USER MOD reduce.3.24.130724 H: found=0, std=0, add=513, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 513 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 11 ASN : amide:sc= -0.462 X(o=-0.46,f=-0.85) USER MOD Set 1.2: A 12 LYS NZ :NH3+ -123:sc= 0 (180deg=0) USER MOD Set 2.1: A 10 MET CE :methyl 172:sc= -2.72 (180deg=-1.42) USER MOD Set 2.2: A 15 THR OG1 : rot -151:sc= -2.1 USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 18:sc= 1.09 USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.0013) USER MOD Single : A 9 HIS : no HD1:sc= -0.121 X(o=-0.12,f=-0.36) USER MOD Single : A 13 GLN :FLIP amide:sc= -2.14 F(o=-3.6,f=-2.1) USER MOD Single : A 19 ASN : amide:sc= -0.652 K(o=-0.65,f=-2.2!) USER MOD Single : A 21 TYR OH : rot 30:sc= 0 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -0.147 X(o=-0.15,f=-0.0044) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.264 K(o=-0.26,f=-0.77) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 91:sc= 0.0616 USER MOD Single : A 36 LYS NZ :NH3+ -146:sc= 0 (180deg=-0.315) USER MOD Single : A 41 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00948) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 CYS SG : rot 65:sc= -2.77! USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.186 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.308 X(o=-0.31,f=-0.036) USER MOD Single : A 56 ASN : amide:sc=-0.00334 X(o=-0.0033,f=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 20.727 10.925 2.372 1.00 15.00 N ATOM 2 CA SER A 1 22.138 11.351 2.178 1.00 15.00 C ATOM 3 C SER A 1 22.290 12.190 0.913 1.00 15.00 C ATOM 4 O SER A 1 22.732 13.338 0.967 1.00 15.00 O ATOM 5 CB SER A 1 23.016 10.102 2.091 1.00 15.00 C ATOM 6 OG SER A 1 23.326 9.605 3.382 1.00 15.00 O ATOM 0 H1 SER A 1 20.652 10.356 3.239 1.00 15.00 H new ATOM 0 H2 SER A 1 20.119 11.765 2.455 1.00 15.00 H new ATOM 0 H3 SER A 1 20.421 10.356 1.557 1.00 15.00 H new ATOM 0 HA SER A 1 22.445 11.969 3.022 1.00 15.00 H new ATOM 0 HB2 SER A 1 22.502 9.332 1.515 1.00 15.00 H new ATOM 0 HB3 SER A 1 23.937 10.338 1.558 1.00 15.00 H new ATOM 0 HG SER A 1 23.887 8.806 3.299 1.00 15.00 H new ATOM 14 N SER A 2 21.922 11.610 -0.224 1.00 15.00 N ATOM 15 CA SER A 2 22.018 12.305 -1.503 1.00 15.00 C ATOM 16 C SER A 2 21.162 11.618 -2.562 1.00 15.00 C ATOM 17 O SER A 2 21.554 10.593 -3.122 1.00 15.00 O ATOM 18 CB SER A 2 23.475 12.363 -1.967 1.00 15.00 C ATOM 19 OG SER A 2 23.954 11.074 -2.309 1.00 15.00 O ATOM 0 H SER A 2 21.555 10.661 -0.286 1.00 15.00 H new ATOM 0 HA SER A 2 21.647 13.320 -1.365 1.00 15.00 H new ATOM 0 HB2 SER A 2 23.559 13.026 -2.828 1.00 15.00 H new ATOM 0 HB3 SER A 2 24.095 12.787 -1.177 1.00 15.00 H new ATOM 0 HG SER A 2 23.195 10.470 -2.450 1.00 15.00 H new ATOM 25 N GLY A 3 19.992 12.187 -2.831 1.00 15.00 N ATOM 26 CA GLY A 3 19.098 11.616 -3.820 1.00 15.00 C ATOM 27 C GLY A 3 17.694 11.414 -3.285 1.00 15.00 C ATOM 28 O GLY A 3 17.259 10.280 -3.079 1.00 15.00 O ATOM 0 H GLY A 3 19.647 13.035 -2.381 1.00 15.00 H new ATOM 0 HA2 GLY A 3 19.061 12.269 -4.692 1.00 15.00 H new ATOM 0 HA3 GLY A 3 19.497 10.659 -4.156 1.00 15.00 H new ATOM 32 N HIS A 4 16.986 12.514 -3.058 1.00 15.00 N ATOM 33 CA HIS A 4 15.624 12.455 -2.541 1.00 15.00 C ATOM 34 C HIS A 4 14.720 11.657 -3.476 1.00 15.00 C ATOM 35 O HIS A 4 14.785 11.805 -4.695 1.00 15.00 O ATOM 36 CB HIS A 4 15.065 13.865 -2.354 1.00 15.00 C ATOM 37 CG HIS A 4 15.798 14.668 -1.325 1.00 15.00 C ATOM 38 ND1 HIS A 4 16.112 16.001 -1.492 1.00 15.00 N ATOM 39 CD2 HIS A 4 16.280 14.319 -0.108 1.00 15.00 C ATOM 40 CE1 HIS A 4 16.755 16.436 -0.424 1.00 15.00 C ATOM 41 NE2 HIS A 4 16.869 15.436 0.431 1.00 15.00 N ATOM 0 H HIS A 4 17.333 13.459 -3.224 1.00 15.00 H new ATOM 0 HA HIS A 4 15.652 11.952 -1.575 1.00 15.00 H new ATOM 0 HB2 HIS A 4 15.102 14.391 -3.308 1.00 15.00 H new ATOM 0 HB3 HIS A 4 14.015 13.796 -2.069 1.00 15.00 H new ATOM 0 HD2 HIS A 4 16.213 13.344 0.352 1.00 15.00 H new ATOM 0 HE1 HIS A 4 17.125 17.440 -0.275 1.00 15.00 H new ATOM 0 HE2 HIS A 4 17.321 15.485 1.344 1.00 15.00 H new ATOM 50 N ILE A 5 13.876 10.811 -2.894 1.00 15.00 N ATOM 51 CA ILE A 5 12.957 9.990 -3.673 1.00 15.00 C ATOM 52 C ILE A 5 13.714 9.018 -4.573 1.00 15.00 C ATOM 53 O ILE A 5 14.685 9.393 -5.230 1.00 15.00 O ATOM 54 CB ILE A 5 12.028 10.856 -4.543 1.00 15.00 C ATOM 55 CG1 ILE A 5 11.438 12.003 -3.717 1.00 15.00 C ATOM 56 CG2 ILE A 5 10.922 10.005 -5.147 1.00 15.00 C ATOM 57 CD1 ILE A 5 11.965 13.365 -4.113 1.00 15.00 C ATOM 0 H ILE A 5 13.810 10.676 -1.885 1.00 15.00 H new ATOM 0 HA ILE A 5 12.355 9.428 -2.959 1.00 15.00 H new ATOM 0 HB ILE A 5 12.613 11.285 -5.356 1.00 15.00 H new ATOM 0 HG12 ILE A 5 10.353 11.997 -3.824 1.00 15.00 H new ATOM 0 HG13 ILE A 5 11.655 11.830 -2.663 1.00 15.00 H new ATOM 0 HG21 ILE A 5 10.274 10.632 -5.759 1.00 15.00 H new ATOM 0 HG22 ILE A 5 11.362 9.223 -5.767 1.00 15.00 H new ATOM 0 HG23 ILE A 5 10.337 9.549 -4.349 1.00 15.00 H new ATOM 0 HD11 ILE A 5 11.505 14.129 -3.487 1.00 15.00 H new ATOM 0 HD12 ILE A 5 13.046 13.390 -3.979 1.00 15.00 H new ATOM 0 HD13 ILE A 5 11.724 13.558 -5.158 1.00 15.00 H new ATOM 69 N GLU A 6 13.257 7.771 -4.603 1.00 15.00 N ATOM 70 CA GLU A 6 13.877 6.749 -5.420 1.00 15.00 C ATOM 71 C GLU A 6 13.332 6.809 -6.845 1.00 15.00 C ATOM 72 O GLU A 6 13.070 7.890 -7.371 1.00 15.00 O ATOM 73 CB GLU A 6 13.632 5.375 -4.789 1.00 15.00 C ATOM 74 CG GLU A 6 14.769 4.394 -5.012 1.00 15.00 C ATOM 75 CD GLU A 6 15.884 4.554 -3.997 1.00 15.00 C ATOM 76 OE1 GLU A 6 15.759 3.999 -2.885 1.00 15.00 O ATOM 77 OE2 GLU A 6 16.882 5.234 -4.315 1.00 15.00 O ATOM 0 H GLU A 6 12.453 7.448 -4.065 1.00 15.00 H new ATOM 0 HA GLU A 6 14.952 6.922 -5.469 1.00 15.00 H new ATOM 0 HB2 GLU A 6 13.475 5.499 -3.718 1.00 15.00 H new ATOM 0 HB3 GLU A 6 12.714 4.954 -5.199 1.00 15.00 H new ATOM 0 HG2 GLU A 6 14.381 3.377 -4.963 1.00 15.00 H new ATOM 0 HG3 GLU A 6 15.173 4.533 -6.015 1.00 15.00 H new ATOM 84 N GLY A 7 13.161 5.650 -7.465 1.00 15.00 N ATOM 85 CA GLY A 7 12.648 5.602 -8.821 1.00 15.00 C ATOM 86 C GLY A 7 11.368 4.798 -8.929 1.00 15.00 C ATOM 87 O GLY A 7 10.508 4.863 -8.051 1.00 15.00 O ATOM 0 H GLY A 7 13.368 4.740 -7.053 1.00 15.00 H new ATOM 0 HA2 GLY A 7 12.466 6.617 -9.173 1.00 15.00 H new ATOM 0 HA3 GLY A 7 13.403 5.167 -9.476 1.00 15.00 H new ATOM 91 N ARG A 8 11.243 4.043 -10.016 1.00 15.00 N ATOM 92 CA ARG A 8 10.062 3.217 -10.254 1.00 15.00 C ATOM 93 C ARG A 8 8.808 4.071 -10.435 1.00 15.00 C ATOM 94 O ARG A 8 7.692 3.553 -10.416 1.00 15.00 O ATOM 95 CB ARG A 8 9.859 2.231 -9.101 1.00 15.00 C ATOM 96 CG ARG A 8 10.906 1.130 -9.050 1.00 15.00 C ATOM 97 CD ARG A 8 11.333 0.831 -7.622 1.00 15.00 C ATOM 98 NE ARG A 8 12.774 0.617 -7.515 1.00 15.00 N ATOM 99 CZ ARG A 8 13.425 0.519 -6.359 1.00 15.00 C ATOM 100 NH1 ARG A 8 12.766 0.612 -5.210 1.00 15.00 N ATOM 101 NH2 ARG A 8 14.737 0.324 -6.349 1.00 15.00 N ATOM 0 H ARG A 8 11.949 3.986 -10.750 1.00 15.00 H new ATOM 0 HA ARG A 8 10.230 2.662 -11.177 1.00 15.00 H new ATOM 0 HB2 ARG A 8 9.874 2.779 -8.159 1.00 15.00 H new ATOM 0 HB3 ARG A 8 8.872 1.778 -9.191 1.00 15.00 H new ATOM 0 HG2 ARG A 8 10.506 0.225 -9.508 1.00 15.00 H new ATOM 0 HG3 ARG A 8 11.776 1.427 -9.636 1.00 15.00 H new ATOM 0 HD2 ARG A 8 11.040 1.658 -6.975 1.00 15.00 H new ATOM 0 HD3 ARG A 8 10.807 -0.054 -7.264 1.00 15.00 H new ATOM 0 HE ARG A 8 13.313 0.538 -8.377 1.00 15.00 H new ATOM 0 HH11 ARG A 8 11.757 0.759 -5.211 1.00 15.00 H new ATOM 0 HH12 ARG A 8 13.269 0.536 -4.326 1.00 15.00 H new ATOM 0 HH21 ARG A 8 15.248 0.249 -7.228 1.00 15.00 H new ATOM 0 HH22 ARG A 8 15.235 0.249 -5.462 1.00 15.00 H new ATOM 115 N HIS A 9 8.995 5.379 -10.619 1.00 15.00 N ATOM 116 CA HIS A 9 7.876 6.300 -10.809 1.00 15.00 C ATOM 117 C HIS A 9 7.000 6.375 -9.560 1.00 15.00 C ATOM 118 O HIS A 9 6.952 7.403 -8.885 1.00 15.00 O ATOM 119 CB HIS A 9 7.035 5.873 -12.014 1.00 15.00 C ATOM 120 CG HIS A 9 7.477 6.500 -13.301 1.00 15.00 C ATOM 121 ND1 HIS A 9 7.737 7.848 -13.430 1.00 15.00 N ATOM 122 CD2 HIS A 9 7.708 5.956 -14.519 1.00 15.00 C ATOM 123 CE1 HIS A 9 8.108 8.106 -14.671 1.00 15.00 C ATOM 124 NE2 HIS A 9 8.099 6.975 -15.352 1.00 15.00 N ATOM 0 H HIS A 9 9.913 5.824 -10.640 1.00 15.00 H new ATOM 0 HA HIS A 9 8.288 7.292 -10.994 1.00 15.00 H new ATOM 0 HB2 HIS A 9 7.080 4.788 -12.113 1.00 15.00 H new ATOM 0 HB3 HIS A 9 5.993 6.134 -11.831 1.00 15.00 H new ATOM 0 HD2 HIS A 9 7.604 4.915 -14.786 1.00 15.00 H new ATOM 0 HE1 HIS A 9 8.374 9.077 -15.062 1.00 15.00 H new ATOM 0 HE2 HIS A 9 8.343 6.874 -16.337 1.00 15.00 H new ATOM 133 N MET A 10 6.327 5.273 -9.248 1.00 15.00 N ATOM 134 CA MET A 10 5.478 5.195 -8.080 1.00 15.00 C ATOM 135 C MET A 10 6.353 4.887 -6.877 1.00 15.00 C ATOM 136 O MET A 10 7.498 5.337 -6.820 1.00 15.00 O ATOM 137 CB MET A 10 4.386 4.136 -8.290 1.00 15.00 C ATOM 138 CG MET A 10 3.372 4.514 -9.362 1.00 15.00 C ATOM 139 SD MET A 10 4.067 4.496 -11.026 1.00 15.00 S ATOM 140 CE MET A 10 4.602 2.793 -11.148 1.00 15.00 C ATOM 0 H MET A 10 6.359 4.415 -9.799 1.00 15.00 H new ATOM 0 HA MET A 10 4.967 6.142 -7.908 1.00 15.00 H new ATOM 0 HB2 MET A 10 4.855 3.191 -8.562 1.00 15.00 H new ATOM 0 HB3 MET A 10 3.863 3.973 -7.348 1.00 15.00 H new ATOM 0 HG2 MET A 10 2.530 3.823 -9.318 1.00 15.00 H new ATOM 0 HG3 MET A 10 2.979 5.508 -9.149 1.00 15.00 H new ATOM 0 HE1 MET A 10 4.924 2.585 -12.168 1.00 15.00 H new ATOM 0 HE2 MET A 10 5.433 2.623 -10.463 1.00 15.00 H new ATOM 0 HE3 MET A 10 3.775 2.132 -10.887 1.00 15.00 H new ATOM 150 N ASN A 11 5.847 4.128 -5.920 1.00 15.00 N ATOM 151 CA ASN A 11 6.646 3.802 -4.760 1.00 15.00 C ATOM 152 C ASN A 11 7.380 2.479 -4.946 1.00 15.00 C ATOM 153 O ASN A 11 7.411 1.921 -6.043 1.00 15.00 O ATOM 154 CB ASN A 11 5.786 3.768 -3.496 1.00 15.00 C ATOM 155 CG ASN A 11 6.492 4.374 -2.299 1.00 15.00 C ATOM 156 OD1 ASN A 11 7.187 5.383 -2.419 1.00 15.00 O ATOM 157 ND2 ASN A 11 6.317 3.760 -1.134 1.00 15.00 N ATOM 0 H ASN A 11 4.906 3.735 -5.924 1.00 15.00 H new ATOM 0 HA ASN A 11 7.394 4.587 -4.645 1.00 15.00 H new ATOM 0 HB2 ASN A 11 4.857 4.308 -3.678 1.00 15.00 H new ATOM 0 HB3 ASN A 11 5.516 2.736 -3.271 1.00 15.00 H new ATOM 0 HD21 ASN A 11 6.767 4.123 -0.294 1.00 15.00 H new ATOM 0 HD22 ASN A 11 5.732 2.926 -1.080 1.00 15.00 H new ATOM 164 N LYS A 12 7.983 1.989 -3.866 1.00 15.00 N ATOM 165 CA LYS A 12 8.734 0.739 -3.904 1.00 15.00 C ATOM 166 C LYS A 12 7.894 -0.407 -4.475 1.00 15.00 C ATOM 167 O LYS A 12 7.842 -0.595 -5.689 1.00 15.00 O ATOM 168 CB LYS A 12 9.242 0.385 -2.503 1.00 15.00 C ATOM 169 CG LYS A 12 10.549 1.070 -2.141 1.00 15.00 C ATOM 170 CD LYS A 12 10.308 2.393 -1.434 1.00 15.00 C ATOM 171 CE LYS A 12 9.851 2.182 0.001 1.00 15.00 C ATOM 172 NZ LYS A 12 9.119 3.366 0.531 1.00 15.00 N ATOM 0 H LYS A 12 7.965 2.441 -2.952 1.00 15.00 H new ATOM 0 HA LYS A 12 9.588 0.882 -4.566 1.00 15.00 H new ATOM 0 HB2 LYS A 12 8.483 0.658 -1.770 1.00 15.00 H new ATOM 0 HB3 LYS A 12 9.376 -0.695 -2.436 1.00 15.00 H new ATOM 0 HG2 LYS A 12 11.138 0.415 -1.499 1.00 15.00 H new ATOM 0 HG3 LYS A 12 11.134 1.241 -3.045 1.00 15.00 H new ATOM 0 HD2 LYS A 12 11.224 2.983 -1.442 1.00 15.00 H new ATOM 0 HD3 LYS A 12 9.555 2.965 -1.976 1.00 15.00 H new ATOM 0 HE2 LYS A 12 9.206 1.304 0.051 1.00 15.00 H new ATOM 0 HE3 LYS A 12 10.717 1.978 0.631 1.00 15.00 H new ATOM 0 HZ1 LYS A 12 9.590 3.708 1.393 1.00 15.00 H new ATOM 0 HZ2 LYS A 12 9.116 4.121 -0.184 1.00 15.00 H new ATOM 0 HZ3 LYS A 12 8.140 3.097 0.755 1.00 15.00 H new ATOM 186 N GLN A 13 7.246 -1.175 -3.600 1.00 15.00 N ATOM 187 CA GLN A 13 6.428 -2.297 -4.036 1.00 15.00 C ATOM 188 C GLN A 13 5.021 -1.850 -4.438 1.00 15.00 C ATOM 189 O GLN A 13 4.216 -2.663 -4.888 1.00 15.00 O ATOM 190 CB GLN A 13 6.383 -3.372 -2.944 1.00 15.00 C ATOM 191 CG GLN A 13 5.055 -3.462 -2.228 1.00 15.00 C ATOM 192 CD GLN A 13 4.321 -4.759 -2.509 1.00 15.00 C ATOM 193 OE1 GLN A 13 3.681 -4.840 -3.670 1.00 15.00 O flip ATOM 194 NE2 GLN A 13 4.330 -5.680 -1.691 1.00 15.00 N flip ATOM 0 H GLN A 13 7.274 -1.039 -2.590 1.00 15.00 H new ATOM 0 HA GLN A 13 6.888 -2.727 -4.926 1.00 15.00 H new ATOM 0 HB2 GLN A 13 6.610 -4.340 -3.391 1.00 15.00 H new ATOM 0 HB3 GLN A 13 7.165 -3.167 -2.213 1.00 15.00 H new ATOM 0 HG2 GLN A 13 5.219 -3.368 -1.155 1.00 15.00 H new ATOM 0 HG3 GLN A 13 4.428 -2.623 -2.529 1.00 15.00 H new ATOM 0 HE21 GLN A 13 4.835 -5.575 -0.811 1.00 15.00 H new ATOM 0 HE22 GLN A 13 3.833 -6.547 -1.894 1.00 15.00 H new ATOM 203 N ALA A 14 4.723 -0.564 -4.273 1.00 15.00 N ATOM 204 CA ALA A 14 3.406 -0.042 -4.624 1.00 15.00 C ATOM 205 C ALA A 14 2.984 -0.516 -6.013 1.00 15.00 C ATOM 206 O ALA A 14 1.836 -0.891 -6.228 1.00 15.00 O ATOM 207 CB ALA A 14 3.400 1.477 -4.553 1.00 15.00 C ATOM 0 H ALA A 14 5.370 0.131 -3.901 1.00 15.00 H new ATOM 0 HA ALA A 14 2.685 -0.426 -3.902 1.00 15.00 H new ATOM 0 HB1 ALA A 14 2.410 1.850 -4.818 1.00 15.00 H new ATOM 0 HB2 ALA A 14 3.649 1.795 -3.540 1.00 15.00 H new ATOM 0 HB3 ALA A 14 4.137 1.877 -5.250 1.00 15.00 H new ATOM 213 N THR A 15 3.927 -0.515 -6.947 1.00 15.00 N ATOM 214 CA THR A 15 3.651 -0.969 -8.305 1.00 15.00 C ATOM 215 C THR A 15 3.195 -2.423 -8.283 1.00 15.00 C ATOM 216 O THR A 15 2.384 -2.847 -9.106 1.00 15.00 O ATOM 217 CB THR A 15 4.908 -0.817 -9.170 1.00 15.00 C ATOM 218 OG1 THR A 15 4.896 0.420 -9.859 1.00 15.00 O ATOM 219 CG2 THR A 15 5.082 -1.914 -10.202 1.00 15.00 C ATOM 0 H THR A 15 4.886 -0.206 -6.790 1.00 15.00 H new ATOM 0 HA THR A 15 2.855 -0.359 -8.733 1.00 15.00 H new ATOM 0 HB THR A 15 5.739 -0.876 -8.467 1.00 15.00 H new ATOM 0 HG1 THR A 15 5.393 0.331 -10.699 1.00 15.00 H new ATOM 0 HG21 THR A 15 5.993 -1.735 -10.773 1.00 15.00 H new ATOM 0 HG22 THR A 15 5.152 -2.879 -9.699 1.00 15.00 H new ATOM 0 HG23 THR A 15 4.226 -1.918 -10.877 1.00 15.00 H new ATOM 227 N GLU A 16 3.708 -3.173 -7.315 1.00 15.00 N ATOM 228 CA GLU A 16 3.340 -4.573 -7.158 1.00 15.00 C ATOM 229 C GLU A 16 2.006 -4.650 -6.437 1.00 15.00 C ATOM 230 O GLU A 16 1.252 -5.613 -6.578 1.00 15.00 O ATOM 231 CB GLU A 16 4.418 -5.331 -6.378 1.00 15.00 C ATOM 232 CG GLU A 16 5.510 -5.911 -7.263 1.00 15.00 C ATOM 233 CD GLU A 16 6.417 -6.870 -6.519 1.00 15.00 C ATOM 234 OE1 GLU A 16 5.913 -7.893 -6.012 1.00 15.00 O ATOM 235 OE2 GLU A 16 7.635 -6.598 -6.444 1.00 15.00 O ATOM 0 H GLU A 16 4.380 -2.834 -6.627 1.00 15.00 H new ATOM 0 HA GLU A 16 3.253 -5.039 -8.140 1.00 15.00 H new ATOM 0 HB2 GLU A 16 4.870 -4.657 -5.650 1.00 15.00 H new ATOM 0 HB3 GLU A 16 3.949 -6.139 -5.816 1.00 15.00 H new ATOM 0 HG2 GLU A 16 5.052 -6.430 -8.105 1.00 15.00 H new ATOM 0 HG3 GLU A 16 6.108 -5.098 -7.676 1.00 15.00 H new ATOM 242 N ILE A 17 1.716 -3.590 -5.694 1.00 15.00 N ATOM 243 CA ILE A 17 0.473 -3.461 -4.967 1.00 15.00 C ATOM 244 C ILE A 17 -0.627 -3.096 -5.949 1.00 15.00 C ATOM 245 O ILE A 17 -1.725 -3.651 -5.928 1.00 15.00 O ATOM 246 CB ILE A 17 0.603 -2.348 -3.903 1.00 15.00 C ATOM 247 CG1 ILE A 17 1.378 -2.837 -2.676 1.00 15.00 C ATOM 248 CG2 ILE A 17 -0.765 -1.818 -3.500 1.00 15.00 C ATOM 249 CD1 ILE A 17 1.067 -4.260 -2.280 1.00 15.00 C ATOM 0 H ILE A 17 2.344 -2.794 -5.582 1.00 15.00 H new ATOM 0 HA ILE A 17 0.236 -4.401 -4.470 1.00 15.00 H new ATOM 0 HB ILE A 17 1.168 -1.530 -4.350 1.00 15.00 H new ATOM 0 HG12 ILE A 17 2.446 -2.752 -2.876 1.00 15.00 H new ATOM 0 HG13 ILE A 17 1.158 -2.180 -1.834 1.00 15.00 H new ATOM 0 HG21 ILE A 17 -0.646 -1.036 -2.750 1.00 15.00 H new ATOM 0 HG22 ILE A 17 -1.269 -1.408 -4.375 1.00 15.00 H new ATOM 0 HG23 ILE A 17 -1.362 -2.630 -3.085 1.00 15.00 H new ATOM 0 HD11 ILE A 17 1.656 -4.531 -1.403 1.00 15.00 H new ATOM 0 HD12 ILE A 17 0.006 -4.349 -2.046 1.00 15.00 H new ATOM 0 HD13 ILE A 17 1.314 -4.929 -3.104 1.00 15.00 H new ATOM 261 N LEU A 18 -0.291 -2.155 -6.815 1.00 15.00 N ATOM 262 CA LEU A 18 -1.190 -1.672 -7.845 1.00 15.00 C ATOM 263 C LEU A 18 -1.417 -2.750 -8.891 1.00 15.00 C ATOM 264 O LEU A 18 -2.540 -2.971 -9.346 1.00 15.00 O ATOM 265 CB LEU A 18 -0.570 -0.443 -8.495 1.00 15.00 C ATOM 266 CG LEU A 18 -0.398 0.757 -7.562 1.00 15.00 C ATOM 267 CD1 LEU A 18 0.216 1.930 -8.308 1.00 15.00 C ATOM 268 CD2 LEU A 18 -1.731 1.145 -6.945 1.00 15.00 C ATOM 0 H LEU A 18 0.623 -1.702 -6.821 1.00 15.00 H new ATOM 0 HA LEU A 18 -2.152 -1.414 -7.401 1.00 15.00 H new ATOM 0 HB2 LEU A 18 0.406 -0.715 -8.898 1.00 15.00 H new ATOM 0 HB3 LEU A 18 -1.191 -0.143 -9.339 1.00 15.00 H new ATOM 0 HG LEU A 18 0.281 0.476 -6.757 1.00 15.00 H new ATOM 0 HD11 LEU A 18 0.331 2.774 -7.628 1.00 15.00 H new ATOM 0 HD12 LEU A 18 1.193 1.643 -8.697 1.00 15.00 H new ATOM 0 HD13 LEU A 18 -0.434 2.216 -9.135 1.00 15.00 H new ATOM 0 HD21 LEU A 18 -1.591 2.000 -6.284 1.00 15.00 H new ATOM 0 HD22 LEU A 18 -2.435 1.408 -7.735 1.00 15.00 H new ATOM 0 HD23 LEU A 18 -2.125 0.305 -6.373 1.00 15.00 H new ATOM 280 N ASN A 19 -0.337 -3.430 -9.255 1.00 15.00 N ATOM 281 CA ASN A 19 -0.406 -4.503 -10.235 1.00 15.00 C ATOM 282 C ASN A 19 -1.169 -5.673 -9.641 1.00 15.00 C ATOM 283 O ASN A 19 -2.047 -6.250 -10.281 1.00 15.00 O ATOM 284 CB ASN A 19 0.996 -4.944 -10.659 1.00 15.00 C ATOM 285 CG ASN A 19 0.991 -5.690 -11.978 1.00 15.00 C ATOM 286 OD1 ASN A 19 0.156 -5.435 -12.845 1.00 15.00 O ATOM 287 ND2 ASN A 19 1.928 -6.618 -12.137 1.00 15.00 N ATOM 0 H ASN A 19 0.597 -3.256 -8.885 1.00 15.00 H new ATOM 0 HA ASN A 19 -0.925 -4.141 -11.122 1.00 15.00 H new ATOM 0 HB2 ASN A 19 1.640 -4.069 -10.742 1.00 15.00 H new ATOM 0 HB3 ASN A 19 1.423 -5.582 -9.885 1.00 15.00 H new ATOM 0 HD21 ASN A 19 1.975 -7.152 -13.005 1.00 15.00 H new ATOM 0 HD22 ASN A 19 2.601 -6.797 -11.391 1.00 15.00 H new ATOM 294 N GLU A 20 -0.842 -5.996 -8.396 1.00 15.00 N ATOM 295 CA GLU A 20 -1.514 -7.073 -7.692 1.00 15.00 C ATOM 296 C GLU A 20 -2.946 -6.662 -7.378 1.00 15.00 C ATOM 297 O GLU A 20 -3.834 -7.505 -7.269 1.00 15.00 O ATOM 298 CB GLU A 20 -0.771 -7.420 -6.401 1.00 15.00 C ATOM 299 CG GLU A 20 -1.340 -8.631 -5.679 1.00 15.00 C ATOM 300 CD GLU A 20 -0.563 -8.979 -4.425 1.00 15.00 C ATOM 301 OE1 GLU A 20 0.498 -9.625 -4.544 1.00 15.00 O ATOM 302 OE2 GLU A 20 -1.019 -8.606 -3.323 1.00 15.00 O ATOM 0 H GLU A 20 -0.116 -5.526 -7.856 1.00 15.00 H new ATOM 0 HA GLU A 20 -1.523 -7.957 -8.329 1.00 15.00 H new ATOM 0 HB2 GLU A 20 0.278 -7.605 -6.634 1.00 15.00 H new ATOM 0 HB3 GLU A 20 -0.802 -6.560 -5.731 1.00 15.00 H new ATOM 0 HG2 GLU A 20 -2.380 -8.437 -5.416 1.00 15.00 H new ATOM 0 HG3 GLU A 20 -1.336 -9.487 -6.354 1.00 15.00 H new ATOM 309 N TYR A 21 -3.166 -5.353 -7.246 1.00 15.00 N ATOM 310 CA TYR A 21 -4.497 -4.833 -6.960 1.00 15.00 C ATOM 311 C TYR A 21 -5.330 -4.777 -8.233 1.00 15.00 C ATOM 312 O TYR A 21 -6.546 -4.964 -8.204 1.00 15.00 O ATOM 313 CB TYR A 21 -4.405 -3.439 -6.345 1.00 15.00 C ATOM 314 CG TYR A 21 -5.747 -2.760 -6.195 1.00 15.00 C ATOM 315 CD1 TYR A 21 -6.662 -3.197 -5.248 1.00 15.00 C ATOM 316 CD2 TYR A 21 -6.099 -1.690 -7.005 1.00 15.00 C ATOM 317 CE1 TYR A 21 -7.894 -2.585 -5.111 1.00 15.00 C ATOM 318 CE2 TYR A 21 -7.329 -1.072 -6.875 1.00 15.00 C ATOM 319 CZ TYR A 21 -8.222 -1.523 -5.927 1.00 15.00 C ATOM 320 OH TYR A 21 -9.447 -0.911 -5.794 1.00 15.00 O ATOM 0 H TYR A 21 -2.442 -4.640 -7.333 1.00 15.00 H new ATOM 0 HA TYR A 21 -4.979 -5.503 -6.248 1.00 15.00 H new ATOM 0 HB2 TYR A 21 -3.932 -3.512 -5.366 1.00 15.00 H new ATOM 0 HB3 TYR A 21 -3.759 -2.818 -6.966 1.00 15.00 H new ATOM 0 HD1 TYR A 21 -6.408 -4.029 -4.608 1.00 15.00 H new ATOM 0 HD2 TYR A 21 -5.401 -1.334 -7.749 1.00 15.00 H new ATOM 0 HE1 TYR A 21 -8.596 -2.937 -4.369 1.00 15.00 H new ATOM 0 HE2 TYR A 21 -7.589 -0.240 -7.513 1.00 15.00 H new ATOM 0 HH TYR A 21 -9.748 -0.980 -4.864 1.00 15.00 H new ATOM 330 N PHE A 22 -4.661 -4.514 -9.344 1.00 15.00 N ATOM 331 CA PHE A 22 -5.320 -4.426 -10.639 1.00 15.00 C ATOM 332 C PHE A 22 -5.753 -5.813 -11.109 1.00 15.00 C ATOM 333 O PHE A 22 -6.944 -6.113 -11.182 1.00 15.00 O ATOM 334 CB PHE A 22 -4.372 -3.776 -11.651 1.00 15.00 C ATOM 335 CG PHE A 22 -4.832 -3.881 -13.075 1.00 15.00 C ATOM 336 CD1 PHE A 22 -6.146 -3.606 -13.413 1.00 15.00 C ATOM 337 CD2 PHE A 22 -3.948 -4.261 -14.071 1.00 15.00 C ATOM 338 CE1 PHE A 22 -6.571 -3.708 -14.724 1.00 15.00 C ATOM 339 CE2 PHE A 22 -4.369 -4.366 -15.383 1.00 15.00 C ATOM 340 CZ PHE A 22 -5.682 -4.089 -15.709 1.00 15.00 C ATOM 0 H PHE A 22 -3.654 -4.356 -9.375 1.00 15.00 H new ATOM 0 HA PHE A 22 -6.214 -3.809 -10.549 1.00 15.00 H new ATOM 0 HB2 PHE A 22 -4.252 -2.723 -11.396 1.00 15.00 H new ATOM 0 HB3 PHE A 22 -3.390 -4.240 -11.562 1.00 15.00 H new ATOM 0 HD1 PHE A 22 -6.845 -3.309 -12.645 1.00 15.00 H new ATOM 0 HD2 PHE A 22 -2.920 -4.477 -13.820 1.00 15.00 H new ATOM 0 HE1 PHE A 22 -7.598 -3.490 -14.978 1.00 15.00 H new ATOM 0 HE2 PHE A 22 -3.672 -4.664 -16.152 1.00 15.00 H new ATOM 0 HZ PHE A 22 -6.013 -4.170 -16.734 1.00 15.00 H new ATOM 350 N TYR A 23 -4.772 -6.652 -11.412 1.00 15.00 N ATOM 351 CA TYR A 23 -5.020 -8.014 -11.862 1.00 15.00 C ATOM 352 C TYR A 23 -5.996 -8.730 -10.926 1.00 15.00 C ATOM 353 O TYR A 23 -7.054 -9.182 -11.350 1.00 15.00 O ATOM 354 CB TYR A 23 -3.700 -8.782 -11.924 1.00 15.00 C ATOM 355 CG TYR A 23 -2.907 -8.523 -13.184 1.00 15.00 C ATOM 356 CD1 TYR A 23 -3.449 -8.784 -14.437 1.00 15.00 C ATOM 357 CD2 TYR A 23 -1.616 -8.014 -13.122 1.00 15.00 C ATOM 358 CE1 TYR A 23 -2.726 -8.546 -15.590 1.00 15.00 C ATOM 359 CE2 TYR A 23 -0.886 -7.774 -14.271 1.00 15.00 C ATOM 360 CZ TYR A 23 -1.446 -8.042 -15.502 1.00 15.00 C ATOM 361 OH TYR A 23 -0.723 -7.803 -16.649 1.00 15.00 O ATOM 0 H TYR A 23 -3.783 -6.408 -11.353 1.00 15.00 H new ATOM 0 HA TYR A 23 -5.467 -7.975 -12.855 1.00 15.00 H new ATOM 0 HB2 TYR A 23 -3.092 -8.513 -11.060 1.00 15.00 H new ATOM 0 HB3 TYR A 23 -3.907 -9.850 -11.848 1.00 15.00 H new ATOM 0 HD1 TYR A 23 -4.451 -9.179 -14.510 1.00 15.00 H new ATOM 0 HD2 TYR A 23 -1.175 -7.802 -12.159 1.00 15.00 H new ATOM 0 HE1 TYR A 23 -3.162 -8.754 -16.556 1.00 15.00 H new ATOM 0 HE2 TYR A 23 0.117 -7.379 -14.205 1.00 15.00 H new ATOM 0 HH TYR A 23 0.159 -7.448 -16.412 1.00 15.00 H new ATOM 371 N SER A 24 -5.639 -8.809 -9.643 1.00 15.00 N ATOM 372 CA SER A 24 -6.495 -9.427 -8.631 1.00 15.00 C ATOM 373 C SER A 24 -7.942 -9.065 -8.898 1.00 15.00 C ATOM 374 O SER A 24 -8.862 -9.867 -8.734 1.00 15.00 O ATOM 375 CB SER A 24 -6.090 -8.973 -7.228 1.00 15.00 C ATOM 376 OG SER A 24 -7.007 -9.442 -6.255 1.00 15.00 O ATOM 0 H SER A 24 -4.756 -8.450 -9.279 1.00 15.00 H new ATOM 0 HA SER A 24 -6.377 -10.509 -8.687 1.00 15.00 H new ATOM 0 HB2 SER A 24 -5.090 -9.342 -6.998 1.00 15.00 H new ATOM 0 HB3 SER A 24 -6.044 -7.885 -7.194 1.00 15.00 H new ATOM 0 HG SER A 24 -6.725 -9.139 -5.367 1.00 15.00 H new ATOM 382 N HIS A 25 -8.101 -7.811 -9.284 1.00 15.00 N ATOM 383 CA HIS A 25 -9.386 -7.222 -9.566 1.00 15.00 C ATOM 384 C HIS A 25 -9.539 -6.913 -11.053 1.00 15.00 C ATOM 385 O HIS A 25 -10.269 -6.001 -11.439 1.00 15.00 O ATOM 386 CB HIS A 25 -9.483 -5.941 -8.761 1.00 15.00 C ATOM 387 CG HIS A 25 -9.653 -6.173 -7.294 1.00 15.00 C ATOM 388 ND1 HIS A 25 -10.701 -6.893 -6.765 1.00 15.00 N ATOM 389 CD2 HIS A 25 -8.887 -5.796 -6.242 1.00 15.00 C ATOM 390 CE1 HIS A 25 -10.574 -6.950 -5.453 1.00 15.00 C ATOM 391 NE2 HIS A 25 -9.482 -6.292 -5.110 1.00 15.00 N ATOM 0 H HIS A 25 -7.321 -7.166 -9.411 1.00 15.00 H new ATOM 0 HA HIS A 25 -10.179 -7.919 -9.296 1.00 15.00 H new ATOM 0 HB2 HIS A 25 -8.583 -5.348 -8.926 1.00 15.00 H new ATOM 0 HB3 HIS A 25 -10.324 -5.353 -9.128 1.00 15.00 H new ATOM 0 HD2 HIS A 25 -7.978 -5.214 -6.286 1.00 15.00 H new ATOM 0 HE1 HIS A 25 -11.249 -7.450 -4.774 1.00 15.00 H new ATOM 0 HE2 HIS A 25 -9.137 -6.172 -4.158 1.00 15.00 H new ATOM 400 N LEU A 26 -8.836 -7.676 -11.876 1.00 15.00 N ATOM 401 CA LEU A 26 -8.868 -7.497 -13.318 1.00 15.00 C ATOM 402 C LEU A 26 -10.285 -7.684 -13.856 1.00 15.00 C ATOM 403 O LEU A 26 -10.652 -7.113 -14.884 1.00 15.00 O ATOM 404 CB LEU A 26 -7.891 -8.478 -13.976 1.00 15.00 C ATOM 405 CG LEU A 26 -7.352 -8.062 -15.345 1.00 15.00 C ATOM 406 CD1 LEU A 26 -8.486 -7.661 -16.270 1.00 15.00 C ATOM 407 CD2 LEU A 26 -6.354 -6.925 -15.195 1.00 15.00 C ATOM 0 H LEU A 26 -8.229 -8.434 -11.564 1.00 15.00 H new ATOM 0 HA LEU A 26 -8.560 -6.480 -13.560 1.00 15.00 H new ATOM 0 HB2 LEU A 26 -7.046 -8.626 -13.303 1.00 15.00 H new ATOM 0 HB3 LEU A 26 -8.388 -9.442 -14.080 1.00 15.00 H new ATOM 0 HG LEU A 26 -6.840 -8.916 -15.789 1.00 15.00 H new ATOM 0 HD11 LEU A 26 -8.080 -7.369 -17.238 1.00 15.00 H new ATOM 0 HD12 LEU A 26 -9.164 -8.504 -16.401 1.00 15.00 H new ATOM 0 HD13 LEU A 26 -9.030 -6.822 -15.836 1.00 15.00 H new ATOM 0 HD21 LEU A 26 -5.978 -6.639 -16.177 1.00 15.00 H new ATOM 0 HD22 LEU A 26 -6.844 -6.069 -14.731 1.00 15.00 H new ATOM 0 HD23 LEU A 26 -5.523 -7.251 -14.569 1.00 15.00 H new ATOM 419 N SER A 27 -11.090 -8.464 -13.143 1.00 15.00 N ATOM 420 CA SER A 27 -12.472 -8.700 -13.547 1.00 15.00 C ATOM 421 C SER A 27 -13.231 -7.380 -13.665 1.00 15.00 C ATOM 422 O SER A 27 -14.176 -7.264 -14.445 1.00 15.00 O ATOM 423 CB SER A 27 -13.170 -9.615 -12.540 1.00 15.00 C ATOM 424 OG SER A 27 -13.015 -10.979 -12.895 1.00 15.00 O ATOM 0 H SER A 27 -10.812 -8.942 -12.286 1.00 15.00 H new ATOM 0 HA SER A 27 -12.465 -9.186 -14.523 1.00 15.00 H new ATOM 0 HB2 SER A 27 -12.758 -9.446 -11.545 1.00 15.00 H new ATOM 0 HB3 SER A 27 -14.230 -9.367 -12.493 1.00 15.00 H new ATOM 0 HG SER A 27 -13.469 -11.543 -12.234 1.00 15.00 H new ATOM 430 N ASN A 28 -12.809 -6.386 -12.886 1.00 15.00 N ATOM 431 CA ASN A 28 -13.444 -5.072 -12.903 1.00 15.00 C ATOM 432 C ASN A 28 -12.710 -4.101 -11.977 1.00 15.00 C ATOM 433 O ASN A 28 -13.260 -3.650 -10.973 1.00 15.00 O ATOM 434 CB ASN A 28 -14.912 -5.187 -12.484 1.00 15.00 C ATOM 435 CG ASN A 28 -15.092 -6.014 -11.226 1.00 15.00 C ATOM 436 OD1 ASN A 28 -15.294 -7.227 -11.292 1.00 15.00 O ATOM 437 ND2 ASN A 28 -15.021 -5.362 -10.072 1.00 15.00 N ATOM 0 H ASN A 28 -12.028 -6.467 -12.234 1.00 15.00 H new ATOM 0 HA ASN A 28 -13.394 -4.683 -13.920 1.00 15.00 H new ATOM 0 HB2 ASN A 28 -15.319 -4.189 -12.321 1.00 15.00 H new ATOM 0 HB3 ASN A 28 -15.484 -5.636 -13.296 1.00 15.00 H new ATOM 0 HD21 ASN A 28 -15.135 -5.867 -9.193 1.00 15.00 H new ATOM 0 HD22 ASN A 28 -14.852 -4.356 -10.064 1.00 15.00 H new ATOM 444 N PRO A 29 -11.447 -3.772 -12.302 1.00 15.00 N ATOM 445 CA PRO A 29 -10.630 -2.864 -11.505 1.00 15.00 C ATOM 446 C PRO A 29 -10.763 -1.414 -11.952 1.00 15.00 C ATOM 447 O PRO A 29 -9.979 -0.935 -12.773 1.00 15.00 O ATOM 448 CB PRO A 29 -9.227 -3.375 -11.795 1.00 15.00 C ATOM 449 CG PRO A 29 -9.289 -3.790 -13.227 1.00 15.00 C ATOM 450 CD PRO A 29 -10.703 -4.268 -13.475 1.00 15.00 C ATOM 0 HA PRO A 29 -10.911 -2.857 -10.452 1.00 15.00 H new ATOM 0 HB2 PRO A 29 -8.478 -2.600 -11.635 1.00 15.00 H new ATOM 0 HB3 PRO A 29 -8.964 -4.211 -11.147 1.00 15.00 H new ATOM 0 HG2 PRO A 29 -9.041 -2.956 -13.884 1.00 15.00 H new ATOM 0 HG3 PRO A 29 -8.570 -4.583 -13.433 1.00 15.00 H new ATOM 0 HD2 PRO A 29 -11.105 -3.865 -14.405 1.00 15.00 H new ATOM 0 HD3 PRO A 29 -10.752 -5.354 -13.551 1.00 15.00 H new ATOM 458 N TYR A 30 -11.752 -0.717 -11.410 1.00 15.00 N ATOM 459 CA TYR A 30 -11.976 0.680 -11.758 1.00 15.00 C ATOM 460 C TYR A 30 -11.701 1.585 -10.562 1.00 15.00 C ATOM 461 O TYR A 30 -12.592 1.854 -9.758 1.00 15.00 O ATOM 462 CB TYR A 30 -13.408 0.875 -12.261 1.00 15.00 C ATOM 463 CG TYR A 30 -13.765 -0.016 -13.434 1.00 15.00 C ATOM 464 CD1 TYR A 30 -12.775 -0.586 -14.227 1.00 15.00 C ATOM 465 CD2 TYR A 30 -15.091 -0.288 -13.747 1.00 15.00 C ATOM 466 CE1 TYR A 30 -13.094 -1.400 -15.296 1.00 15.00 C ATOM 467 CE2 TYR A 30 -15.419 -1.101 -14.816 1.00 15.00 C ATOM 468 CZ TYR A 30 -14.418 -1.655 -15.586 1.00 15.00 C ATOM 469 OH TYR A 30 -14.742 -2.464 -16.651 1.00 15.00 O ATOM 0 H TYR A 30 -12.411 -1.095 -10.729 1.00 15.00 H new ATOM 0 HA TYR A 30 -11.285 0.953 -12.556 1.00 15.00 H new ATOM 0 HB2 TYR A 30 -14.101 0.680 -11.443 1.00 15.00 H new ATOM 0 HB3 TYR A 30 -13.543 1.917 -12.552 1.00 15.00 H new ATOM 0 HD1 TYR A 30 -11.737 -0.388 -14.003 1.00 15.00 H new ATOM 0 HD2 TYR A 30 -15.878 0.143 -13.146 1.00 15.00 H new ATOM 0 HE1 TYR A 30 -12.312 -1.834 -15.901 1.00 15.00 H new ATOM 0 HE2 TYR A 30 -16.455 -1.301 -15.047 1.00 15.00 H new ATOM 0 HH TYR A 30 -15.717 -2.543 -16.717 1.00 15.00 H new ATOM 479 N PRO A 31 -10.448 2.060 -10.429 1.00 15.00 N ATOM 480 CA PRO A 31 -10.044 2.933 -9.321 1.00 15.00 C ATOM 481 C PRO A 31 -10.960 4.139 -9.156 1.00 15.00 C ATOM 482 O PRO A 31 -10.675 5.222 -9.668 1.00 15.00 O ATOM 483 CB PRO A 31 -8.638 3.385 -9.720 1.00 15.00 C ATOM 484 CG PRO A 31 -8.128 2.305 -10.606 1.00 15.00 C ATOM 485 CD PRO A 31 -9.326 1.776 -11.344 1.00 15.00 C ATOM 0 HA PRO A 31 -10.089 2.414 -8.364 1.00 15.00 H new ATOM 0 HB2 PRO A 31 -8.663 4.343 -10.239 1.00 15.00 H new ATOM 0 HB3 PRO A 31 -8.001 3.513 -8.845 1.00 15.00 H new ATOM 0 HG2 PRO A 31 -7.381 2.690 -11.300 1.00 15.00 H new ATOM 0 HG3 PRO A 31 -7.648 1.517 -10.025 1.00 15.00 H new ATOM 0 HD2 PRO A 31 -9.457 2.273 -12.305 1.00 15.00 H new ATOM 0 HD3 PRO A 31 -9.234 0.709 -11.547 1.00 15.00 H new ATOM 493 N SER A 32 -12.056 3.949 -8.430 1.00 15.00 N ATOM 494 CA SER A 32 -13.005 5.024 -8.187 1.00 15.00 C ATOM 495 C SER A 32 -12.396 6.066 -7.259 1.00 15.00 C ATOM 496 O SER A 32 -11.186 6.081 -7.038 1.00 15.00 O ATOM 497 CB SER A 32 -14.289 4.467 -7.569 1.00 15.00 C ATOM 498 OG SER A 32 -14.442 3.088 -7.863 1.00 15.00 O ATOM 0 H SER A 32 -12.308 3.059 -8.000 1.00 15.00 H new ATOM 0 HA SER A 32 -13.245 5.495 -9.140 1.00 15.00 H new ATOM 0 HB2 SER A 32 -14.268 4.611 -6.489 1.00 15.00 H new ATOM 0 HB3 SER A 32 -15.148 5.020 -7.948 1.00 15.00 H new ATOM 0 HG SER A 32 -14.026 2.554 -7.154 1.00 15.00 H new ATOM 504 N GLU A 33 -13.239 6.929 -6.708 1.00 15.00 N ATOM 505 CA GLU A 33 -12.774 7.960 -5.796 1.00 15.00 C ATOM 506 C GLU A 33 -12.206 7.329 -4.531 1.00 15.00 C ATOM 507 O GLU A 33 -11.153 7.733 -4.043 1.00 15.00 O ATOM 508 CB GLU A 33 -13.918 8.912 -5.440 1.00 15.00 C ATOM 509 CG GLU A 33 -14.209 9.944 -6.517 1.00 15.00 C ATOM 510 CD GLU A 33 -13.585 11.291 -6.216 1.00 15.00 C ATOM 511 OE1 GLU A 33 -12.395 11.325 -5.840 1.00 15.00 O ATOM 512 OE2 GLU A 33 -14.287 12.316 -6.359 1.00 15.00 O ATOM 0 H GLU A 33 -14.245 6.934 -6.877 1.00 15.00 H new ATOM 0 HA GLU A 33 -11.986 8.529 -6.290 1.00 15.00 H new ATOM 0 HB2 GLU A 33 -14.820 8.329 -5.254 1.00 15.00 H new ATOM 0 HB3 GLU A 33 -13.675 9.428 -4.511 1.00 15.00 H new ATOM 0 HG2 GLU A 33 -13.835 9.580 -7.474 1.00 15.00 H new ATOM 0 HG3 GLU A 33 -15.288 10.062 -6.620 1.00 15.00 H new ATOM 519 N GLU A 34 -12.913 6.332 -4.009 1.00 15.00 N ATOM 520 CA GLU A 34 -12.482 5.636 -2.802 1.00 15.00 C ATOM 521 C GLU A 34 -11.267 4.752 -3.077 1.00 15.00 C ATOM 522 O GLU A 34 -10.425 4.549 -2.203 1.00 15.00 O ATOM 523 CB GLU A 34 -13.626 4.789 -2.240 1.00 15.00 C ATOM 524 CG GLU A 34 -13.546 4.577 -0.737 1.00 15.00 C ATOM 525 CD GLU A 34 -14.912 4.529 -0.083 1.00 15.00 C ATOM 526 OE1 GLU A 34 -15.473 5.608 0.204 1.00 15.00 O ATOM 527 OE2 GLU A 34 -15.423 3.412 0.145 1.00 15.00 O ATOM 0 H GLU A 34 -13.788 5.988 -4.404 1.00 15.00 H new ATOM 0 HA GLU A 34 -12.198 6.388 -2.066 1.00 15.00 H new ATOM 0 HB2 GLU A 34 -14.574 5.269 -2.481 1.00 15.00 H new ATOM 0 HB3 GLU A 34 -13.626 3.818 -2.736 1.00 15.00 H new ATOM 0 HG2 GLU A 34 -13.016 3.647 -0.533 1.00 15.00 H new ATOM 0 HG3 GLU A 34 -12.961 5.381 -0.291 1.00 15.00 H new ATOM 534 N ALA A 35 -11.189 4.223 -4.294 1.00 15.00 N ATOM 535 CA ALA A 35 -10.085 3.353 -4.683 1.00 15.00 C ATOM 536 C ALA A 35 -8.801 4.143 -4.909 1.00 15.00 C ATOM 537 O ALA A 35 -7.787 3.895 -4.257 1.00 15.00 O ATOM 538 CB ALA A 35 -10.448 2.570 -5.934 1.00 15.00 C ATOM 0 H ALA A 35 -11.878 4.382 -5.029 1.00 15.00 H new ATOM 0 HA ALA A 35 -9.907 2.656 -3.864 1.00 15.00 H new ATOM 0 HB1 ALA A 35 -9.615 1.925 -6.214 1.00 15.00 H new ATOM 0 HB2 ALA A 35 -11.330 1.960 -5.738 1.00 15.00 H new ATOM 0 HB3 ALA A 35 -10.659 3.263 -6.748 1.00 15.00 H new ATOM 544 N LYS A 36 -8.846 5.093 -5.840 1.00 15.00 N ATOM 545 CA LYS A 36 -7.677 5.912 -6.149 1.00 15.00 C ATOM 546 C LYS A 36 -7.093 6.524 -4.882 1.00 15.00 C ATOM 547 O LYS A 36 -5.882 6.493 -4.668 1.00 15.00 O ATOM 548 CB LYS A 36 -8.041 7.009 -7.153 1.00 15.00 C ATOM 549 CG LYS A 36 -9.176 7.909 -6.693 1.00 15.00 C ATOM 550 CD LYS A 36 -8.652 9.213 -6.113 1.00 15.00 C ATOM 551 CE LYS A 36 -9.788 10.137 -5.705 1.00 15.00 C ATOM 552 NZ LYS A 36 -9.298 11.318 -4.943 1.00 15.00 N ATOM 0 H LYS A 36 -9.675 5.314 -6.391 1.00 15.00 H new ATOM 0 HA LYS A 36 -6.920 5.268 -6.597 1.00 15.00 H new ATOM 0 HB2 LYS A 36 -7.159 7.621 -7.344 1.00 15.00 H new ATOM 0 HB3 LYS A 36 -8.318 6.545 -8.099 1.00 15.00 H new ATOM 0 HG2 LYS A 36 -9.836 8.123 -7.534 1.00 15.00 H new ATOM 0 HG3 LYS A 36 -9.773 7.390 -5.943 1.00 15.00 H new ATOM 0 HD2 LYS A 36 -8.025 9.001 -5.247 1.00 15.00 H new ATOM 0 HD3 LYS A 36 -8.022 9.712 -6.849 1.00 15.00 H new ATOM 0 HE2 LYS A 36 -10.319 10.474 -6.595 1.00 15.00 H new ATOM 0 HE3 LYS A 36 -10.504 9.585 -5.097 1.00 15.00 H new ATOM 0 HZ1 LYS A 36 -10.004 11.588 -4.229 1.00 15.00 H new ATOM 0 HZ2 LYS A 36 -8.402 11.080 -4.471 1.00 15.00 H new ATOM 0 HZ3 LYS A 36 -9.144 12.113 -5.596 1.00 15.00 H new ATOM 566 N GLU A 37 -7.961 7.068 -4.037 1.00 15.00 N ATOM 567 CA GLU A 37 -7.521 7.670 -2.787 1.00 15.00 C ATOM 568 C GLU A 37 -6.933 6.601 -1.874 1.00 15.00 C ATOM 569 O GLU A 37 -5.897 6.808 -1.244 1.00 15.00 O ATOM 570 CB GLU A 37 -8.685 8.378 -2.093 1.00 15.00 C ATOM 571 CG GLU A 37 -8.389 9.824 -1.734 1.00 15.00 C ATOM 572 CD GLU A 37 -7.618 9.956 -0.435 1.00 15.00 C ATOM 573 OE1 GLU A 37 -8.194 9.657 0.631 1.00 15.00 O ATOM 574 OE2 GLU A 37 -6.436 10.358 -0.485 1.00 15.00 O ATOM 0 H GLU A 37 -8.968 7.104 -4.195 1.00 15.00 H new ATOM 0 HA GLU A 37 -6.752 8.410 -3.007 1.00 15.00 H new ATOM 0 HB2 GLU A 37 -9.559 8.345 -2.743 1.00 15.00 H new ATOM 0 HB3 GLU A 37 -8.942 7.832 -1.185 1.00 15.00 H new ATOM 0 HG2 GLU A 37 -7.818 10.285 -2.540 1.00 15.00 H new ATOM 0 HG3 GLU A 37 -9.327 10.374 -1.653 1.00 15.00 H new ATOM 581 N GLU A 38 -7.599 5.448 -1.821 1.00 15.00 N ATOM 582 CA GLU A 38 -7.139 4.335 -0.997 1.00 15.00 C ATOM 583 C GLU A 38 -5.692 3.993 -1.328 1.00 15.00 C ATOM 584 O GLU A 38 -4.824 4.010 -0.454 1.00 15.00 O ATOM 585 CB GLU A 38 -8.027 3.109 -1.218 1.00 15.00 C ATOM 586 CG GLU A 38 -9.128 2.957 -0.180 1.00 15.00 C ATOM 587 CD GLU A 38 -8.586 2.687 1.210 1.00 15.00 C ATOM 588 OE1 GLU A 38 -8.270 1.515 1.506 1.00 15.00 O ATOM 589 OE2 GLU A 38 -8.477 3.646 2.002 1.00 15.00 O ATOM 0 H GLU A 38 -8.458 5.262 -2.339 1.00 15.00 H new ATOM 0 HA GLU A 38 -7.200 4.632 0.050 1.00 15.00 H new ATOM 0 HB2 GLU A 38 -8.479 3.172 -2.208 1.00 15.00 H new ATOM 0 HB3 GLU A 38 -7.405 2.214 -1.209 1.00 15.00 H new ATOM 0 HG2 GLU A 38 -9.732 3.864 -0.161 1.00 15.00 H new ATOM 0 HG3 GLU A 38 -9.788 2.141 -0.473 1.00 15.00 H new ATOM 596 N LEU A 39 -5.436 3.698 -2.599 1.00 15.00 N ATOM 597 CA LEU A 39 -4.089 3.370 -3.047 1.00 15.00 C ATOM 598 C LEU A 39 -3.162 4.553 -2.811 1.00 15.00 C ATOM 599 O LEU A 39 -2.000 4.386 -2.440 1.00 15.00 O ATOM 600 CB LEU A 39 -4.091 3.000 -4.531 1.00 15.00 C ATOM 601 CG LEU A 39 -5.182 2.014 -4.955 1.00 15.00 C ATOM 602 CD1 LEU A 39 -5.082 1.717 -6.443 1.00 15.00 C ATOM 603 CD2 LEU A 39 -5.084 0.727 -4.147 1.00 15.00 C ATOM 0 H LEU A 39 -6.143 3.680 -3.334 1.00 15.00 H new ATOM 0 HA LEU A 39 -3.733 2.513 -2.475 1.00 15.00 H new ATOM 0 HB2 LEU A 39 -4.201 3.913 -5.116 1.00 15.00 H new ATOM 0 HB3 LEU A 39 -3.120 2.574 -4.784 1.00 15.00 H new ATOM 0 HG LEU A 39 -6.152 2.470 -4.758 1.00 15.00 H new ATOM 0 HD11 LEU A 39 -5.865 1.014 -6.727 1.00 15.00 H new ATOM 0 HD12 LEU A 39 -5.202 2.642 -7.007 1.00 15.00 H new ATOM 0 HD13 LEU A 39 -4.107 1.282 -6.662 1.00 15.00 H new ATOM 0 HD21 LEU A 39 -5.868 0.039 -4.463 1.00 15.00 H new ATOM 0 HD22 LEU A 39 -4.109 0.267 -4.312 1.00 15.00 H new ATOM 0 HD23 LEU A 39 -5.204 0.953 -3.087 1.00 15.00 H new ATOM 615 N ALA A 40 -3.692 5.753 -3.028 1.00 15.00 N ATOM 616 CA ALA A 40 -2.924 6.977 -2.841 1.00 15.00 C ATOM 617 C ALA A 40 -2.292 7.028 -1.450 1.00 15.00 C ATOM 618 O ALA A 40 -1.109 7.337 -1.306 1.00 15.00 O ATOM 619 CB ALA A 40 -3.814 8.193 -3.061 1.00 15.00 C ATOM 0 H ALA A 40 -4.653 5.903 -3.334 1.00 15.00 H new ATOM 0 HA ALA A 40 -2.119 6.986 -3.576 1.00 15.00 H new ATOM 0 HB1 ALA A 40 -3.230 9.102 -2.919 1.00 15.00 H new ATOM 0 HB2 ALA A 40 -4.213 8.173 -4.075 1.00 15.00 H new ATOM 0 HB3 ALA A 40 -4.637 8.175 -2.347 1.00 15.00 H new ATOM 625 N LYS A 41 -3.093 6.729 -0.429 1.00 15.00 N ATOM 626 CA LYS A 41 -2.619 6.747 0.952 1.00 15.00 C ATOM 627 C LYS A 41 -1.577 5.659 1.200 1.00 15.00 C ATOM 628 O LYS A 41 -0.523 5.919 1.779 1.00 15.00 O ATOM 629 CB LYS A 41 -3.793 6.570 1.919 1.00 15.00 C ATOM 630 CG LYS A 41 -4.920 7.573 1.713 1.00 15.00 C ATOM 631 CD LYS A 41 -4.393 8.986 1.510 1.00 15.00 C ATOM 632 CE LYS A 41 -3.491 9.413 2.655 1.00 15.00 C ATOM 633 NZ LYS A 41 -4.245 9.553 3.931 1.00 15.00 N ATOM 0 H LYS A 41 -4.074 6.471 -0.533 1.00 15.00 H new ATOM 0 HA LYS A 41 -2.148 7.715 1.127 1.00 15.00 H new ATOM 0 HB2 LYS A 41 -4.193 5.562 1.809 1.00 15.00 H new ATOM 0 HB3 LYS A 41 -3.425 6.657 2.941 1.00 15.00 H new ATOM 0 HG2 LYS A 41 -5.514 7.279 0.847 1.00 15.00 H new ATOM 0 HG3 LYS A 41 -5.585 7.554 2.577 1.00 15.00 H new ATOM 0 HD2 LYS A 41 -3.841 9.038 0.572 1.00 15.00 H new ATOM 0 HD3 LYS A 41 -5.230 9.679 1.427 1.00 15.00 H new ATOM 0 HE2 LYS A 41 -2.694 8.680 2.782 1.00 15.00 H new ATOM 0 HE3 LYS A 41 -3.015 10.362 2.408 1.00 15.00 H new ATOM 0 HZ1 LYS A 41 -3.605 9.895 4.677 1.00 15.00 H new ATOM 0 HZ2 LYS A 41 -5.021 10.233 3.803 1.00 15.00 H new ATOM 0 HZ3 LYS A 41 -4.636 8.629 4.207 1.00 15.00 H new ATOM 647 N LYS A 42 -1.880 4.437 0.765 1.00 15.00 N ATOM 648 CA LYS A 42 -0.969 3.309 0.948 1.00 15.00 C ATOM 649 C LYS A 42 0.462 3.687 0.574 1.00 15.00 C ATOM 650 O LYS A 42 1.400 3.427 1.328 1.00 15.00 O ATOM 651 CB LYS A 42 -1.428 2.116 0.108 1.00 15.00 C ATOM 652 CG LYS A 42 -2.084 1.014 0.924 1.00 15.00 C ATOM 653 CD LYS A 42 -3.423 0.606 0.334 1.00 15.00 C ATOM 654 CE LYS A 42 -4.339 0.009 1.390 1.00 15.00 C ATOM 655 NZ LYS A 42 -5.427 -0.805 0.784 1.00 15.00 N ATOM 0 H LYS A 42 -2.748 4.203 0.284 1.00 15.00 H new ATOM 0 HA LYS A 42 -0.985 3.034 2.003 1.00 15.00 H new ATOM 0 HB2 LYS A 42 -2.131 2.464 -0.649 1.00 15.00 H new ATOM 0 HB3 LYS A 42 -0.569 1.703 -0.421 1.00 15.00 H new ATOM 0 HG2 LYS A 42 -1.424 0.148 0.964 1.00 15.00 H new ATOM 0 HG3 LYS A 42 -2.226 1.355 1.950 1.00 15.00 H new ATOM 0 HD2 LYS A 42 -3.903 1.475 -0.116 1.00 15.00 H new ATOM 0 HD3 LYS A 42 -3.264 -0.120 -0.464 1.00 15.00 H new ATOM 0 HE2 LYS A 42 -3.755 -0.613 2.068 1.00 15.00 H new ATOM 0 HE3 LYS A 42 -4.774 0.810 1.988 1.00 15.00 H new ATOM 0 HZ1 LYS A 42 -6.030 -1.194 1.537 1.00 15.00 H new ATOM 0 HZ2 LYS A 42 -6.001 -0.206 0.157 1.00 15.00 H new ATOM 0 HZ3 LYS A 42 -5.012 -1.585 0.234 1.00 15.00 H new ATOM 669 N CYS A 43 0.621 4.297 -0.593 1.00 15.00 N ATOM 670 CA CYS A 43 1.938 4.707 -1.066 1.00 15.00 C ATOM 671 C CYS A 43 2.242 6.152 -0.672 1.00 15.00 C ATOM 672 O CYS A 43 3.389 6.593 -0.740 1.00 15.00 O ATOM 673 CB CYS A 43 2.035 4.554 -2.587 1.00 15.00 C ATOM 674 SG CYS A 43 1.063 3.187 -3.268 1.00 15.00 S ATOM 0 H CYS A 43 -0.144 4.519 -1.230 1.00 15.00 H new ATOM 0 HA CYS A 43 2.675 4.058 -0.594 1.00 15.00 H new ATOM 0 HB2 CYS A 43 1.709 5.483 -3.054 1.00 15.00 H new ATOM 0 HB3 CYS A 43 3.081 4.410 -2.859 1.00 15.00 H new ATOM 0 HG CYS A 43 -0.202 3.413 -3.069 1.00 15.00 H new ATOM 680 N GLY A 44 1.210 6.888 -0.264 1.00 15.00 N ATOM 681 CA GLY A 44 1.402 8.273 0.126 1.00 15.00 C ATOM 682 C GLY A 44 1.953 9.115 -1.007 1.00 15.00 C ATOM 683 O GLY A 44 2.803 9.979 -0.794 1.00 15.00 O ATOM 0 H GLY A 44 0.250 6.551 -0.197 1.00 15.00 H new ATOM 0 HA2 GLY A 44 0.451 8.690 0.458 1.00 15.00 H new ATOM 0 HA3 GLY A 44 2.084 8.319 0.975 1.00 15.00 H new ATOM 687 N ILE A 45 1.472 8.852 -2.216 1.00 15.00 N ATOM 688 CA ILE A 45 1.917 9.575 -3.396 1.00 15.00 C ATOM 689 C ILE A 45 0.832 10.535 -3.890 1.00 15.00 C ATOM 690 O ILE A 45 0.281 11.317 -3.117 1.00 15.00 O ATOM 691 CB ILE A 45 2.325 8.576 -4.509 1.00 15.00 C ATOM 692 CG1 ILE A 45 1.181 7.602 -4.807 1.00 15.00 C ATOM 693 CG2 ILE A 45 3.569 7.809 -4.097 1.00 15.00 C ATOM 694 CD1 ILE A 45 1.484 6.642 -5.936 1.00 15.00 C ATOM 0 H ILE A 45 0.769 8.137 -2.403 1.00 15.00 H new ATOM 0 HA ILE A 45 2.789 10.172 -3.130 1.00 15.00 H new ATOM 0 HB ILE A 45 2.542 9.142 -5.415 1.00 15.00 H new ATOM 0 HG12 ILE A 45 0.956 7.031 -3.906 1.00 15.00 H new ATOM 0 HG13 ILE A 45 0.285 8.171 -5.055 1.00 15.00 H new ATOM 0 HG21 ILE A 45 3.845 7.111 -4.888 1.00 15.00 H new ATOM 0 HG22 ILE A 45 4.388 8.508 -3.928 1.00 15.00 H new ATOM 0 HG23 ILE A 45 3.368 7.257 -3.179 1.00 15.00 H new ATOM 0 HD11 ILE A 45 0.630 5.982 -6.092 1.00 15.00 H new ATOM 0 HD12 ILE A 45 1.679 7.204 -6.849 1.00 15.00 H new ATOM 0 HD13 ILE A 45 2.361 6.047 -5.682 1.00 15.00 H new ATOM 706 N THR A 46 0.511 10.440 -5.166 1.00 15.00 N ATOM 707 CA THR A 46 -0.511 11.237 -5.787 1.00 15.00 C ATOM 708 C THR A 46 -1.209 10.343 -6.769 1.00 15.00 C ATOM 709 O THR A 46 -0.572 9.616 -7.531 1.00 15.00 O ATOM 710 CB THR A 46 0.052 12.458 -6.499 1.00 15.00 C ATOM 711 OG1 THR A 46 1.029 12.082 -7.454 1.00 15.00 O ATOM 712 CG2 THR A 46 0.680 13.466 -5.563 1.00 15.00 C ATOM 0 H THR A 46 0.967 9.791 -5.807 1.00 15.00 H new ATOM 0 HA THR A 46 -1.190 11.621 -5.026 1.00 15.00 H new ATOM 0 HB THR A 46 -0.806 12.927 -6.981 1.00 15.00 H new ATOM 0 HG1 THR A 46 1.375 12.883 -7.900 1.00 15.00 H new ATOM 0 HG21 THR A 46 1.060 14.310 -6.139 1.00 15.00 H new ATOM 0 HG22 THR A 46 -0.068 13.819 -4.853 1.00 15.00 H new ATOM 0 HG23 THR A 46 1.501 12.997 -5.021 1.00 15.00 H new ATOM 720 N VAL A 47 -2.505 10.349 -6.706 1.00 15.00 N ATOM 721 CA VAL A 47 -3.293 9.500 -7.529 1.00 15.00 C ATOM 722 C VAL A 47 -2.920 9.541 -8.984 1.00 15.00 C ATOM 723 O VAL A 47 -3.039 8.535 -9.661 1.00 15.00 O ATOM 724 CB VAL A 47 -4.762 9.791 -7.300 1.00 15.00 C ATOM 725 CG1 VAL A 47 -5.565 9.789 -8.580 1.00 15.00 C ATOM 726 CG2 VAL A 47 -5.226 8.758 -6.339 1.00 15.00 C ATOM 0 H VAL A 47 -3.043 10.947 -6.078 1.00 15.00 H new ATOM 0 HA VAL A 47 -3.083 8.473 -7.230 1.00 15.00 H new ATOM 0 HB VAL A 47 -4.904 10.796 -6.903 1.00 15.00 H new ATOM 0 HG11 VAL A 47 -6.610 10.003 -8.354 1.00 15.00 H new ATOM 0 HG12 VAL A 47 -5.176 10.551 -9.255 1.00 15.00 H new ATOM 0 HG13 VAL A 47 -5.490 8.811 -9.055 1.00 15.00 H new ATOM 0 HG21 VAL A 47 -6.285 8.908 -6.127 1.00 15.00 H new ATOM 0 HG22 VAL A 47 -5.079 7.768 -6.770 1.00 15.00 H new ATOM 0 HG23 VAL A 47 -4.655 8.839 -5.414 1.00 15.00 H new ATOM 736 N SER A 48 -2.445 10.658 -9.478 1.00 15.00 N ATOM 737 CA SER A 48 -2.056 10.693 -10.878 1.00 15.00 C ATOM 738 C SER A 48 -1.037 9.589 -11.131 1.00 15.00 C ATOM 739 O SER A 48 -1.026 8.977 -12.197 1.00 15.00 O ATOM 740 CB SER A 48 -1.504 12.062 -11.277 1.00 15.00 C ATOM 741 OG SER A 48 -1.198 12.106 -12.660 1.00 15.00 O ATOM 0 H SER A 48 -2.319 11.528 -8.960 1.00 15.00 H new ATOM 0 HA SER A 48 -2.937 10.524 -11.498 1.00 15.00 H new ATOM 0 HB2 SER A 48 -2.234 12.835 -11.038 1.00 15.00 H new ATOM 0 HB3 SER A 48 -0.608 12.279 -10.696 1.00 15.00 H new ATOM 0 HG SER A 48 -0.848 12.992 -12.890 1.00 15.00 H new ATOM 747 N GLN A 49 -0.234 9.281 -10.111 1.00 15.00 N ATOM 748 CA GLN A 49 0.715 8.180 -10.215 1.00 15.00 C ATOM 749 C GLN A 49 -0.107 6.921 -10.434 1.00 15.00 C ATOM 750 O GLN A 49 0.201 6.081 -11.280 1.00 15.00 O ATOM 751 CB GLN A 49 1.560 8.059 -8.944 1.00 15.00 C ATOM 752 CG GLN A 49 2.103 9.386 -8.442 1.00 15.00 C ATOM 753 CD GLN A 49 3.579 9.563 -8.738 1.00 15.00 C ATOM 754 OE1 GLN A 49 4.074 9.120 -9.775 1.00 15.00 O ATOM 755 NE2 GLN A 49 4.290 10.215 -7.826 1.00 15.00 N ATOM 0 H GLN A 49 -0.223 9.772 -9.217 1.00 15.00 H new ATOM 0 HA GLN A 49 1.411 8.345 -11.038 1.00 15.00 H new ATOM 0 HB2 GLN A 49 0.956 7.604 -8.159 1.00 15.00 H new ATOM 0 HB3 GLN A 49 2.394 7.385 -9.136 1.00 15.00 H new ATOM 0 HG2 GLN A 49 1.544 10.200 -8.903 1.00 15.00 H new ATOM 0 HG3 GLN A 49 1.941 9.457 -7.366 1.00 15.00 H new ATOM 0 HE21 GLN A 49 3.838 10.565 -6.981 1.00 15.00 H new ATOM 0 HE22 GLN A 49 5.288 10.366 -7.970 1.00 15.00 H new ATOM 764 N VAL A 50 -1.210 6.859 -9.688 1.00 15.00 N ATOM 765 CA VAL A 50 -2.177 5.787 -9.791 1.00 15.00 C ATOM 766 C VAL A 50 -3.031 6.053 -11.027 1.00 15.00 C ATOM 767 O VAL A 50 -3.017 5.286 -11.985 1.00 15.00 O ATOM 768 CB VAL A 50 -3.070 5.743 -8.529 1.00 15.00 C ATOM 769 CG1 VAL A 50 -4.192 4.726 -8.672 1.00 15.00 C ATOM 770 CG2 VAL A 50 -2.229 5.450 -7.293 1.00 15.00 C ATOM 0 H VAL A 50 -1.452 7.563 -8.991 1.00 15.00 H new ATOM 0 HA VAL A 50 -1.669 4.826 -9.874 1.00 15.00 H new ATOM 0 HB VAL A 50 -3.532 6.724 -8.413 1.00 15.00 H new ATOM 0 HG11 VAL A 50 -4.798 4.723 -7.766 1.00 15.00 H new ATOM 0 HG12 VAL A 50 -4.816 4.990 -9.526 1.00 15.00 H new ATOM 0 HG13 VAL A 50 -3.767 3.734 -8.827 1.00 15.00 H new ATOM 0 HG21 VAL A 50 -2.872 5.422 -6.413 1.00 15.00 H new ATOM 0 HG22 VAL A 50 -1.733 4.486 -7.410 1.00 15.00 H new ATOM 0 HG23 VAL A 50 -1.479 6.231 -7.170 1.00 15.00 H new ATOM 780 N SER A 51 -3.747 7.183 -11.000 1.00 15.00 N ATOM 781 CA SER A 51 -4.589 7.606 -12.115 1.00 15.00 C ATOM 782 C SER A 51 -3.954 7.264 -13.463 1.00 15.00 C ATOM 783 O SER A 51 -4.623 6.771 -14.371 1.00 15.00 O ATOM 784 CB SER A 51 -4.847 9.112 -12.038 1.00 15.00 C ATOM 785 OG SER A 51 -6.202 9.412 -12.320 1.00 15.00 O ATOM 0 H SER A 51 -3.757 7.824 -10.207 1.00 15.00 H new ATOM 0 HA SER A 51 -5.533 7.066 -12.038 1.00 15.00 H new ATOM 0 HB2 SER A 51 -4.590 9.478 -11.044 1.00 15.00 H new ATOM 0 HB3 SER A 51 -4.201 9.631 -12.746 1.00 15.00 H new ATOM 0 HG SER A 51 -6.341 10.380 -12.263 1.00 15.00 H new ATOM 791 N ASN A 52 -2.656 7.524 -13.581 1.00 15.00 N ATOM 792 CA ASN A 52 -1.931 7.241 -14.817 1.00 15.00 C ATOM 793 C ASN A 52 -1.643 5.750 -14.970 1.00 15.00 C ATOM 794 O ASN A 52 -1.900 5.164 -16.021 1.00 15.00 O ATOM 795 CB ASN A 52 -0.621 8.031 -14.860 1.00 15.00 C ATOM 796 CG ASN A 52 -0.159 8.302 -16.278 1.00 15.00 C ATOM 797 OD1 ASN A 52 0.978 8.002 -16.641 1.00 15.00 O ATOM 798 ND2 ASN A 52 -1.042 8.874 -17.088 1.00 15.00 N ATOM 0 H ASN A 52 -2.085 7.929 -12.839 1.00 15.00 H new ATOM 0 HA ASN A 52 -2.566 7.550 -15.648 1.00 15.00 H new ATOM 0 HB2 ASN A 52 -0.753 8.978 -14.336 1.00 15.00 H new ATOM 0 HB3 ASN A 52 0.152 7.477 -14.328 1.00 15.00 H new ATOM 0 HD21 ASN A 52 -0.788 9.082 -18.054 1.00 15.00 H new ATOM 0 HD22 ASN A 52 -1.974 9.106 -16.744 1.00 15.00 H new ATOM 805 N TRP A 53 -1.101 5.142 -13.916 1.00 15.00 N ATOM 806 CA TRP A 53 -0.768 3.716 -13.931 1.00 15.00 C ATOM 807 C TRP A 53 -1.893 2.885 -14.525 1.00 15.00 C ATOM 808 O TRP A 53 -1.675 2.072 -15.419 1.00 15.00 O ATOM 809 CB TRP A 53 -0.498 3.217 -12.513 1.00 15.00 C ATOM 810 CG TRP A 53 0.021 1.811 -12.463 1.00 15.00 C ATOM 811 CD1 TRP A 53 1.319 1.417 -12.308 1.00 15.00 C ATOM 812 CD2 TRP A 53 -0.754 0.609 -12.561 1.00 15.00 C ATOM 813 NE1 TRP A 53 1.399 0.044 -12.306 1.00 15.00 N ATOM 814 CE2 TRP A 53 0.139 -0.474 -12.459 1.00 15.00 C ATOM 815 CE3 TRP A 53 -2.117 0.344 -12.726 1.00 15.00 C ATOM 816 CZ2 TRP A 53 -0.289 -1.799 -12.515 1.00 15.00 C ATOM 817 CZ3 TRP A 53 -2.539 -0.970 -12.782 1.00 15.00 C ATOM 818 CH2 TRP A 53 -1.629 -2.027 -12.677 1.00 15.00 C ATOM 0 H TRP A 53 -0.882 5.614 -13.039 1.00 15.00 H new ATOM 0 HA TRP A 53 0.123 3.603 -14.548 1.00 15.00 H new ATOM 0 HB2 TRP A 53 0.223 3.879 -12.034 1.00 15.00 H new ATOM 0 HB3 TRP A 53 -1.419 3.277 -11.934 1.00 15.00 H new ATOM 0 HD1 TRP A 53 2.160 2.086 -12.202 1.00 15.00 H new ATOM 0 HE1 TRP A 53 2.256 -0.500 -12.207 1.00 15.00 H new ATOM 0 HE3 TRP A 53 -2.828 1.153 -12.808 1.00 15.00 H new ATOM 0 HZ2 TRP A 53 0.412 -2.617 -12.433 1.00 15.00 H new ATOM 0 HZ3 TRP A 53 -3.590 -1.185 -12.909 1.00 15.00 H new ATOM 0 HH2 TRP A 53 -1.991 -3.043 -12.725 1.00 15.00 H new ATOM 829 N PHE A 54 -3.094 3.083 -14.005 1.00 15.00 N ATOM 830 CA PHE A 54 -4.247 2.334 -14.466 1.00 15.00 C ATOM 831 C PHE A 54 -4.665 2.780 -15.853 1.00 15.00 C ATOM 832 O PHE A 54 -5.280 2.026 -16.601 1.00 15.00 O ATOM 833 CB PHE A 54 -5.409 2.475 -13.487 1.00 15.00 C ATOM 834 CG PHE A 54 -5.062 1.991 -12.113 1.00 15.00 C ATOM 835 CD1 PHE A 54 -4.107 2.651 -11.370 1.00 15.00 C ATOM 836 CD2 PHE A 54 -5.675 0.874 -11.574 1.00 15.00 C ATOM 837 CE1 PHE A 54 -3.758 2.218 -10.113 1.00 15.00 C ATOM 838 CE2 PHE A 54 -5.335 0.429 -10.311 1.00 15.00 C ATOM 839 CZ PHE A 54 -4.373 1.102 -9.577 1.00 15.00 C ATOM 0 H PHE A 54 -3.293 3.756 -13.265 1.00 15.00 H new ATOM 0 HA PHE A 54 -3.965 1.282 -14.518 1.00 15.00 H new ATOM 0 HB2 PHE A 54 -5.711 3.521 -13.435 1.00 15.00 H new ATOM 0 HB3 PHE A 54 -6.265 1.914 -13.861 1.00 15.00 H new ATOM 0 HD1 PHE A 54 -3.624 3.524 -11.783 1.00 15.00 H new ATOM 0 HD2 PHE A 54 -6.425 0.346 -12.145 1.00 15.00 H new ATOM 0 HE1 PHE A 54 -3.006 2.748 -9.546 1.00 15.00 H new ATOM 0 HE2 PHE A 54 -5.819 -0.443 -9.897 1.00 15.00 H new ATOM 0 HZ PHE A 54 -4.104 0.756 -8.590 1.00 15.00 H new ATOM 849 N GLY A 55 -4.323 4.008 -16.201 1.00 15.00 N ATOM 850 CA GLY A 55 -4.670 4.510 -17.514 1.00 15.00 C ATOM 851 C GLY A 55 -4.141 3.615 -18.621 1.00 15.00 C ATOM 852 O GLY A 55 -4.906 3.118 -19.448 1.00 15.00 O ATOM 0 H GLY A 55 -3.816 4.663 -15.605 1.00 15.00 H new ATOM 0 HA2 GLY A 55 -5.754 4.589 -17.598 1.00 15.00 H new ATOM 0 HA3 GLY A 55 -4.267 5.515 -17.636 1.00 15.00 H new ATOM 856 N ASN A 56 -2.826 3.411 -18.633 1.00 15.00 N ATOM 857 CA ASN A 56 -2.182 2.570 -19.639 1.00 15.00 C ATOM 858 C ASN A 56 -1.912 1.159 -19.122 1.00 15.00 C ATOM 859 O ASN A 56 -2.299 0.173 -19.747 1.00 15.00 O ATOM 860 CB ASN A 56 -0.873 3.207 -20.103 1.00 15.00 C ATOM 861 CG ASN A 56 -0.698 3.138 -21.608 1.00 15.00 C ATOM 862 OD1 ASN A 56 0.180 2.436 -22.110 1.00 15.00 O ATOM 863 ND2 ASN A 56 -1.533 3.870 -22.335 1.00 15.00 N ATOM 0 H ASN A 56 -2.183 3.819 -17.954 1.00 15.00 H new ATOM 0 HA ASN A 56 -2.871 2.490 -20.480 1.00 15.00 H new ATOM 0 HB2 ASN A 56 -0.846 4.249 -19.784 1.00 15.00 H new ATOM 0 HB3 ASN A 56 -0.036 2.704 -19.619 1.00 15.00 H new ATOM 0 HD21 ASN A 56 -1.462 3.865 -23.353 1.00 15.00 H new ATOM 0 HD22 ASN A 56 -2.246 4.437 -21.876 1.00 15.00 H new ATOM 870 N LYS A 57 -1.212 1.074 -17.989 1.00 15.00 N ATOM 871 CA LYS A 57 -0.850 -0.216 -17.402 1.00 15.00 C ATOM 872 C LYS A 57 -2.054 -1.139 -17.266 1.00 15.00 C ATOM 873 O LYS A 57 -1.897 -2.358 -17.205 1.00 15.00 O ATOM 874 CB LYS A 57 -0.186 -0.022 -16.039 1.00 15.00 C ATOM 875 CG LYS A 57 0.820 -1.113 -15.701 1.00 15.00 C ATOM 876 CD LYS A 57 2.184 -0.536 -15.355 1.00 15.00 C ATOM 877 CE LYS A 57 3.299 -1.247 -16.106 1.00 15.00 C ATOM 878 NZ LYS A 57 4.280 -0.288 -16.685 1.00 15.00 N ATOM 0 H LYS A 57 -0.885 1.883 -17.461 1.00 15.00 H new ATOM 0 HA LYS A 57 -0.142 -0.689 -18.082 1.00 15.00 H new ATOM 0 HB2 LYS A 57 0.317 0.945 -16.021 1.00 15.00 H new ATOM 0 HB3 LYS A 57 -0.956 0.005 -15.268 1.00 15.00 H new ATOM 0 HG2 LYS A 57 0.450 -1.701 -14.861 1.00 15.00 H new ATOM 0 HG3 LYS A 57 0.917 -1.793 -16.547 1.00 15.00 H new ATOM 0 HD2 LYS A 57 2.202 0.527 -15.596 1.00 15.00 H new ATOM 0 HD3 LYS A 57 2.355 -0.622 -14.282 1.00 15.00 H new ATOM 0 HE2 LYS A 57 3.814 -1.929 -15.430 1.00 15.00 H new ATOM 0 HE3 LYS A 57 2.870 -1.853 -16.904 1.00 15.00 H new ATOM 0 HZ1 LYS A 57 5.023 -0.813 -17.188 1.00 15.00 H new ATOM 0 HZ2 LYS A 57 3.794 0.347 -17.350 1.00 15.00 H new ATOM 0 HZ3 LYS A 57 4.709 0.273 -15.922 1.00 15.00 H new ATOM 892 N ARG A 58 -3.255 -0.572 -17.249 1.00 15.00 N ATOM 893 CA ARG A 58 -4.454 -1.383 -17.156 1.00 15.00 C ATOM 894 C ARG A 58 -4.553 -2.229 -18.404 1.00 15.00 C ATOM 895 O ARG A 58 -4.992 -3.377 -18.366 1.00 15.00 O ATOM 896 CB ARG A 58 -5.701 -0.507 -17.012 1.00 15.00 C ATOM 897 CG ARG A 58 -7.011 -1.265 -17.176 1.00 15.00 C ATOM 898 CD ARG A 58 -8.185 -0.481 -16.611 1.00 15.00 C ATOM 899 NE ARG A 58 -9.468 -1.058 -17.003 1.00 15.00 N ATOM 900 CZ ARG A 58 -9.999 -0.927 -18.217 1.00 15.00 C ATOM 901 NH1 ARG A 58 -9.360 -0.245 -19.158 1.00 15.00 N ATOM 902 NH2 ARG A 58 -11.173 -1.482 -18.491 1.00 15.00 N ATOM 0 H ARG A 58 -3.419 0.433 -17.298 1.00 15.00 H new ATOM 0 HA ARG A 58 -4.395 -2.018 -16.272 1.00 15.00 H new ATOM 0 HB2 ARG A 58 -5.688 -0.032 -16.031 1.00 15.00 H new ATOM 0 HB3 ARG A 58 -5.660 0.291 -17.753 1.00 15.00 H new ATOM 0 HG2 ARG A 58 -7.184 -1.470 -18.233 1.00 15.00 H new ATOM 0 HG3 ARG A 58 -6.940 -2.229 -16.672 1.00 15.00 H new ATOM 0 HD2 ARG A 58 -8.115 -0.457 -15.523 1.00 15.00 H new ATOM 0 HD3 ARG A 58 -8.131 0.551 -16.956 1.00 15.00 H new ATOM 0 HE ARG A 58 -9.987 -1.592 -16.306 1.00 15.00 H new ATOM 0 HH11 ARG A 58 -8.457 0.183 -18.954 1.00 15.00 H new ATOM 0 HH12 ARG A 58 -9.772 -0.148 -20.086 1.00 15.00 H new ATOM 0 HH21 ARG A 58 -11.668 -2.009 -17.772 1.00 15.00 H new ATOM 0 HH22 ARG A 58 -11.580 -1.382 -19.421 1.00 15.00 H new ATOM 916 N ILE A 59 -4.129 -1.649 -19.522 1.00 15.00 N ATOM 917 CA ILE A 59 -4.162 -2.355 -20.781 1.00 15.00 C ATOM 918 C ILE A 59 -2.893 -3.132 -21.044 1.00 15.00 C ATOM 919 O ILE A 59 -2.505 -3.373 -22.186 1.00 15.00 O ATOM 920 CB ILE A 59 -4.444 -1.425 -21.942 1.00 15.00 C ATOM 921 CG1 ILE A 59 -5.217 -2.172 -23.043 1.00 15.00 C ATOM 922 CG2 ILE A 59 -3.164 -0.790 -22.480 1.00 15.00 C ATOM 923 CD1 ILE A 59 -4.922 -3.672 -23.137 1.00 15.00 C ATOM 0 H ILE A 59 -3.762 -0.699 -19.574 1.00 15.00 H new ATOM 0 HA ILE A 59 -4.982 -3.069 -20.698 1.00 15.00 H new ATOM 0 HB ILE A 59 -5.068 -0.607 -21.582 1.00 15.00 H new ATOM 0 HG12 ILE A 59 -6.285 -2.037 -22.872 1.00 15.00 H new ATOM 0 HG13 ILE A 59 -4.988 -1.711 -24.004 1.00 15.00 H new ATOM 0 HG21 ILE A 59 -3.407 -0.129 -23.312 1.00 15.00 H new ATOM 0 HG22 ILE A 59 -2.683 -0.215 -21.689 1.00 15.00 H new ATOM 0 HG23 ILE A 59 -2.487 -1.572 -22.824 1.00 15.00 H new ATOM 0 HD11 ILE A 59 -5.514 -4.109 -23.941 1.00 15.00 H new ATOM 0 HD12 ILE A 59 -3.862 -3.822 -23.343 1.00 15.00 H new ATOM 0 HD13 ILE A 59 -5.180 -4.153 -22.194 1.00 15.00 H new ATOM 935 N ARG A 60 -2.267 -3.535 -19.980 1.00 15.00 N ATOM 936 CA ARG A 60 -1.050 -4.315 -20.076 1.00 15.00 C ATOM 937 C ARG A 60 -1.387 -5.749 -20.457 1.00 15.00 C ATOM 938 O ARG A 60 -0.513 -6.562 -20.755 1.00 15.00 O ATOM 939 CB ARG A 60 -0.295 -4.275 -18.749 1.00 15.00 C ATOM 940 CG ARG A 60 1.030 -5.023 -18.766 1.00 15.00 C ATOM 941 CD ARG A 60 2.203 -4.078 -18.961 1.00 15.00 C ATOM 942 NE ARG A 60 3.428 -4.593 -18.353 1.00 15.00 N ATOM 943 CZ ARG A 60 4.652 -4.207 -18.707 1.00 15.00 C ATOM 944 NH1 ARG A 60 4.819 -3.297 -19.659 1.00 15.00 N ATOM 945 NH2 ARG A 60 5.711 -4.731 -18.107 1.00 15.00 N ATOM 0 H ARG A 60 -2.573 -3.340 -19.027 1.00 15.00 H new ATOM 0 HA ARG A 60 -0.410 -3.889 -20.849 1.00 15.00 H new ATOM 0 HB2 ARG A 60 -0.110 -3.235 -18.480 1.00 15.00 H new ATOM 0 HB3 ARG A 60 -0.929 -4.698 -17.970 1.00 15.00 H new ATOM 0 HG2 ARG A 60 1.153 -5.568 -17.830 1.00 15.00 H new ATOM 0 HG3 ARG A 60 1.021 -5.763 -19.567 1.00 15.00 H new ATOM 0 HD2 ARG A 60 2.367 -3.918 -20.027 1.00 15.00 H new ATOM 0 HD3 ARG A 60 1.963 -3.108 -18.527 1.00 15.00 H new ATOM 0 HE ARG A 60 3.340 -5.290 -17.613 1.00 15.00 H new ATOM 0 HH11 ARG A 60 4.007 -2.890 -20.123 1.00 15.00 H new ATOM 0 HH12 ARG A 60 5.759 -3.005 -19.926 1.00 15.00 H new ATOM 0 HH21 ARG A 60 5.588 -5.430 -17.374 1.00 15.00 H new ATOM 0 HH22 ARG A 60 6.649 -4.436 -18.378 1.00 15.00 H new ATOM 959 N TYR A 61 -2.675 -6.033 -20.442 1.00 15.00 N ATOM 960 CA TYR A 61 -3.185 -7.352 -20.779 1.00 15.00 C ATOM 961 C TYR A 61 -3.591 -7.479 -22.249 1.00 15.00 C ATOM 962 O TYR A 61 -4.291 -8.416 -22.630 1.00 15.00 O ATOM 963 CB TYR A 61 -4.327 -7.734 -19.839 1.00 15.00 C ATOM 964 CG TYR A 61 -5.398 -6.696 -19.705 1.00 15.00 C ATOM 965 CD1 TYR A 61 -5.522 -5.725 -20.655 1.00 15.00 C ATOM 966 CD2 TYR A 61 -6.275 -6.694 -18.630 1.00 15.00 C ATOM 967 CE1 TYR A 61 -6.498 -4.752 -20.564 1.00 15.00 C ATOM 968 CE2 TYR A 61 -7.259 -5.731 -18.522 1.00 15.00 C ATOM 969 CZ TYR A 61 -7.368 -4.760 -19.496 1.00 15.00 C ATOM 970 OH TYR A 61 -8.345 -3.796 -19.397 1.00 15.00 O ATOM 0 H TYR A 61 -3.399 -5.358 -20.196 1.00 15.00 H new ATOM 0 HA TYR A 61 -2.368 -8.060 -20.639 1.00 15.00 H new ATOM 0 HB2 TYR A 61 -4.779 -8.660 -20.195 1.00 15.00 H new ATOM 0 HB3 TYR A 61 -3.914 -7.940 -18.852 1.00 15.00 H new ATOM 0 HD1 TYR A 61 -4.843 -5.717 -21.495 1.00 15.00 H new ATOM 0 HD2 TYR A 61 -6.187 -7.455 -17.868 1.00 15.00 H new ATOM 0 HE1 TYR A 61 -6.579 -3.990 -21.325 1.00 15.00 H new ATOM 0 HE2 TYR A 61 -7.938 -5.738 -17.682 1.00 15.00 H new ATOM 0 HH TYR A 61 -8.873 -3.947 -18.585 1.00 15.00 H new ATOM 980 N LYS A 62 -3.128 -6.541 -23.071 1.00 15.00 N ATOM 981 CA LYS A 62 -3.419 -6.550 -24.506 1.00 15.00 C ATOM 982 C LYS A 62 -4.889 -6.863 -24.796 1.00 15.00 C ATOM 983 O LYS A 62 -5.217 -7.413 -25.847 1.00 15.00 O ATOM 984 CB LYS A 62 -2.521 -7.567 -25.217 1.00 15.00 C ATOM 985 CG LYS A 62 -1.471 -6.931 -26.111 1.00 15.00 C ATOM 986 CD LYS A 62 -0.180 -7.735 -26.114 1.00 15.00 C ATOM 987 CE LYS A 62 0.889 -7.075 -25.259 1.00 15.00 C ATOM 988 NZ LYS A 62 1.689 -8.078 -24.502 1.00 15.00 N ATOM 0 H LYS A 62 -2.546 -5.760 -22.768 1.00 15.00 H new ATOM 0 HA LYS A 62 -3.215 -5.549 -24.885 1.00 15.00 H new ATOM 0 HB2 LYS A 62 -2.024 -8.185 -24.469 1.00 15.00 H new ATOM 0 HB3 LYS A 62 -3.143 -8.231 -25.817 1.00 15.00 H new ATOM 0 HG2 LYS A 62 -1.856 -6.855 -27.128 1.00 15.00 H new ATOM 0 HG3 LYS A 62 -1.268 -5.916 -25.770 1.00 15.00 H new ATOM 0 HD2 LYS A 62 -0.376 -8.741 -25.742 1.00 15.00 H new ATOM 0 HD3 LYS A 62 0.183 -7.839 -27.137 1.00 15.00 H new ATOM 0 HE2 LYS A 62 1.551 -6.487 -25.895 1.00 15.00 H new ATOM 0 HE3 LYS A 62 0.419 -6.382 -24.560 1.00 15.00 H new ATOM 0 HZ1 LYS A 62 2.408 -7.589 -23.931 1.00 15.00 H new ATOM 0 HZ2 LYS A 62 1.061 -8.622 -23.877 1.00 15.00 H new ATOM 0 HZ3 LYS A 62 2.158 -8.724 -25.169 1.00 15.00 H new ATOM 1002 N LYS A 63 -5.768 -6.509 -23.867 1.00 15.00 N ATOM 1003 CA LYS A 63 -7.194 -6.752 -24.031 1.00 15.00 C ATOM 1004 C LYS A 63 -7.828 -5.694 -24.932 1.00 15.00 C ATOM 1005 O LYS A 63 -8.744 -4.981 -24.523 1.00 15.00 O ATOM 1006 CB LYS A 63 -7.889 -6.762 -22.669 1.00 15.00 C ATOM 1007 CG LYS A 63 -9.094 -7.685 -22.610 1.00 15.00 C ATOM 1008 CD LYS A 63 -8.812 -8.922 -21.772 1.00 15.00 C ATOM 1009 CE LYS A 63 -9.573 -10.133 -22.289 1.00 15.00 C ATOM 1010 NZ LYS A 63 -10.322 -10.823 -21.203 1.00 15.00 N ATOM 0 H LYS A 63 -5.517 -6.052 -22.991 1.00 15.00 H new ATOM 0 HA LYS A 63 -7.320 -7.726 -24.503 1.00 15.00 H new ATOM 0 HB2 LYS A 63 -7.172 -7.065 -21.906 1.00 15.00 H new ATOM 0 HB3 LYS A 63 -8.206 -5.748 -22.424 1.00 15.00 H new ATOM 0 HG2 LYS A 63 -9.945 -7.147 -22.191 1.00 15.00 H new ATOM 0 HG3 LYS A 63 -9.373 -7.985 -23.620 1.00 15.00 H new ATOM 0 HD2 LYS A 63 -7.743 -9.132 -21.781 1.00 15.00 H new ATOM 0 HD3 LYS A 63 -9.091 -8.732 -20.736 1.00 15.00 H new ATOM 0 HE2 LYS A 63 -10.269 -9.819 -23.067 1.00 15.00 H new ATOM 0 HE3 LYS A 63 -8.874 -10.832 -22.749 1.00 15.00 H new ATOM 0 HZ1 LYS A 63 -10.827 -11.643 -21.596 1.00 15.00 H new ATOM 0 HZ2 LYS A 63 -9.656 -11.145 -20.472 1.00 15.00 H new ATOM 0 HZ3 LYS A 63 -11.007 -10.164 -20.781 1.00 15.00 H new ATOM 1024 N ASN A 64 -7.334 -5.597 -26.163 1.00 15.00 N ATOM 1025 CA ASN A 64 -7.853 -4.627 -27.119 1.00 15.00 C ATOM 1026 C ASN A 64 -7.666 -5.117 -28.551 1.00 15.00 C ATOM 1027 O ASN A 64 -6.564 -5.612 -28.867 1.00 15.00 O ATOM 1028 CB ASN A 64 -7.158 -3.276 -26.935 1.00 15.00 C ATOM 1029 CG ASN A 64 -8.109 -2.108 -27.106 1.00 15.00 C ATOM 1030 OD1 ASN A 64 -8.852 -1.759 -26.189 1.00 15.00 O ATOM 1031 ND2 ASN A 64 -8.091 -1.497 -28.285 1.00 15.00 N ATOM 1032 OXT ASN A 64 -8.624 -5.004 -29.344 1.00 15.00 O ATOM 0 H ASN A 64 -6.576 -6.178 -26.521 1.00 15.00 H new ATOM 0 HA ASN A 64 -8.920 -4.508 -26.933 1.00 15.00 H new ATOM 0 HB2 ASN A 64 -6.710 -3.233 -25.942 1.00 15.00 H new ATOM 0 HB3 ASN A 64 -6.345 -3.188 -27.656 1.00 15.00 H new ATOM 0 HD21 ASN A 64 -8.710 -0.705 -28.458 1.00 15.00 H new ATOM 0 HD22 ASN A 64 -7.459 -1.820 -29.017 1.00 15.00 H new TER 1039 ASN A 64