.00 0.00 O ATOM 855 OE2 GLU A 53 17.812 13.265 17.796 1.00 0.00 O ATOM 0 H GLU A 53 15.138 15.475 14.855 1.00 0.00 H new ATOM 0 HA GLU A 53 17.369 17.158 14.130 1.00 0.00 H new ATOM 0 HB2 GLU A 53 18.757 15.495 15.191 1.00 0.00 H new ATOM 0 HB3 GLU A 53 17.435 16.014 16.218 1.00 0.00 H new ATOM 0 HG2 GLU A 53 16.242 13.928 15.875 1.00 0.00 H new ATOM 0 HG3 GLU A 53 17.350 13.430 14.612 1.00 0.00 H new ATOM 862 N PHE A 54 16.672 14.547 12.274 1.00 0.00 N ATOM 863 CA PHE A 54 16.888 13.864 11.009 1.00 0.00 C ATOM 864 C PHE A 54 16.756 14.882 9.877 1.00 0.00 C ATOM 865 O PHE A 54 17.614 14.963 8.998 1.00 0.00 O ATOM 866 CB PHE A 54 15.822 12.763 10.977 1.00 0.00 C ATOM 867 CG PHE A 54 15.608 11.954 9.724 1.00 0.00 C ATOM 868 CD1 PHE A 54 14.652 12.393 8.791 1.00 0.00 C ATOM 869 CD2 PHE A 54 16.172 10.669 9.609 1.00 0.00 C ATOM 870 CE1 PHE A 54 14.229 11.534 7.769 1.00 0.00 C ATOM 871 CE2 PHE A 54 15.745 9.810 8.582 1.00 0.00 C ATOM 872 CZ PHE A 54 14.757 10.238 7.677 1.00 0.00 C ATOM 0 H PHE A 54 15.847 14.202 12.764 1.00 0.00 H new ATOM 0 HA PHE A 54 17.877 13.420 10.894 1.00 0.00 H new ATOM 0 HB2 PHE A 54 16.056 12.062 11.778 1.00 0.00 H new ATOM 0 HB3 PHE A 54 14.869 13.228 11.229 1.00 0.00 H new ATOM 0 HD1 PHE A 54 14.245 13.391 8.862 1.00 0.00 H new ATOM 0 HD2 PHE A 54 16.930 10.345 10.307 1.00 0.00 H new ATOM 0 HE1 PHE A 54 13.495 11.870 7.051 1.00 0.00 H new ATOM 0 HE2 PHE A 54 16.174 8.824 8.488 1.00 0.00 H new ATOM 0 HZ PHE A 54 14.404 9.566 6.909 1.00 0.00 H new ATOM 882 N ARG A 55 15.727 15.731 9.954 1.00 0.00 N ATOM 883 CA ARG A 55 15.509 16.821 9.022 1.00 0.00 C ATOM 884 C ARG A 55 16.703 17.752 9.003 1.00 0.00 C ATOM 885 O ARG A 55 17.127 18.131 7.919 1.00 0.00 O ATOM 886 CB ARG A 55 14.172 17.515 9.360 1.00 0.00 C ATOM 887 CG ARG A 55 13.853 18.902 8.756 1.00 0.00 C ATOM 888 CD ARG A 55 14.549 20.117 9.406 1.00 0.00 C ATOM 889 NE ARG A 55 14.690 19.980 10.871 1.00 0.00 N ATOM 890 CZ ARG A 55 14.164 20.737 11.846 1.00 0.00 C ATOM 891 NH1 ARG A 55 13.337 21.738 11.610 1.00 0.00 N ATOM 892 NH2 ARG A 55 14.455 20.475 13.109 1.00 0.00 N ATOM 0 H ARG A 55 15.014 15.672 10.681 1.00 0.00 H new ATOM 0 HA ARG A 55 15.422 16.445 8.003 1.00 0.00 H new ATOM 0 HB2 ARG A 55 13.370 16.839 9.063 1.00 0.00 H new ATOM 0 HB3 ARG A 55 14.121 17.613 10.444 1.00 0.00 H new ATOM 0 HG2 ARG A 55 14.119 18.882 7.699 1.00 0.00 H new ATOM 0 HG3 ARG A 55 12.776 19.057 8.811 1.00 0.00 H new ATOM 0 HD2 ARG A 55 15.536 20.246 8.961 1.00 0.00 H new ATOM 0 HD3 ARG A 55 13.979 21.019 9.183 1.00 0.00 H new ATOM 0 HE ARG A 55 15.268 19.201 11.185 1.00 0.00 H new ATOM 0 HH11 ARG A 55 13.071 21.965 10.652 1.00 0.00 H new ATOM 0 HH12 ARG A 55 12.963 22.285 12.386 1.00 0.00 H new ATOM 0 HH21 ARG A 55 15.077 19.700 13.339 1.00 0.00 H new ATOM 0 HH22 ARG A 55 14.057 21.048 13.853 1.00 0.00 H new ATOM 906 N ASP A 56 17.267 18.120 10.152 1.00 0.00 N ATOM 907 CA ASP A 56 18.357 19.093 10.174 1.00 0.00 C ATOM 908 C ASP A 56 19.644 18.457 9.665 1.00 0.00 C ATOM 909 O ASP A 56 20.357 19.051 8.855 1.00 0.00 O ATOM 910 CB ASP A 56 18.567 19.608 11.591 1.00 0.00 C ATOM 911 CG ASP A 56 19.761 20.574 11.652 1.00 0.00 C ATOM 912 OD1 ASP A 56 19.641 21.720 11.164 1.00 0.00 O ATOM 913 OD2 ASP A 56 20.818 20.202 12.209 1.00 0.00 O ATOM 0 H ASP A 56 16.992 17.765 11.068 1.00 0.00 H new ATOM 0 HA ASP A 56 18.092 19.926 9.523 1.00 0.00 H new ATOM 0 HB2 ASP A 56 17.666 20.115 11.935 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.738 18.769 12.266 1.00 0.00 H new ATOM 918 N LYS A 57 19.916 17.222 10.100 1.00 0.00 N ATOM 919 CA LYS A 57 21.134 16.517 9.738 1.00 0.00 C ATOM 920 C LYS A 57 21.200 16.237 8.240 1.00 0.00 C ATOM 921 O LYS A 57 22.303 16.221 7.690 1.00 0.00 O ATOM 922 CB LYS A 57 21.258 15.204 10.528 1.00 0.00 C ATOM 923 CG LYS A 57 21.615 15.456 12.004 1.00 0.00 C ATOM 924 CD LYS A 57 21.683 14.172 12.845 1.00 0.00 C ATOM 925 CE LYS A 57 20.373 13.375 12.808 1.00 0.00 C ATOM 926 NZ LYS A 57 20.379 12.248 13.765 1.00 0.00 N ATOM 0 H LYS A 57 19.295 16.691 10.711 1.00 0.00 H new ATOM 0 HA LYS A 57 21.972 17.165 9.995 1.00 0.00 H new ATOM 0 HB2 LYS A 57 20.318 14.655 10.470 1.00 0.00 H new ATOM 0 HB3 LYS A 57 22.023 14.576 10.071 1.00 0.00 H new ATOM 0 HG2 LYS A 57 22.577 15.966 12.055 1.00 0.00 H new ATOM 0 HG3 LYS A 57 20.875 16.127 12.439 1.00 0.00 H new ATOM 0 HD2 LYS A 57 22.496 13.545 12.480 1.00 0.00 H new ATOM 0 HD3 LYS A 57 21.918 14.430 13.878 1.00 0.00 H new ATOM 0 HE2 LYS A 57 19.539 14.039 13.036 1.00 0.00 H new ATOM 0 HE3 LYS A 57 20.210 12.993 11.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 19.670 11.544 13.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 21.321 11.806 13.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 20.151 12.600 14.717 1.00 0.00 H new ATOM 940 N TYR A 58 20.052 16.047 7.578 1.00 0.00 N ATOM 941 CA TYR A 58 20.023 15.558 6.205 1.00 0.00 C ATOM 942 C TYR A 58 19.335 16.501 5.221 1.00 0.00 C ATOM 943 O TYR A 58 19.366 16.183 4.038 1.00 0.00 O ATOM 944 CB TYR A 58 19.448 14.129 6.170 1.00 0.00 C ATOM 945 CG TYR A 58 20.123 13.157 7.129 1.00 0.00 C ATOM 946 CD1 TYR A 58 21.517 12.952 7.066 1.00 0.00 C ATOM 947 CD2 TYR A 58 19.369 12.490 8.114 1.00 0.00 C ATOM 948 CE1 TYR A 58 22.161 12.130 8.007 1.00 0.00 C ATOM 949 CE2 TYR A 58 20.004 11.663 9.058 1.00 0.00 C ATOM 950 CZ TYR A 58 21.406 11.489 9.016 1.00 0.00 C ATOM 951 OH TYR A 58 22.019 10.709 9.952 1.00 0.00 O ATOM 0 H TYR A 58 19.131 16.227 7.978 1.00 0.00 H new ATOM 0 HA TYR A 58 21.054 15.525 5.853 1.00 0.00 H new ATOM 0 HB2 TYR A 58 18.384 14.172 6.404 1.00 0.00 H new ATOM 0 HB3 TYR A 58 19.535 13.740 5.156 1.00 0.00 H new ATOM 0 HD1 TYR A 58 22.094 13.430 6.289 1.00 0.00 H new ATOM 0 HD2 TYR A 58 18.297 12.614 8.145 1.00 0.00 H new ATOM 0 HE1 TYR A 58 23.231 11.988 7.959 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.420 11.161 9.815 1.00 0.00 H new ATOM 0 HH TYR A 58 21.403 10.545 10.696 1.00 0.00 H new ATOM 961 N GLN A 59 18.791 17.666 5.615 1.00 0.00 N ATOM 962 CA GLN A 59 18.160 18.587 4.646 1.00 0.00 C ATOM 963 C GLN A 59 19.040 18.955 3.437 1.00 0.00 C ATOM 964 O GLN A 59 18.527 19.248 2.357 1.00 0.00 O ATOM 965 CB GLN A 59 17.569 19.850 5.314 1.00 0.00 C ATOM 966 CG GLN A 59 18.432 20.599 6.347 1.00 0.00 C ATOM 967 CD GLN A 59 19.794 21.066 5.838 1.00 0.00 C ATOM 968 OE1 GLN A 59 19.893 21.833 4.885 1.00 0.00 O ATOM 969 NE2 GLN A 59 20.870 20.611 6.463 1.00 0.00 N ATOM 0 H GLN A 59 18.774 17.991 6.582 1.00 0.00 H new ATOM 0 HA GLN A 59 17.332 18.006 4.240 1.00 0.00 H new ATOM 0 HB2 GLN A 59 17.310 20.554 4.524 1.00 0.00 H new ATOM 0 HB3 GLN A 59 16.638 19.563 5.803 1.00 0.00 H new ATOM 0 HG2 GLN A 59 17.876 21.468 6.700 1.00 0.00 H new ATOM 0 HG3 GLN A 59 18.587 19.948 7.208 1.00 0.00 H new ATOM 0 HE21 GLN A 59 20.770 19.974 7.253 1.00 0.00 H new ATOM 0 HE22 GLN A 59 21.799 20.898 6.154 1.00 0.00 H new ATOM 978 N ASP A 60 20.363 18.903 3.582 1.00 0.00 N ATOM 979 CA ASP A 60 21.324 19.234 2.523 1.00 0.00 C ATOM 980 C ASP A 60 21.525 18.077 1.525 1.00 0.00 C ATOM 981 O ASP A 60 22.179 18.244 0.497 1.00 0.00 O ATOM 982 CB ASP A 60 22.661 19.609 3.180 1.00 0.00 C ATOM 983 CG ASP A 60 23.721 20.065 2.161 1.00 0.00 C ATOM 984 OD1 ASP A 60 23.515 21.102 1.490 1.00 0.00 O ATOM 985 OD2 ASP A 60 24.795 19.427 2.073 1.00 0.00 O ATOM 0 H ASP A 60 20.809 18.624 4.456 1.00 0.00 H new ATOM 0 HA ASP A 60 20.928 20.072 1.949 1.00 0.00 H new ATOM 0 HB2 ASP A 60 22.493 20.406 3.904 1.00 0.00 H new ATOM 0 HB3 ASP A 60 23.042 18.751 3.733 1.00 0.00 H new ATOM 990 N GLN A 61 20.943 16.906 1.805 1.00 0.00 N ATOM 991 CA GLN A 61 21.203 15.643 1.110 1.00 0.00 C ATOM 992 C GLN A 61 19.929 14.820 0.865 1.00 0.00 C ATOM 993 O GLN A 61 19.968 13.828 0.141 1.00 0.00 O ATOM 994 CB GLN A 61 22.140 14.805 1.998 1.00 0.00 C ATOM 995 CG GLN A 61 23.477 15.479 2.350 1.00 0.00 C ATOM 996 CD GLN A 61 24.363 14.555 3.186 1.00 0.00 C ATOM 997 OE1 GLN A 61 25.086 13.714 2.658 1.00 0.00 O ATOM 998 NE2 GLN A 61 24.331 14.681 4.505 1.00 0.00 N ATOM 0 H GLN A 61 20.253 16.809 2.550 1.00 0.00 H new ATOM 0 HA GLN A 61 21.636 15.880 0.138 1.00 0.00 H new ATOM 0 HB2 GLN A 61 21.618 14.562 2.924 1.00 0.00 H new ATOM 0 HB3 GLN A 61 22.348 13.862 1.493 1.00 0.00 H new ATOM 0 HG2 GLN A 61 23.999 15.756 1.434 1.00 0.00 H new ATOM 0 HG3 GLN A 61 23.288 16.401 2.900 1.00 0.00 H new ATOM 0 HE21 GLN A 61 23.728 15.382 4.936 1.00 0.00 H new ATOM 0 HE22 GLN A 61 24.909 14.077 5.089 1.00 0.00 H new ATOM 1007 N LEU A 62 18.806 15.206 1.465 1.00 0.00 N ATOM 1008 CA LEU A 62 17.569 14.451 1.527 1.00 0.00 C ATOM 1009 C LEU A 62 16.447 15.469 1.653 1.00 0.00 C ATOM 1010 O LEU A 62 16.509 16.360 2.500 1.00 0.00 O ATOM 1011 CB LEU A 62 17.591 13.561 2.788 1.00 0.00 C ATOM 1012 CG LEU A 62 16.285 12.790 3.060 1.00 0.00 C ATOM 1013 CD1 LEU A 62 16.083 11.677 2.029 1.00 0.00 C ATOM 1014 CD2 LEU A 62 16.311 12.209 4.476 1.00 0.00 C ATOM 0 H LEU A 62 18.737 16.103 1.945 1.00 0.00 H new ATOM 0 HA LEU A 62 17.437 13.821 0.647 1.00 0.00 H new ATOM 0 HB2 LEU A 62 18.407 12.844 2.695 1.00 0.00 H new ATOM 0 HB3 LEU A 62 17.814 14.186 3.653 1.00 0.00 H new ATOM 0 HG LEU A 62 15.448 13.483 2.974 1.00 0.00 H new ATOM 0 HD11 LEU A 62 15.155 11.147 2.242 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.032 12.111 1.030 1.00 0.00 H new ATOM 0 HD13 LEU A 62 16.919 10.979 2.079 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.385 11.665 4.663 1.00 0.00 H new ATOM 0 HD22 LEU A 62 17.158 11.530 4.575 1.00 0.00 H new ATOM 0 HD23 LEU A 62 16.409 13.018 5.200 1.00 0.00 H new ATOM 1026 N ASN A 63 15.429 15.353 0.810 1.00 0.00 N ATOM 1027 CA ASN A 63 14.197 16.113 0.973 1.00 0.00 C ATOM 1028 C ASN A 63 13.362 15.327 1.972 1.00 0.00 C ATOM 1029 O ASN A 63 13.258 14.107 1.829 1.00 0.00 O ATOM 1030 CB ASN A 63 13.408 16.203 -0.339 1.00 0.00 C ATOM 1031 CG ASN A 63 14.159 16.890 -1.465 1.00 0.00 C ATOM 1032 OD1 ASN A 63 14.007 18.087 -1.688 1.00 0.00 O ATOM 1033 ND2 ASN A 63 14.999 16.159 -2.175 1.00 0.00 N ATOM 0 H ASN A 63 15.434 14.734 -0.001 1.00 0.00 H new ATOM 0 HA ASN A 63 14.423 17.130 1.295 1.00 0.00 H new ATOM 0 HB2 ASN A 63 13.137 15.197 -0.658 1.00 0.00 H new ATOM 0 HB3 ASN A 63 12.478 16.741 -0.155 1.00 0.00 H new ATOM 0 HD21 ASN A 63 15.538 16.588 -2.927 1.00 0.00 H new ATOM 0 HD22 ASN A 63 15.109 15.166 -1.971 1.00 0.00 H new ATOM 1040 N VAL A 64 12.713 15.982 2.928 1.00 0.00 N ATOM 1041 CA VAL A 64 11.807 15.309 3.843 1.00 0.00 C ATOM 1042 C VAL A 64 10.440 15.949 3.661 1.00 0.00 C ATOM 1043 O VAL A 64 10.344 17.176 3.567 1.00 0.00 O ATOM 1044 CB VAL A 64 12.267 15.421 5.313 1.00 0.00 C ATOM 1045 CG1 VAL A 64 11.894 14.144 6.056 1.00 0.00 C ATOM 1046 CG2 VAL A 64 13.760 15.711 5.554 1.00 0.00 C ATOM 0 H VAL A 64 12.801 16.986 3.088 1.00 0.00 H new ATOM 0 HA VAL A 64 11.782 14.243 3.617 1.00 0.00 H new ATOM 0 HB VAL A 64 11.746 16.302 5.688 1.00 0.00 H new ATOM 0 HG11 VAL A 64 12.217 14.219 7.094 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.813 14.005 6.022 1.00 0.00 H new ATOM 0 HG13 VAL A 64 12.384 13.292 5.584 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.952 15.765 6.626 1.00 0.00 H new ATOM 0 HG22 VAL A 64 14.361 14.913 5.118 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.026 16.661 5.089 1.00 0.00 H new ATOM 1056 N VAL A 65 9.404 15.121 3.612 1.00 0.00 N ATOM 1057 CA VAL A 65 8.016 15.545 3.666 1.00 0.00 C ATOM 1058 C VAL A 65 7.274 14.503 4.498 1.00 0.00 C ATOM 1059 O VAL A 65 7.749 13.375 4.681 1.00 0.00 O ATOM 1060 CB VAL A 65 7.391 15.725 2.264 1.00 0.00 C ATOM 1061 CG1 VAL A 65 8.008 16.901 1.504 1.00 0.00 C ATOM 1062 CG2 VAL A 65 7.481 14.477 1.372 1.00 0.00 C ATOM 0 H VAL A 65 9.512 14.110 3.531 1.00 0.00 H new ATOM 0 HA VAL A 65 7.941 16.531 4.124 1.00 0.00 H new ATOM 0 HB VAL A 65 6.339 15.919 2.471 1.00 0.00 H new ATOM 0 HG11 VAL A 65 7.537 16.988 0.525 1.00 0.00 H new ATOM 0 HG12 VAL A 65 7.849 17.821 2.066 1.00 0.00 H new ATOM 0 HG13 VAL A 65 9.078 16.732 1.379 1.00 0.00 H new ATOM 0 HG21 VAL A 65 7.020 14.686 0.407 1.00 0.00 H new ATOM 0 HG22 VAL A 65 8.527 14.210 1.224 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.959 13.649 1.851 1.00 0.00 H new ATOM 1072 N ALA A 66 6.086 14.849 4.979 1.00 0.00 N ATOM 1073 CA ALA A 66 5.237 13.900 5.675 1.00 0.00 C ATOM 1074 C ALA A 66 3.773 14.084 5.315 1.00 0.00 C ATOM 1075 O ALA A 66 3.366 15.080 4.713 1.00 0.00 O ATOM 1076 CB ALA A 66 5.463 14.016 7.183 1.00 0.00 C ATOM 0 H ALA A 66 5.690 15.786 4.897 1.00 0.00 H new ATOM 0 HA ALA A 66 5.510 12.894 5.356 1.00 0.00 H new ATOM 0 HB1 ALA A 66 4.824 13.302 7.703 1.00 0.00 H new ATOM 0 HB2 ALA A 66 6.507 13.802 7.412 1.00 0.00 H new ATOM 0 HB3 ALA A 66 5.219 15.027 7.511 1.00 0.00 H new ATOM 1082 N VAL A 67 2.983 13.103 5.729 1.00 0.00 N ATOM 1083 CA VAL A 67 1.568 12.999 5.433 1.00 0.00 C ATOM 1084 C VAL A 67 0.915 12.603 6.749 1.00 0.00 C ATOM 1085 O VAL A 67 1.307 11.602 7.358 1.00 0.00 O ATOM 1086 CB VAL A 67 1.321 11.968 4.309 1.00 0.00 C ATOM 1087 CG1 VAL A 67 -0.157 11.951 3.897 1.00 0.00 C ATOM 1088 CG2 VAL A 67 2.165 12.256 3.056 1.00 0.00 C ATOM 0 H VAL A 67 3.326 12.331 6.301 1.00 0.00 H new ATOM 0 HA VAL A 67 1.146 13.932 5.060 1.00 0.00 H new ATOM 0 HB VAL A 67 1.613 11.000 4.717 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -0.305 11.217 3.105 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -0.771 11.685 4.757 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -0.446 12.938 3.536 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.955 11.504 2.295 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.915 13.244 2.668 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.223 12.225 3.315 1.00 0.00 H new ATOM 1098 N HIS A 68 -0.031 13.407 7.233 1.00 0.00 N ATOM 1099 CA HIS A 68 -0.771 13.023 8.420 1.00 0.00 C ATOM 1100 C HIS A 68 -1.862 12.048 8.002 1.00 0.00 C ATOM 1101 O HIS A 68 -2.630 12.337 7.082 1.00 0.00 O ATOM 1102 CB HIS A 68 -1.340 14.237 9.160 1.00 0.00 C ATOM 1103 CG HIS A 68 -1.258 13.994 10.637 1.00 0.00 C ATOM 1104 ND1 HIS A 68 -0.101 14.015 11.373 1.00 0.00 N ATOM 1105 CD2 HIS A 68 -2.258 13.541 11.457 1.00 0.00 C ATOM 1106 CE1 HIS A 68 -0.393 13.582 12.600 1.00 0.00 C ATOM 1107 NE2 HIS A 68 -1.705 13.315 12.721 1.00 0.00 N ATOM 0 H HIS A 68 -0.294 14.306 6.829 1.00 0.00 H new ATOM 0 HA HIS A 68 -0.099 12.539 9.129 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -0.781 15.135 8.895 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.375 14.407 8.864 1.00 0.00 H new ATOM 0 HD1 HIS A 68 0.818 14.309 11.041 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -3.289 13.386 11.177 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.330 13.462 13.393 1.00 0.00 H new ATOM 1115 N MET A 69 -1.943 10.902 8.670 1.00 0.00 N ATOM 1116 CA MET A 69 -2.997 9.923 8.477 1.00 0.00 C ATOM 1117 C MET A 69 -4.098 10.248 9.492 1.00 0.00 C ATOM 1118 O MET A 69 -3.860 10.065 10.691 1.00 0.00 O ATOM 1119 CB MET A 69 -2.403 8.524 8.690 1.00 0.00 C ATOM 1120 CG MET A 69 -3.440 7.397 8.748 1.00 0.00 C ATOM 1121 SD MET A 69 -4.420 7.150 7.245 1.00 0.00 S ATOM 1122 CE MET A 69 -5.308 5.656 7.766 1.00 0.00 C ATOM 0 H MET A 69 -1.260 10.626 9.376 1.00 0.00 H new ATOM 0 HA MET A 69 -3.421 9.950 7.473 1.00 0.00 H new ATOM 0 HB2 MET A 69 -1.701 8.314 7.883 1.00 0.00 H new ATOM 0 HB3 MET A 69 -1.831 8.523 9.618 1.00 0.00 H new ATOM 0 HG2 MET A 69 -2.924 6.465 8.980 1.00 0.00 H new ATOM 0 HG3 MET A 69 -4.122 7.598 9.575 1.00 0.00 H new ATOM 0 HE1 MET A 69 -5.977 5.334 6.968 1.00 0.00 H new ATOM 0 HE2 MET A 69 -4.591 4.863 7.981 1.00 0.00 H new ATOM 0 HE3 MET A 69 -5.890 5.872 8.662 1.00 0.00 H new ATOM 1132 N PRO A 70 -5.277 10.743 9.068 1.00 0.00 N ATOM 1133 CA PRO A 70 -6.416 10.856 9.959 1.00 0.00 C ATOM 1134 C PRO A 70 -6.837 9.424 10.315 1.00 0.00 C ATOM 1135 O PRO A 70 -7.087 8.590 9.439 1.00 0.00 O ATOM 1136 CB PRO A 70 -7.466 11.660 9.193 1.00 0.00 C ATOM 1137 CG PRO A 70 -7.165 11.344 7.728 1.00 0.00 C ATOM 1138 CD PRO A 70 -5.651 11.132 7.716 1.00 0.00 C ATOM 0 HA PRO A 70 -6.228 11.373 10.900 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -8.478 11.362 9.467 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -7.382 12.727 9.398 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -7.698 10.455 7.391 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -7.462 12.162 7.071 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -5.373 10.359 6.999 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -5.134 12.044 7.418 1.00 0.00 H new ATOM 1146 N ARG A 71 -6.895 9.133 11.608 1.00 0.00 N ATOM 1147 CA ARG A 71 -7.040 7.807 12.176 1.00 0.00 C ATOM 1148 C ARG A 71 -8.024 7.809 13.353 1.00 0.00 C ATOM 1149 O ARG A 71 -8.733 6.817 13.534 1.00 0.00 O ATOM 1150 CB ARG A 71 -5.632 7.396 12.624 1.00 0.00 C ATOM 1151 CG ARG A 71 -5.542 5.893 12.901 1.00 0.00 C ATOM 1152 CD ARG A 71 -4.406 5.591 13.876 1.00 0.00 C ATOM 1153 NE ARG A 71 -4.771 6.023 15.237 1.00 0.00 N ATOM 1154 CZ ARG A 71 -4.836 5.282 16.347 1.00 0.00 C ATOM 1155 NH1 ARG A 71 -4.363 4.038 16.383 1.00 0.00 N ATOM 1156 NH2 ARG A 71 -5.409 5.816 17.418 1.00 0.00 N ATOM 0 H ARG A 71 -6.839 9.858 12.324 1.00 0.00 H new ATOM 0 HA ARG A 71 -7.449 7.103 11.451 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.911 7.668 11.853 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.360 7.949 13.523 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.486 5.537 13.313 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -5.379 5.355 11.967 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -4.189 4.523 13.872 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -3.498 6.102 13.556 1.00 0.00 H new ATOM 0 HE ARG A 71 -5.003 7.010 15.345 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -3.939 3.629 15.550 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -4.425 3.494 17.243 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -5.783 6.764 17.377 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -5.476 5.278 18.282 1.00 0.00 H new ATOM 1170 N SER A 72 -8.113 8.896 14.123 1.00 0.00 N ATOM 1171 CA SER A 72 -8.890 8.963 15.361 1.00 0.00 C ATOM 1172 C SER A 72 -9.302 10.412 15.633 1.00 0.00 C ATOM 1173 O SER A 72 -8.709 11.341 15.091 1.00 0.00 O ATOM 1174 CB SER A 72 -8.076 8.402 16.548 1.00 0.00 C ATOM 1175 OG SER A 72 -6.727 8.090 16.230 1.00 0.00 O ATOM 0 H SER A 72 -7.638 9.770 13.898 1.00 0.00 H new ATOM 0 HA SER A 72 -9.786 8.352 15.247 1.00 0.00 H new ATOM 0 HB2 SER A 72 -8.088 9.130 17.359 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.568 7.503 16.919 1.00 0.00 H new ATOM 0 HG SER A 72 -6.252 8.910 15.980 1.00 0.00 H new ATOM 1181 N GLU A 73 -10.288 10.641 16.505 1.00 0.00 N ATOM 1182 CA GLU A 73 -10.775 11.995 16.785 1.00 0.00 C ATOM 1183 C GLU A 73 -9.678 12.880 17.403 1.00 0.00 C ATOM 1184 O GLU A 73 -9.702 14.098 17.232 1.00 0.00 O ATOM 1185 CB GLU A 73 -12.027 11.968 17.672 1.00 0.00 C ATOM 1186 CG GLU A 73 -13.186 11.178 17.044 1.00 0.00 C ATOM 1187 CD GLU A 73 -14.450 11.240 17.919 1.00 0.00 C ATOM 1188 OE1 GLU A 73 -14.634 10.366 18.796 1.00 0.00 O ATOM 1189 OE2 GLU A 73 -15.286 12.154 17.731 1.00 0.00 O ATOM 0 H GLU A 73 -10.764 9.907 17.029 1.00 0.00 H new ATOM 0 HA GLU A 73 -11.053 12.439 15.829 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -11.774 11.528 18.636 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -12.352 12.990 17.864 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -13.407 11.579 16.055 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -12.887 10.139 16.907 1.00 0.00 H new ATOM 1196 N ASP A 74 -8.683 12.279 18.071 1.00 0.00 N ATOM 1197 CA ASP A 74 -7.541 12.994 18.647 1.00 0.00 C ATOM 1198 C ASP A 74 -6.601 13.573 17.580 1.00 0.00 C ATOM 1199 O ASP A 74 -5.748 14.391 17.904 1.00 0.00 O ATOM 1200 CB ASP A 74 -6.740 12.076 19.584 1.00 0.00 C ATOM 1201 CG ASP A 74 -5.741 12.868 20.448 1.00 0.00 C ATOM 1202 OD1 ASP A 74 -6.171 13.762 21.212 1.00 0.00 O ATOM 1203 OD2 ASP A 74 -4.533 12.541 20.434 1.00 0.00 O ATOM 0 H ASP A 74 -8.651 11.271 18.227 1.00 0.00 H new ATOM 0 HA ASP A 74 -7.958 13.828 19.211 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.426 11.530 20.231 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -6.201 11.335 18.993 1.00 0.00 H new ATOM 1208 N ASP A 75 -6.753 13.176 16.312 1.00 0.00 N ATOM 1209 CA ASP A 75 -5.888 13.546 15.185 1.00 0.00 C ATOM 1210 C ASP A 75 -6.696 13.985 13.952 1.00 0.00 C ATOM 1211 O ASP A 75 -6.126 14.334 12.920 1.00 0.00 O ATOM 1212 CB ASP A 75 -4.940 12.385 14.847 1.00 0.00 C ATOM 1213 CG ASP A 75 -5.662 11.131 14.362 1.00 0.00 C ATOM 1214 OD1 ASP A 75 -6.311 11.166 13.301 1.00 0.00 O ATOM 1215 OD2 ASP A 75 -5.570 10.090 15.054 1.00 0.00 O ATOM 0 H ASP A 75 -7.516 12.561 16.030 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.294 14.408 15.488 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -4.239 12.711 14.079 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.352 12.137 15.731 1.00 0.00 H new ATOM 1220 N LEU A 76 -8.024 14.033 14.067 1.00 0.00 N ATOM 1221 CA LEU A 76 -8.982 14.337 13.022 1.00 0.00 C ATOM 1222 C LEU A 76 -8.937 15.808 12.570 1.00 0.00 C ATOM 1223 O LEU A 76 -9.524 16.146 11.540 1.00 0.00 O ATOM 1224 CB LEU A 76 -10.331 13.931 13.646 1.00 0.00 C ATOM 1225 CG LEU A 76 -11.616 14.360 12.943 1.00 0.00 C ATOM 1226 CD1 LEU A 76 -11.759 13.746 11.544 1.00 0.00 C ATOM 1227 CD2 LEU A 76 -12.818 13.947 13.804 1.00 0.00 C ATOM 0 H LEU A 76 -8.483 13.846 14.959 1.00 0.00 H new ATOM 0 HA LEU A 76 -8.776 13.800 12.096 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -10.345 12.844 13.728 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -10.360 14.328 14.661 1.00 0.00 H new ATOM 0 HG LEU A 76 -11.577 15.442 12.818 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -12.691 14.085 11.091 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -10.919 14.057 10.923 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -11.769 12.659 11.623 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -13.741 14.250 13.309 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -12.816 12.865 13.937 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.752 14.433 14.778 1.00 0.00 H new ATOM 1239 N ASP A 77 -8.232 16.686 13.291 1.00 0.00 N ATOM 1240 CA ASP A 77 -8.290 18.137 13.102 1.00 0.00 C ATOM 1241 C ASP A 77 -6.901 18.733 12.824 1.00 0.00 C ATOM 1242 O ASP A 77 -5.997 18.567 13.649 1.00 0.00 O ATOM 1243 CB ASP A 77 -8.889 18.780 14.352 1.00 0.00 C ATOM 1244 CG ASP A 77 -8.946 20.303 14.194 1.00 0.00 C ATOM 1245 OD1 ASP A 77 -9.940 20.820 13.638 1.00 0.00 O ATOM 1246 OD2 ASP A 77 -7.982 20.976 14.614 1.00 0.00 O ATOM 0 H ASP A 77 -7.594 16.402 14.035 1.00 0.00 H new ATOM 0 HA ASP A 77 -8.915 18.344 12.233 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -9.891 18.388 14.526 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.290 18.521 15.225 1.00 0.00 H new ATOM 1251 N PRO A 78 -6.700 19.444 11.697 1.00 0.00 N ATOM 1252 CA PRO A 78 -5.420 20.049 11.338 1.00 0.00 C ATOM 1253 C PRO A 78 -4.829 21.037 12.343 1.00 0.00 C ATOM 1254 O PRO A 78 -3.623 21.280 12.296 1.00 0.00 O ATOM 1255 CB PRO A 78 -5.636 20.752 10.004 1.00 0.00 C ATOM 1256 CG PRO A 78 -6.794 19.985 9.381 1.00 0.00 C ATOM 1257 CD PRO A 78 -7.638 19.608 10.596 1.00 0.00 C ATOM 0 HA PRO A 78 -4.687 19.243 11.306 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -5.880 21.806 10.140 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -4.744 20.710 9.379 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -7.353 20.599 8.674 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -6.451 19.105 8.837 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -8.370 20.384 10.819 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -8.193 18.688 10.416 1.00 0.00 H new ATOM 1265 N GLY A 79 -5.630 21.616 13.240 1.00 0.00 N ATOM 1266 CA GLY A 79 -5.142 22.575 14.217 1.00 0.00 C ATOM 1267 C GLY A 79 -4.389 21.830 15.306 1.00 0.00 C ATOM 1268 O GLY A 79 -3.298 22.245 15.692 1.00 0.00 O ATOM 0 H GLY A 79 -6.631 21.430 13.305 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.488 23.302 13.737 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.975 23.131 14.648 1.00 0.00 H new ATOM 1272 N LYS A 80 -4.908 20.673 15.732 1.00 0.00 N ATOM 1273 CA LYS A 80 -4.191 19.789 16.648 1.00 0.00 C ATOM 1274 C LYS A 80 -2.876 19.352 16.009 1.00 0.00 C ATOM 1275 O LYS A 80 -1.840 19.350 16.675 1.00 0.00 O ATOM 1276 CB LYS A 80 -5.021 18.541 16.976 1.00 0.00 C ATOM 1277 CG LYS A 80 -6.412 18.801 17.571 1.00 0.00 C ATOM 1278 CD LYS A 80 -7.156 17.459 17.644 1.00 0.00 C ATOM 1279 CE LYS A 80 -8.599 17.565 18.160 1.00 0.00 C ATOM 1280 NZ LYS A 80 -8.681 17.991 19.581 1.00 0.00 N ATOM 0 H LYS A 80 -5.827 20.329 15.453 1.00 0.00 H new ATOM 0 HA LYS A 80 -4.002 20.338 17.571 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -5.140 17.957 16.063 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.456 17.926 17.676 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -6.325 19.243 18.564 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -6.964 19.510 16.954 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -7.169 17.010 16.651 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -6.599 16.783 18.292 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -9.148 18.275 17.542 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -9.090 16.599 18.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -9.678 18.044 19.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -8.183 17.301 20.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -8.239 18.926 19.689 1.00 0.00 H new ATOM 1294 N ILE A 81 -2.921 18.990 14.722 1.00 0.00 N ATOM 1295 CA ILE A 81 -1.760 18.531 13.971 1.00 0.00 C ATOM 1296 C ILE A 81 -0.721 19.659 13.961 1.00 0.00 C ATOM 1297 O ILE A 81 0.396 19.431 14.421 1.00 0.00 O ATOM 1298 CB ILE A 81 -2.192 18.034 12.570 1.00 0.00 C ATOM 1299 CG1 ILE A 81 -3.125 16.805 12.697 1.00 0.00 C ATOM 1300 CG2 ILE A 81 -0.986 17.656 11.688 1.00 0.00 C ATOM 1301 CD1 ILE A 81 -3.816 16.406 11.384 1.00 0.00 C ATOM 0 H ILE A 81 -3.779 19.010 14.171 1.00 0.00 H new ATOM 0 HA ILE A 81 -1.288 17.667 14.440 1.00 0.00 H new ATOM 0 HB ILE A 81 -2.720 18.860 12.093 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.545 15.958 13.062 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.887 17.016 13.447 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -1.340 17.313 10.716 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -0.345 18.528 11.555 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.419 16.859 12.169 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.452 15.537 11.557 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.425 17.236 11.027 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -3.062 16.161 10.636 1.00 0.00 H new ATOM 1313 N LYS A 82 -1.068 20.877 13.517 1.00 0.00 N ATOM 1314 CA LYS A 82 -0.150 22.010 13.547 1.00 0.00 C ATOM 1315 C LYS A 82 0.405 22.295 14.939 1.00 0.00 C ATOM 1316 O LYS A 82 1.616 22.447 15.063 1.00 0.00 O ATOM 1317 CB LYS A 82 -0.843 23.248 12.951 1.00 0.00 C ATOM 1318 CG LYS A 82 0.073 24.476 12.799 1.00 0.00 C ATOM 1319 CD LYS A 82 1.412 24.161 12.112 1.00 0.00 C ATOM 1320 CE LYS A 82 2.179 25.461 11.815 1.00 0.00 C ATOM 1321 NZ LYS A 82 3.617 25.237 11.504 1.00 0.00 N ATOM 0 H LYS A 82 -1.987 21.096 13.131 1.00 0.00 H new ATOM 0 HA LYS A 82 0.715 21.751 12.937 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.247 22.988 11.973 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.689 23.516 13.584 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -0.450 25.241 12.225 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.270 24.897 13.785 1.00 0.00 H new ATOM 0 HD2 LYS A 82 2.013 23.514 12.751 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.233 23.616 11.185 1.00 0.00 H new ATOM 0 HE2 LYS A 82 1.707 25.969 10.974 1.00 0.00 H new ATOM 0 HE3 LYS A 82 2.100 26.126 12.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 4.092 26.154 11.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 4.065 24.718 12.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 3.700 24.683 10.628 1.00 0.00 H new ATOM 1335 N GLU A 83 -0.427 22.357 15.978 1.00 0.00 N ATOM 1336 CA GLU A 83 0.046 22.682 17.324 1.00 0.00 C ATOM 1337 C GLU A 83 1.053 21.634 17.814 1.00 0.00 C ATOM 1338 O GLU A 83 2.034 21.975 18.473 1.00 0.00 O ATOM 1339 CB GLU A 83 -1.142 22.790 18.293 1.00 0.00 C ATOM 1340 CG GLU A 83 -1.952 24.085 18.119 1.00 0.00 C ATOM 1341 CD GLU A 83 -1.186 25.329 18.608 1.00 0.00 C ATOM 1342 OE1 GLU A 83 -1.214 25.628 19.824 1.00 0.00 O ATOM 1343 OE2 GLU A 83 -0.565 26.035 17.781 1.00 0.00 O ATOM 0 H GLU A 83 -1.431 22.187 15.914 1.00 0.00 H new ATOM 0 HA GLU A 83 0.554 23.646 17.289 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.801 21.935 18.146 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.773 22.735 19.317 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.209 24.211 17.067 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.890 24.000 18.668 1.00 0.00 H new ATOM 1350 N THR A 84 0.840 20.368 17.461 1.00 0.00 N ATOM 1351 CA THR A 84 1.735 19.273 17.797 1.00 0.00 C ATOM 1352 C THR A 84 3.044 19.390 16.995 1.00 0.00 C ATOM 1353 O THR A 84 4.134 19.415 17.569 1.00 0.00 O ATOM 1354 CB THR A 84 0.961 17.972 17.521 1.00 0.00 C ATOM 1355 OG1 THR A 84 -0.198 17.901 18.329 1.00 0.00 O ATOM 1356 CG2 THR A 84 1.804 16.730 17.756 1.00 0.00 C ATOM 0 H THR A 84 0.024 20.074 16.924 1.00 0.00 H new ATOM 0 HA THR A 84 2.037 19.291 18.844 1.00 0.00 H new ATOM 0 HB THR A 84 0.683 17.998 16.467 1.00 0.00 H new ATOM 0 HG1 THR A 84 -0.936 18.369 17.885 1.00 0.00 H new ATOM 0 HG21 THR A 84 1.209 15.841 17.547 1.00 0.00 H new ATOM 0 HG22 THR A 84 2.672 16.749 17.097 1.00 0.00 H new ATOM 0 HG23 THR A 84 2.137 16.707 18.794 1.00 0.00 H new ATOM 1364 N ALA A 85 2.947 19.515 15.670 1.00 0.00 N ATOM 1365 CA ALA A 85 4.082 19.669 14.765 1.00 0.00 C ATOM 1366 C ALA A 85 4.984 20.841 15.165 1.00 0.00 C ATOM 1367 O ALA A 85 6.207 20.704 15.202 1.00 0.00 O ATOM 1368 CB ALA A 85 3.544 19.860 13.342 1.00 0.00 C ATOM 0 H ALA A 85 2.049 19.511 15.185 1.00 0.00 H new ATOM 0 HA ALA A 85 4.699 18.772 14.819 1.00 0.00 H new ATOM 0 HB1 ALA A 85 4.378 19.977 12.650 1.00 0.00 H new ATOM 0 HB2 ALA A 85 2.955 18.989 13.056 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.916 20.750 13.307 1.00 0.00 H new ATOM 1374 N ALA A 86 4.381 21.978 15.513 1.00 0.00 N ATOM 1375 CA ALA A 86 5.087 23.177 15.947 1.00 0.00 C ATOM 1376 C ALA A 86 6.010 22.904 17.138 1.00 0.00 C ATOM 1377 O ALA A 86 7.074 23.512 17.249 1.00 0.00 O ATOM 1378 CB ALA A 86 4.063 24.243 16.344 1.00 0.00 C ATOM 0 H ALA A 86 3.367 22.090 15.500 1.00 0.00 H new ATOM 0 HA ALA A 86 5.705 23.519 15.117 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.583 25.144 16.670 1.00 0.00 H new ATOM 0 HB2 ALA A 86 3.432 24.479 15.487 1.00 0.00 H new ATOM 0 HB3 ALA A 86 3.443 23.867 17.158 1.00 0.00 H new ATOM 1384 N GLU A 87 5.603 21.998 18.029 1.00 0.00 N ATOM 1385 CA GLU A 87 6.335 21.682 19.248 1.00 0.00 C ATOM 1386 C GLU A 87 7.424 20.648 18.942 1.00 0.00 C ATOM 1387 O GLU A 87 8.526 20.737 19.486 1.00 0.00 O ATOM 1388 CB GLU A 87 5.345 21.178 20.313 1.00 0.00 C ATOM 1389 CG GLU A 87 4.534 22.313 20.957 1.00 0.00 C ATOM 1390 CD GLU A 87 5.392 23.217 21.861 1.00 0.00 C ATOM 1391 OE1 GLU A 87 5.652 22.848 23.029 1.00 0.00 O ATOM 1392 OE2 GLU A 87 5.799 24.318 21.425 1.00 0.00 O ATOM 0 H GLU A 87 4.744 21.459 17.919 1.00 0.00 H new ATOM 0 HA GLU A 87 6.828 22.572 19.639 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.661 20.462 19.857 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.894 20.644 21.089 1.00 0.00 H new ATOM 0 HG2 GLU A 87 4.078 22.918 20.173 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.721 21.886 21.544 1.00 0.00 H new ATOM 1399 N HIS A 88 7.151 19.709 18.029 1.00 0.00 N ATOM 1400 CA HIS A 88 8.135 18.766 17.510 1.00 0.00 C ATOM 1401 C HIS A 88 9.230 19.409 16.648 1.00 0.00 C ATOM 1402 O HIS A 88 10.198 18.722 16.336 1.00 0.00 O ATOM 1403 CB HIS A 88 7.413 17.670 16.723 1.00 0.00 C ATOM 1404 CG HIS A 88 6.485 16.846 17.578 1.00 0.00 C ATOM 1405 ND1 HIS A 88 6.749 16.389 18.850 1.00 0.00 N ATOM 1406 CD2 HIS A 88 5.253 16.367 17.221 1.00 0.00 C ATOM 1407 CE1 HIS A 88 5.698 15.662 19.250 1.00 0.00 C ATOM 1408 NE2 HIS A 88 4.765 15.599 18.285 1.00 0.00 N ATOM 0 H HIS A 88 6.222 19.585 17.626 1.00 0.00 H new ATOM 0 HA HIS A 88 8.654 18.348 18.372 1.00 0.00 H new ATOM 0 HB2 HIS A 88 6.843 18.127 15.914 1.00 0.00 H new ATOM 0 HB3 HIS A 88 8.152 17.014 16.262 1.00 0.00 H new ATOM 0 HD1 HIS A 88 7.594 16.572 19.391 1.00 0.00 H new ATOM 0 HD2 HIS A 88 4.747 16.549 16.284 1.00 0.00 H new ATOM 0 HE1 HIS A 88 5.612 15.190 20.218 1.00 0.00 H new ATOM 1416 N ASP A 89 9.108 20.688 16.264 1.00 0.00 N ATOM 1417 CA ASP A 89 10.105 21.456 15.504 1.00 0.00 C ATOM 1418 C ASP A 89 10.231 20.978 14.053 1.00 0.00 C ATOM 1419 O ASP A 89 11.167 21.348 13.348 1.00 0.00 O ATOM 1420 CB ASP A 89 11.470 21.499 16.222 1.00 0.00 C ATOM 1421 CG ASP A 89 12.405 22.563 15.616 1.00 0.00 C ATOM 1422 OD1 ASP A 89 12.102 23.773 15.740 1.00 0.00 O ATOM 1423 OD2 ASP A 89 13.466 22.203 15.057 1.00 0.00 O ATOM 0 H ASP A 89 8.278 21.238 16.484 1.00 0.00 H new ATOM 0 HA ASP A 89 9.738 22.481 15.459 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.317 21.711 17.280 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.945 20.520 16.158 1.00 0.00 H new ATOM 1428 N ILE A 90 9.306 20.141 13.583 1.00 0.00 N ATOM 1429 CA ILE A 90 9.271 19.684 12.206 1.00 0.00 C ATOM 1430 C ILE A 90 8.834 20.849 11.301 1.00 0.00 C ATOM 1431 O ILE A 90 7.735 21.389 11.442 1.00 0.00 O ATOM 1432 CB ILE A 90 8.401 18.406 12.115 1.00 0.00 C ATOM 1433 CG1 ILE A 90 6.948 18.605 12.607 1.00 0.00 C ATOM 1434 CG2 ILE A 90 9.107 17.292 12.915 1.00 0.00 C ATOM 1435 CD1 ILE A 90 6.104 17.330 12.636 1.00 0.00 C ATOM 0 H ILE A 90 8.555 19.761 14.159 1.00 0.00 H new ATOM 0 HA ILE A 90 10.256 19.388 11.844 1.00 0.00 H new ATOM 0 HB ILE A 90 8.307 18.134 11.064 1.00 0.00 H new ATOM 0 HG12 ILE A 90 6.973 19.031 13.610 1.00 0.00 H new ATOM 0 HG13 ILE A 90 6.457 19.335 11.963 1.00 0.00 H new ATOM 0 HG21 ILE A 90 8.514 16.378 12.868 1.00 0.00 H new ATOM 0 HG22 ILE A 90 10.093 17.107 12.489 1.00 0.00 H new ATOM 0 HG23 ILE A 90 9.213 17.602 13.955 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.102 17.565 12.994 1.00 0.00 H new ATOM 0 HD12 ILE A 90 6.042 16.912 11.631 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.566 16.603 13.304 1.00 0.00 H new ATOM 1447 N THR A 91 9.705 21.237 10.365 1.00 0.00 N ATOM 1448 CA THR A 91 9.511 22.386 9.468 1.00 0.00 C ATOM 1449 C THR A 91 9.430 21.951 7.997 1.00 0.00 C ATOM 1450 O THR A 91 9.171 22.776 7.118 1.00 0.00 O ATOM 1451 CB THR A 91 10.627 23.415 9.702 1.00 0.00 C ATOM 1452 OG1 THR A 91 11.887 22.794 9.511 1.00 0.00 O ATOM 1453 CG2 THR A 91 10.562 24.014 11.113 1.00 0.00 C ATOM 0 H THR A 91 10.587 20.751 10.204 1.00 0.00 H new ATOM 0 HA THR A 91 8.554 22.854 9.700 1.00 0.00 H new ATOM 0 HB THR A 91 10.492 24.226 8.987 1.00 0.00 H new ATOM 0 HG1 THR A 91 12.590 23.477 9.500 1.00 0.00 H new ATOM 0 HG21 THR A 91 11.368 24.737 11.239 1.00 0.00 H new ATOM 0 HG22 THR A 91 9.603 24.512 11.253 1.00 0.00 H new ATOM 0 HG23 THR A 91 10.669 23.219 11.851 1.00 0.00 H new ATOM 1461 N GLN A 92 9.634 20.656 7.726 1.00 0.00 N ATOM 1462 CA GLN A 92 9.383 20.024 6.434 1.00 0.00 C ATOM 1463 C GLN A 92 7.952 20.331 5.964 1.00 0.00 C ATOM 1464 O GLN A 92 7.087 20.524 6.821 1.00 0.00 O ATOM 1465 CB GLN A 92 9.542 18.495 6.579 1.00 0.00 C ATOM 1466 CG GLN A 92 8.796 17.904 7.799 1.00 0.00 C ATOM 1467 CD GLN A 92 8.551 16.398 7.733 1.00 0.00 C ATOM 1468 OE1 GLN A 92 9.045 15.690 6.865 1.00 0.00 O ATOM 1469 NE2 GLN A 92 7.755 15.876 8.655 1.00 0.00 N ATOM 0 H GLN A 92 9.989 20.003 8.424 1.00 0.00 H new ATOM 0 HA GLN A 92 10.094 20.412 5.704 1.00 0.00 H new ATOM 0 HB2 GLN A 92 9.176 18.013 5.672 1.00 0.00 H new ATOM 0 HB3 GLN A 92 10.602 18.255 6.662 1.00 0.00 H new ATOM 0 HG2 GLN A 92 9.369 18.125 8.699 1.00 0.00 H new ATOM 0 HG3 GLN A 92 7.836 18.410 7.900 1.00 0.00 H new ATOM 0 HE21 GLN A 92 7.348 16.473 9.375 1.00 0.00 H new ATOM 0 HE22 GLN A 92 7.550 14.877 8.645 1.00 0.00 H new ATOM 1478 N PRO A 93 7.663 20.369 4.654 1.00 0.00 N ATOM 1479 CA PRO A 93 6.288 20.414 4.166 1.00 0.00 C ATOM 1480 C PRO A 93 5.531 19.182 4.688 1.00 0.00 C ATOM 1481 O PRO A 93 6.066 18.066 4.668 1.00 0.00 O ATOM 1482 CB PRO A 93 6.388 20.407 2.635 1.00 0.00 C ATOM 1483 CG PRO A 93 7.806 20.904 2.353 1.00 0.00 C ATOM 1484 CD PRO A 93 8.607 20.406 3.552 1.00 0.00 C ATOM 0 HA PRO A 93 5.746 21.296 4.507 1.00 0.00 H new ATOM 0 HB2 PRO A 93 6.227 19.408 2.229 1.00 0.00 H new ATOM 0 HB3 PRO A 93 5.640 21.058 2.183 1.00 0.00 H new ATOM 0 HG2 PRO A 93 8.193 20.501 1.417 1.00 0.00 H new ATOM 0 HG3 PRO A 93 7.841 21.990 2.271 1.00 0.00 H new ATOM 0 HD2 PRO A 93 9.028 19.419 3.361 1.00 0.00 H new ATOM 0 HD3 PRO A 93 9.442 21.072 3.771 1.00 0.00 H new ATOM 1492 N ILE A 94 4.288 19.359 5.131 1.00 0.00 N ATOM 1493 CA ILE A 94 3.438 18.285 5.627 1.00 0.00 C ATOM 1494 C ILE A 94 2.072 18.552 5.019 1.00 0.00 C ATOM 1495 O ILE A 94 1.646 19.706 4.964 1.00 0.00 O ATOM 1496 CB ILE A 94 3.373 18.264 7.178 1.00 0.00 C ATOM 1497 CG1 ILE A 94 4.788 18.230 7.790 1.00 0.00 C ATOM 1498 CG2 ILE A 94 2.526 17.081 7.689 1.00 0.00 C ATOM 1499 CD1 ILE A 94 4.869 18.228 9.320 1.00 0.00 C ATOM 0 H ILE A 94 3.837 20.273 5.155 1.00 0.00 H new ATOM 0 HA ILE A 94 3.827 17.306 5.346 1.00 0.00 H new ATOM 0 HB ILE A 94 2.886 19.185 7.499 1.00 0.00 H new ATOM 0 HG12 ILE A 94 5.299 17.341 7.420 1.00 0.00 H new ATOM 0 HG13 ILE A 94 5.341 19.093 7.420 1.00 0.00 H new ATOM 0 HG21 ILE A 94 2.501 17.095 8.779 1.00 0.00 H new ATOM 0 HG22 ILE A 94 1.511 17.166 7.301 1.00 0.00 H new ATOM 0 HG23 ILE A 94 2.967 16.144 7.349 1.00 0.00 H new ATOM 0 HD11 ILE A 94 5.914 18.203 9.629 1.00 0.00 H new ATOM 0 HD12 ILE A 94 4.397 19.129 9.711 1.00 0.00 H new ATOM 0 HD13 ILE A 94 4.354 17.350 9.710 1.00 0.00 H new ATOM 1511 N PHE A 95 1.355 17.513 4.600 1.00 0.00 N ATOM 1512 CA PHE A 95 -0.019 17.687 4.160 1.00 0.00 C ATOM 1513 C PHE A 95 -0.920 16.640 4.797 1.00 0.00 C ATOM 1514 O PHE A 95 -0.463 15.621 5.321 1.00 0.00 O ATOM 1515 CB PHE A 95 -0.102 17.770 2.624 1.00 0.00 C ATOM 1516 CG PHE A 95 -0.410 16.483 1.878 1.00 0.00 C ATOM 1517 CD1 PHE A 95 0.620 15.629 1.438 1.00 0.00 C ATOM 1518 CD2 PHE A 95 -1.748 16.175 1.568 1.00 0.00 C ATOM 1519 CE1 PHE A 95 0.313 14.482 0.678 1.00 0.00 C ATOM 1520 CE2 PHE A 95 -2.049 15.028 0.818 1.00 0.00 C ATOM 1521 CZ PHE A 95 -1.026 14.184 0.362 1.00 0.00 C ATOM 0 H PHE A 95 1.700 16.554 4.557 1.00 0.00 H new ATOM 0 HA PHE A 95 -0.400 18.646 4.510 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -0.867 18.502 2.365 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.848 18.157 2.254 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.648 15.853 1.683 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -2.543 16.822 1.908 1.00 0.00 H new ATOM 0 HE1 PHE A 95 1.105 13.832 0.338 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -3.078 14.793 0.590 1.00 0.00 H new ATOM 0 HZ PHE A 95 -1.264 13.311 -0.228 1.00 0.00 H new ATOM 1531 N VAL A 96 -2.213 16.919 4.769 1.00 0.00 N ATOM 1532 CA VAL A 96 -3.269 15.999 5.130 1.00 0.00 C ATOM 1533 C VAL A 96 -4.432 16.347 4.210 1.00 0.00 C ATOM 1534 O VAL A 96 -4.556 17.493 3.760 1.00 0.00 O ATOM 1535 CB VAL A 96 -3.558 16.074 6.648 1.00 0.00 C ATOM 1536 CG1 VAL A 96 -3.755 17.482 7.226 1.00 0.00 C ATOM 1537 CG2 VAL A 96 -4.731 15.178 7.074 1.00 0.00 C ATOM 0 H VAL A 96 -2.566 17.832 4.482 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.016 14.949 4.983 1.00 0.00 H new ATOM 0 HB VAL A 96 -2.630 15.698 7.079 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.951 17.412 8.296 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.854 18.073 7.060 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -4.600 17.963 6.733 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.888 15.271 8.149 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -5.634 15.486 6.547 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -4.504 14.140 6.829 1.00 0.00 H new ATOM 1547 N ASP A 97 -5.267 15.368 3.886 1.00 0.00 N ATOM 1548 CA ASP A 97 -6.350 15.528 2.936 1.00 0.00 C ATOM 1549 C ASP A 97 -7.523 14.631 3.306 1.00 0.00 C ATOM 1550 O ASP A 97 -7.339 13.572 3.907 1.00 0.00 O ATOM 1551 CB ASP A 97 -5.847 15.206 1.534 1.00 0.00 C ATOM 1552 CG ASP A 97 -6.956 15.482 0.530 1.00 0.00 C ATOM 1553 OD1 ASP A 97 -7.329 16.665 0.394 1.00 0.00 O ATOM 1554 OD2 ASP A 97 -7.474 14.505 -0.044 1.00 0.00 O ATOM 0 H ASP A 97 -5.207 14.430 4.283 1.00 0.00 H new ATOM 0 HA ASP A 97 -6.698 16.561 2.960 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -4.970 15.811 1.301 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -5.539 14.162 1.476 1.00 0.00 H new ATOM 1559 N SER A 98 -8.731 15.067 2.952 1.00 0.00 N ATOM 1560 CA SER A 98 -9.977 14.374 3.240 1.00 0.00 C ATOM 1561 C SER A 98 -10.129 13.068 2.440 1.00 0.00 C ATOM 1562 O SER A 98 -10.979 12.245 2.788 1.00 0.00 O ATOM 1563 CB SER A 98 -11.137 15.335 2.947 1.00 0.00 C ATOM 1564 OG SER A 98 -10.878 16.624 3.489 1.00 0.00 O ATOM 0 H SER A 98 -8.869 15.939 2.442 1.00 0.00 H new ATOM 0 HA SER A 98 -9.979 14.080 4.290 1.00 0.00 H new ATOM 0 HB2 SER A 98 -11.287 15.412 1.870 1.00 0.00 H new ATOM 0 HB3 SER A 98 -12.060 14.937 3.370 1.00 0.00 H new ATOM 0 HG SER A 98 -11.630 17.220 3.289 1.00 0.00 H new ATOM 1570 N ASP A 99 -9.325 12.855 1.389 1.00 0.00 N ATOM 1571 CA ASP A 99 -9.414 11.701 0.495 1.00 0.00 C ATOM 1572 C ASP A 99 -8.062 11.004 0.312 1.00 0.00 C ATOM 1573 O ASP A 99 -8.045 9.775 0.260 1.00 0.00 O ATOM 1574 CB ASP A 99 -9.970 12.145 -0.863 1.00 0.00 C ATOM 1575 CG ASP A 99 -10.015 10.972 -1.856 1.00 0.00 C ATOM 1576 OD1 ASP A 99 -10.914 10.109 -1.738 1.00 0.00 O ATOM 1577 OD2 ASP A 99 -9.179 10.932 -2.787 1.00 0.00 O ATOM 0 H ASP A 99 -8.577 13.500 1.134 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.088 10.977 0.952 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -10.972 12.553 -0.733 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -9.350 12.945 -1.269 1.00 0.00 H new ATOM 1582 N HIS A 100 -6.948 11.754 0.304 1.00 0.00 N ATOM 1583 CA HIS A 100 -5.589 11.311 0.022 1.00 0.00 C ATOM 1584 C HIS A 100 -5.495 10.587 -1.315 1.00 0.00 C ATOM 1585 O HIS A 100 -5.729 9.381 -1.402 1.00 0.00 O ATOM 1586 CB HIS A 100 -4.990 10.487 1.172 1.00 0.00 C ATOM 1587 CG HIS A 100 -4.556 11.322 2.342 1.00 0.00 C ATOM 1588 ND1 HIS A 100 -4.961 11.179 3.648 1.00 0.00 N ATOM 1589 CD2 HIS A 100 -3.650 12.346 2.301 1.00 0.00 C ATOM 1590 CE1 HIS A 100 -4.313 12.101 4.375 1.00 0.00 C ATOM 1591 NE2 HIS A 100 -3.511 12.849 3.597 1.00 0.00 N ATOM 0 H HIS A 100 -6.985 12.752 0.509 1.00 0.00 H new ATOM 0 HA HIS A 100 -4.978 12.210 -0.060 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -5.727 9.758 1.509 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -4.134 9.925 0.799 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -5.632 10.496 4.000 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -3.133 12.703 1.422 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -4.421 12.226 5.442 1.00 0.00 H new ATOM 1599 N ALA A 101 -5.025 11.302 -2.343 1.00 0.00 N ATOM 1600 CA ALA A 101 -4.757 10.708 -3.652 1.00 0.00 C ATOM 1601 C ALA A 101 -3.726 9.569 -3.556 1.00 0.00 C ATOM 1602 O ALA A 101 -3.696 8.677 -4.402 1.00 0.00 O ATOM 1603 CB ALA A 101 -4.280 11.807 -4.606 1.00 0.00 C ATOM 0 H ALA A 101 -4.822 12.300 -2.290 1.00 0.00 H new ATOM 0 HA ALA A 101 -5.676 10.266 -4.037 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -4.077 11.375 -5.586 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -5.053 12.569 -4.699 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.370 12.260 -4.213 1.00 0.00 H new ATOM 1609 N LEU A 102 -2.914 9.565 -2.492 1.00 0.00 N ATOM 1610 CA LEU A 102 -1.940 8.527 -2.198 1.00 0.00 C ATOM 1611 C LEU A 102 -2.620 7.227 -1.856 1.00 0.00 C ATOM 1612 O LEU A 102 -2.023 6.192 -2.095 1.00 0.00 O ATOM 1613 CB LEU A 102 -1.030 8.898 -1.013 1.00 0.00 C ATOM 1614 CG LEU A 102 0.261 9.559 -1.488 1.00 0.00 C ATOM 1615 CD1 LEU A 102 0.048 10.897 -2.176 1.00 0.00 C ATOM 1616 CD2 LEU A 102 1.235 9.746 -0.326 1.00 0.00 C ATOM 0 H LEU A 102 -2.923 10.310 -1.796 1.00 0.00 H new ATOM 0 HA LEU A 102 -1.338 8.422 -3.100 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.561 9.573 -0.342 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -0.792 8.002 -0.440 1.00 0.00 H new ATOM 0 HG LEU A 102 0.678 8.877 -2.229 1.00 0.00 H new ATOM 0 HD11 LEU A 102 1.011 11.305 -2.485 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -0.586 10.759 -3.052 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -0.434 11.589 -1.485 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.148 10.219 -0.689 1.00 0.00 H new ATOM 0 HD22 LEU A 102 0.777 10.378 0.435 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.477 8.775 0.106 1.00 0.00 H new ATOM 1628 N THR A 103 -3.836 7.223 -1.319 1.00 0.00 N ATOM 1629 CA THR A 103 -4.497 5.960 -1.011 1.00 0.00 C ATOM 1630 C THR A 103 -4.742 5.134 -2.279 1.00 0.00 C ATOM 1631 O THR A 103 -4.841 3.914 -2.187 1.00 0.00 O ATOM 1632 CB THR A 103 -5.779 6.138 -0.188 1.00 0.00 C ATOM 1633 OG1 THR A 103 -6.735 6.958 -0.828 1.00 0.00 O ATOM 1634 CG2 THR A 103 -5.487 6.657 1.225 1.00 0.00 C ATOM 0 H THR A 103 -4.374 8.060 -1.092 1.00 0.00 H new ATOM 0 HA THR A 103 -3.811 5.399 -0.376 1.00 0.00 H new ATOM 0 HB THR A 103 -6.213 5.142 -0.104 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.348 7.843 -0.994 1.00 0.00 H new ATOM 0 HG21 THR A 103 -6.423 6.768 1.772 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.843 5.949 1.747 1.00 0.00 H new ATOM 0 HG23 THR A 103 -4.987 7.623 1.162 1.00 0.00 H new ATOM 1642 N ASP A 104 -4.748 5.745 -3.468 1.00 0.00 N ATOM 1643 CA ASP A 104 -4.832 4.977 -4.705 1.00 0.00 C ATOM 1644 C ASP A 104 -3.517 4.276 -5.037 1.00 0.00 C ATOM 1645 O ASP A 104 -3.522 3.270 -5.748 1.00 0.00 O ATOM 1646 CB ASP A 104 -5.240 5.895 -5.861 1.00 0.00 C ATOM 1647 CG ASP A 104 -5.436 5.109 -7.168 1.00 0.00 C ATOM 1648 OD1 ASP A 104 -6.414 4.334 -7.273 1.00 0.00 O ATOM 1649 OD2 ASP A 104 -4.643 5.295 -8.118 1.00 0.00 O ATOM 0 H ASP A 104 -4.696 6.756 -3.595 1.00 0.00 H new ATOM 0 HA ASP A 104 -5.588 4.205 -4.561 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -6.164 6.413 -5.606 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -4.476 6.659 -6.006 1.00 0.00 H new ATOM 1654 N ALA A 105 -2.399 4.771 -4.493 1.00 0.00 N ATOM 1655 CA ALA A 105 -1.069 4.240 -4.786 1.00 0.00 C ATOM 1656 C ALA A 105 -0.425 3.523 -3.593 1.00 0.00 C ATOM 1657 O ALA A 105 0.499 2.735 -3.792 1.00 0.00 O ATOM 1658 CB ALA A 105 -0.194 5.389 -5.274 1.00 0.00 C ATOM 0 H ALA A 105 -2.395 5.552 -3.837 1.00 0.00 H new ATOM 0 HA ALA A 105 -1.168 3.478 -5.559 1.00 0.00 H new ATOM 0 HB1 ALA A 105 0.805 5.015 -5.499 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -0.631 5.822 -6.174 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -0.130 6.152 -4.498 1.00 0.00 H new ATOM 1664 N PHE A 106 -0.913 3.756 -2.373 1.00 0.00 N ATOM 1665 CA PHE A 106 -0.369 3.240 -1.125 1.00 0.00 C ATOM 1666 C PHE A 106 -1.433 2.436 -0.376 1.00 0.00 C ATOM 1667 O PHE A 106 -1.072 1.550 0.397 1.00 0.00 O ATOM 1668 CB PHE A 106 0.066 4.401 -0.211 1.00 0.00 C ATOM 1669 CG PHE A 106 1.363 5.130 -0.526 1.00 0.00 C ATOM 1670 CD1 PHE A 106 1.407 6.144 -1.502 1.00 0.00 C ATOM 1671 CD2 PHE A 106 2.507 4.885 0.257 1.00 0.00 C ATOM 1672 CE1 PHE A 106 2.579 6.909 -1.670 1.00 0.00 C ATOM 1673 CE2 PHE A 106 3.667 5.659 0.093 1.00 0.00 C ATOM 1674 CZ PHE A 106 3.708 6.671 -0.875 1.00 0.00 C ATOM 0 H PHE A 106 -1.738 4.338 -2.226 1.00 0.00 H new ATOM 0 HA PHE A 106 0.485 2.608 -1.370 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.736 5.139 -0.209 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.143 4.012 0.804 1.00 0.00 H new ATOM 0 HD1 PHE A 106 0.543 6.336 -2.122 1.00 0.00 H new ATOM 0 HD2 PHE A 106 2.492 4.093 0.992 1.00 0.00 H new ATOM 0 HE1 PHE A 106 2.607 7.686 -2.419 1.00 0.00 H new ATOM 0 HE2 PHE A 106 4.530 5.474 0.715 1.00 0.00 H new ATOM 0 HZ PHE A 106 4.602 7.262 -1.007 1.00 0.00 H new ATOM 1684 N GLU A 107 -2.726 2.739 -0.586 1.00 0.00 N ATOM 1685 CA GLU A 107 -3.852 2.220 0.192 1.00 0.00 C ATOM 1686 C GLU A 107 -3.541 2.174 1.706 1.00 0.00 C ATOM 1687 O GLU A 107 -3.700 1.143 2.362 1.00 0.00 O ATOM 1688 CB GLU A 107 -4.347 0.917 -0.459 1.00 0.00 C ATOM 1689 CG GLU A 107 -5.862 0.755 -0.287 1.00 0.00 C ATOM 1690 CD GLU A 107 -6.360 -0.578 -0.875 1.00 0.00 C ATOM 1691 OE1 GLU A 107 -6.403 -1.595 -0.146 1.00 0.00 O ATOM 1692 OE2 GLU A 107 -6.737 -0.623 -2.068 1.00 0.00 O ATOM 0 H GLU A 107 -3.020 3.374 -1.328 1.00 0.00 H new ATOM 0 HA GLU A 107 -4.701 2.903 0.160 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -4.096 0.919 -1.520 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -3.834 0.066 -0.012 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -6.116 0.804 0.772 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -6.375 1.583 -0.776 1.00 0.00 H new ATOM 1699 N ASN A 108 -3.026 3.305 2.221 1.00 0.00 N ATOM 1700 CA ASN A 108 -2.480 3.490 3.574 1.00 0.00 C ATOM 1701 C ASN A 108 -3.325 2.806 4.656 1.00 0.00 C ATOM 1702 O ASN A 108 -4.508 3.122 4.795 1.00 0.00 O ATOM 1703 CB ASN A 108 -2.349 4.997 3.886 1.00 0.00 C ATOM 1704 CG ASN A 108 -1.547 5.281 5.162 1.00 0.00 C ATOM 1705 OD1 ASN A 108 -0.487 5.888 5.099 1.00 0.00 O ATOM 1706 ND2 ASN A 108 -2.009 4.878 6.337 1.00 0.00 N ATOM 0 H ASN A 108 -2.978 4.163 1.671 1.00 0.00 H new ATOM 0 HA ASN A 108 -1.498 3.016 3.589 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -1.869 5.496 3.044 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -3.345 5.429 3.987 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -1.481 5.074 7.187 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -2.893 4.372 6.391 1.00 0.00 H new ATOM 1713 N GLU A 109 -2.712 1.945 5.474 1.00 0.00 N ATOM 1714 CA GLU A 109 -3.392 1.200 6.541 1.00 0.00 C ATOM 1715 C GLU A 109 -2.424 0.932 7.719 1.00 0.00 C ATOM 1716 O GLU A 109 -2.479 -0.108 8.378 1.00 0.00 O ATOM 1717 CB GLU A 109 -4.003 -0.084 5.937 1.00 0.00 C ATOM 1718 CG GLU A 109 -5.175 -0.636 6.766 1.00 0.00 C ATOM 1719 CD GLU A 109 -5.789 -1.886 6.113 1.00 0.00 C ATOM 1720 OE1 GLU A 109 -5.268 -3.008 6.313 1.00 0.00 O ATOM 1721 OE2 GLU A 109 -6.821 -1.769 5.412 1.00 0.00 O ATOM 0 H GLU A 109 -1.714 1.742 5.414 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.209 1.786 6.962 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -4.348 0.125 4.924 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -3.229 -0.847 5.859 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -4.828 -0.882 7.770 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -5.940 0.133 6.873 1.00 0.00 H new ATOM 1728 N TYR A 110 -1.479 1.845 7.955 1.00 0.00 N ATOM 1729 CA TYR A 110 -0.358 1.745 8.856 1.00 0.00 C ATOM 1730 C TYR A 110 -0.023 3.171 9.305 1.00 0.00 C ATOM 1731 O TYR A 110 -0.325 4.137 8.601 1.00 0.00 O ATOM 1732 CB TYR A 110 0.820 1.143 8.061 1.00 0.00 C ATOM 1733 CG TYR A 110 1.078 1.806 6.715 1.00 0.00 C ATOM 1734 CD1 TYR A 110 1.641 3.094 6.666 1.00 0.00 C ATOM 1735 CD2 TYR A 110 0.659 1.180 5.523 1.00 0.00 C ATOM 1736 CE1 TYR A 110 1.715 3.796 5.457 1.00 0.00 C ATOM 1737 CE2 TYR A 110 0.745 1.871 4.301 1.00 0.00 C ATOM 1738 CZ TYR A 110 1.236 3.195 4.275 1.00 0.00 C ATOM 1739 OH TYR A 110 1.212 3.901 3.119 1.00 0.00 O ATOM 0 H TYR A 110 -1.491 2.744 7.474 1.00 0.00 H new ATOM 0 HA TYR A 110 -0.567 1.120 9.724 1.00 0.00 H new ATOM 0 HB2 TYR A 110 1.724 1.214 8.666 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.628 0.082 7.898 1.00 0.00 H new ATOM 0 HD1 TYR A 110 2.020 3.546 7.571 1.00 0.00 H new ATOM 0 HD2 TYR A 110 0.273 0.172 5.548 1.00 0.00 H new ATOM 0 HE1 TYR A 110 2.136 4.790 5.430 1.00 0.00 H new ATOM 0 HE2 TYR A 110 0.436 1.390 3.385 1.00 0.00 H new ATOM 0 HH TYR A 110 1.938 4.559 3.123 1.00 0.00 H new ATOM 1749 N VAL A 111 0.613 3.263 10.465 1.00 0.00 N ATOM 1750 CA VAL A 111 1.269 4.432 11.063 1.00 0.00 C ATOM 1751 C VAL A 111 2.010 3.991 12.345 1.00 0.00 C ATOM 1752 O VAL A 111 1.511 3.102 13.042 1.00 0.00 O ATOM 1753 CB VAL A 111 0.299 5.570 11.469 1.00 0.00 C ATOM 1754 CG1 VAL A 111 0.026 6.558 10.334 1.00 0.00 C ATOM 1755 CG2 VAL A 111 -1.025 5.095 12.091 1.00 0.00 C ATOM 0 H VAL A 111 0.694 2.448 11.073 1.00 0.00 H new ATOM 0 HA VAL A 111 1.936 4.822 10.294 1.00 0.00 H new ATOM 0 HB VAL A 111 0.842 6.092 12.257 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -0.660 7.331 10.681 1.00 0.00 H new ATOM 0 HG12 VAL A 111 0.962 7.019 10.020 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.419 6.030 9.491 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -1.639 5.959 12.343 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -1.558 4.467 11.377 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.817 4.521 12.994 1.00 0.00 H new ATOM 1765 N PRO A 112 3.169 4.588 12.685 1.00 0.00 N ATOM 1766 CA PRO A 112 3.947 5.480 11.834 1.00 0.00 C ATOM 1767 C PRO A 112 4.600 4.642 10.728 1.00 0.00 C ATOM 1768 O PRO A 112 4.918 3.470 10.953 1.00 0.00 O ATOM 1769 CB PRO A 112 5.017 6.110 12.733 1.00 0.00 C ATOM 1770 CG PRO A 112 5.148 5.133 13.901 1.00 0.00 C ATOM 1771 CD PRO A 112 3.757 4.506 14.012 1.00 0.00 C ATOM 0 HA PRO A 112 3.336 6.254 11.369 1.00 0.00 H new ATOM 0 HB2 PRO A 112 5.963 6.227 12.204 1.00 0.00 H new ATOM 0 HB3 PRO A 112 4.717 7.101 13.074 1.00 0.00 H new ATOM 0 HG2 PRO A 112 5.912 4.380 13.708 1.00 0.00 H new ATOM 0 HG3 PRO A 112 5.430 5.645 14.821 1.00 0.00 H new ATOM 0 HD2 PRO A 112 3.822 3.470 14.346 1.00 0.00 H new ATOM 0 HD3 PRO A 112 3.147 5.038 14.742 1.00 0.00 H new ATOM 1779 N ALA A 113 4.838 5.216 9.548 1.00 0.00 N ATOM 1780 CA ALA A 113 5.622 4.539 8.518 1.00 0.00 C ATOM 1781 C ALA A 113 6.430 5.521 7.701 1.00 0.00 C ATOM 1782 O ALA A 113 6.119 6.710 7.654 1.00 0.00 O ATOM 1783 CB ALA A 113 4.739 3.709 7.588 1.00 0.00 C ATOM 0 H ALA A 113 4.501 6.142 9.284 1.00 0.00 H new ATOM 0 HA ALA A 113 6.304 3.869 9.041 1.00 0.00 H new ATOM 0 HB1 ALA A 113 5.360 3.222 6.836 1.00 0.00 H new ATOM 0 HB2 ALA A 113 4.210 2.953 8.168 1.00 0.00 H new ATOM 0 HB3 ALA A 113 4.016 4.360 7.096 1.00 0.00 H new ATOM 1789 N TYR A 114 7.456 4.996 7.040 1.00 0.00 N ATOM 1790 CA TYR A 114 8.480 5.779 6.374 1.00 0.00 C ATOM 1791 C TYR A 114 8.794 5.119 5.034 1.00 0.00 C ATOM 1792 O TYR A 114 8.816 3.888 4.934 1.00 0.00 O ATOM 1793 CB TYR A 114 9.727 5.826 7.274 1.00 0.00 C ATOM 1794 CG TYR A 114 9.472 5.941 8.773 1.00 0.00 C ATOM 1795 CD1 TYR A 114 8.693 6.997 9.282 1.00 0.00 C ATOM 1796 CD2 TYR A 114 10.002 4.978 9.657 1.00 0.00 C ATOM 1797 CE1 TYR A 114 8.415 7.077 10.657 1.00 0.00 C ATOM 1798 CE2 TYR A 114 9.758 5.069 11.039 1.00 0.00 C ATOM 1799 CZ TYR A 114 8.951 6.115 11.541 1.00 0.00 C ATOM 1800 OH TYR A 114 8.679 6.207 12.870 1.00 0.00 O ATOM 0 H TYR A 114 7.598 3.990 6.953 1.00 0.00 H new ATOM 0 HA TYR A 114 8.143 6.800 6.194 1.00 0.00 H new ATOM 0 HB2 TYR A 114 10.313 4.925 7.094 1.00 0.00 H new ATOM 0 HB3 TYR A 114 10.341 6.672 6.965 1.00 0.00 H new ATOM 0 HD1 TYR A 114 8.307 7.750 8.612 1.00 0.00 H new ATOM 0 HD2 TYR A 114 10.599 4.166 9.270 1.00 0.00 H new ATOM 0 HE1 TYR A 114 7.792 7.873 11.037 1.00 0.00 H new ATOM 0 HE2 TYR A 114 10.186 4.342 11.714 1.00 0.00 H new ATOM 0 HH TYR A 114 9.496 6.037 13.384 1.00 0.00 H new ATOM 1810 N TYR A 115 9.050 5.932 4.012 1.00 0.00 N ATOM 1811 CA TYR A 115 9.261 5.484 2.641 1.00 0.00 C ATOM 1812 C TYR A 115 10.402 6.333 2.103 1.00 0.00 C ATOM 1813 O TYR A 115 10.384 7.553 2.288 1.00 0.00 O ATOM 1814 CB TYR A 115 7.991 5.696 1.801 1.00 0.00 C ATOM 1815 CG TYR A 115 6.870 4.688 1.988 1.00 0.00 C ATOM 1816 CD1 TYR A 115 6.033 4.732 3.121 1.00 0.00 C ATOM 1817 CD2 TYR A 115 6.614 3.742 0.977 1.00 0.00 C ATOM 1818 CE1 TYR A 115 4.952 3.838 3.247 1.00 0.00 C ATOM 1819 CE2 TYR A 115 5.561 2.823 1.111 1.00 0.00 C ATOM 1820 CZ TYR A 115 4.718 2.868 2.242 1.00 0.00 C ATOM 1821 OH TYR A 115 3.695 1.974 2.341 1.00 0.00 O ATOM 0 H TYR A 115 9.118 6.944 4.118 1.00 0.00 H new ATOM 0 HA TYR A 115 9.495 4.420 2.598 1.00 0.00 H new ATOM 0 HB2 TYR A 115 7.597 6.687 2.025 1.00 0.00 H new ATOM 0 HB3 TYR A 115 8.276 5.696 0.749 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.222 5.457 3.899 1.00 0.00 H new ATOM 0 HD2 TYR A 115 7.232 3.723 0.092 1.00 0.00 H new ATOM 0 HE1 TYR A 115 4.303 3.892 4.108 1.00 0.00 H new ATOM 0 HE2 TYR A 115 5.396 2.079 0.346 1.00 0.00 H new ATOM 0 HH TYR A 115 2.998 2.338 2.926 1.00 0.00 H new ATOM 1831 N VAL A 116 11.381 5.708 1.452 1.00 0.00 N ATOM 1832 CA VAL A 116 12.635 6.351 1.075 1.00 0.00 C ATOM 1833 C VAL A 116 12.765 6.207 -0.432 1.00 0.00 C ATOM 1834 O VAL A 116 12.616 5.103 -0.955 1.00 0.00 O ATOM 1835 CB VAL A 116 13.843 5.717 1.809 1.00 0.00 C ATOM 1836 CG1 VAL A 116 15.009 6.718 1.834 1.00 0.00 C ATOM 1837 CG2 VAL A 116 13.549 5.256 3.249 1.00 0.00 C ATOM 0 H VAL A 116 11.324 4.730 1.169 1.00 0.00 H new ATOM 0 HA VAL A 116 12.629 7.402 1.364 1.00 0.00 H new ATOM 0 HB VAL A 116 14.093 4.818 1.245 1.00 0.00 H new ATOM 0 HG11 VAL A 116 15.860 6.273 2.350 1.00 0.00 H new ATOM 0 HG12 VAL A 116 15.295 6.969 0.813 1.00 0.00 H new ATOM 0 HG13 VAL A 116 14.700 7.623 2.357 1.00 0.00 H new ATOM 0 HG21 VAL A 116 14.451 4.825 3.684 1.00 0.00 H new ATOM 0 HG22 VAL A 116 13.230 6.110 3.846 1.00 0.00 H new ATOM 0 HG23 VAL A 116 12.758 4.506 3.237 1.00 0.00 H new ATOM 1847 N PHE A 117 13.047 7.300 -1.129 1.00 0.00 N ATOM 1848 CA PHE A 117 13.025 7.376 -2.577 1.00 0.00 C ATOM 1849 C PHE A 117 14.348 7.967 -3.034 1.00 0.00 C ATOM 1850 O PHE A 117 14.873 8.891 -2.410 1.00 0.00 O ATOM 1851 CB PHE A 117 11.867 8.266 -3.052 1.00 0.00 C ATOM 1852 CG PHE A 117 10.483 7.850 -2.583 1.00 0.00 C ATOM 1853 CD1 PHE A 117 10.034 8.206 -1.297 1.00 0.00 C ATOM 1854 CD2 PHE A 117 9.630 7.123 -3.436 1.00 0.00 C ATOM 1855 CE1 PHE A 117 8.758 7.814 -0.864 1.00 0.00 C ATOM 1856 CE2 PHE A 117 8.342 6.754 -3.011 1.00 0.00 C ATOM 1857 CZ PHE A 117 7.909 7.091 -1.719 1.00 0.00 C ATOM 0 H PHE A 117 13.304 8.182 -0.686 1.00 0.00 H new ATOM 0 HA PHE A 117 12.882 6.381 -2.999 1.00 0.00 H new ATOM 0 HB2 PHE A 117 12.054 9.285 -2.714 1.00 0.00 H new ATOM 0 HB3 PHE A 117 11.871 8.285 -4.142 1.00 0.00 H new ATOM 0 HD1 PHE A 117 10.672 8.781 -0.643 1.00 0.00 H new ATOM 0 HD2 PHE A 117 9.968 6.847 -4.424 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.427 8.069 0.132 1.00 0.00 H new ATOM 0 HE2 PHE A 117 7.687 6.212 -3.677 1.00 0.00 H new ATOM 0 HZ PHE A 117 6.926 6.795 -1.383 1.00 0.00 H new ATOM 1867 N ASP A 118 14.887 7.435 -4.125 1.00 0.00 N ATOM 1868 CA ASP A 118 16.079 8.005 -4.761 1.00 0.00 C ATOM 1869 C ASP A 118 15.825 9.398 -5.348 1.00 0.00 C ATOM 1870 O ASP A 118 14.695 9.892 -5.379 1.00 0.00 O ATOM 1871 CB ASP A 118 16.716 7.026 -5.763 1.00 0.00 C ATOM 1872 CG ASP A 118 16.251 7.153 -7.218 1.00 0.00 C ATOM 1873 OD1 ASP A 118 15.148 7.677 -7.478 1.00 0.00 O ATOM 1874 OD2 ASP A 118 16.995 6.677 -8.101 1.00 0.00 O ATOM 0 H ASP A 118 14.519 6.606 -4.592 1.00 0.00 H new ATOM 0 HA ASP A 118 16.818 8.157 -3.975 1.00 0.00 H new ATOM 0 HB2 ASP A 118 17.797 7.162 -5.735 1.00 0.00 H new ATOM 0 HB3 ASP A 118 16.514 6.010 -5.426 1.00 0.00 H new ATOM 1879 N LYS A 119 16.894 10.053 -5.818 1.00 0.00 N ATOM 1880 CA LYS A 119 16.834 11.393 -6.415 1.00 0.00 C ATOM 1881 C LYS A 119 15.948 11.525 -7.652 1.00 0.00 C ATOM 1882 O LYS A 119 15.798 12.646 -8.133 1.00 0.00 O ATOM 1883 CB LYS A 119 18.236 11.962 -6.696 1.00 0.00 C ATOM 1884 CG LYS A 119 19.015 11.268 -7.826 1.00 0.00 C ATOM 1885 CD LYS A 119 19.574 12.247 -8.878 1.00 0.00 C ATOM 1886 CE LYS A 119 18.531 12.580 -9.958 1.00 0.00 C ATOM 1887 NZ LYS A 119 19.058 13.504 -10.996 1.00 0.00 N ATOM 0 H LYS A 119 17.836 9.663 -5.794 1.00 0.00 H new ATOM 0 HA LYS A 119 16.346 11.992 -5.646 1.00 0.00 H new ATOM 0 HB2 LYS A 119 18.138 13.019 -6.941 1.00 0.00 H new ATOM 0 HB3 LYS A 119 18.825 11.900 -5.781 1.00 0.00 H new ATOM 0 HG2 LYS A 119 19.840 10.702 -7.394 1.00 0.00 H new ATOM 0 HG3 LYS A 119 18.360 10.550 -8.321 1.00 0.00 H new ATOM 0 HD2 LYS A 119 19.894 13.166 -8.386 1.00 0.00 H new ATOM 0 HD3 LYS A 119 20.457 11.812 -9.347 1.00 0.00 H new ATOM 0 HE2 LYS A 119 18.198 11.657 -10.433 1.00 0.00 H new ATOM 0 HE3 LYS A 119 17.657 13.029 -9.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 18.700 13.218 -11.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 18.746 14.474 -10.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 20.097 13.467 -10.998 1.00 0.00 H new ATOM 1901 N THR A 120 15.377 10.447 -8.181 1.00 0.00 N ATOM 1902 CA THR A 120 14.428 10.514 -9.295 1.00 0.00 C ATOM 1903 C THR A 120 13.094 9.856 -8.894 1.00 0.00 C ATOM 1904 O THR A 120 12.222 9.600 -9.726 1.00 0.00 O ATOM 1905 CB THR A 120 15.115 10.031 -10.590 1.00 0.00 C ATOM 1906 OG1 THR A 120 14.464 10.515 -11.750 1.00 0.00 O ATOM 1907 CG2 THR A 120 15.275 8.514 -10.718 1.00 0.00 C ATOM 0 H THR A 120 15.558 9.499 -7.851 1.00 0.00 H new ATOM 0 HA THR A 120 14.133 11.536 -9.531 1.00 0.00 H new ATOM 0 HB THR A 120 16.117 10.452 -10.510 1.00 0.00 H new ATOM 0 HG1 THR A 120 14.931 10.188 -12.547 1.00 0.00 H new ATOM 0 HG21 THR A 120 15.768 8.278 -11.661 1.00 0.00 H new ATOM 0 HG22 THR A 120 15.878 8.141 -9.890 1.00 0.00 H new ATOM 0 HG23 THR A 120 14.293 8.041 -10.694 1.00 0.00 H new ATOM 1915 N GLY A 121 12.904 9.642 -7.590 1.00 0.00 N ATOM 1916 CA GLY A 121 11.654 9.242 -6.990 1.00 0.00 C ATOM 1917 C GLY A 121 11.398 7.754 -7.053 1.00 0.00 C ATOM 1918 O GLY A 121 10.268 7.373 -6.763 1.00 0.00 O ATOM 0 H GLY A 121 13.654 9.750 -6.907 1.00 0.00 H new ATOM 0 HA2 GLY A 121 11.644 9.560 -5.947 1.00 0.00 H new ATOM 0 HA3 GLY A 121 10.838 9.764 -7.490 1.00 0.00 H new ATOM 1922 N GLN A 122 12.371 6.919 -7.433 1.00 0.00 N ATOM 1923 CA GLN A 122 12.156 5.482 -7.407 1.00 0.00 C ATOM 1924 C GLN A 122 12.163 5.057 -5.937 1.00 0.00 C ATOM 1925 O GLN A 122 13.120 5.326 -5.206 1.00 0.00 O ATOM 1926 CB GLN A 122 13.145 4.732 -8.326 1.00 0.00 C ATOM 1927 CG GLN A 122 14.391 4.132 -7.660 1.00 0.00 C ATOM 1928 CD GLN A 122 15.315 3.483 -8.688 1.00 0.00 C ATOM 1929 OE1 GLN A 122 15.134 2.324 -9.053 1.00 0.00 O ATOM 1930 NE2 GLN A 122 16.329 4.184 -9.163 1.00 0.00 N ATOM 0 H GLN A 122 13.294 7.212 -7.755 1.00 0.00 H new ATOM 0 HA GLN A 122 11.190 5.207 -7.831 1.00 0.00 H new ATOM 0 HB2 GLN A 122 12.604 3.926 -8.822 1.00 0.00 H new ATOM 0 HB3 GLN A 122 13.474 5.421 -9.104 1.00 0.00 H new ATOM 0 HG2 GLN A 122 14.931 4.913 -7.125 1.00 0.00 H new ATOM 0 HG3 GLN A 122 14.089 3.390 -6.921 1.00 0.00 H new ATOM 0 HE21 GLN A 122 16.473 5.146 -8.855 1.00 0.00 H new ATOM 0 HE22 GLN A 122 16.968 3.763 -9.838 1.00 0.00 H new ATOM 1939 N LEU A 123 11.074 4.433 -5.501 1.00 0.00 N ATOM 1940 CA LEU A 123 10.895 3.911 -4.152 1.00 0.00 C ATOM 1941 C LEU A 123 11.996 2.898 -3.830 1.00 0.00 C ATOM 1942 O LEU A 123 11.985 1.790 -4.364 1.00 0.00 O ATOM 1943 CB LEU A 123 9.485 3.315 -4.022 1.00 0.00 C ATOM 1944 CG LEU A 123 9.216 2.668 -2.652 1.00 0.00 C ATOM 1945 CD1 LEU A 123 9.633 3.543 -1.466 1.00 0.00 C ATOM 1946 CD2 LEU A 123 7.727 2.354 -2.514 1.00 0.00 C ATOM 0 H LEU A 123 10.263 4.271 -6.099 1.00 0.00 H new ATOM 0 HA LEU A 123 10.983 4.714 -3.420 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.750 4.101 -4.194 1.00 0.00 H new ATOM 0 HB3 LEU A 123 9.342 2.568 -4.802 1.00 0.00 H new ATOM 0 HG LEU A 123 9.823 1.763 -2.622 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.413 3.022 -0.534 1.00 0.00 H new ATOM 0 HD12 LEU A 123 10.702 3.748 -1.523 1.00 0.00 H new ATOM 0 HD13 LEU A 123 9.081 4.482 -1.495 1.00 0.00 H new ATOM 0 HD21 LEU A 123 7.540 1.896 -1.543 1.00 0.00 H new ATOM 0 HD22 LEU A 123 7.152 3.276 -2.597 1.00 0.00 H new ATOM 0 HD23 LEU A 123 7.426 1.666 -3.304 1.00 0.00 H new ATOM 1958 N ARG A 124 12.960 3.258 -2.983 1.00 0.00 N ATOM 1959 CA ARG A 124 14.066 2.377 -2.624 1.00 0.00 C ATOM 1960 C ARG A 124 13.700 1.446 -1.475 1.00 0.00 C ATOM 1961 O ARG A 124 14.112 0.288 -1.518 1.00 0.00 O ATOM 1962 CB ARG A 124 15.328 3.190 -2.277 1.00 0.00 C ATOM 1963 CG ARG A 124 15.940 3.937 -3.475 1.00 0.00 C ATOM 1964 CD ARG A 124 16.310 3.050 -4.677 1.00 0.00 C ATOM 1965 NE ARG A 124 17.277 1.998 -4.313 1.00 0.00 N ATOM 1966 CZ ARG A 124 17.114 0.671 -4.343 1.00 0.00 C ATOM 1967 NH1 ARG A 124 15.997 0.104 -4.800 1.00 0.00 N ATOM 1968 NH2 ARG A 124 18.113 -0.075 -3.897 1.00 0.00 N ATOM 0 H ARG A 124 12.994 4.170 -2.527 1.00 0.00 H new ATOM 0 HA ARG A 124 14.279 1.758 -3.496 1.00 0.00 H new ATOM 0 HB2 ARG A 124 15.080 3.913 -1.500 1.00 0.00 H new ATOM 0 HB3 ARG A 124 16.078 2.518 -1.860 1.00 0.00 H new ATOM 0 HG2 ARG A 124 15.234 4.698 -3.808 1.00 0.00 H new ATOM 0 HG3 ARG A 124 16.836 4.459 -3.139 1.00 0.00 H new ATOM 0 HD2 ARG A 124 15.407 2.589 -5.078 1.00 0.00 H new ATOM 0 HD3 ARG A 124 16.730 3.670 -5.469 1.00 0.00 H new ATOM 0 HE ARG A 124 18.190 2.325 -3.997 1.00 0.00 H new ATOM 0 HH11 ARG A 124 15.232 0.686 -5.141 1.00 0.00 H new ATOM 0 HH12 ARG A 124 15.907 -0.912 -4.808 1.00 0.00 H new ATOM 0 HH21 ARG A 124 18.964 0.367 -3.549 1.00 0.00 H new ATOM 0 HH22 ARG A 124 18.032 -1.092 -3.901 1.00 0.00 H new ATOM 1982 N HIS A 125 12.951 1.903 -0.466 1.00 0.00 N ATOM 1983 CA HIS A 125 12.629 1.087 0.702 1.00 0.00 C ATOM 1984 C HIS A 125 11.397 1.642 1.418 1.00 0.00 C ATOM 1985 O HIS A 125 11.110 2.835 1.323 1.00 0.00 O ATOM 1986 CB HIS A 125 13.838 1.103 1.650 1.00 0.00 C ATOM 1987 CG HIS A 125 13.716 0.169 2.826 1.00 0.00 C ATOM 1988 ND1 HIS A 125 14.010 -1.176 2.840 1.00 0.00 N ATOM 1989 CD2 HIS A 125 13.348 0.516 4.098 1.00 0.00 C ATOM 1990 CE1 HIS A 125 13.836 -1.627 4.093 1.00 0.00 C ATOM 1991 NE2 HIS A 125 13.476 -0.619 4.910 1.00 0.00 N ATOM 0 H HIS A 125 12.555 2.843 -0.439 1.00 0.00 H new ATOM 0 HA HIS A 125 12.408 0.066 0.389 1.00 0.00 H new ATOM 0 HB2 HIS A 125 14.732 0.841 1.084 1.00 0.00 H new ATOM 0 HB3 HIS A 125 13.981 2.118 2.020 1.00 0.00 H new ATOM 0 HD2 HIS A 125 13.017 1.493 4.419 1.00 0.00 H new ATOM 0 HE1 HIS A 125 13.966 -2.654 4.402 1.00 0.00 H new ATOM 0 HE2 HIS A 125 13.326 -0.671 5.918 1.00 0.00 H new ATOM 1999 N PHE A 126 10.730 0.790 2.197 1.00 0.00 N ATOM 2000 CA PHE A 126 9.640 1.134 3.101 1.00 0.00 C ATOM 2001 C PHE A 126 9.808 0.307 4.371 1.00 0.00 C ATOM 2002 O PHE A 126 10.193 -0.865 4.302 1.00 0.00 O ATOM 2003 CB PHE A 126 8.280 0.836 2.441 1.00 0.00 C ATOM 2004 CG PHE A 126 7.182 0.305 3.359 1.00 0.00 C ATOM 2005 CD1 PHE A 126 6.533 1.154 4.279 1.00 0.00 C ATOM 2006 CD2 PHE A 126 6.821 -1.057 3.308 1.00 0.00 C ATOM 2007 CE1 PHE A 126 5.513 0.653 5.113 1.00 0.00 C ATOM 2008 CE2 PHE A 126 5.818 -1.561 4.157 1.00 0.00 C ATOM 2009 CZ PHE A 126 5.160 -0.703 5.056 1.00 0.00 C ATOM 0 H PHE A 126 10.948 -0.206 2.213 1.00 0.00 H new ATOM 0 HA PHE A 126 9.667 2.198 3.337 1.00 0.00 H new ATOM 0 HB2 PHE A 126 7.920 1.752 1.972 1.00 0.00 H new ATOM 0 HB3 PHE A 126 8.439 0.110 1.643 1.00 0.00 H new ATOM 0 HD1 PHE A 126 6.819 2.193 4.345 1.00 0.00 H new ATOM 0 HD2 PHE A 126 7.317 -1.718 2.613 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.002 1.315 5.797 1.00 0.00 H new ATOM 0 HE2 PHE A 126 5.554 -2.607 4.118 1.00 0.00 H new ATOM 0 HZ PHE A 126 4.384 -1.088 5.701 1.00 0.00 H new ATOM 2019 N GLN A 127 9.475 0.906 5.512 1.00 0.00 N ATOM 2020 CA GLN A 127 9.360 0.220 6.788 1.00 0.00 C ATOM 2021 C GLN A 127 8.305 0.970 7.613 1.00 0.00 C ATOM 2022 O GLN A 127 8.048 2.153 7.368 1.00 0.00 O ATOM 2023 CB GLN A 127 10.738 0.165 7.488 1.00 0.00 C ATOM 2024 CG GLN A 127 11.068 -1.236 8.030 1.00 0.00 C ATOM 2025 CD GLN A 127 10.079 -1.663 9.111 1.00 0.00 C ATOM 2026 OE1 GLN A 127 9.085 -2.327 8.832 1.00 0.00 O ATOM 2027 NE2 GLN A 127 10.258 -1.210 10.338 1.00 0.00 N ATOM 0 H GLN A 127 9.274 1.904 5.572 1.00 0.00 H new ATOM 0 HA GLN A 127 9.043 -0.815 6.663 1.00 0.00 H new ATOM 0 HB2 GLN A 127 11.512 0.470 6.784 1.00 0.00 H new ATOM 0 HB3 GLN A 127 10.754 0.882 8.309 1.00 0.00 H new ATOM 0 HG2 GLN A 127 11.050 -1.957 7.213 1.00 0.00 H new ATOM 0 HG3 GLN A 127 12.079 -1.241 8.437 1.00 0.00 H new ATOM 0 HE21 GLN A 127 11.086 -0.659 10.562 1.00 0.00 H new ATOM 0 HE22 GLN A 127 9.568 -1.411 11.062 1.00 0.00 H new ATOM 2036 N ALA A 128 7.711 0.306 8.605 1.00 0.00 N ATOM 2037 CA ALA A 128 6.724 0.896 9.494 1.00 0.00 C ATOM 2038 C ALA A 128 7.056 0.530 10.941 1.00 0.00 C ATOM 2039 O ALA A 128 7.607 -0.542 11.213 1.00 0.00 O ATOM 2040 CB ALA A 128 5.322 0.404 9.119 1.00 0.00 C ATOM 0 H ALA A 128 7.909 -0.673 8.812 1.00 0.00 H new ATOM 0 HA ALA A 128 6.745 1.981 9.393 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.588 0.851 9.790 1.00 0.00 H new ATOM 0 HB2 ALA A 128 5.098 0.692 8.092 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.281 -0.682 9.208 1.00 0.00 H new ATOM 2046 N GLY A 129 6.685 1.410 11.868 1.00 0.00 N ATOM 2047 CA GLY A 129 7.040 1.303 13.273 1.00 0.00 C ATOM 2048 C GLY A 129 8.534 1.542 13.518 1.00 0.00 C ATOM 2049 O GLY A 129 9.338 1.691 12.593 1.00 0.00 O ATOM 0 H GLY A 129 6.119 2.231 11.655 1.00 0.00 H new ATOM 0 HA2 GLY A 129 6.460 2.026 13.847 1.00 0.00 H new ATOM 0 HA3 GLY A 129 6.768 0.313 13.639 1.00 0.00 H new ATOM 2053 N GLY A 130 8.890 1.595 14.799 1.00 0.00 N ATOM 2054 CA GLY A 130 10.220 1.862 15.324 1.00 0.00 C ATOM 2055 C GLY A 130 10.041 2.470 16.717 1.00 0.00 C ATOM 2056 O GLY A 130 8.962 2.982 17.026 1.00 0.00 O ATOM 0 H GLY A 130 8.210 1.442 15.544 1.00 0.00 H new ATOM 0 HA2 GLY A 130 10.805 0.944 15.377 1.00 0.00 H new ATOM 0 HA3 GLY A 130 10.761 2.547 14.671 1.00 0.00 H new ATOM 2060 N SER A 131 11.079 2.452 17.557 1.00 0.00 N ATOM 2061 CA SER A 131 11.064 3.173 18.836 1.00 0.00 C ATOM 2062 C SER A 131 10.935 4.692 18.607 1.00 0.00 C ATOM 2063 O SER A 131 10.418 5.420 19.454 1.00 0.00 O ATOM 2064 CB SER A 131 12.336 2.847 19.629 1.00 0.00 C ATOM 2065 OG SER A 131 12.572 1.444 19.657 1.00 0.00 O ATOM 0 H SER A 131 11.945 1.944 17.375 1.00 0.00 H new ATOM 0 HA SER A 131 10.197 2.850 19.413 1.00 0.00 H new ATOM 0 HB2 SER A 131 13.190 3.354 19.179 1.00 0.00 H new ATOM 0 HB3 SER A 131 12.241 3.224 20.647 1.00 0.00 H new ATOM 0 HG SER A 131 13.389 1.260 20.166 1.00 0.00 H new ATOM 2071 N GLY A 132 11.377 5.147 17.434 1.00 0.00 N ATOM 2072 CA GLY A 132 11.195 6.469 16.872 1.00 0.00 C ATOM 2073 C GLY A 132 11.588 6.292 15.413 1.00 0.00 C ATOM 2074 O GLY A 132 10.805 5.733 14.646 1.00 0.00 O ATOM 0 H GLY A 132 11.914 4.545 16.809 1.00 0.00 H new ATOM 0 HA2 GLY A 132 10.164 6.809 16.972 1.00 0.00 H new ATOM 0 HA3 GLY A 132 11.824 7.207 17.370 1.00 0.00 H new ATOM 2078 N MET A 133 12.829 6.637 15.051 1.00 0.00 N ATOM 2079 CA MET A 133 13.333 6.508 13.676 1.00 0.00 C ATOM 2080 C MET A 133 14.795 6.046 13.581 1.00 0.00 C ATOM 2081 O MET A 133 15.401 6.196 12.521 1.00 0.00 O ATOM 2082 CB MET A 133 13.171 7.837 12.918 1.00 0.00 C ATOM 2083 CG MET A 133 11.739 8.365 12.844 1.00 0.00 C ATOM 2084 SD MET A 133 11.398 9.407 11.403 1.00 0.00 S ATOM 2085 CE MET A 133 12.871 10.466 11.368 1.00 0.00 C ATOM 0 H MET A 133 13.515 7.015 15.704 1.00 0.00 H new ATOM 0 HA MET A 133 12.728 5.726 13.218 1.00 0.00 H new ATOM 0 HB2 MET A 133 13.796 8.590 13.397 1.00 0.00 H new ATOM 0 HB3 MET A 133 13.548 7.708 11.903 1.00 0.00 H new ATOM 0 HG2 MET A 133 11.053 7.518 12.835 1.00 0.00 H new ATOM 0 HG3 MET A 133 11.528 8.936 13.748 1.00 0.00 H new ATOM 0 HE1 MET A 133 12.738 11.250 10.623 1.00 0.00 H new ATOM 0 HE2 MET A 133 13.017 10.918 12.349 1.00 0.00 H new ATOM 0 HE3 MET A 133 13.744 9.866 11.111 1.00 0.00 H new ATOM 2095 N LYS A 134 15.417 5.501 14.638 1.00 0.00 N ATOM 2096 CA LYS A 134 16.843 5.138 14.548 1.00 0.00 C ATOM 2097 C LYS A 134 17.114 4.109 13.449 1.00 0.00 C ATOM 2098 O LYS A 134 18.144 4.216 12.789 1.00 0.00 O ATOM 2099 CB LYS A 134 17.406 4.652 15.897 1.00 0.00 C ATOM 2100 CG LYS A 134 17.727 5.777 16.897 1.00 0.00 C ATOM 2101 CD LYS A 134 18.736 6.844 16.419 1.00 0.00 C ATOM 2102 CE LYS A 134 20.044 6.244 15.877 1.00 0.00 C ATOM 2103 NZ LYS A 134 21.061 7.284 15.578 1.00 0.00 N ATOM 0 H LYS A 134 14.975 5.306 15.537 1.00 0.00 H new ATOM 0 HA LYS A 134 17.368 6.055 14.278 1.00 0.00 H new ATOM 0 HB2 LYS A 134 16.686 3.972 16.353 1.00 0.00 H new ATOM 0 HB3 LYS A 134 18.314 4.078 15.712 1.00 0.00 H new ATOM 0 HG2 LYS A 134 16.796 6.279 17.159 1.00 0.00 H new ATOM 0 HG3 LYS A 134 18.113 5.324 17.810 1.00 0.00 H new ATOM 0 HD2 LYS A 134 18.272 7.450 15.641 1.00 0.00 H new ATOM 0 HD3 LYS A 134 18.967 7.513 17.248 1.00 0.00 H new ATOM 0 HE2 LYS A 134 20.449 5.543 16.607 1.00 0.00 H new ATOM 0 HE3 LYS A 134 19.832 5.675 14.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 21.986 6.832 15.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 20.786 7.802 14.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 21.124 7.947 16.377 1.00 0.00 H new ATOM 2117 N MET A 135 16.205 3.159 13.200 1.00 0.00 N ATOM 2118 CA MET A 135 16.382 2.218 12.093 1.00 0.00 C ATOM 2119 C MET A 135 16.261 2.938 10.742 1.00 0.00 C ATOM 2120 O MET A 135 17.043 2.669 9.830 1.00 0.00 O ATOM 2121 CB MET A 135 15.442 1.006 12.230 1.00 0.00 C ATOM 2122 CG MET A 135 13.934 1.287 12.099 1.00 0.00 C ATOM 2123 SD MET A 135 13.099 0.409 10.744 1.00 0.00 S ATOM 2124 CE MET A 135 13.919 1.119 9.289 1.00 0.00 C ATOM 0 H MET A 135 15.352 3.024 13.742 1.00 0.00 H new ATOM 0 HA MET A 135 17.393 1.813 12.136 1.00 0.00 H new ATOM 0 HB2 MET A 135 15.719 0.272 11.473 1.00 0.00 H new ATOM 0 HB3 MET A 135 15.620 0.545 13.201 1.00 0.00 H new ATOM 0 HG2 MET A 135 13.448 1.020 13.038 1.00 0.00 H new ATOM 0 HG3 MET A 135 13.791 2.358 11.959 1.00 0.00 H new ATOM 0 HE1 MET A 135 13.494 0.685 8.384 1.00 0.00 H new ATOM 0 HE2 MET A 135 13.770 2.199 9.278 1.00 0.00 H new ATOM 0 HE3 MET A 135 14.986 0.900 9.330 1.00 0.00 H new ATOM 2134 N LEU A 136 15.327 3.892 10.611 1.00 0.00 N ATOM 2135 CA LEU A 136 15.165 4.668 9.377 1.00 0.00 C ATOM 2136 C LEU A 136 16.422 5.475 9.071 1.00 0.00 C ATOM 2137 O LEU A 136 16.799 5.614 7.910 1.00 0.00 O ATOM 2138 CB LEU A 136 13.974 5.628 9.497 1.00 0.00 C ATOM 2139 CG LEU A 136 13.686 6.411 8.200 1.00 0.00 C ATOM 2140 CD1 LEU A 136 13.256 5.453 7.081 1.00 0.00 C ATOM 2141 CD2 LEU A 136 12.648 7.494 8.502 1.00 0.00 C ATOM 0 H LEU A 136 14.670 4.144 11.350 1.00 0.00 H new ATOM 0 HA LEU A 136 14.986 3.962 8.566 1.00 0.00 H new ATOM 0 HB2 LEU A 136 13.086 5.060 9.775 1.00 0.00 H new ATOM 0 HB3 LEU A 136 14.166 6.335 10.304 1.00 0.00 H new ATOM 0 HG LEU A 136 14.587 6.906 7.839 1.00 0.00 H new ATOM 0 HD11 LEU A 136 13.056 6.021 6.172 1.00 0.00 H new ATOM 0 HD12 LEU A 136 14.053 4.734 6.892 1.00 0.00 H new ATOM 0 HD13 LEU A 136 12.353 4.923 7.383 1.00 0.00 H new ATOM 0 HD21 LEU A 136 12.434 8.057 7.593 1.00 0.00 H new ATOM 0 HD22 LEU A 136 11.732 7.029 8.865 1.00 0.00 H new ATOM 0 HD23 LEU A 136 13.038 8.169 9.263 1.00 0.00 H new ATOM 2153 N GLU A 137 17.082 5.993 10.102 1.00 0.00 N ATOM 2154 CA GLU A 137 18.307 6.756 9.951 1.00 0.00 C ATOM 2155 C GLU A 137 19.405 5.912 9.292 1.00 0.00 C ATOM 2156 O GLU A 137 20.171 6.433 8.476 1.00 0.00 O ATOM 2157 CB GLU A 137 18.704 7.310 11.324 1.00 0.00 C ATOM 2158 CG GLU A 137 19.804 8.367 11.227 1.00 0.00 C ATOM 2159 CD GLU A 137 19.787 9.262 12.470 1.00 0.00 C ATOM 2160 OE1 GLU A 137 19.041 10.267 12.474 1.00 0.00 O ATOM 2161 OE2 GLU A 137 20.503 8.968 13.454 1.00 0.00 O ATOM 0 H GLU A 137 16.777 5.892 11.070 1.00 0.00 H new ATOM 0 HA GLU A 137 18.153 7.600 9.278 1.00 0.00 H new ATOM 0 HB2 GLU A 137 17.828 7.744 11.805 1.00 0.00 H new ATOM 0 HB3 GLU A 137 19.044 6.492 11.959 1.00 0.00 H new ATOM 0 HG2 GLU A 137 20.776 7.883 11.131 1.00 0.00 H new ATOM 0 HG3 GLU A 137 19.659 8.972 10.332 1.00 0.00 H new ATOM 2168 N LYS A 138 19.446 4.598 9.552 1.00 0.00 N ATOM 2169 CA LYS A 138 20.369 3.704 8.857 1.00 0.00 C ATOM 2170 C LYS A 138 19.979 3.648 7.388 1.00 0.00 C ATOM 2171 O LYS A 138 20.842 3.774 6.519 1.00 0.00 O ATOM 2172 CB LYS A 138 20.358 2.276 9.446 1.00 0.00 C ATOM 2173 CG LYS A 138 20.413 2.176 10.979 1.00 0.00 C ATOM 2174 CD LYS A 138 21.550 2.951 11.658 1.00 0.00 C ATOM 2175 CE LYS A 138 22.933 2.448 11.215 1.00 0.00 C ATOM 2176 NZ LYS A 138 24.038 3.144 11.920 1.00 0.00 N ATOM 0 H LYS A 138 18.850 4.136 10.238 1.00 0.00 H new ATOM 0 HA LYS A 138 21.378 4.098 8.980 1.00 0.00 H new ATOM 0 HB2 LYS A 138 19.456 1.770 9.101 1.00 0.00 H new ATOM 0 HB3 LYS A 138 21.207 1.729 9.036 1.00 0.00 H new ATOM 0 HG2 LYS A 138 19.465 2.532 11.382 1.00 0.00 H new ATOM 0 HG3 LYS A 138 20.501 1.125 11.253 1.00 0.00 H new ATOM 0 HD2 LYS A 138 21.457 4.011 11.423 1.00 0.00 H new ATOM 0 HD3 LYS A 138 21.459 2.855 12.740 1.00 0.00 H new ATOM 0 HE2 LYS A 138 23.004 1.376 11.401 1.00 0.00 H new ATOM 0 HE3 LYS A 138 23.043 2.593 10.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 24.951 2.771 11.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 23.988 4.164 11.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 23.951 2.985 12.944 1.00 0.00 H new ATOM 2190 N ARG A 139 18.680 3.496 7.099 1.00 0.00 N ATOM 2191 CA ARG A 139 18.215 3.339 5.734 1.00 0.00 C ATOM 2192 C ARG A 139 18.529 4.576 4.910 1.00 0.00 C ATOM 2193 O ARG A 139 19.052 4.427 3.810 1.00 0.00 O ATOM 2194 CB ARG A 139 16.719 3.000 5.712 1.00 0.00 C ATOM 2195 CG ARG A 139 16.241 2.607 4.304 1.00 0.00 C ATOM 2196 CD ARG A 139 16.865 1.306 3.771 1.00 0.00 C ATOM 2197 NE ARG A 139 16.521 0.160 4.636 1.00 0.00 N ATOM 2198 CZ ARG A 139 17.359 -0.683 5.252 1.00 0.00 C ATOM 2199 NH1 ARG A 139 18.672 -0.629 5.038 1.00 0.00 N ATOM 2200 NH2 ARG A 139 16.863 -1.584 6.093 1.00 0.00 N ATOM 0 H ARG A 139 17.939 3.480 7.800 1.00 0.00 H new ATOM 0 HA ARG A 139 18.748 2.505 5.277 1.00 0.00 H new ATOM 0 HB2 ARG A 139 16.522 2.181 6.404 1.00 0.00 H new ATOM 0 HB3 ARG A 139 16.147 3.859 6.063 1.00 0.00 H new ATOM 0 HG2 ARG A 139 15.156 2.499 4.317 1.00 0.00 H new ATOM 0 HG3 ARG A 139 16.472 3.418 3.614 1.00 0.00 H new ATOM 0 HD2 ARG A 139 16.513 1.119 2.757 1.00 0.00 H new ATOM 0 HD3 ARG A 139 17.948 1.413 3.718 1.00 0.00 H new ATOM 0 HE ARG A 139 15.526 -0.010 4.782 1.00 0.00 H new ATOM 0 HH11 ARG A 139 19.056 0.064 4.395 1.00 0.00 H new ATOM 0 HH12 ARG A 139 19.294 -1.280 5.517 1.00 0.00 H new ATOM 0 HH21 ARG A 139 15.858 -1.626 6.261 1.00 0.00 H new ATOM 0 HH22 ARG A 139 17.487 -2.234 6.571 1.00 0.00 H new ATOM 2214 N VAL A 140 18.268 5.776 5.429 1.00 0.00 N ATOM 2215 CA VAL A 140 18.616 7.015 4.746 1.00 0.00 C ATOM 2216 C VAL A 140 20.104 7.032 4.428 1.00 0.00 C ATOM 2217 O VAL A 140 20.465 7.306 3.286 1.00 0.00 O ATOM 2218 CB VAL A 140 18.166 8.221 5.597 1.00 0.00 C ATOM 2219 CG1 VAL A 140 18.922 9.526 5.305 1.00 0.00 C ATOM 2220 CG2 VAL A 140 16.670 8.444 5.346 1.00 0.00 C ATOM 0 H VAL A 140 17.811 5.913 6.331 1.00 0.00 H new ATOM 0 HA VAL A 140 18.091 7.083 3.793 1.00 0.00 H new ATOM 0 HB VAL A 140 18.386 7.976 6.636 1.00 0.00 H new ATOM 0 HG11 VAL A 140 18.541 10.319 5.948 1.00 0.00 H new ATOM 0 HG12 VAL A 140 19.985 9.382 5.498 1.00 0.00 H new ATOM 0 HG13 VAL A 140 18.778 9.804 4.261 1.00 0.00 H new ATOM 0 HG21 VAL A 140 16.325 9.293 5.936 1.00 0.00 H new ATOM 0 HG22 VAL A 140 16.505 8.647 4.288 1.00 0.00 H new ATOM 0 HG23 VAL A 140 16.116 7.551 5.635 1.00 0.00 H new ATOM 2230 N ASN A 141 20.975 6.706 5.388 1.00 0.00 N ATOM 2231 CA ASN A 141 22.409 6.796 5.144 1.00 0.00 C ATOM 2232 C ASN A 141 22.829 5.770 4.094 1.00 0.00 C ATOM 2233 O ASN A 141 23.704 6.064 3.280 1.00 0.00 O ATOM 2234 CB ASN A 141 23.212 6.646 6.446 1.00 0.00 C ATOM 2235 CG ASN A 141 23.264 7.962 7.220 1.00 0.00 C ATOM 2236 OD1 ASN A 141 24.157 8.779 7.015 1.00 0.00 O ATOM 2237 ND2 ASN A 141 22.309 8.211 8.101 1.00 0.00 N ATOM 0 H ASN A 141 20.716 6.385 6.321 1.00 0.00 H new ATOM 0 HA ASN A 141 22.632 7.789 4.754 1.00 0.00 H new ATOM 0 HB2 ASN A 141 22.760 5.873 7.068 1.00 0.00 H new ATOM 0 HB3 ASN A 141 24.225 6.317 6.215 1.00 0.00 H new ATOM 0 HD21 ASN A 141 22.309 9.090 8.619 1.00 0.00 H new ATOM 0 HD22 ASN A 141 21.572 7.524 8.262 1.00 0.00 H new ATOM 2244 N ARG A 142 22.178 4.602 4.036 1.00 0.00 N ATOM 2245 CA ARG A 142 22.411 3.641 2.963 1.00 0.00 C ATOM 2246 C ARG A 142 21.943 4.201 1.623 1.00 0.00 C ATOM 2247 O ARG A 142 22.687 4.106 0.655 1.00 0.00 O ATOM 2248 CB ARG A 142 21.728 2.298 3.274 1.00 0.00 C ATOM 2249 CG ARG A 142 22.596 1.103 2.858 1.00 0.00 C ATOM 2250 CD ARG A 142 22.929 1.010 1.358 1.00 0.00 C ATOM 2251 NE ARG A 142 23.706 -0.208 1.066 1.00 0.00 N ATOM 2252 CZ ARG A 142 23.766 -0.856 -0.105 1.00 0.00 C ATOM 2253 NH1 ARG A 142 23.037 -0.476 -1.151 1.00 0.00 N ATOM 2254 NH2 ARG A 142 24.574 -1.906 -0.226 1.00 0.00 N ATOM 0 H ARG A 142 21.486 4.304 4.723 1.00 0.00 H new ATOM 0 HA ARG A 142 23.484 3.461 2.893 1.00 0.00 H new ATOM 0 HB2 ARG A 142 21.515 2.238 4.341 1.00 0.00 H new ATOM 0 HB3 ARG A 142 20.771 2.249 2.755 1.00 0.00 H new ATOM 0 HG2 ARG A 142 23.531 1.144 3.417 1.00 0.00 H new ATOM 0 HG3 ARG A 142 22.087 0.186 3.156 1.00 0.00 H new ATOM 0 HD2 ARG A 142 22.007 1.006 0.776 1.00 0.00 H new ATOM 0 HD3 ARG A 142 23.495 1.890 1.052 1.00 0.00 H new ATOM 0 HE ARG A 142 24.254 -0.597 1.834 1.00 0.00 H new ATOM 0 HH11 ARG A 142 22.413 0.327 -1.073 1.00 0.00 H new ATOM 0 HH12 ARG A 142 23.102 -0.988 -2.031 1.00 0.00 H new ATOM 0 HH21 ARG A 142 25.139 -2.209 0.568 1.00 0.00 H new ATOM 0 HH22 ARG A 142 24.629 -2.408 -1.112 1.00 0.00 H new ATOM 2268 N VAL A 143 20.754 4.803 1.554 1.00 0.00 N ATOM 2269 CA VAL A 143 20.255 5.408 0.322 1.00 0.00 C ATOM 2270 C VAL A 143 21.229 6.495 -0.154 1.00 0.00 C ATOM 2271 O VAL A 143 21.543 6.538 -1.342 1.00 0.00 O ATOM 2272 CB VAL A 143 18.789 5.864 0.471 1.00 0.00 C ATOM 2273 CG1 VAL A 143 18.302 6.692 -0.730 1.00 0.00 C ATOM 2274 CG2 VAL A 143 17.884 4.622 0.580 1.00 0.00 C ATOM 0 H VAL A 143 20.116 4.884 2.345 1.00 0.00 H new ATOM 0 HA VAL A 143 20.223 4.664 -0.474 1.00 0.00 H new ATOM 0 HB VAL A 143 18.738 6.487 1.364 1.00 0.00 H new ATOM 0 HG11 VAL A 143 17.264 6.986 -0.572 1.00 0.00 H new ATOM 0 HG12 VAL A 143 18.921 7.584 -0.832 1.00 0.00 H new ATOM 0 HG13 VAL A 143 18.375 6.094 -1.638 1.00 0.00 H new ATOM 0 HG21 VAL A 143 16.846 4.937 0.686 1.00 0.00 H new ATOM 0 HG22 VAL A 143 17.990 4.015 -0.319 1.00 0.00 H new ATOM 0 HG23 VAL A 143 18.176 4.035 1.451 1.00 0.00 H new ATOM 2284 N LEU A 144 21.787 7.315 0.744 1.00 0.00 N ATOM 2285 CA LEU A 144 22.819 8.290 0.381 1.00 0.00 C ATOM 2286 C LEU A 144 24.028 7.559 -0.194 1.00 0.00 C ATOM 2287 O LEU A 144 24.513 7.922 -1.261 1.00 0.00 O ATOM 2288 CB LEU A 144 23.271 9.143 1.580 1.00 0.00 C ATOM 2289 CG LEU A 144 22.181 10.053 2.162 1.00 0.00 C ATOM 2290 CD1 LEU A 144 22.697 10.763 3.417 1.00 0.00 C ATOM 2291 CD2 LEU A 144 21.675 11.088 1.155 1.00 0.00 C ATOM 0 H LEU A 144 21.538 7.321 1.733 1.00 0.00 H new ATOM 0 HA LEU A 144 22.384 8.962 -0.359 1.00 0.00 H new ATOM 0 HB2 LEU A 144 23.630 8.479 2.367 1.00 0.00 H new ATOM 0 HB3 LEU A 144 24.115 9.760 1.273 1.00 0.00 H new ATOM 0 HG LEU A 144 21.339 9.410 2.418 1.00 0.00 H new ATOM 0 HD11 LEU A 144 21.914 11.405 3.820 1.00 0.00 H new ATOM 0 HD12 LEU A 144 22.978 10.022 4.165 1.00 0.00 H new ATOM 0 HD13 LEU A 144 23.567 11.368 3.161 1.00 0.00 H new ATOM 0 HD21 LEU A 144 20.906 11.704 1.621 1.00 0.00 H new ATOM 0 HD22 LEU A 144 22.503 11.721 0.837 1.00 0.00 H new ATOM 0 HD23 LEU A 144 21.255 10.577 0.288 1.00 0.00 H new ATOM 2303 N ALA A 145 24.474 6.495 0.480 1.00 0.00 N ATOM 2304 CA ALA A 145 25.595 5.661 0.065 1.00 0.00 C ATOM 2305 C ALA A 145 25.358 4.895 -1.249 1.00 0.00 C ATOM 2306 O ALA A 145 26.279 4.210 -1.700 1.00 0.00 O ATOM 2307 CB ALA A 145 25.979 4.704 1.201 1.00 0.00 C ATOM 0 H ALA A 145 24.050 6.185 1.354 1.00 0.00 H new ATOM 0 HA ALA A 145 26.423 6.337 -0.146 1.00 0.00 H new ATOM 0 HB1 ALA A 145 26.817 4.083 0.886 1.00 0.00 H new ATOM 0 HB2 ALA A 145 26.265 5.280 2.081 1.00 0.00 H new ATOM 0 HB3 ALA A 145 25.128 4.068 1.444 1.00 0.00 H new ATOM 2313 N GLU A 146 24.188 5.005 -1.891 1.00 0.00 N ATOM 2314 CA GLU A 146 23.940 4.443 -3.219 1.00 0.00 C ATOM 2315 C GLU A 146 23.387 5.514 -4.175 1.00 0.00 C ATOM 2316 O GLU A 146 23.046 5.204 -5.319 1.00 0.00 O ATOM 2317 CB GLU A 146 23.065 3.182 -3.117 1.00 0.00 C ATOM 2318 CG GLU A 146 21.633 3.454 -2.649 1.00 0.00 C ATOM 2319 CD GLU A 146 20.820 2.164 -2.492 1.00 0.00 C ATOM 2320 OE1 GLU A 146 21.071 1.397 -1.535 1.00 0.00 O ATOM 2321 OE2 GLU A 146 19.915 1.916 -3.320 1.00 0.00 O ATOM 0 H GLU A 146 23.382 5.491 -1.498 1.00 0.00 H new ATOM 0 HA GLU A 146 24.884 4.119 -3.657 1.00 0.00 H new ATOM 0 HB2 GLU A 146 23.031 2.696 -4.092 1.00 0.00 H new ATOM 0 HB3 GLU A 146 23.535 2.481 -2.427 1.00 0.00 H new ATOM 0 HG2 GLU A 146 21.658 3.984 -1.697 1.00 0.00 H new ATOM 0 HG3 GLU A 146 21.137 4.109 -3.365 1.00 0.00 H new ATOM 2328 N THR A 147 23.340 6.776 -3.730 1.00 0.00 N ATOM 2329 CA THR A 147 22.789 7.905 -4.468 1.00 0.00 C ATOM 2330 C THR A 147 23.680 9.144 -4.257 1.00 0.00 C ATOM 2331 O THR A 147 23.221 10.260 -3.999 1.00 0.00 O ATOM 2332 CB THR A 147 21.316 8.138 -4.080 1.00 0.00 C ATOM 2333 OG1 THR A 147 20.602 6.950 -3.798 1.00 0.00 O ATOM 2334 CG2 THR A 147 20.616 8.804 -5.256 1.00 0.00 C ATOM 0 H THR A 147 23.699 7.042 -2.813 1.00 0.00 H new ATOM 0 HA THR A 147 22.788 7.690 -5.536 1.00 0.00 H new ATOM 0 HB THR A 147 21.326 8.745 -3.175 1.00 0.00 H new ATOM 0 HG1 THR A 147 20.924 6.567 -2.955 1.00 0.00 H new ATOM 0 HG21 THR A 147 19.570 8.979 -5.005 1.00 0.00 H new ATOM 0 HG22 THR A 147 21.101 9.755 -5.477 1.00 0.00 H new ATOM 0 HG23 THR A 147 20.675 8.155 -6.130 1.00 0.00 H new ATOM 2342 N GLU A 148 24.987 8.924 -4.351 1.00 0.00 N ATOM 2343 CA GLU A 148 26.051 9.907 -4.244 1.00 0.00 C ATOM 2344 C GLU A 148 27.156 9.445 -5.194 1.00 0.00 C ATOM 2345 O GLU A 148 27.639 10.270 -5.996 1.00 0.00 O ATOM 2346 CB GLU A 148 26.530 9.998 -2.782 1.00 0.00 C ATOM 2347 CG GLU A 148 27.698 10.978 -2.621 1.00 0.00 C ATOM 2348 CD GLU A 148 28.121 11.141 -1.146 1.00 0.00 C ATOM 2349 OE1 GLU A 148 28.927 10.326 -0.640 1.00 0.00 O ATOM 2350 OE2 GLU A 148 27.677 12.107 -0.480 1.00 0.00 O ATOM 2351 OXT GLU A 148 27.482 8.238 -5.192 1.00 0.00 O ATOM 0 H GLU A 148 25.353 7.986 -4.516 1.00 0.00 H new ATOM 0 HA GLU A 148 25.723 10.909 -4.520 1.00 0.00 H new ATOM 0 HB2 GLU A 148 25.702 10.314 -2.148 1.00 0.00 H new ATOM 0 HB3 GLU A 148 26.836 9.010 -2.438 1.00 0.00 H new ATOM 0 HG2 GLU A 148 28.549 10.626 -3.205 1.00 0.00 H new ATOM 0 HG3 GLU A 148 27.414 11.949 -3.025 1.00 0.00 H new