USER MOD reduce.3.24.130724 H: found=0, std=0, add=692, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 691 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 130 HIS : no HE2:sc= -1.89 K(o=-7.6,f=-8.3!) USER MOD Set 1.2: A 133 LYS NZ :NH3+ -151:sc= -5.72! (180deg=-6.96!) USER MOD Set 2.1: A 61 MET CE :methyl 180:sc= -0.02 (180deg=-0.02) USER MOD Set 2.2: A 65 GLN :FLIP amide:sc= 0 F(o=-1.4!,f=-0.02) USER MOD Single : A 60 LYS NZ :NH3+ -135:sc= -2.78! (180deg=-5.37!) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.0626 USER MOD Single : A 66 MET CE :methyl 133:sc= -0.743 (180deg=-1.99!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl 144:sc= -0.856 (180deg=-2.17) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.00249 USER MOD Single : A 84 LYS NZ :NH3+ 152:sc= -0.236 (180deg=-1.23!) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -123:sc= -0.358 (180deg=-1.16) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 TYR OH : rot -152:sc= 0.885 USER MOD Single : A 95 SER OG : rot -26:sc= 0.0817 USER MOD Single : A 96 LYS NZ :NH3+ -153:sc= -0.131 (180deg=-0.811) USER MOD Single : A 98 LYS NZ :NH3+ -161:sc= -0.0128 (180deg=-0.564) USER MOD Single : A 99 TYR OH : rot 180:sc= -0.0575 USER MOD Single : A 105 THR OG1 : rot 90:sc= 0.436 USER MOD Single : A 107 ASN : amide:sc= -0.553 X(o=-0.55,f=-0.54) USER MOD Single : A 108 THR OG1 : rot -55:sc= 0.692 USER MOD Single : A 109 SER OG : rot 180:sc= -0.409! USER MOD Single : A 110 CYS SG : rot -44:sc= 0.333! USER MOD Single : A 118 CYS SG : rot -160:sc= 0.0437 USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 127 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.00705) USER MOD Single : A 129 TYR OH : rot 180:sc= -0.284 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ -149:sc= -0.0706 (180deg=-1.1) USER MOD Single : A 136 ASN : amide:sc= 0.199 K(o=0.2,f=-0.65) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 162:sc= 0.113 (180deg=-0.282) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 58 -15.219 6.034 -13.809 1.00 0.00 N ATOM 2 CA ARG A 58 -14.234 5.049 -13.373 1.00 0.00 C ATOM 3 C ARG A 58 -14.923 3.904 -12.630 1.00 0.00 C ATOM 4 O ARG A 58 -16.021 4.068 -12.099 1.00 0.00 O ATOM 5 CB ARG A 58 -13.204 5.718 -12.453 1.00 0.00 C ATOM 6 CG ARG A 58 -12.005 6.198 -13.276 1.00 0.00 C ATOM 7 CD ARG A 58 -11.038 6.962 -12.372 1.00 0.00 C ATOM 8 NE ARG A 58 -9.783 7.211 -13.073 1.00 0.00 N ATOM 9 CZ ARG A 58 -8.861 8.021 -12.563 1.00 0.00 C ATOM 10 NH1 ARG A 58 -9.071 8.609 -11.417 1.00 0.00 N ATOM 11 NH2 ARG A 58 -7.747 8.229 -13.209 1.00 0.00 N ATOM 0 HA ARG A 58 -13.728 4.646 -14.250 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -13.660 6.561 -11.933 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -12.874 5.014 -11.689 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -11.499 5.347 -13.731 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -12.343 6.840 -14.090 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -11.485 7.907 -12.065 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -10.848 6.390 -11.464 1.00 0.00 H new ATOM 0 HE ARG A 58 -9.610 6.756 -13.969 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -9.943 8.447 -10.913 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -8.363 9.231 -11.026 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -7.584 7.770 -14.105 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -7.039 8.851 -12.818 1.00 0.00 H new ATOM 25 N PRO A 59 -14.299 2.754 -12.586 1.00 0.00 N ATOM 26 CA PRO A 59 -14.860 1.557 -11.892 1.00 0.00 C ATOM 27 C PRO A 59 -14.891 1.735 -10.375 1.00 0.00 C ATOM 28 O PRO A 59 -14.520 2.789 -9.856 1.00 0.00 O ATOM 29 CB PRO A 59 -13.906 0.424 -12.294 1.00 0.00 C ATOM 30 CG PRO A 59 -12.618 1.098 -12.632 1.00 0.00 C ATOM 31 CD PRO A 59 -12.988 2.471 -13.193 1.00 0.00 C ATOM 0 HA PRO A 59 -15.895 1.366 -12.174 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -13.776 -0.289 -11.479 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -14.294 -0.134 -13.146 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -11.987 1.196 -11.749 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -12.055 0.518 -13.363 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -12.250 3.226 -12.923 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -13.045 2.457 -14.281 1.00 0.00 H new ATOM 39 N LYS A 60 -15.333 0.697 -9.671 1.00 0.00 N ATOM 40 CA LYS A 60 -15.408 0.746 -8.214 1.00 0.00 C ATOM 41 C LYS A 60 -14.180 0.089 -7.590 1.00 0.00 C ATOM 42 O LYS A 60 -13.791 -1.012 -7.980 1.00 0.00 O ATOM 43 CB LYS A 60 -16.670 0.027 -7.733 1.00 0.00 C ATOM 44 CG LYS A 60 -16.764 0.119 -6.208 1.00 0.00 C ATOM 45 CD LYS A 60 -18.185 -0.232 -5.759 1.00 0.00 C ATOM 46 CE LYS A 60 -18.505 -1.678 -6.151 1.00 0.00 C ATOM 47 NZ LYS A 60 -18.876 -1.731 -7.593 1.00 0.00 N ATOM 0 H LYS A 60 -15.643 -0.183 -10.082 1.00 0.00 H new ATOM 0 HA LYS A 60 -15.443 1.791 -7.906 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -17.552 0.475 -8.189 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -16.646 -1.018 -8.044 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -16.048 -0.562 -5.748 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -16.505 1.125 -5.878 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -18.277 -0.108 -4.680 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -18.901 0.448 -6.220 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -17.642 -2.317 -5.963 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -19.323 -2.059 -5.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -19.720 -2.327 -7.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -19.079 -0.770 -7.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -18.088 -2.133 -8.140 1.00 0.00 H new ATOM 61 N MET A 61 -13.572 0.772 -6.626 1.00 0.00 N ATOM 62 CA MET A 61 -12.389 0.244 -5.957 1.00 0.00 C ATOM 63 C MET A 61 -12.786 -0.759 -4.878 1.00 0.00 C ATOM 64 O MET A 61 -13.784 -0.572 -4.182 1.00 0.00 O ATOM 65 CB MET A 61 -11.591 1.390 -5.328 1.00 0.00 C ATOM 66 CG MET A 61 -10.152 0.933 -5.071 1.00 0.00 C ATOM 67 SD MET A 61 -9.220 0.974 -6.624 1.00 0.00 S ATOM 68 CE MET A 61 -8.681 -0.754 -6.626 1.00 0.00 C ATOM 0 H MET A 61 -13.876 1.686 -6.292 1.00 0.00 H new ATOM 0 HA MET A 61 -11.771 -0.265 -6.697 1.00 0.00 H new ATOM 0 HB2 MET A 61 -11.596 2.256 -5.990 1.00 0.00 H new ATOM 0 HB3 MET A 61 -12.057 1.701 -4.393 1.00 0.00 H new ATOM 0 HG2 MET A 61 -9.679 1.581 -4.333 1.00 0.00 H new ATOM 0 HG3 MET A 61 -10.148 -0.076 -4.658 1.00 0.00 H new ATOM 0 HE1 MET A 61 -8.080 -0.947 -7.515 1.00 0.00 H new ATOM 0 HE2 MET A 61 -8.084 -0.950 -5.735 1.00 0.00 H new ATOM 0 HE3 MET A 61 -9.554 -1.407 -6.629 1.00 0.00 H new ATOM 78 N THR A 62 -11.997 -1.822 -4.744 1.00 0.00 N ATOM 79 CA THR A 62 -12.273 -2.854 -3.746 1.00 0.00 C ATOM 80 C THR A 62 -11.012 -3.157 -2.936 1.00 0.00 C ATOM 81 O THR A 62 -9.902 -3.068 -3.457 1.00 0.00 O ATOM 82 CB THR A 62 -12.753 -4.131 -4.443 1.00 0.00 C ATOM 83 OG1 THR A 62 -11.628 -4.905 -4.835 1.00 0.00 O ATOM 84 CG2 THR A 62 -13.576 -3.762 -5.678 1.00 0.00 C ATOM 0 H THR A 62 -11.166 -1.992 -5.310 1.00 0.00 H new ATOM 0 HA THR A 62 -13.050 -2.493 -3.072 1.00 0.00 H new ATOM 0 HB THR A 62 -13.372 -4.709 -3.757 1.00 0.00 H new ATOM 0 HG1 THR A 62 -11.933 -5.723 -5.280 1.00 0.00 H new ATOM 0 HG21 THR A 62 -13.917 -4.671 -6.173 1.00 0.00 H new ATOM 0 HG22 THR A 62 -14.439 -3.168 -5.376 1.00 0.00 H new ATOM 0 HG23 THR A 62 -12.960 -3.183 -6.366 1.00 0.00 H new ATOM 92 N PRO A 63 -11.160 -3.512 -1.682 1.00 0.00 N ATOM 93 CA PRO A 63 -9.998 -3.828 -0.798 1.00 0.00 C ATOM 94 C PRO A 63 -9.207 -5.031 -1.310 1.00 0.00 C ATOM 95 O PRO A 63 -7.980 -5.066 -1.213 1.00 0.00 O ATOM 96 CB PRO A 63 -10.632 -4.120 0.571 1.00 0.00 C ATOM 97 CG PRO A 63 -12.067 -4.427 0.292 1.00 0.00 C ATOM 98 CD PRO A 63 -12.439 -3.653 -0.970 1.00 0.00 C ATOM 0 HA PRO A 63 -9.279 -3.010 -0.760 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -10.139 -4.960 1.060 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -10.537 -3.263 1.238 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -12.214 -5.497 0.148 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -12.697 -4.129 1.130 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -13.173 -4.192 -1.569 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -12.873 -2.682 -0.731 1.00 0.00 H new ATOM 106 N GLU A 64 -9.918 -6.010 -1.859 1.00 0.00 N ATOM 107 CA GLU A 64 -9.269 -7.203 -2.388 1.00 0.00 C ATOM 108 C GLU A 64 -8.480 -6.859 -3.646 1.00 0.00 C ATOM 109 O GLU A 64 -7.390 -7.384 -3.873 1.00 0.00 O ATOM 110 CB GLU A 64 -10.318 -8.268 -2.715 1.00 0.00 C ATOM 111 CG GLU A 64 -9.623 -9.527 -3.236 1.00 0.00 C ATOM 112 CD GLU A 64 -10.622 -10.674 -3.327 1.00 0.00 C ATOM 113 OE1 GLU A 64 -11.116 -11.089 -2.292 1.00 0.00 O ATOM 114 OE2 GLU A 64 -10.880 -11.123 -4.433 1.00 0.00 O ATOM 0 H GLU A 64 -10.934 -6.002 -1.949 1.00 0.00 H new ATOM 0 HA GLU A 64 -8.585 -7.592 -1.634 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -10.902 -8.504 -1.825 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -11.015 -7.889 -3.462 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -9.189 -9.333 -4.217 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -8.802 -9.800 -2.573 1.00 0.00 H new ATOM 121 N GLN A 65 -9.038 -5.969 -4.459 1.00 0.00 N ATOM 122 CA GLN A 65 -8.379 -5.553 -5.692 1.00 0.00 C ATOM 123 C GLN A 65 -7.061 -4.853 -5.380 1.00 0.00 C ATOM 124 O GLN A 65 -6.004 -5.255 -5.867 1.00 0.00 O ATOM 125 CB GLN A 65 -9.289 -4.608 -6.478 1.00 0.00 C ATOM 126 CG GLN A 65 -8.581 -4.167 -7.761 1.00 0.00 C ATOM 127 CD GLN A 65 -9.560 -3.428 -8.668 1.00 0.00 C ATOM 128 OE1 GLN A 65 -10.727 -3.075 -8.202 1.00 0.00 O flip ATOM 129 NE2 GLN A 65 -9.252 -3.165 -9.831 1.00 0.00 N flip ATOM 0 H GLN A 65 -9.940 -5.524 -4.288 1.00 0.00 H new ATOM 0 HA GLN A 65 -8.175 -6.440 -6.292 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -10.227 -5.108 -6.721 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -9.539 -3.738 -5.871 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -7.738 -3.520 -7.517 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -8.176 -5.036 -8.280 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -8.339 -3.442 -10.192 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -9.910 -2.670 -10.433 1.00 0.00 H new ATOM 138 N MET A 66 -7.131 -3.806 -4.565 1.00 0.00 N ATOM 139 CA MET A 66 -5.932 -3.060 -4.197 1.00 0.00 C ATOM 140 C MET A 66 -4.920 -3.980 -3.520 1.00 0.00 C ATOM 141 O MET A 66 -3.714 -3.854 -3.731 1.00 0.00 O ATOM 142 CB MET A 66 -6.295 -1.909 -3.251 1.00 0.00 C ATOM 143 CG MET A 66 -7.001 -2.462 -2.016 1.00 0.00 C ATOM 144 SD MET A 66 -7.480 -1.094 -0.930 1.00 0.00 S ATOM 145 CE MET A 66 -8.664 -0.304 -2.049 1.00 0.00 C ATOM 0 H MET A 66 -7.995 -3.457 -4.150 1.00 0.00 H new ATOM 0 HA MET A 66 -5.488 -2.652 -5.105 1.00 0.00 H new ATOM 0 HB2 MET A 66 -5.395 -1.370 -2.956 1.00 0.00 H new ATOM 0 HB3 MET A 66 -6.941 -1.195 -3.762 1.00 0.00 H new ATOM 0 HG2 MET A 66 -7.882 -3.031 -2.312 1.00 0.00 H new ATOM 0 HG3 MET A 66 -6.342 -3.149 -1.484 1.00 0.00 H new ATOM 0 HE1 MET A 66 -9.580 -0.073 -1.505 1.00 0.00 H new ATOM 0 HE2 MET A 66 -8.234 0.617 -2.443 1.00 0.00 H new ATOM 0 HE3 MET A 66 -8.892 -0.980 -2.874 1.00 0.00 H new ATOM 155 N ALA A 67 -5.419 -4.903 -2.707 1.00 0.00 N ATOM 156 CA ALA A 67 -4.549 -5.839 -2.006 1.00 0.00 C ATOM 157 C ALA A 67 -3.795 -6.716 -2.998 1.00 0.00 C ATOM 158 O ALA A 67 -2.628 -7.046 -2.791 1.00 0.00 O ATOM 159 CB ALA A 67 -5.376 -6.719 -1.067 1.00 0.00 C ATOM 0 H ALA A 67 -6.414 -5.023 -2.518 1.00 0.00 H new ATOM 0 HA ALA A 67 -3.827 -5.267 -1.424 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.718 -7.415 -0.547 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -5.889 -6.092 -0.338 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -6.111 -7.278 -1.646 1.00 0.00 H new ATOM 165 N LYS A 68 -4.472 -7.088 -4.080 1.00 0.00 N ATOM 166 CA LYS A 68 -3.859 -7.926 -5.102 1.00 0.00 C ATOM 167 C LYS A 68 -2.745 -7.171 -5.822 1.00 0.00 C ATOM 168 O LYS A 68 -1.625 -7.667 -5.940 1.00 0.00 O ATOM 169 CB LYS A 68 -4.918 -8.369 -6.115 1.00 0.00 C ATOM 170 CG LYS A 68 -5.754 -9.504 -5.521 1.00 0.00 C ATOM 171 CD LYS A 68 -6.979 -9.756 -6.404 1.00 0.00 C ATOM 172 CE LYS A 68 -6.527 -10.237 -7.785 1.00 0.00 C ATOM 173 NZ LYS A 68 -7.664 -10.915 -8.471 1.00 0.00 N ATOM 0 H LYS A 68 -5.439 -6.824 -4.270 1.00 0.00 H new ATOM 0 HA LYS A 68 -3.429 -8.803 -4.617 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -5.561 -7.528 -6.375 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -4.438 -8.701 -7.036 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -5.154 -10.411 -5.447 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -6.069 -9.247 -4.510 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -7.626 -10.502 -5.942 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.565 -8.842 -6.500 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.180 -9.393 -8.381 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -5.686 -10.924 -7.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -7.358 -11.242 -9.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -7.975 -11.730 -7.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -8.453 -10.246 -8.578 1.00 0.00 H new ATOM 187 N GLU A 69 -3.061 -5.971 -6.300 1.00 0.00 N ATOM 188 CA GLU A 69 -2.080 -5.156 -7.011 1.00 0.00 C ATOM 189 C GLU A 69 -0.921 -4.777 -6.093 1.00 0.00 C ATOM 190 O GLU A 69 0.236 -4.754 -6.514 1.00 0.00 O ATOM 191 CB GLU A 69 -2.745 -3.886 -7.545 1.00 0.00 C ATOM 192 CG GLU A 69 -3.977 -4.261 -8.370 1.00 0.00 C ATOM 193 CD GLU A 69 -4.654 -3.000 -8.898 1.00 0.00 C ATOM 194 OE1 GLU A 69 -4.067 -2.346 -9.743 1.00 0.00 O ATOM 195 OE2 GLU A 69 -5.750 -2.708 -8.448 1.00 0.00 O ATOM 0 H GLU A 69 -3.982 -5.543 -6.209 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.689 -5.742 -7.843 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -3.033 -3.238 -6.717 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -2.041 -3.325 -8.159 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.687 -4.903 -9.201 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.676 -4.830 -7.757 1.00 0.00 H new ATOM 202 N MET A 70 -1.238 -4.481 -4.839 1.00 0.00 N ATOM 203 CA MET A 70 -0.209 -4.108 -3.877 1.00 0.00 C ATOM 204 C MET A 70 0.673 -5.308 -3.552 1.00 0.00 C ATOM 205 O MET A 70 1.886 -5.272 -3.748 1.00 0.00 O ATOM 206 CB MET A 70 -0.860 -3.590 -2.589 1.00 0.00 C ATOM 207 CG MET A 70 -1.324 -2.141 -2.779 1.00 0.00 C ATOM 208 SD MET A 70 -1.658 -1.401 -1.159 1.00 0.00 S ATOM 209 CE MET A 70 -3.296 -2.123 -0.889 1.00 0.00 C ATOM 0 H MET A 70 -2.188 -4.491 -4.467 1.00 0.00 H new ATOM 0 HA MET A 70 0.406 -3.322 -4.315 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.709 -4.220 -2.323 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.149 -3.647 -1.765 1.00 0.00 H new ATOM 0 HG2 MET A 70 -0.559 -1.568 -3.302 1.00 0.00 H new ATOM 0 HG3 MET A 70 -2.222 -2.113 -3.397 1.00 0.00 H new ATOM 0 HE1 MET A 70 -3.421 -2.356 0.168 1.00 0.00 H new ATOM 0 HE2 MET A 70 -4.062 -1.412 -1.197 1.00 0.00 H new ATOM 0 HE3 MET A 70 -3.392 -3.037 -1.476 1.00 0.00 H new ATOM 219 N SER A 71 0.052 -6.369 -3.048 1.00 0.00 N ATOM 220 CA SER A 71 0.786 -7.575 -2.688 1.00 0.00 C ATOM 221 C SER A 71 1.759 -7.981 -3.792 1.00 0.00 C ATOM 222 O SER A 71 2.958 -8.121 -3.551 1.00 0.00 O ATOM 223 CB SER A 71 -0.192 -8.720 -2.424 1.00 0.00 C ATOM 224 OG SER A 71 0.506 -9.957 -2.477 1.00 0.00 O ATOM 0 H SER A 71 -0.953 -6.418 -2.880 1.00 0.00 H new ATOM 0 HA SER A 71 1.359 -7.363 -1.785 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.660 -8.595 -1.448 1.00 0.00 H new ATOM 0 HB3 SER A 71 -0.991 -8.709 -3.165 1.00 0.00 H new ATOM 0 HG SER A 71 -0.119 -10.693 -2.307 1.00 0.00 H new ATOM 230 N GLU A 72 1.242 -8.173 -5.003 1.00 0.00 N ATOM 231 CA GLU A 72 2.093 -8.570 -6.120 1.00 0.00 C ATOM 232 C GLU A 72 3.188 -7.535 -6.357 1.00 0.00 C ATOM 233 O GLU A 72 4.338 -7.890 -6.611 1.00 0.00 O ATOM 234 CB GLU A 72 1.256 -8.751 -7.391 1.00 0.00 C ATOM 235 CG GLU A 72 0.724 -7.397 -7.859 1.00 0.00 C ATOM 236 CD GLU A 72 -0.279 -7.593 -8.990 1.00 0.00 C ATOM 237 OE1 GLU A 72 -1.408 -7.950 -8.697 1.00 0.00 O ATOM 238 OE2 GLU A 72 0.098 -7.385 -10.131 1.00 0.00 O ATOM 0 H GLU A 72 0.255 -8.062 -5.234 1.00 0.00 H new ATOM 0 HA GLU A 72 2.563 -9.521 -5.870 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.863 -9.204 -8.175 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.426 -9.431 -7.197 1.00 0.00 H new ATOM 0 HG2 GLU A 72 0.249 -6.876 -7.027 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.549 -6.770 -8.198 1.00 0.00 H new ATOM 245 N PHE A 73 2.833 -6.255 -6.273 1.00 0.00 N ATOM 246 CA PHE A 73 3.813 -5.194 -6.481 1.00 0.00 C ATOM 247 C PHE A 73 5.054 -5.447 -5.625 1.00 0.00 C ATOM 248 O PHE A 73 6.177 -5.459 -6.132 1.00 0.00 O ATOM 249 CB PHE A 73 3.200 -3.829 -6.128 1.00 0.00 C ATOM 250 CG PHE A 73 3.006 -3.013 -7.388 1.00 0.00 C ATOM 251 CD1 PHE A 73 2.195 -3.500 -8.418 1.00 0.00 C ATOM 252 CD2 PHE A 73 3.640 -1.770 -7.525 1.00 0.00 C ATOM 253 CE1 PHE A 73 2.015 -2.746 -9.585 1.00 0.00 C ATOM 254 CE2 PHE A 73 3.459 -1.017 -8.691 1.00 0.00 C ATOM 255 CZ PHE A 73 2.648 -1.506 -9.721 1.00 0.00 C ATOM 0 H PHE A 73 1.888 -5.931 -6.065 1.00 0.00 H new ATOM 0 HA PHE A 73 4.104 -5.189 -7.531 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.244 -3.969 -5.624 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.851 -3.296 -5.435 1.00 0.00 H new ATOM 0 HD1 PHE A 73 1.707 -4.458 -8.314 1.00 0.00 H new ATOM 0 HD2 PHE A 73 4.268 -1.394 -6.731 1.00 0.00 H new ATOM 0 HE1 PHE A 73 1.388 -3.122 -10.380 1.00 0.00 H new ATOM 0 HE2 PHE A 73 3.945 -0.058 -8.796 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.511 -0.926 -10.621 1.00 0.00 H new ATOM 265 N LEU A 74 4.844 -5.651 -4.327 1.00 0.00 N ATOM 266 CA LEU A 74 5.957 -5.906 -3.419 1.00 0.00 C ATOM 267 C LEU A 74 6.656 -7.210 -3.789 1.00 0.00 C ATOM 268 O LEU A 74 7.874 -7.331 -3.658 1.00 0.00 O ATOM 269 CB LEU A 74 5.455 -5.991 -1.973 1.00 0.00 C ATOM 270 CG LEU A 74 4.490 -4.838 -1.687 1.00 0.00 C ATOM 271 CD1 LEU A 74 4.197 -4.780 -0.187 1.00 0.00 C ATOM 272 CD2 LEU A 74 5.118 -3.515 -2.133 1.00 0.00 C ATOM 0 H LEU A 74 3.925 -5.645 -3.885 1.00 0.00 H new ATOM 0 HA LEU A 74 6.665 -5.082 -3.507 1.00 0.00 H new ATOM 0 HB2 LEU A 74 4.954 -6.945 -1.808 1.00 0.00 H new ATOM 0 HB3 LEU A 74 6.298 -5.950 -1.283 1.00 0.00 H new ATOM 0 HG LEU A 74 3.562 -5.001 -2.236 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.510 -3.959 0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.746 -5.719 0.132 1.00 0.00 H new ATOM 0 HD13 LEU A 74 5.127 -4.620 0.359 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.428 -2.697 -1.928 1.00 0.00 H new ATOM 0 HD22 LEU A 74 6.047 -3.351 -1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 74 5.327 -3.554 -3.202 1.00 0.00 H new ATOM 284 N SER A 75 5.876 -8.183 -4.247 1.00 0.00 N ATOM 285 CA SER A 75 6.433 -9.475 -4.632 1.00 0.00 C ATOM 286 C SER A 75 7.234 -9.353 -5.925 1.00 0.00 C ATOM 287 O SER A 75 8.034 -10.228 -6.255 1.00 0.00 O ATOM 288 CB SER A 75 5.306 -10.491 -4.821 1.00 0.00 C ATOM 289 OG SER A 75 5.854 -11.803 -4.823 1.00 0.00 O ATOM 0 H SER A 75 4.865 -8.104 -4.360 1.00 0.00 H new ATOM 0 HA SER A 75 7.100 -9.813 -3.839 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.573 -10.392 -4.021 1.00 0.00 H new ATOM 0 HB3 SER A 75 4.783 -10.301 -5.758 1.00 0.00 H new ATOM 0 HG SER A 75 5.135 -12.458 -4.942 1.00 0.00 H new ATOM 295 N ARG A 76 7.013 -8.262 -6.654 1.00 0.00 N ATOM 296 CA ARG A 76 7.719 -8.038 -7.911 1.00 0.00 C ATOM 297 C ARG A 76 9.053 -7.341 -7.661 1.00 0.00 C ATOM 298 O ARG A 76 10.081 -7.738 -8.210 1.00 0.00 O ATOM 299 CB ARG A 76 6.861 -7.181 -8.847 1.00 0.00 C ATOM 300 CG ARG A 76 5.783 -8.053 -9.496 1.00 0.00 C ATOM 301 CD ARG A 76 4.938 -7.196 -10.441 1.00 0.00 C ATOM 302 NE ARG A 76 4.021 -8.039 -11.201 1.00 0.00 N ATOM 303 CZ ARG A 76 4.454 -8.792 -12.207 1.00 0.00 C ATOM 304 NH1 ARG A 76 5.718 -8.787 -12.528 1.00 0.00 N ATOM 305 NH2 ARG A 76 3.615 -9.536 -12.872 1.00 0.00 N ATOM 0 H ARG A 76 6.356 -7.525 -6.398 1.00 0.00 H new ATOM 0 HA ARG A 76 7.909 -9.005 -8.376 1.00 0.00 H new ATOM 0 HB2 ARG A 76 6.398 -6.367 -8.289 1.00 0.00 H new ATOM 0 HB3 ARG A 76 7.486 -6.726 -9.615 1.00 0.00 H new ATOM 0 HG2 ARG A 76 6.245 -8.873 -10.046 1.00 0.00 H new ATOM 0 HG3 ARG A 76 5.151 -8.500 -8.729 1.00 0.00 H new ATOM 0 HD2 ARG A 76 4.376 -6.458 -9.869 1.00 0.00 H new ATOM 0 HD3 ARG A 76 5.587 -6.645 -11.122 1.00 0.00 H new ATOM 0 HE ARG A 76 3.031 -8.051 -10.956 1.00 0.00 H new ATOM 0 HH11 ARG A 76 6.374 -8.205 -12.007 1.00 0.00 H new ATOM 0 HH12 ARG A 76 6.050 -9.365 -13.300 1.00 0.00 H new ATOM 0 HH21 ARG A 76 2.627 -9.540 -12.620 1.00 0.00 H new ATOM 0 HH22 ARG A 76 3.947 -10.114 -13.644 1.00 0.00 H new ATOM 319 N GLY A 77 9.029 -6.301 -6.831 1.00 0.00 N ATOM 320 CA GLY A 77 10.245 -5.553 -6.514 1.00 0.00 C ATOM 321 C GLY A 77 10.635 -5.741 -5.051 1.00 0.00 C ATOM 322 O GLY A 77 9.815 -6.146 -4.228 1.00 0.00 O ATOM 0 H GLY A 77 8.187 -5.958 -6.368 1.00 0.00 H new ATOM 0 HA2 GLY A 77 11.060 -5.886 -7.157 1.00 0.00 H new ATOM 0 HA3 GLY A 77 10.089 -4.494 -6.720 1.00 0.00 H new ATOM 326 N PRO A 78 11.864 -5.448 -4.715 1.00 0.00 N ATOM 327 CA PRO A 78 12.373 -5.583 -3.319 1.00 0.00 C ATOM 328 C PRO A 78 11.824 -4.491 -2.401 1.00 0.00 C ATOM 329 O PRO A 78 11.207 -3.532 -2.864 1.00 0.00 O ATOM 330 CB PRO A 78 13.891 -5.457 -3.476 1.00 0.00 C ATOM 331 CG PRO A 78 14.087 -4.636 -4.707 1.00 0.00 C ATOM 332 CD PRO A 78 12.909 -4.956 -5.631 1.00 0.00 C ATOM 0 HA PRO A 78 12.065 -6.521 -2.856 1.00 0.00 H new ATOM 0 HB2 PRO A 78 14.339 -4.977 -2.606 1.00 0.00 H new ATOM 0 HB3 PRO A 78 14.360 -6.436 -3.576 1.00 0.00 H new ATOM 0 HG2 PRO A 78 14.114 -3.573 -4.465 1.00 0.00 H new ATOM 0 HG3 PRO A 78 15.035 -4.877 -5.188 1.00 0.00 H new ATOM 0 HD2 PRO A 78 12.578 -4.073 -6.177 1.00 0.00 H new ATOM 0 HD3 PRO A 78 13.176 -5.708 -6.373 1.00 0.00 H new ATOM 340 N ALA A 79 12.056 -4.644 -1.102 1.00 0.00 N ATOM 341 CA ALA A 79 11.582 -3.663 -0.131 1.00 0.00 C ATOM 342 C ALA A 79 12.397 -3.747 1.154 1.00 0.00 C ATOM 343 O ALA A 79 11.907 -3.419 2.236 1.00 0.00 O ATOM 344 CB ALA A 79 10.105 -3.907 0.181 1.00 0.00 C ATOM 0 H ALA A 79 12.565 -5.431 -0.699 1.00 0.00 H new ATOM 0 HA ALA A 79 11.701 -2.668 -0.559 1.00 0.00 H new ATOM 0 HB1 ALA A 79 9.760 -3.170 0.906 1.00 0.00 H new ATOM 0 HB2 ALA A 79 9.520 -3.817 -0.734 1.00 0.00 H new ATOM 0 HB3 ALA A 79 9.981 -4.908 0.594 1.00 0.00 H new ATOM 350 N VAL A 80 13.646 -4.185 1.025 1.00 0.00 N ATOM 351 CA VAL A 80 14.535 -4.308 2.177 1.00 0.00 C ATOM 352 C VAL A 80 13.768 -4.773 3.413 1.00 0.00 C ATOM 353 O VAL A 80 13.191 -3.963 4.138 1.00 0.00 O ATOM 354 CB VAL A 80 15.201 -2.965 2.467 1.00 0.00 C ATOM 355 CG1 VAL A 80 16.170 -3.117 3.641 1.00 0.00 C ATOM 356 CG2 VAL A 80 15.971 -2.500 1.229 1.00 0.00 C ATOM 0 H VAL A 80 14.065 -4.460 0.137 1.00 0.00 H new ATOM 0 HA VAL A 80 15.296 -5.051 1.940 1.00 0.00 H new ATOM 0 HB VAL A 80 14.438 -2.229 2.719 1.00 0.00 H new ATOM 0 HG11 VAL A 80 16.645 -2.158 3.847 1.00 0.00 H new ATOM 0 HG12 VAL A 80 15.623 -3.448 4.524 1.00 0.00 H new ATOM 0 HG13 VAL A 80 16.933 -3.853 3.390 1.00 0.00 H new ATOM 0 HG21 VAL A 80 16.447 -1.541 1.435 1.00 0.00 H new ATOM 0 HG22 VAL A 80 16.734 -3.237 0.977 1.00 0.00 H new ATOM 0 HG23 VAL A 80 15.282 -2.390 0.392 1.00 0.00 H new ATOM 366 N LEU A 81 13.766 -6.080 3.645 1.00 0.00 N ATOM 367 CA LEU A 81 13.067 -6.640 4.797 1.00 0.00 C ATOM 368 C LEU A 81 13.518 -5.947 6.080 1.00 0.00 C ATOM 369 O LEU A 81 14.516 -5.227 6.092 1.00 0.00 O ATOM 370 CB LEU A 81 13.346 -8.141 4.901 1.00 0.00 C ATOM 371 CG LEU A 81 12.587 -8.889 3.796 1.00 0.00 C ATOM 372 CD1 LEU A 81 13.335 -10.176 3.439 1.00 0.00 C ATOM 373 CD2 LEU A 81 11.179 -9.244 4.285 1.00 0.00 C ATOM 0 H LEU A 81 14.236 -6.768 3.057 1.00 0.00 H new ATOM 0 HA LEU A 81 11.997 -6.480 4.664 1.00 0.00 H new ATOM 0 HB2 LEU A 81 14.416 -8.328 4.811 1.00 0.00 H new ATOM 0 HB3 LEU A 81 13.039 -8.510 5.880 1.00 0.00 H new ATOM 0 HG LEU A 81 12.517 -8.250 2.916 1.00 0.00 H new ATOM 0 HD11 LEU A 81 12.794 -10.705 2.654 1.00 0.00 H new ATOM 0 HD12 LEU A 81 14.336 -9.929 3.086 1.00 0.00 H new ATOM 0 HD13 LEU A 81 13.408 -10.811 4.322 1.00 0.00 H new ATOM 0 HD21 LEU A 81 10.644 -9.775 3.498 1.00 0.00 H new ATOM 0 HD22 LEU A 81 11.250 -9.879 5.168 1.00 0.00 H new ATOM 0 HD23 LEU A 81 10.641 -8.331 4.538 1.00 0.00 H new ATOM 385 N ALA A 82 12.774 -6.169 7.160 1.00 0.00 N ATOM 386 CA ALA A 82 13.108 -5.560 8.442 1.00 0.00 C ATOM 387 C ALA A 82 12.215 -6.110 9.549 1.00 0.00 C ATOM 388 O ALA A 82 11.292 -5.439 10.008 1.00 0.00 O ATOM 389 CB ALA A 82 12.940 -4.041 8.358 1.00 0.00 C ATOM 0 H ALA A 82 11.943 -6.761 7.173 1.00 0.00 H new ATOM 0 HA ALA A 82 14.145 -5.800 8.676 1.00 0.00 H new ATOM 0 HB1 ALA A 82 13.191 -3.593 9.320 1.00 0.00 H new ATOM 0 HB2 ALA A 82 13.602 -3.644 7.589 1.00 0.00 H new ATOM 0 HB3 ALA A 82 11.907 -3.803 8.106 1.00 0.00 H new ATOM 395 N THR A 83 12.497 -7.338 9.973 1.00 0.00 N ATOM 396 CA THR A 83 11.712 -7.970 11.028 1.00 0.00 C ATOM 397 C THR A 83 12.126 -7.431 12.395 1.00 0.00 C ATOM 398 O THR A 83 12.013 -8.124 13.406 1.00 0.00 O ATOM 399 CB THR A 83 11.910 -9.490 10.987 1.00 0.00 C ATOM 400 OG1 THR A 83 12.004 -9.916 9.636 1.00 0.00 O ATOM 401 CG2 THR A 83 10.726 -10.186 11.661 1.00 0.00 C ATOM 0 H THR A 83 13.257 -7.911 9.606 1.00 0.00 H new ATOM 0 HA THR A 83 10.659 -7.740 10.865 1.00 0.00 H new ATOM 0 HB THR A 83 12.826 -9.749 11.517 1.00 0.00 H new ATOM 0 HG1 THR A 83 12.132 -10.887 9.607 1.00 0.00 H new ATOM 0 HG21 THR A 83 10.872 -11.266 11.629 1.00 0.00 H new ATOM 0 HG22 THR A 83 10.655 -9.860 12.699 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.806 -9.929 11.136 1.00 0.00 H new ATOM 409 N LYS A 84 12.606 -6.192 12.416 1.00 0.00 N ATOM 410 CA LYS A 84 13.035 -5.565 13.663 1.00 0.00 C ATOM 411 C LYS A 84 12.799 -4.059 13.613 1.00 0.00 C ATOM 412 O LYS A 84 13.539 -3.285 14.220 1.00 0.00 O ATOM 413 CB LYS A 84 14.522 -5.842 13.901 1.00 0.00 C ATOM 414 CG LYS A 84 14.768 -7.353 13.912 1.00 0.00 C ATOM 415 CD LYS A 84 16.187 -7.646 14.417 1.00 0.00 C ATOM 416 CE LYS A 84 16.181 -7.765 15.944 1.00 0.00 C ATOM 417 NZ LYS A 84 15.315 -8.909 16.348 1.00 0.00 N ATOM 0 H LYS A 84 12.708 -5.604 11.589 1.00 0.00 H new ATOM 0 HA LYS A 84 12.451 -5.987 14.481 1.00 0.00 H new ATOM 0 HB2 LYS A 84 15.119 -5.372 13.120 1.00 0.00 H new ATOM 0 HB3 LYS A 84 14.836 -5.405 14.849 1.00 0.00 H new ATOM 0 HG2 LYS A 84 14.036 -7.845 14.552 1.00 0.00 H new ATOM 0 HG3 LYS A 84 14.638 -7.759 12.909 1.00 0.00 H new ATOM 0 HD2 LYS A 84 16.557 -8.570 13.973 1.00 0.00 H new ATOM 0 HD3 LYS A 84 16.864 -6.850 14.108 1.00 0.00 H new ATOM 0 HE2 LYS A 84 17.196 -7.915 16.312 1.00 0.00 H new ATOM 0 HE3 LYS A 84 15.813 -6.841 16.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 15.650 -9.295 17.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 14.334 -8.581 16.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 15.357 -9.650 15.620 1.00 0.00 H new ATOM 431 N ALA A 85 11.764 -3.652 12.887 1.00 0.00 N ATOM 432 CA ALA A 85 11.440 -2.236 12.764 1.00 0.00 C ATOM 433 C ALA A 85 10.928 -1.684 14.092 1.00 0.00 C ATOM 434 O ALA A 85 9.913 -2.144 14.615 1.00 0.00 O ATOM 435 CB ALA A 85 10.377 -2.035 11.683 1.00 0.00 C ATOM 0 H ALA A 85 11.139 -4.277 12.378 1.00 0.00 H new ATOM 0 HA ALA A 85 12.347 -1.699 12.486 1.00 0.00 H new ATOM 0 HB1 ALA A 85 10.141 -0.974 11.598 1.00 0.00 H new ATOM 0 HB2 ALA A 85 10.755 -2.400 10.728 1.00 0.00 H new ATOM 0 HB3 ALA A 85 9.476 -2.587 11.951 1.00 0.00 H new ATOM 441 N ALA A 86 11.637 -0.697 14.629 1.00 0.00 N ATOM 442 CA ALA A 86 11.245 -0.090 15.897 1.00 0.00 C ATOM 443 C ALA A 86 10.145 0.945 15.678 1.00 0.00 C ATOM 444 O ALA A 86 10.083 1.957 16.375 1.00 0.00 O ATOM 445 CB ALA A 86 12.456 0.581 16.550 1.00 0.00 C ATOM 0 H ALA A 86 12.479 -0.302 14.211 1.00 0.00 H new ATOM 0 HA ALA A 86 10.866 -0.874 16.552 1.00 0.00 H new ATOM 0 HB1 ALA A 86 12.156 1.032 17.496 1.00 0.00 H new ATOM 0 HB2 ALA A 86 13.230 -0.164 16.733 1.00 0.00 H new ATOM 0 HB3 ALA A 86 12.845 1.354 15.887 1.00 0.00 H new ATOM 451 N ALA A 87 9.280 0.683 14.702 1.00 0.00 N ATOM 452 CA ALA A 87 8.186 1.598 14.398 1.00 0.00 C ATOM 453 C ALA A 87 8.727 2.950 13.945 1.00 0.00 C ATOM 454 O ALA A 87 9.753 3.418 14.441 1.00 0.00 O ATOM 455 CB ALA A 87 7.304 1.787 15.634 1.00 0.00 C ATOM 0 H ALA A 87 9.315 -0.149 14.113 1.00 0.00 H new ATOM 0 HA ALA A 87 7.593 1.169 13.591 1.00 0.00 H new ATOM 0 HB1 ALA A 87 6.489 2.472 15.398 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.893 0.825 15.938 1.00 0.00 H new ATOM 0 HB3 ALA A 87 7.901 2.200 16.447 1.00 0.00 H new ATOM 461 N GLY A 88 8.032 3.573 13.000 1.00 0.00 N ATOM 462 CA GLY A 88 8.452 4.872 12.486 1.00 0.00 C ATOM 463 C GLY A 88 9.920 4.848 12.076 1.00 0.00 C ATOM 464 O GLY A 88 10.649 5.817 12.286 1.00 0.00 O ATOM 0 H GLY A 88 7.181 3.203 12.576 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.836 5.145 11.629 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.296 5.636 13.247 1.00 0.00 H new ATOM 468 N THR A 89 10.348 3.734 11.490 1.00 0.00 N ATOM 469 CA THR A 89 11.733 3.595 11.055 1.00 0.00 C ATOM 470 C THR A 89 11.954 4.322 9.732 1.00 0.00 C ATOM 471 O THR A 89 13.048 4.822 9.463 1.00 0.00 O ATOM 472 CB THR A 89 12.083 2.114 10.890 1.00 0.00 C ATOM 473 OG1 THR A 89 13.357 1.997 10.272 1.00 0.00 O ATOM 474 CG2 THR A 89 11.027 1.430 10.020 1.00 0.00 C ATOM 0 H THR A 89 9.761 2.920 11.307 1.00 0.00 H new ATOM 0 HA THR A 89 12.379 4.038 11.813 1.00 0.00 H new ATOM 0 HB THR A 89 12.107 1.635 11.869 1.00 0.00 H new ATOM 0 HG1 THR A 89 13.584 1.049 10.167 1.00 0.00 H new ATOM 0 HG21 THR A 89 11.278 0.376 9.904 1.00 0.00 H new ATOM 0 HG22 THR A 89 10.050 1.520 10.495 1.00 0.00 H new ATOM 0 HG23 THR A 89 10.999 1.906 9.040 1.00 0.00 H new ATOM 482 N LYS A 90 10.911 4.379 8.911 1.00 0.00 N ATOM 483 CA LYS A 90 11.004 5.051 7.620 1.00 0.00 C ATOM 484 C LYS A 90 11.098 6.562 7.805 1.00 0.00 C ATOM 485 O LYS A 90 10.497 7.123 8.721 1.00 0.00 O ATOM 486 CB LYS A 90 9.779 4.712 6.765 1.00 0.00 C ATOM 487 CG LYS A 90 8.503 5.098 7.515 1.00 0.00 C ATOM 488 CD LYS A 90 7.304 4.389 6.882 1.00 0.00 C ATOM 489 CE LYS A 90 6.007 4.990 7.429 1.00 0.00 C ATOM 490 NZ LYS A 90 5.765 6.314 6.789 1.00 0.00 N ATOM 0 H LYS A 90 9.998 3.972 9.114 1.00 0.00 H new ATOM 0 HA LYS A 90 11.906 4.704 7.116 1.00 0.00 H new ATOM 0 HB2 LYS A 90 9.829 5.244 5.815 1.00 0.00 H new ATOM 0 HB3 LYS A 90 9.768 3.647 6.534 1.00 0.00 H new ATOM 0 HG2 LYS A 90 8.589 4.822 8.566 1.00 0.00 H new ATOM 0 HG3 LYS A 90 8.360 6.178 7.480 1.00 0.00 H new ATOM 0 HD2 LYS A 90 7.337 4.494 5.798 1.00 0.00 H new ATOM 0 HD3 LYS A 90 7.343 3.322 7.100 1.00 0.00 H new ATOM 0 HE2 LYS A 90 5.171 4.320 7.230 1.00 0.00 H new ATOM 0 HE3 LYS A 90 6.074 5.104 8.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 5.683 7.045 7.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 6.559 6.545 6.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 4.884 6.277 6.238 1.00 0.00 H new ATOM 504 N LYS A 91 11.862 7.212 6.932 1.00 0.00 N ATOM 505 CA LYS A 91 12.036 8.661 7.009 1.00 0.00 C ATOM 506 C LYS A 91 11.012 9.377 6.136 1.00 0.00 C ATOM 507 O LYS A 91 10.849 10.594 6.226 1.00 0.00 O ATOM 508 CB LYS A 91 13.449 9.039 6.556 1.00 0.00 C ATOM 509 CG LYS A 91 13.668 8.572 5.115 1.00 0.00 C ATOM 510 CD LYS A 91 15.164 8.583 4.795 1.00 0.00 C ATOM 511 CE LYS A 91 15.393 8.000 3.398 1.00 0.00 C ATOM 512 NZ LYS A 91 16.838 7.681 3.225 1.00 0.00 N ATOM 0 H LYS A 91 12.368 6.764 6.168 1.00 0.00 H new ATOM 0 HA LYS A 91 11.888 8.970 8.044 1.00 0.00 H new ATOM 0 HB2 LYS A 91 13.587 10.118 6.624 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.188 8.581 7.214 1.00 0.00 H new ATOM 0 HG2 LYS A 91 13.264 7.568 4.982 1.00 0.00 H new ATOM 0 HG3 LYS A 91 13.133 9.225 4.425 1.00 0.00 H new ATOM 0 HD2 LYS A 91 15.549 9.602 4.843 1.00 0.00 H new ATOM 0 HD3 LYS A 91 15.710 8.001 5.537 1.00 0.00 H new ATOM 0 HE2 LYS A 91 14.792 7.100 3.265 1.00 0.00 H new ATOM 0 HE3 LYS A 91 15.073 8.713 2.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 16.995 7.285 2.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 17.401 8.549 3.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 17.129 6.986 3.943 1.00 0.00 H new ATOM 526 N TYR A 92 10.322 8.617 5.289 1.00 0.00 N ATOM 527 CA TYR A 92 9.314 9.190 4.402 1.00 0.00 C ATOM 528 C TYR A 92 7.912 8.847 4.896 1.00 0.00 C ATOM 529 O TYR A 92 7.497 7.688 4.862 1.00 0.00 O ATOM 530 CB TYR A 92 9.507 8.649 2.980 1.00 0.00 C ATOM 531 CG TYR A 92 10.425 9.565 2.202 1.00 0.00 C ATOM 532 CD1 TYR A 92 9.931 10.759 1.666 1.00 0.00 C ATOM 533 CD2 TYR A 92 11.769 9.218 2.019 1.00 0.00 C ATOM 534 CE1 TYR A 92 10.779 11.607 0.946 1.00 0.00 C ATOM 535 CE2 TYR A 92 12.618 10.066 1.299 1.00 0.00 C ATOM 536 CZ TYR A 92 12.123 11.261 0.762 1.00 0.00 C ATOM 537 OH TYR A 92 12.960 12.097 0.051 1.00 0.00 O ATOM 0 H TYR A 92 10.442 7.608 5.198 1.00 0.00 H new ATOM 0 HA TYR A 92 9.429 10.274 4.397 1.00 0.00 H new ATOM 0 HB2 TYR A 92 9.928 7.644 3.018 1.00 0.00 H new ATOM 0 HB3 TYR A 92 8.543 8.572 2.477 1.00 0.00 H new ATOM 0 HD1 TYR A 92 8.894 11.026 1.808 1.00 0.00 H new ATOM 0 HD2 TYR A 92 12.150 8.296 2.433 1.00 0.00 H new ATOM 0 HE1 TYR A 92 10.397 12.528 0.532 1.00 0.00 H new ATOM 0 HE2 TYR A 92 13.655 9.799 1.157 1.00 0.00 H new ATOM 0 HH TYR A 92 13.674 11.569 -0.365 1.00 0.00 H new ATOM 547 N ASP A 93 7.186 9.863 5.354 1.00 0.00 N ATOM 548 CA ASP A 93 5.828 9.658 5.850 1.00 0.00 C ATOM 549 C ASP A 93 4.809 9.991 4.766 1.00 0.00 C ATOM 550 O ASP A 93 4.433 11.149 4.587 1.00 0.00 O ATOM 551 CB ASP A 93 5.583 10.547 7.072 1.00 0.00 C ATOM 552 CG ASP A 93 5.821 12.009 6.710 1.00 0.00 C ATOM 553 OD1 ASP A 93 6.349 12.254 5.638 1.00 0.00 O ATOM 554 OD2 ASP A 93 5.472 12.862 7.510 1.00 0.00 O ATOM 0 H ASP A 93 7.511 10.829 5.392 1.00 0.00 H new ATOM 0 HA ASP A 93 5.715 8.611 6.131 1.00 0.00 H new ATOM 0 HB2 ASP A 93 4.562 10.414 7.430 1.00 0.00 H new ATOM 0 HB3 ASP A 93 6.247 10.253 7.885 1.00 0.00 H new ATOM 559 N LEU A 94 4.363 8.966 4.045 1.00 0.00 N ATOM 560 CA LEU A 94 3.384 9.159 2.979 1.00 0.00 C ATOM 561 C LEU A 94 1.990 8.759 3.454 1.00 0.00 C ATOM 562 O LEU A 94 1.125 8.417 2.649 1.00 0.00 O ATOM 563 CB LEU A 94 3.763 8.321 1.755 1.00 0.00 C ATOM 564 CG LEU A 94 5.274 8.397 1.517 1.00 0.00 C ATOM 565 CD1 LEU A 94 5.641 7.551 0.293 1.00 0.00 C ATOM 566 CD2 LEU A 94 5.679 9.852 1.270 1.00 0.00 C ATOM 0 H LEU A 94 4.661 8.000 4.178 1.00 0.00 H new ATOM 0 HA LEU A 94 3.379 10.215 2.708 1.00 0.00 H new ATOM 0 HB2 LEU A 94 3.462 7.284 1.906 1.00 0.00 H new ATOM 0 HB3 LEU A 94 3.229 8.683 0.876 1.00 0.00 H new ATOM 0 HG LEU A 94 5.799 8.017 2.393 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.716 7.605 0.123 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.352 6.514 0.467 1.00 0.00 H new ATOM 0 HD13 LEU A 94 5.116 7.931 -0.583 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.754 9.907 1.101 1.00 0.00 H new ATOM 0 HD22 LEU A 94 5.154 10.232 0.394 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.418 10.455 2.140 1.00 0.00 H new ATOM 578 N SER A 95 1.782 8.799 4.766 1.00 0.00 N ATOM 579 CA SER A 95 0.491 8.432 5.337 1.00 0.00 C ATOM 580 C SER A 95 -0.607 9.369 4.840 1.00 0.00 C ATOM 581 O SER A 95 -1.793 9.059 4.945 1.00 0.00 O ATOM 582 CB SER A 95 0.561 8.491 6.863 1.00 0.00 C ATOM 583 OG SER A 95 -0.689 8.086 7.406 1.00 0.00 O ATOM 0 H SER A 95 2.485 9.080 5.450 1.00 0.00 H new ATOM 0 HA SER A 95 0.253 7.416 5.021 1.00 0.00 H new ATOM 0 HB2 SER A 95 1.357 7.841 7.228 1.00 0.00 H new ATOM 0 HB3 SER A 95 0.801 9.503 7.189 1.00 0.00 H new ATOM 0 HG SER A 95 -1.400 8.257 6.753 1.00 0.00 H new ATOM 589 N LYS A 96 -0.205 10.516 4.302 1.00 0.00 N ATOM 590 CA LYS A 96 -1.165 11.492 3.795 1.00 0.00 C ATOM 591 C LYS A 96 -1.482 11.222 2.327 1.00 0.00 C ATOM 592 O LYS A 96 -2.395 11.821 1.759 1.00 0.00 O ATOM 593 CB LYS A 96 -0.600 12.908 3.943 1.00 0.00 C ATOM 594 CG LYS A 96 -0.247 13.176 5.412 1.00 0.00 C ATOM 595 CD LYS A 96 -1.481 13.695 6.164 1.00 0.00 C ATOM 596 CE LYS A 96 -1.569 15.217 6.026 1.00 0.00 C ATOM 597 NZ LYS A 96 -0.433 15.849 6.754 1.00 0.00 N ATOM 0 H LYS A 96 0.772 10.792 4.206 1.00 0.00 H new ATOM 0 HA LYS A 96 -2.083 11.403 4.376 1.00 0.00 H new ATOM 0 HB2 LYS A 96 0.287 13.023 3.320 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -1.330 13.639 3.596 1.00 0.00 H new ATOM 0 HG2 LYS A 96 0.116 12.261 5.880 1.00 0.00 H new ATOM 0 HG3 LYS A 96 0.560 13.906 5.473 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -2.383 13.232 5.765 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -1.420 13.419 7.217 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -1.542 15.499 4.974 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -2.517 15.575 6.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -0.705 16.806 7.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -0.193 15.275 7.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 0.393 15.908 6.125 1.00 0.00 H new ATOM 611 N TRP A 97 -0.719 10.319 1.720 1.00 0.00 N ATOM 612 CA TRP A 97 -0.925 9.977 0.316 1.00 0.00 C ATOM 613 C TRP A 97 -2.056 8.964 0.170 1.00 0.00 C ATOM 614 O TRP A 97 -2.406 8.267 1.122 1.00 0.00 O ATOM 615 CB TRP A 97 0.358 9.391 -0.274 1.00 0.00 C ATOM 616 CG TRP A 97 1.415 10.446 -0.341 1.00 0.00 C ATOM 617 CD1 TRP A 97 1.850 11.182 0.708 1.00 0.00 C ATOM 618 CD2 TRP A 97 2.179 10.893 -1.498 1.00 0.00 C ATOM 619 NE1 TRP A 97 2.834 12.050 0.269 1.00 0.00 N ATOM 620 CE2 TRP A 97 3.071 11.910 -1.084 1.00 0.00 C ATOM 621 CE3 TRP A 97 2.185 10.518 -2.854 1.00 0.00 C ATOM 622 CZ2 TRP A 97 3.938 12.534 -1.982 1.00 0.00 C ATOM 623 CZ3 TRP A 97 3.058 11.143 -3.761 1.00 0.00 C ATOM 624 CH2 TRP A 97 3.933 12.148 -3.326 1.00 0.00 C ATOM 0 H TRP A 97 0.042 9.814 2.173 1.00 0.00 H new ATOM 0 HA TRP A 97 -1.192 10.887 -0.221 1.00 0.00 H new ATOM 0 HB2 TRP A 97 0.702 8.557 0.338 1.00 0.00 H new ATOM 0 HB3 TRP A 97 0.163 8.996 -1.271 1.00 0.00 H new ATOM 0 HD1 TRP A 97 1.488 11.104 1.723 1.00 0.00 H new ATOM 0 HE1 TRP A 97 3.324 12.712 0.871 1.00 0.00 H new ATOM 0 HE3 TRP A 97 1.515 9.745 -3.200 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 4.608 13.310 -1.641 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 3.055 10.847 -4.800 1.00 0.00 H new ATOM 0 HH2 TRP A 97 4.602 12.623 -4.028 1.00 0.00 H new ATOM 635 N LYS A 98 -2.620 8.883 -1.033 1.00 0.00 N ATOM 636 CA LYS A 98 -3.707 7.947 -1.301 1.00 0.00 C ATOM 637 C LYS A 98 -3.193 6.756 -2.104 1.00 0.00 C ATOM 638 O LYS A 98 -2.143 6.835 -2.740 1.00 0.00 O ATOM 639 CB LYS A 98 -4.823 8.646 -2.081 1.00 0.00 C ATOM 640 CG LYS A 98 -5.121 10.007 -1.445 1.00 0.00 C ATOM 641 CD LYS A 98 -5.587 9.809 -0.001 1.00 0.00 C ATOM 642 CE LYS A 98 -6.288 11.077 0.489 1.00 0.00 C ATOM 643 NZ LYS A 98 -5.493 12.271 0.088 1.00 0.00 N ATOM 0 H LYS A 98 -2.343 9.451 -1.833 1.00 0.00 H new ATOM 0 HA LYS A 98 -4.101 7.592 -0.349 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -4.526 8.777 -3.122 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -5.722 8.029 -2.081 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -4.229 10.633 -1.467 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -5.889 10.527 -2.018 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -6.267 8.959 0.059 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -4.735 9.582 0.639 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -7.291 11.137 0.067 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -6.399 11.048 1.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -5.771 13.085 0.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -4.481 12.076 0.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -5.672 12.487 -0.914 1.00 0.00 H new ATOM 657 N TYR A 99 -3.937 5.657 -2.069 1.00 0.00 N ATOM 658 CA TYR A 99 -3.542 4.457 -2.798 1.00 0.00 C ATOM 659 C TYR A 99 -3.230 4.791 -4.255 1.00 0.00 C ATOM 660 O TYR A 99 -2.253 4.298 -4.820 1.00 0.00 O ATOM 661 CB TYR A 99 -4.666 3.416 -2.733 1.00 0.00 C ATOM 662 CG TYR A 99 -4.378 2.285 -3.696 1.00 0.00 C ATOM 663 CD1 TYR A 99 -3.185 1.560 -3.590 1.00 0.00 C ATOM 664 CD2 TYR A 99 -5.306 1.964 -4.695 1.00 0.00 C ATOM 665 CE1 TYR A 99 -2.920 0.514 -4.481 1.00 0.00 C ATOM 666 CE2 TYR A 99 -5.040 0.917 -5.587 1.00 0.00 C ATOM 667 CZ TYR A 99 -3.847 0.192 -5.480 1.00 0.00 C ATOM 668 OH TYR A 99 -3.585 -0.839 -6.358 1.00 0.00 O ATOM 0 H TYR A 99 -4.810 5.571 -1.548 1.00 0.00 H new ATOM 0 HA TYR A 99 -2.643 4.049 -2.335 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -4.755 3.027 -1.719 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -5.620 3.882 -2.981 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.469 1.808 -2.820 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -6.226 2.523 -4.778 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -2.000 -0.045 -4.398 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -5.755 0.669 -6.357 1.00 0.00 H new ATOM 0 HH TYR A 99 -4.331 -0.931 -6.987 1.00 0.00 H new ATOM 678 N ALA A 100 -4.067 5.630 -4.857 1.00 0.00 N ATOM 679 CA ALA A 100 -3.875 6.023 -6.250 1.00 0.00 C ATOM 680 C ALA A 100 -2.613 6.865 -6.405 1.00 0.00 C ATOM 681 O ALA A 100 -1.884 6.738 -7.390 1.00 0.00 O ATOM 682 CB ALA A 100 -5.085 6.822 -6.736 1.00 0.00 C ATOM 0 H ALA A 100 -4.880 6.049 -4.406 1.00 0.00 H new ATOM 0 HA ALA A 100 -3.768 5.119 -6.850 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -4.935 7.112 -7.776 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -5.982 6.208 -6.656 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -5.201 7.716 -6.123 1.00 0.00 H new ATOM 688 N GLU A 101 -2.360 7.730 -5.429 1.00 0.00 N ATOM 689 CA GLU A 101 -1.186 8.591 -5.468 1.00 0.00 C ATOM 690 C GLU A 101 0.091 7.768 -5.332 1.00 0.00 C ATOM 691 O GLU A 101 1.047 7.959 -6.082 1.00 0.00 O ATOM 692 CB GLU A 101 -1.255 9.621 -4.338 1.00 0.00 C ATOM 693 CG GLU A 101 -2.534 10.452 -4.477 1.00 0.00 C ATOM 694 CD GLU A 101 -2.316 11.592 -5.468 1.00 0.00 C ATOM 695 OE1 GLU A 101 -1.457 11.452 -6.322 1.00 0.00 O ATOM 696 OE2 GLU A 101 -3.010 12.590 -5.356 1.00 0.00 O ATOM 0 H GLU A 101 -2.949 7.853 -4.606 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.170 9.106 -6.429 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -1.240 9.117 -3.372 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -0.381 10.272 -4.372 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -3.354 9.818 -4.815 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.822 10.855 -3.506 1.00 0.00 H new ATOM 703 N LEU A 102 0.098 6.854 -4.368 1.00 0.00 N ATOM 704 CA LEU A 102 1.264 6.007 -4.140 1.00 0.00 C ATOM 705 C LEU A 102 1.580 5.176 -5.380 1.00 0.00 C ATOM 706 O LEU A 102 2.644 5.321 -5.982 1.00 0.00 O ATOM 707 CB LEU A 102 1.010 5.081 -2.948 1.00 0.00 C ATOM 708 CG LEU A 102 0.799 5.914 -1.681 1.00 0.00 C ATOM 709 CD1 LEU A 102 0.169 5.038 -0.596 1.00 0.00 C ATOM 710 CD2 LEU A 102 2.143 6.456 -1.180 1.00 0.00 C ATOM 0 H LEU A 102 -0.684 6.681 -3.736 1.00 0.00 H new ATOM 0 HA LEU A 102 2.119 6.649 -3.926 1.00 0.00 H new ATOM 0 HB2 LEU A 102 0.133 4.461 -3.137 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.855 4.405 -2.814 1.00 0.00 H new ATOM 0 HG LEU A 102 0.138 6.750 -1.909 1.00 0.00 H new ATOM 0 HD11 LEU A 102 0.018 5.629 0.307 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -0.791 4.659 -0.946 1.00 0.00 H new ATOM 0 HD13 LEU A 102 0.831 4.201 -0.375 1.00 0.00 H new ATOM 0 HD21 LEU A 102 1.984 7.047 -0.278 1.00 0.00 H new ATOM 0 HD22 LEU A 102 2.810 5.624 -0.955 1.00 0.00 H new ATOM 0 HD23 LEU A 102 2.592 7.083 -1.950 1.00 0.00 H new ATOM 722 N ARG A 103 0.649 4.302 -5.758 1.00 0.00 N ATOM 723 CA ARG A 103 0.849 3.455 -6.930 1.00 0.00 C ATOM 724 C ARG A 103 1.254 4.302 -8.135 1.00 0.00 C ATOM 725 O ARG A 103 2.103 3.901 -8.935 1.00 0.00 O ATOM 726 CB ARG A 103 -0.433 2.681 -7.247 1.00 0.00 C ATOM 727 CG ARG A 103 -1.507 3.648 -7.747 1.00 0.00 C ATOM 728 CD ARG A 103 -2.847 2.918 -7.857 1.00 0.00 C ATOM 729 NE ARG A 103 -3.746 3.649 -8.744 1.00 0.00 N ATOM 730 CZ ARG A 103 -5.055 3.411 -8.745 1.00 0.00 C ATOM 731 NH1 ARG A 103 -5.554 2.510 -7.946 1.00 0.00 N ATOM 732 NH2 ARG A 103 -5.838 4.079 -9.546 1.00 0.00 N ATOM 0 H ARG A 103 -0.240 4.163 -5.277 1.00 0.00 H new ATOM 0 HA ARG A 103 1.648 2.746 -6.712 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -0.233 1.921 -8.003 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -0.785 2.160 -6.356 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -1.597 4.492 -7.063 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -1.222 4.053 -8.718 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -2.690 1.909 -8.237 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -3.298 2.820 -6.870 1.00 0.00 H new ATOM 0 HE ARG A 103 -3.364 4.355 -9.374 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -4.941 1.988 -7.320 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -6.558 2.327 -7.947 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -5.447 4.783 -10.171 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -6.842 3.897 -9.547 1.00 0.00 H new ATOM 746 N ASP A 104 0.641 5.472 -8.258 1.00 0.00 N ATOM 747 CA ASP A 104 0.945 6.367 -9.367 1.00 0.00 C ATOM 748 C ASP A 104 2.394 6.836 -9.295 1.00 0.00 C ATOM 749 O ASP A 104 3.140 6.729 -10.269 1.00 0.00 O ATOM 750 CB ASP A 104 0.013 7.576 -9.329 1.00 0.00 C ATOM 751 CG ASP A 104 0.420 8.585 -10.397 1.00 0.00 C ATOM 752 OD1 ASP A 104 0.544 8.186 -11.544 1.00 0.00 O ATOM 753 OD2 ASP A 104 0.600 9.742 -10.055 1.00 0.00 O ATOM 0 H ASP A 104 -0.064 5.822 -7.609 1.00 0.00 H new ATOM 0 HA ASP A 104 0.798 5.824 -10.300 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -1.016 7.257 -9.493 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.049 8.042 -8.344 1.00 0.00 H new ATOM 758 N THR A 105 2.784 7.359 -8.138 1.00 0.00 N ATOM 759 CA THR A 105 4.144 7.847 -7.952 1.00 0.00 C ATOM 760 C THR A 105 5.162 6.804 -8.403 1.00 0.00 C ATOM 761 O THR A 105 5.983 7.069 -9.281 1.00 0.00 O ATOM 762 CB THR A 105 4.381 8.195 -6.480 1.00 0.00 C ATOM 763 OG1 THR A 105 3.217 8.810 -5.949 1.00 0.00 O ATOM 764 CG2 THR A 105 5.565 9.157 -6.364 1.00 0.00 C ATOM 0 H THR A 105 2.182 7.455 -7.320 1.00 0.00 H new ATOM 0 HA THR A 105 4.270 8.742 -8.561 1.00 0.00 H new ATOM 0 HB THR A 105 4.600 7.285 -5.922 1.00 0.00 H new ATOM 0 HG1 THR A 105 2.622 8.123 -5.583 1.00 0.00 H new ATOM 0 HG21 THR A 105 5.732 9.404 -5.315 1.00 0.00 H new ATOM 0 HG22 THR A 105 6.459 8.685 -6.773 1.00 0.00 H new ATOM 0 HG23 THR A 105 5.349 10.069 -6.921 1.00 0.00 H new ATOM 772 N ILE A 106 5.109 5.620 -7.800 1.00 0.00 N ATOM 773 CA ILE A 106 6.043 4.560 -8.157 1.00 0.00 C ATOM 774 C ILE A 106 5.908 4.192 -9.628 1.00 0.00 C ATOM 775 O ILE A 106 6.873 3.763 -10.260 1.00 0.00 O ATOM 776 CB ILE A 106 5.798 3.326 -7.292 1.00 0.00 C ATOM 777 CG1 ILE A 106 4.388 2.792 -7.541 1.00 0.00 C ATOM 778 CG2 ILE A 106 5.937 3.706 -5.819 1.00 0.00 C ATOM 779 CD1 ILE A 106 4.131 1.607 -6.611 1.00 0.00 C ATOM 0 H ILE A 106 4.439 5.373 -7.072 1.00 0.00 H new ATOM 0 HA ILE A 106 7.054 4.926 -7.981 1.00 0.00 H new ATOM 0 HB ILE A 106 6.527 2.557 -7.547 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.652 3.576 -7.363 1.00 0.00 H new ATOM 0 HG13 ILE A 106 4.281 2.484 -8.581 1.00 0.00 H new ATOM 0 HG21 ILE A 106 5.763 2.827 -5.198 1.00 0.00 H new ATOM 0 HG22 ILE A 106 6.942 4.087 -5.635 1.00 0.00 H new ATOM 0 HG23 ILE A 106 5.206 4.476 -5.571 1.00 0.00 H new ATOM 0 HD11 ILE A 106 3.126 1.221 -6.783 1.00 0.00 H new ATOM 0 HD12 ILE A 106 4.861 0.822 -6.811 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.222 1.932 -5.574 1.00 0.00 H new ATOM 791 N ASN A 107 4.707 4.357 -10.171 1.00 0.00 N ATOM 792 CA ASN A 107 4.471 4.033 -11.573 1.00 0.00 C ATOM 793 C ASN A 107 5.182 5.031 -12.486 1.00 0.00 C ATOM 794 O ASN A 107 5.546 4.698 -13.614 1.00 0.00 O ATOM 795 CB ASN A 107 2.968 4.049 -11.856 1.00 0.00 C ATOM 796 CG ASN A 107 2.394 2.638 -11.762 1.00 0.00 C ATOM 797 OD1 ASN A 107 2.952 1.700 -12.332 1.00 0.00 O ATOM 798 ND2 ASN A 107 1.305 2.430 -11.073 1.00 0.00 N ATOM 0 H ASN A 107 3.891 4.709 -9.670 1.00 0.00 H new ATOM 0 HA ASN A 107 4.870 3.039 -11.774 1.00 0.00 H new ATOM 0 HB2 ASN A 107 2.464 4.702 -11.143 1.00 0.00 H new ATOM 0 HB3 ASN A 107 2.783 4.458 -12.849 1.00 0.00 H new ATOM 0 HD21 ASN A 107 0.915 1.490 -11.006 1.00 0.00 H new ATOM 0 HD22 ASN A 107 0.844 3.208 -10.601 1.00 0.00 H new ATOM 805 N THR A 108 5.370 6.255 -11.998 1.00 0.00 N ATOM 806 CA THR A 108 6.033 7.291 -12.790 1.00 0.00 C ATOM 807 C THR A 108 7.106 8.005 -11.972 1.00 0.00 C ATOM 808 O THR A 108 7.220 9.230 -12.020 1.00 0.00 O ATOM 809 CB THR A 108 4.999 8.310 -13.280 1.00 0.00 C ATOM 810 OG1 THR A 108 5.632 9.240 -14.148 1.00 0.00 O ATOM 811 CG2 THR A 108 4.396 9.055 -12.084 1.00 0.00 C ATOM 0 H THR A 108 5.076 6.553 -11.068 1.00 0.00 H new ATOM 0 HA THR A 108 6.512 6.812 -13.644 1.00 0.00 H new ATOM 0 HB THR A 108 4.204 7.790 -13.815 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.394 9.651 -13.688 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.662 9.778 -12.439 1.00 0.00 H new ATOM 0 HG22 THR A 108 3.911 8.342 -11.418 1.00 0.00 H new ATOM 0 HG23 THR A 108 5.186 9.576 -11.544 1.00 0.00 H new ATOM 819 N SER A 109 7.895 7.233 -11.230 1.00 0.00 N ATOM 820 CA SER A 109 8.965 7.802 -10.409 1.00 0.00 C ATOM 821 C SER A 109 10.296 7.129 -10.726 1.00 0.00 C ATOM 822 O SER A 109 10.355 6.187 -11.517 1.00 0.00 O ATOM 823 CB SER A 109 8.643 7.623 -8.928 1.00 0.00 C ATOM 824 OG SER A 109 9.807 7.898 -8.157 1.00 0.00 O ATOM 0 H SER A 109 7.816 6.217 -11.179 1.00 0.00 H new ATOM 0 HA SER A 109 9.043 8.865 -10.635 1.00 0.00 H new ATOM 0 HB2 SER A 109 7.833 8.292 -8.637 1.00 0.00 H new ATOM 0 HB3 SER A 109 8.300 6.606 -8.739 1.00 0.00 H new ATOM 0 HG SER A 109 9.603 7.786 -7.205 1.00 0.00 H new ATOM 830 N CYS A 110 11.363 7.619 -10.103 1.00 0.00 N ATOM 831 CA CYS A 110 12.693 7.060 -10.323 1.00 0.00 C ATOM 832 C CYS A 110 13.572 7.261 -9.093 1.00 0.00 C ATOM 833 O CYS A 110 14.799 7.271 -9.189 1.00 0.00 O ATOM 834 CB CYS A 110 13.346 7.729 -11.534 1.00 0.00 C ATOM 835 SG CYS A 110 14.923 6.916 -11.895 1.00 0.00 S ATOM 0 H CYS A 110 11.334 8.398 -9.445 1.00 0.00 H new ATOM 0 HA CYS A 110 12.590 5.991 -10.509 1.00 0.00 H new ATOM 0 HB2 CYS A 110 12.685 7.665 -12.399 1.00 0.00 H new ATOM 0 HB3 CYS A 110 13.508 8.788 -11.334 1.00 0.00 H new ATOM 0 HG CYS A 110 15.573 6.719 -10.787 1.00 0.00 H new ATOM 841 N ASP A 111 12.934 7.419 -7.935 1.00 0.00 N ATOM 842 CA ASP A 111 13.665 7.616 -6.687 1.00 0.00 C ATOM 843 C ASP A 111 13.668 6.325 -5.874 1.00 0.00 C ATOM 844 O ASP A 111 12.650 5.645 -5.765 1.00 0.00 O ATOM 845 CB ASP A 111 13.017 8.746 -5.877 1.00 0.00 C ATOM 846 CG ASP A 111 13.719 10.071 -6.164 1.00 0.00 C ATOM 847 OD1 ASP A 111 13.846 10.412 -7.328 1.00 0.00 O ATOM 848 OD2 ASP A 111 14.118 10.725 -5.215 1.00 0.00 O ATOM 0 H ASP A 111 11.919 7.414 -7.836 1.00 0.00 H new ATOM 0 HA ASP A 111 14.695 7.889 -6.917 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.960 8.824 -6.130 1.00 0.00 H new ATOM 0 HB3 ASP A 111 13.074 8.519 -4.812 1.00 0.00 H new ATOM 853 N ILE A 112 14.821 5.985 -5.312 1.00 0.00 N ATOM 854 CA ILE A 112 14.943 4.765 -4.523 1.00 0.00 C ATOM 855 C ILE A 112 14.208 4.900 -3.192 1.00 0.00 C ATOM 856 O ILE A 112 13.242 4.181 -2.933 1.00 0.00 O ATOM 857 CB ILE A 112 16.422 4.463 -4.266 1.00 0.00 C ATOM 858 CG1 ILE A 112 17.179 4.415 -5.605 1.00 0.00 C ATOM 859 CG2 ILE A 112 16.553 3.119 -3.541 1.00 0.00 C ATOM 860 CD1 ILE A 112 17.070 3.019 -6.228 1.00 0.00 C ATOM 0 H ILE A 112 15.679 6.532 -5.386 1.00 0.00 H new ATOM 0 HA ILE A 112 14.492 3.946 -5.084 1.00 0.00 H new ATOM 0 HB ILE A 112 16.851 5.248 -3.643 1.00 0.00 H new ATOM 0 HG12 ILE A 112 16.770 5.159 -6.289 1.00 0.00 H new ATOM 0 HG13 ILE A 112 18.227 4.669 -5.447 1.00 0.00 H new ATOM 0 HG21 ILE A 112 17.606 2.905 -3.359 1.00 0.00 H new ATOM 0 HG22 ILE A 112 16.022 3.165 -2.590 1.00 0.00 H new ATOM 0 HG23 ILE A 112 16.124 2.329 -4.158 1.00 0.00 H new ATOM 0 HD11 ILE A 112 17.610 3.000 -7.175 1.00 0.00 H new ATOM 0 HD12 ILE A 112 17.501 2.283 -5.549 1.00 0.00 H new ATOM 0 HD13 ILE A 112 16.021 2.780 -6.404 1.00 0.00 H new ATOM 872 N GLU A 113 14.668 5.820 -2.353 1.00 0.00 N ATOM 873 CA GLU A 113 14.042 6.033 -1.053 1.00 0.00 C ATOM 874 C GLU A 113 12.530 6.184 -1.201 1.00 0.00 C ATOM 875 O GLU A 113 11.760 5.553 -0.478 1.00 0.00 O ATOM 876 CB GLU A 113 14.626 7.282 -0.383 1.00 0.00 C ATOM 877 CG GLU A 113 14.753 8.412 -1.410 1.00 0.00 C ATOM 878 CD GLU A 113 15.404 9.630 -0.763 1.00 0.00 C ATOM 879 OE1 GLU A 113 16.167 9.444 0.170 1.00 0.00 O ATOM 880 OE2 GLU A 113 15.128 10.731 -1.211 1.00 0.00 O ATOM 0 H GLU A 113 15.465 6.426 -2.546 1.00 0.00 H new ATOM 0 HA GLU A 113 14.246 5.163 -0.428 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.985 7.597 0.440 1.00 0.00 H new ATOM 0 HB3 GLU A 113 15.603 7.054 0.043 1.00 0.00 H new ATOM 0 HG2 GLU A 113 15.349 8.078 -2.259 1.00 0.00 H new ATOM 0 HG3 GLU A 113 13.769 8.677 -1.796 1.00 0.00 H new ATOM 887 N LEU A 114 12.114 7.024 -2.143 1.00 0.00 N ATOM 888 CA LEU A 114 10.693 7.249 -2.380 1.00 0.00 C ATOM 889 C LEU A 114 9.995 5.925 -2.680 1.00 0.00 C ATOM 890 O LEU A 114 9.073 5.520 -1.968 1.00 0.00 O ATOM 891 CB LEU A 114 10.523 8.222 -3.559 1.00 0.00 C ATOM 892 CG LEU A 114 9.047 8.617 -3.759 1.00 0.00 C ATOM 893 CD1 LEU A 114 8.242 7.429 -4.300 1.00 0.00 C ATOM 894 CD2 LEU A 114 8.438 9.092 -2.433 1.00 0.00 C ATOM 0 H LEU A 114 12.736 7.557 -2.751 1.00 0.00 H new ATOM 0 HA LEU A 114 10.240 7.682 -1.488 1.00 0.00 H new ATOM 0 HB2 LEU A 114 11.119 9.117 -3.382 1.00 0.00 H new ATOM 0 HB3 LEU A 114 10.904 7.761 -4.470 1.00 0.00 H new ATOM 0 HG LEU A 114 9.006 9.431 -4.483 1.00 0.00 H new ATOM 0 HD11 LEU A 114 7.202 7.726 -4.435 1.00 0.00 H new ATOM 0 HD12 LEU A 114 8.657 7.114 -5.257 1.00 0.00 H new ATOM 0 HD13 LEU A 114 8.294 6.602 -3.592 1.00 0.00 H new ATOM 0 HD21 LEU A 114 7.395 9.368 -2.590 1.00 0.00 H new ATOM 0 HD22 LEU A 114 8.495 8.289 -1.698 1.00 0.00 H new ATOM 0 HD23 LEU A 114 8.991 9.957 -2.068 1.00 0.00 H new ATOM 906 N LEU A 115 10.442 5.253 -3.735 1.00 0.00 N ATOM 907 CA LEU A 115 9.861 3.972 -4.121 1.00 0.00 C ATOM 908 C LEU A 115 9.678 3.086 -2.890 1.00 0.00 C ATOM 909 O LEU A 115 8.607 2.517 -2.675 1.00 0.00 O ATOM 910 CB LEU A 115 10.778 3.263 -5.134 1.00 0.00 C ATOM 911 CG LEU A 115 10.339 3.544 -6.583 1.00 0.00 C ATOM 912 CD1 LEU A 115 9.177 2.623 -6.961 1.00 0.00 C ATOM 913 CD2 LEU A 115 9.906 5.011 -6.746 1.00 0.00 C ATOM 0 H LEU A 115 11.202 5.572 -4.336 1.00 0.00 H new ATOM 0 HA LEU A 115 8.889 4.152 -4.580 1.00 0.00 H new ATOM 0 HB2 LEU A 115 11.806 3.597 -4.992 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.764 2.189 -4.950 1.00 0.00 H new ATOM 0 HG LEU A 115 11.186 3.354 -7.242 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.871 2.826 -7.987 1.00 0.00 H new ATOM 0 HD12 LEU A 115 9.494 1.584 -6.876 1.00 0.00 H new ATOM 0 HD13 LEU A 115 8.337 2.802 -6.289 1.00 0.00 H new ATOM 0 HD21 LEU A 115 9.600 5.188 -7.777 1.00 0.00 H new ATOM 0 HD22 LEU A 115 9.070 5.220 -6.078 1.00 0.00 H new ATOM 0 HD23 LEU A 115 10.741 5.666 -6.498 1.00 0.00 H new ATOM 925 N ALA A 116 10.732 2.976 -2.089 1.00 0.00 N ATOM 926 CA ALA A 116 10.683 2.159 -0.883 1.00 0.00 C ATOM 927 C ALA A 116 9.554 2.623 0.031 1.00 0.00 C ATOM 928 O ALA A 116 8.746 1.819 0.497 1.00 0.00 O ATOM 929 CB ALA A 116 12.014 2.252 -0.138 1.00 0.00 C ATOM 0 H ALA A 116 11.626 3.440 -2.252 1.00 0.00 H new ATOM 0 HA ALA A 116 10.499 1.124 -1.173 1.00 0.00 H new ATOM 0 HB1 ALA A 116 11.971 1.639 0.762 1.00 0.00 H new ATOM 0 HB2 ALA A 116 12.817 1.894 -0.782 1.00 0.00 H new ATOM 0 HB3 ALA A 116 12.205 3.289 0.138 1.00 0.00 H new ATOM 935 N ALA A 117 9.509 3.925 0.282 1.00 0.00 N ATOM 936 CA ALA A 117 8.478 4.493 1.143 1.00 0.00 C ATOM 937 C ALA A 117 7.102 3.965 0.753 1.00 0.00 C ATOM 938 O ALA A 117 6.408 3.351 1.562 1.00 0.00 O ATOM 939 CB ALA A 117 8.492 6.017 1.028 1.00 0.00 C ATOM 0 H ALA A 117 10.170 4.605 -0.095 1.00 0.00 H new ATOM 0 HA ALA A 117 8.686 4.201 2.172 1.00 0.00 H new ATOM 0 HB1 ALA A 117 7.720 6.438 1.673 1.00 0.00 H new ATOM 0 HB2 ALA A 117 9.467 6.396 1.334 1.00 0.00 H new ATOM 0 HB3 ALA A 117 8.299 6.306 -0.005 1.00 0.00 H new ATOM 945 N CYS A 118 6.712 4.210 -0.493 1.00 0.00 N ATOM 946 CA CYS A 118 5.413 3.754 -0.979 1.00 0.00 C ATOM 947 C CYS A 118 5.215 2.269 -0.693 1.00 0.00 C ATOM 948 O CYS A 118 4.254 1.873 -0.032 1.00 0.00 O ATOM 949 CB CYS A 118 5.304 4.001 -2.484 1.00 0.00 C ATOM 950 SG CYS A 118 5.504 5.766 -2.824 1.00 0.00 S ATOM 0 H CYS A 118 7.270 4.717 -1.180 1.00 0.00 H new ATOM 0 HA CYS A 118 4.638 4.316 -0.457 1.00 0.00 H new ATOM 0 HB2 CYS A 118 6.067 3.430 -3.013 1.00 0.00 H new ATOM 0 HB3 CYS A 118 4.337 3.657 -2.850 1.00 0.00 H new ATOM 0 HG CYS A 118 5.008 6.042 -3.994 1.00 0.00 H new ATOM 956 N ARG A 119 6.128 1.448 -1.200 1.00 0.00 N ATOM 957 CA ARG A 119 6.042 0.006 -0.997 1.00 0.00 C ATOM 958 C ARG A 119 5.795 -0.317 0.475 1.00 0.00 C ATOM 959 O ARG A 119 4.967 -1.170 0.800 1.00 0.00 O ATOM 960 CB ARG A 119 7.338 -0.664 -1.463 1.00 0.00 C ATOM 961 CG ARG A 119 7.282 -0.896 -2.978 1.00 0.00 C ATOM 962 CD ARG A 119 8.585 -1.553 -3.457 1.00 0.00 C ATOM 963 NE ARG A 119 9.298 -0.656 -4.359 1.00 0.00 N ATOM 964 CZ ARG A 119 10.341 -1.078 -5.065 1.00 0.00 C ATOM 965 NH1 ARG A 119 10.745 -2.313 -4.957 1.00 0.00 N ATOM 966 NH2 ARG A 119 10.961 -0.257 -5.868 1.00 0.00 N ATOM 0 H ARG A 119 6.931 1.753 -1.751 1.00 0.00 H new ATOM 0 HA ARG A 119 5.206 -0.376 -1.583 1.00 0.00 H new ATOM 0 HB2 ARG A 119 8.194 -0.037 -1.212 1.00 0.00 H new ATOM 0 HB3 ARG A 119 7.475 -1.613 -0.945 1.00 0.00 H new ATOM 0 HG2 ARG A 119 6.432 -1.532 -3.226 1.00 0.00 H new ATOM 0 HG3 ARG A 119 7.132 0.052 -3.494 1.00 0.00 H new ATOM 0 HD2 ARG A 119 9.215 -1.796 -2.601 1.00 0.00 H new ATOM 0 HD3 ARG A 119 8.363 -2.491 -3.966 1.00 0.00 H new ATOM 0 HE ARG A 119 8.990 0.312 -4.449 1.00 0.00 H new ATOM 0 HH11 ARG A 119 10.260 -2.955 -4.330 1.00 0.00 H new ATOM 0 HH12 ARG A 119 11.546 -2.637 -5.499 1.00 0.00 H new ATOM 0 HH21 ARG A 119 10.645 0.709 -5.954 1.00 0.00 H new ATOM 0 HH22 ARG A 119 11.762 -0.581 -6.410 1.00 0.00 H new ATOM 980 N GLU A 120 6.513 0.366 1.361 1.00 0.00 N ATOM 981 CA GLU A 120 6.353 0.134 2.793 1.00 0.00 C ATOM 982 C GLU A 120 4.925 0.446 3.228 1.00 0.00 C ATOM 983 O GLU A 120 4.304 -0.336 3.947 1.00 0.00 O ATOM 984 CB GLU A 120 7.335 1.001 3.582 1.00 0.00 C ATOM 985 CG GLU A 120 8.760 0.486 3.367 1.00 0.00 C ATOM 986 CD GLU A 120 8.955 -0.832 4.109 1.00 0.00 C ATOM 987 OE1 GLU A 120 8.171 -1.109 5.000 1.00 0.00 O ATOM 988 OE2 GLU A 120 9.887 -1.544 3.774 1.00 0.00 O ATOM 0 H GLU A 120 7.203 1.076 1.117 1.00 0.00 H new ATOM 0 HA GLU A 120 6.561 -0.916 2.996 1.00 0.00 H new ATOM 0 HB2 GLU A 120 7.260 2.039 3.259 1.00 0.00 H new ATOM 0 HB3 GLU A 120 7.085 0.978 4.643 1.00 0.00 H new ATOM 0 HG2 GLU A 120 8.948 0.345 2.303 1.00 0.00 H new ATOM 0 HG3 GLU A 120 9.480 1.223 3.723 1.00 0.00 H new ATOM 995 N GLU A 121 4.407 1.588 2.785 1.00 0.00 N ATOM 996 CA GLU A 121 3.048 1.977 3.139 1.00 0.00 C ATOM 997 C GLU A 121 2.085 0.835 2.829 1.00 0.00 C ATOM 998 O GLU A 121 1.281 0.443 3.675 1.00 0.00 O ATOM 999 CB GLU A 121 2.639 3.235 2.358 1.00 0.00 C ATOM 1000 CG GLU A 121 2.879 4.483 3.214 1.00 0.00 C ATOM 1001 CD GLU A 121 4.371 4.651 3.483 1.00 0.00 C ATOM 1002 OE1 GLU A 121 4.940 3.779 4.119 1.00 0.00 O ATOM 1003 OE2 GLU A 121 4.922 5.648 3.048 1.00 0.00 O ATOM 0 H GLU A 121 4.901 2.252 2.188 1.00 0.00 H new ATOM 0 HA GLU A 121 3.009 2.197 4.206 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.213 3.302 1.434 1.00 0.00 H new ATOM 0 HB3 GLU A 121 1.588 3.173 2.077 1.00 0.00 H new ATOM 0 HG2 GLU A 121 2.491 5.365 2.703 1.00 0.00 H new ATOM 0 HG3 GLU A 121 2.338 4.397 4.157 1.00 0.00 H new ATOM 1010 N PHE A 122 2.176 0.301 1.615 1.00 0.00 N ATOM 1011 CA PHE A 122 1.309 -0.801 1.220 1.00 0.00 C ATOM 1012 C PHE A 122 1.442 -1.953 2.210 1.00 0.00 C ATOM 1013 O PHE A 122 0.467 -2.357 2.840 1.00 0.00 O ATOM 1014 CB PHE A 122 1.676 -1.301 -0.183 1.00 0.00 C ATOM 1015 CG PHE A 122 1.503 -0.206 -1.219 1.00 0.00 C ATOM 1016 CD1 PHE A 122 0.494 0.764 -1.089 1.00 0.00 C ATOM 1017 CD2 PHE A 122 2.357 -0.176 -2.328 1.00 0.00 C ATOM 1018 CE1 PHE A 122 0.349 1.756 -2.066 1.00 0.00 C ATOM 1019 CE2 PHE A 122 2.206 0.816 -3.303 1.00 0.00 C ATOM 1020 CZ PHE A 122 1.205 1.782 -3.173 1.00 0.00 C ATOM 0 H PHE A 122 2.832 0.609 0.897 1.00 0.00 H new ATOM 0 HA PHE A 122 0.281 -0.439 1.214 1.00 0.00 H new ATOM 0 HB2 PHE A 122 2.708 -1.651 -0.189 1.00 0.00 H new ATOM 0 HB3 PHE A 122 1.049 -2.154 -0.443 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -0.169 0.744 -0.236 1.00 0.00 H new ATOM 0 HD2 PHE A 122 3.133 -0.920 -2.431 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -0.425 2.503 -1.965 1.00 0.00 H new ATOM 0 HE2 PHE A 122 2.865 0.835 -4.158 1.00 0.00 H new ATOM 0 HZ PHE A 122 1.092 2.548 -3.926 1.00 0.00 H new ATOM 1030 N HIS A 123 2.658 -2.477 2.343 1.00 0.00 N ATOM 1031 CA HIS A 123 2.912 -3.584 3.259 1.00 0.00 C ATOM 1032 C HIS A 123 2.132 -3.401 4.555 1.00 0.00 C ATOM 1033 O HIS A 123 1.491 -4.334 5.041 1.00 0.00 O ATOM 1034 CB HIS A 123 4.408 -3.668 3.570 1.00 0.00 C ATOM 1035 CG HIS A 123 4.653 -4.762 4.574 1.00 0.00 C ATOM 1036 ND1 HIS A 123 4.263 -6.072 4.350 1.00 0.00 N ATOM 1037 CD2 HIS A 123 5.248 -4.753 5.811 1.00 0.00 C ATOM 1038 CE1 HIS A 123 4.623 -6.793 5.428 1.00 0.00 C ATOM 1039 NE2 HIS A 123 5.228 -6.037 6.347 1.00 0.00 N ATOM 0 H HIS A 123 3.479 -2.154 1.831 1.00 0.00 H new ATOM 0 HA HIS A 123 2.585 -4.508 2.781 1.00 0.00 H new ATOM 0 HB2 HIS A 123 4.969 -3.866 2.657 1.00 0.00 H new ATOM 0 HB3 HIS A 123 4.763 -2.715 3.962 1.00 0.00 H new ATOM 0 HD2 HIS A 123 5.667 -3.883 6.294 1.00 0.00 H new ATOM 0 HE1 HIS A 123 4.444 -7.853 5.536 1.00 0.00 H new ATOM 0 HE2 HIS A 123 5.597 -6.337 7.250 1.00 0.00 H new ATOM 1047 N ARG A 124 2.190 -2.197 5.111 1.00 0.00 N ATOM 1048 CA ARG A 124 1.484 -1.909 6.352 1.00 0.00 C ATOM 1049 C ARG A 124 -0.021 -2.087 6.164 1.00 0.00 C ATOM 1050 O ARG A 124 -0.690 -2.702 6.995 1.00 0.00 O ATOM 1051 CB ARG A 124 1.779 -0.475 6.805 1.00 0.00 C ATOM 1052 CG ARG A 124 3.126 -0.433 7.532 1.00 0.00 C ATOM 1053 CD ARG A 124 3.406 0.994 8.006 1.00 0.00 C ATOM 1054 NE ARG A 124 2.255 1.521 8.730 1.00 0.00 N ATOM 1055 CZ ARG A 124 2.273 2.742 9.254 1.00 0.00 C ATOM 1056 NH1 ARG A 124 3.334 3.492 9.126 1.00 0.00 N ATOM 1057 NH2 ARG A 124 1.229 3.192 9.896 1.00 0.00 N ATOM 0 H ARG A 124 2.714 -1.411 4.726 1.00 0.00 H new ATOM 0 HA ARG A 124 1.830 -2.607 7.115 1.00 0.00 H new ATOM 0 HB2 ARG A 124 1.798 0.193 5.944 1.00 0.00 H new ATOM 0 HB3 ARG A 124 0.987 -0.121 7.465 1.00 0.00 H new ATOM 0 HG2 ARG A 124 3.113 -1.114 8.383 1.00 0.00 H new ATOM 0 HG3 ARG A 124 3.921 -0.769 6.866 1.00 0.00 H new ATOM 0 HD2 ARG A 124 4.285 1.005 8.650 1.00 0.00 H new ATOM 0 HD3 ARG A 124 3.629 1.632 7.151 1.00 0.00 H new ATOM 0 HE ARG A 124 1.422 0.942 8.836 1.00 0.00 H new ATOM 0 HH11 ARG A 124 4.149 3.141 8.624 1.00 0.00 H new ATOM 0 HH12 ARG A 124 3.348 4.429 9.528 1.00 0.00 H new ATOM 0 HH21 ARG A 124 0.400 2.606 9.995 1.00 0.00 H new ATOM 0 HH22 ARG A 124 1.243 4.129 10.298 1.00 0.00 H new ATOM 1071 N ARG A 125 -0.545 -1.543 5.072 1.00 0.00 N ATOM 1072 CA ARG A 125 -1.973 -1.643 4.789 1.00 0.00 C ATOM 1073 C ARG A 125 -2.380 -3.101 4.572 1.00 0.00 C ATOM 1074 O ARG A 125 -3.467 -3.514 4.976 1.00 0.00 O ATOM 1075 CB ARG A 125 -2.314 -0.814 3.543 1.00 0.00 C ATOM 1076 CG ARG A 125 -2.732 0.606 3.960 1.00 0.00 C ATOM 1077 CD ARG A 125 -2.464 1.594 2.817 1.00 0.00 C ATOM 1078 NE ARG A 125 -1.214 2.306 3.052 1.00 0.00 N ATOM 1079 CZ ARG A 125 -1.137 3.273 3.962 1.00 0.00 C ATOM 1080 NH1 ARG A 125 -2.193 3.602 4.656 1.00 0.00 N ATOM 1081 NH2 ARG A 125 -0.007 3.894 4.160 1.00 0.00 N ATOM 0 H ARG A 125 -0.008 -1.031 4.372 1.00 0.00 H new ATOM 0 HA ARG A 125 -2.525 -1.255 5.645 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -1.451 -0.768 2.878 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -3.120 -1.292 2.987 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -3.790 0.619 4.222 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -2.180 0.909 4.850 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -2.414 1.060 1.868 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -3.287 2.304 2.740 1.00 0.00 H new ATOM 0 HE ARG A 125 -0.386 2.059 2.510 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -3.077 3.117 4.500 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -2.134 4.344 5.354 1.00 0.00 H new ATOM 0 HH21 ARG A 125 0.818 3.638 3.617 1.00 0.00 H new ATOM 0 HH22 ARG A 125 0.052 4.636 4.858 1.00 0.00 H new ATOM 1095 N LEU A 126 -1.506 -3.874 3.937 1.00 0.00 N ATOM 1096 CA LEU A 126 -1.796 -5.282 3.682 1.00 0.00 C ATOM 1097 C LEU A 126 -1.853 -6.054 4.997 1.00 0.00 C ATOM 1098 O LEU A 126 -2.709 -6.921 5.181 1.00 0.00 O ATOM 1099 CB LEU A 126 -0.719 -5.887 2.768 1.00 0.00 C ATOM 1100 CG LEU A 126 -1.106 -5.712 1.290 1.00 0.00 C ATOM 1101 CD1 LEU A 126 -2.385 -6.504 0.977 1.00 0.00 C ATOM 1102 CD2 LEU A 126 -1.330 -4.226 0.986 1.00 0.00 C ATOM 0 H LEU A 126 -0.600 -3.555 3.592 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.764 -5.355 3.186 1.00 0.00 H new ATOM 0 HB2 LEU A 126 0.240 -5.405 2.958 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.594 -6.946 2.994 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.296 -6.091 0.667 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -2.648 -6.371 -0.073 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.216 -7.562 1.178 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.200 -6.141 1.603 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.604 -4.106 -0.062 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.132 -3.842 1.617 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -0.413 -3.671 1.187 1.00 0.00 H new ATOM 1114 N LYS A 127 -0.945 -5.730 5.910 1.00 0.00 N ATOM 1115 CA LYS A 127 -0.912 -6.398 7.205 1.00 0.00 C ATOM 1116 C LYS A 127 -2.196 -6.111 7.979 1.00 0.00 C ATOM 1117 O LYS A 127 -2.836 -7.024 8.501 1.00 0.00 O ATOM 1118 CB LYS A 127 0.298 -5.910 8.014 1.00 0.00 C ATOM 1119 CG LYS A 127 1.547 -6.711 7.619 1.00 0.00 C ATOM 1120 CD LYS A 127 1.615 -8.009 8.434 1.00 0.00 C ATOM 1121 CE LYS A 127 2.301 -7.742 9.778 1.00 0.00 C ATOM 1122 NZ LYS A 127 3.779 -7.743 9.590 1.00 0.00 N ATOM 0 H LYS A 127 -0.228 -5.016 5.780 1.00 0.00 H new ATOM 0 HA LYS A 127 -0.828 -7.473 7.043 1.00 0.00 H new ATOM 0 HB2 LYS A 127 0.464 -4.848 7.832 1.00 0.00 H new ATOM 0 HB3 LYS A 127 0.104 -6.025 9.080 1.00 0.00 H new ATOM 0 HG2 LYS A 127 1.520 -6.941 6.554 1.00 0.00 H new ATOM 0 HG3 LYS A 127 2.442 -6.114 7.794 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.611 -8.399 8.599 1.00 0.00 H new ATOM 0 HD3 LYS A 127 2.165 -8.769 7.879 1.00 0.00 H new ATOM 0 HE2 LYS A 127 1.976 -6.783 10.180 1.00 0.00 H new ATOM 0 HE3 LYS A 127 2.015 -8.505 10.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 4.227 -7.200 10.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 4.131 -8.722 9.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 4.013 -7.308 8.675 1.00 0.00 H new ATOM 1136 N VAL A 128 -2.566 -4.836 8.042 1.00 0.00 N ATOM 1137 CA VAL A 128 -3.776 -4.435 8.750 1.00 0.00 C ATOM 1138 C VAL A 128 -5.012 -4.971 8.038 1.00 0.00 C ATOM 1139 O VAL A 128 -5.971 -5.406 8.677 1.00 0.00 O ATOM 1140 CB VAL A 128 -3.854 -2.908 8.825 1.00 0.00 C ATOM 1141 CG1 VAL A 128 -5.081 -2.499 9.642 1.00 0.00 C ATOM 1142 CG2 VAL A 128 -2.591 -2.363 9.495 1.00 0.00 C ATOM 0 H VAL A 128 -2.049 -4.068 7.614 1.00 0.00 H new ATOM 0 HA VAL A 128 -3.740 -4.848 9.758 1.00 0.00 H new ATOM 0 HB VAL A 128 -3.935 -2.500 7.818 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -5.137 -1.412 9.695 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -5.981 -2.885 9.164 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -5.000 -2.908 10.649 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -2.647 -1.276 9.548 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -2.508 -2.772 10.502 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -1.716 -2.653 8.913 1.00 0.00 H new ATOM 1152 N TYR A 129 -4.985 -4.938 6.710 1.00 0.00 N ATOM 1153 CA TYR A 129 -6.107 -5.423 5.917 1.00 0.00 C ATOM 1154 C TYR A 129 -6.262 -6.933 6.077 1.00 0.00 C ATOM 1155 O TYR A 129 -7.377 -7.447 6.152 1.00 0.00 O ATOM 1156 CB TYR A 129 -5.880 -5.072 4.441 1.00 0.00 C ATOM 1157 CG TYR A 129 -6.818 -5.875 3.566 1.00 0.00 C ATOM 1158 CD1 TYR A 129 -8.202 -5.750 3.723 1.00 0.00 C ATOM 1159 CD2 TYR A 129 -6.299 -6.741 2.595 1.00 0.00 C ATOM 1160 CE1 TYR A 129 -9.069 -6.490 2.910 1.00 0.00 C ATOM 1161 CE2 TYR A 129 -7.165 -7.482 1.783 1.00 0.00 C ATOM 1162 CZ TYR A 129 -8.550 -7.358 1.940 1.00 0.00 C ATOM 1163 OH TYR A 129 -9.405 -8.087 1.139 1.00 0.00 O ATOM 0 H TYR A 129 -4.202 -4.582 6.163 1.00 0.00 H new ATOM 0 HA TYR A 129 -7.021 -4.944 6.268 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -6.045 -4.006 4.283 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -4.846 -5.279 4.165 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -8.602 -5.082 4.472 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -5.230 -6.837 2.473 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -10.138 -6.392 3.030 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -6.764 -8.150 1.035 1.00 0.00 H new ATOM 0 HH TYR A 129 -8.883 -8.638 0.519 1.00 0.00 H new ATOM 1173 N HIS A 130 -5.136 -7.637 6.132 1.00 0.00 N ATOM 1174 CA HIS A 130 -5.161 -9.088 6.289 1.00 0.00 C ATOM 1175 C HIS A 130 -5.596 -9.465 7.701 1.00 0.00 C ATOM 1176 O HIS A 130 -6.230 -10.500 7.911 1.00 0.00 O ATOM 1177 CB HIS A 130 -3.771 -9.666 6.007 1.00 0.00 C ATOM 1178 CG HIS A 130 -3.534 -9.711 4.521 1.00 0.00 C ATOM 1179 ND1 HIS A 130 -4.484 -10.195 3.635 1.00 0.00 N ATOM 1180 CD2 HIS A 130 -2.459 -9.338 3.752 1.00 0.00 C ATOM 1181 CE1 HIS A 130 -3.967 -10.101 2.396 1.00 0.00 C ATOM 1182 NE2 HIS A 130 -2.735 -9.586 2.411 1.00 0.00 N ATOM 0 H HIS A 130 -4.202 -7.231 6.071 1.00 0.00 H new ATOM 0 HA HIS A 130 -5.877 -9.502 5.579 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -3.008 -9.055 6.489 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -3.690 -10.668 6.429 1.00 0.00 H new ATOM 0 HD1 HIS A 130 -5.406 -10.556 3.878 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -1.540 -8.916 4.130 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -4.485 -10.405 1.499 1.00 0.00 H new ATOM 1190 N ALA A 131 -5.253 -8.618 8.665 1.00 0.00 N ATOM 1191 CA ALA A 131 -5.614 -8.872 10.054 1.00 0.00 C ATOM 1192 C ALA A 131 -7.087 -8.561 10.285 1.00 0.00 C ATOM 1193 O ALA A 131 -7.851 -9.414 10.733 1.00 0.00 O ATOM 1194 CB ALA A 131 -4.755 -8.012 10.984 1.00 0.00 C ATOM 0 H ALA A 131 -4.730 -7.756 8.512 1.00 0.00 H new ATOM 0 HA ALA A 131 -5.437 -9.925 10.271 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.032 -8.208 12.020 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -3.703 -8.256 10.837 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.918 -6.958 10.759 1.00 0.00 H new ATOM 1200 N TRP A 132 -7.479 -7.331 9.969 1.00 0.00 N ATOM 1201 CA TRP A 132 -8.863 -6.917 10.139 1.00 0.00 C ATOM 1202 C TRP A 132 -9.791 -7.843 9.352 1.00 0.00 C ATOM 1203 O TRP A 132 -10.893 -8.157 9.801 1.00 0.00 O ATOM 1204 CB TRP A 132 -9.032 -5.468 9.665 1.00 0.00 C ATOM 1205 CG TRP A 132 -10.471 -5.194 9.363 1.00 0.00 C ATOM 1206 CD1 TRP A 132 -11.356 -4.636 10.221 1.00 0.00 C ATOM 1207 CD2 TRP A 132 -11.201 -5.454 8.134 1.00 0.00 C ATOM 1208 NE1 TRP A 132 -12.585 -4.540 9.593 1.00 0.00 N ATOM 1209 CE2 TRP A 132 -12.540 -5.031 8.304 1.00 0.00 C ATOM 1210 CE3 TRP A 132 -10.833 -6.013 6.897 1.00 0.00 C ATOM 1211 CZ2 TRP A 132 -13.482 -5.159 7.282 1.00 0.00 C ATOM 1212 CZ3 TRP A 132 -11.778 -6.143 5.866 1.00 0.00 C ATOM 1213 CH2 TRP A 132 -13.101 -5.715 6.059 1.00 0.00 C ATOM 0 H TRP A 132 -6.861 -6.610 9.597 1.00 0.00 H new ATOM 0 HA TRP A 132 -9.126 -6.978 11.195 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -8.676 -4.781 10.433 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -8.426 -5.294 8.776 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -11.139 -4.318 11.230 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -13.422 -4.154 10.029 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -9.817 -6.344 6.739 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -14.499 -4.830 7.436 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -11.485 -6.574 4.920 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -13.823 -5.816 5.262 1.00 0.00 H new ATOM 1224 N LYS A 133 -9.334 -8.280 8.182 1.00 0.00 N ATOM 1225 CA LYS A 133 -10.132 -9.173 7.349 1.00 0.00 C ATOM 1226 C LYS A 133 -10.192 -10.568 7.964 1.00 0.00 C ATOM 1227 O LYS A 133 -11.236 -11.221 7.949 1.00 0.00 O ATOM 1228 CB LYS A 133 -9.530 -9.263 5.946 1.00 0.00 C ATOM 1229 CG LYS A 133 -10.427 -10.131 5.058 1.00 0.00 C ATOM 1230 CD LYS A 133 -10.198 -9.774 3.589 1.00 0.00 C ATOM 1231 CE LYS A 133 -8.788 -10.195 3.169 1.00 0.00 C ATOM 1232 NZ LYS A 133 -7.791 -9.262 3.764 1.00 0.00 N ATOM 0 H LYS A 133 -8.424 -8.033 7.792 1.00 0.00 H new ATOM 0 HA LYS A 133 -11.142 -8.768 7.285 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -9.431 -8.266 5.517 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -8.528 -9.689 5.996 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -10.208 -11.186 5.224 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -11.474 -9.977 5.321 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -10.938 -10.273 2.964 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -10.327 -8.702 3.441 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -8.589 -11.215 3.498 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -8.704 -10.189 2.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -6.955 -9.207 3.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -8.214 -8.317 3.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -7.507 -9.610 4.702 1.00 0.00 H new ATOM 1246 N SER A 134 -9.062 -11.020 8.504 1.00 0.00 N ATOM 1247 CA SER A 134 -8.998 -12.340 9.120 1.00 0.00 C ATOM 1248 C SER A 134 -9.919 -12.409 10.333 1.00 0.00 C ATOM 1249 O SER A 134 -10.456 -13.468 10.659 1.00 0.00 O ATOM 1250 CB SER A 134 -7.562 -12.644 9.552 1.00 0.00 C ATOM 1251 OG SER A 134 -7.538 -13.868 10.274 1.00 0.00 O ATOM 0 H SER A 134 -8.187 -10.496 8.527 1.00 0.00 H new ATOM 0 HA SER A 134 -9.323 -13.079 8.388 1.00 0.00 H new ATOM 0 HB2 SER A 134 -6.914 -12.711 8.678 1.00 0.00 H new ATOM 0 HB3 SER A 134 -7.178 -11.835 10.173 1.00 0.00 H new ATOM 0 HG SER A 134 -6.619 -14.066 10.551 1.00 0.00 H new ATOM 1257 N LYS A 135 -10.097 -11.273 10.998 1.00 0.00 N ATOM 1258 CA LYS A 135 -10.955 -11.211 12.176 1.00 0.00 C ATOM 1259 C LYS A 135 -12.396 -10.904 11.775 1.00 0.00 C ATOM 1260 O LYS A 135 -13.340 -11.414 12.378 1.00 0.00 O ATOM 1261 CB LYS A 135 -10.442 -10.128 13.130 1.00 0.00 C ATOM 1262 CG LYS A 135 -9.303 -10.693 13.986 1.00 0.00 C ATOM 1263 CD LYS A 135 -8.649 -9.564 14.794 1.00 0.00 C ATOM 1264 CE LYS A 135 -7.524 -8.924 13.976 1.00 0.00 C ATOM 1265 NZ LYS A 135 -6.377 -9.872 13.885 1.00 0.00 N ATOM 0 H LYS A 135 -9.661 -10.387 10.743 1.00 0.00 H new ATOM 0 HA LYS A 135 -10.932 -12.179 12.676 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -10.091 -9.266 12.563 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -11.253 -9.779 13.770 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -9.688 -11.459 14.660 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -8.561 -11.173 13.348 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -9.394 -8.812 15.055 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -8.252 -9.957 15.730 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -7.883 -8.673 12.978 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -7.204 -7.993 14.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -5.487 -9.336 13.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -6.362 -10.480 14.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -6.481 -10.462 13.035 1.00 0.00 H new ATOM 1279 N ASN A 136 -12.556 -10.068 10.753 1.00 0.00 N ATOM 1280 CA ASN A 136 -13.886 -9.698 10.278 1.00 0.00 C ATOM 1281 C ASN A 136 -14.280 -10.542 9.070 1.00 0.00 C ATOM 1282 O ASN A 136 -15.008 -10.083 8.191 1.00 0.00 O ATOM 1283 CB ASN A 136 -13.910 -8.218 9.895 1.00 0.00 C ATOM 1284 CG ASN A 136 -13.647 -7.355 11.122 1.00 0.00 C ATOM 1285 OD1 ASN A 136 -14.557 -6.698 11.628 1.00 0.00 O ATOM 1286 ND2 ASN A 136 -12.448 -7.317 11.637 1.00 0.00 N ATOM 0 H ASN A 136 -11.787 -9.636 10.241 1.00 0.00 H new ATOM 0 HA ASN A 136 -14.600 -9.879 11.082 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -13.156 -8.019 9.133 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -14.877 -7.962 9.461 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -12.264 -6.743 12.460 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -11.695 -7.862 11.217 1.00 0.00 H new ATOM 1293 N LYS A 137 -13.797 -11.780 9.036 1.00 0.00 N ATOM 1294 CA LYS A 137 -14.105 -12.679 7.930 1.00 0.00 C ATOM 1295 C LYS A 137 -15.584 -13.056 7.945 1.00 0.00 C ATOM 1296 O LYS A 137 -16.146 -13.444 6.922 1.00 0.00 O ATOM 1297 CB LYS A 137 -13.252 -13.945 8.030 1.00 0.00 C ATOM 1298 CG LYS A 137 -13.359 -14.527 9.443 1.00 0.00 C ATOM 1299 CD LYS A 137 -12.931 -15.997 9.426 1.00 0.00 C ATOM 1300 CE LYS A 137 -11.511 -16.111 8.869 1.00 0.00 C ATOM 1301 NZ LYS A 137 -10.976 -17.473 9.145 1.00 0.00 N ATOM 0 H LYS A 137 -13.195 -12.181 9.756 1.00 0.00 H new ATOM 0 HA LYS A 137 -13.881 -12.165 6.995 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -13.586 -14.679 7.297 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -12.212 -13.714 7.799 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -12.728 -13.962 10.129 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -14.383 -14.440 9.807 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -12.971 -16.410 10.434 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -13.620 -16.580 8.815 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -11.514 -15.921 7.796 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -10.869 -15.357 9.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -10.011 -17.550 8.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -10.959 -17.638 10.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -11.584 -18.184 8.690 1.00 0.00 H new ATOM 1315 N LYS A 138 -16.207 -12.941 9.113 1.00 0.00 N ATOM 1316 CA LYS A 138 -17.620 -13.273 9.250 1.00 0.00 C ATOM 1317 C LYS A 138 -18.447 -12.552 8.190 1.00 0.00 C ATOM 1318 O LYS A 138 -18.122 -11.434 7.793 1.00 0.00 O ATOM 1319 CB LYS A 138 -18.118 -12.880 10.643 1.00 0.00 C ATOM 1320 CG LYS A 138 -19.537 -13.417 10.848 1.00 0.00 C ATOM 1321 CD LYS A 138 -20.010 -13.111 12.276 1.00 0.00 C ATOM 1322 CE LYS A 138 -20.630 -11.712 12.328 1.00 0.00 C ATOM 1323 NZ LYS A 138 -21.925 -11.715 11.591 1.00 0.00 N ATOM 0 H LYS A 138 -15.760 -12.623 9.973 1.00 0.00 H new ATOM 0 HA LYS A 138 -17.734 -14.348 9.114 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -17.452 -13.282 11.406 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -18.109 -11.795 10.752 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -20.215 -12.962 10.126 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -19.557 -14.492 10.671 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -20.741 -13.855 12.594 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -19.170 -13.173 12.968 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -20.789 -11.411 13.364 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -19.949 -10.984 11.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -22.486 -10.885 11.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -21.742 -11.680 10.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -22.452 -12.582 11.819 1.00 0.00 H new ATOM 1337 N ARG A 139 -19.516 -13.201 7.738 1.00 0.00 N ATOM 1338 CA ARG A 139 -20.386 -12.613 6.723 1.00 0.00 C ATOM 1339 C ARG A 139 -21.572 -11.911 7.375 1.00 0.00 C ATOM 1340 O ARG A 139 -22.163 -11.064 6.728 1.00 0.00 O ATOM 1341 CB ARG A 139 -20.892 -13.702 5.777 1.00 0.00 C ATOM 1342 CG ARG A 139 -21.819 -14.652 6.538 1.00 0.00 C ATOM 1343 CD ARG A 139 -22.081 -15.898 5.693 1.00 0.00 C ATOM 1344 NE ARG A 139 -22.378 -15.521 4.315 1.00 0.00 N ATOM 1345 CZ ARG A 139 -23.004 -16.358 3.493 1.00 0.00 C ATOM 1346 NH1 ARG A 139 -23.361 -17.541 3.913 1.00 0.00 N ATOM 1347 NH2 ARG A 139 -23.260 -15.998 2.265 1.00 0.00 N ATOM 1348 OXT ARG A 139 -21.872 -12.231 8.514 1.00 0.00 O ATOM 0 H ARG A 139 -19.800 -14.128 8.055 1.00 0.00 H new ATOM 0 HA ARG A 139 -19.811 -11.879 6.158 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -21.424 -13.252 4.939 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -20.051 -14.255 5.360 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -21.367 -14.934 7.489 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -22.760 -14.152 6.768 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -21.210 -16.553 5.719 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -22.915 -16.461 6.111 1.00 0.00 H new ATOM 0 HE ARG A 139 -22.101 -14.600 3.976 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -23.160 -17.824 4.872 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -23.841 -18.183 3.282 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -22.980 -15.074 1.935 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -23.740 -16.640 1.635 1.00 0.00 H new TER 1362 ARG A 139