USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1110 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 31 TYR OH : rot 42:sc= 1.19 USER MOD Set 1.2: A 50 CYS SG : rot 89:sc= 0.232 USER MOD Set 1.3: A 55 SER OG : rot 102:sc= 1.8 USER MOD Set 2.1: A 39 HIS : no HE2:sc= -0.924 K(o=0.27,f=-7.9!) USER MOD Set 2.2: A 43 GLN : amide:sc= 1.2 K(o=0.27,f=-0.41) USER MOD Single : A 10 GLN : amide:sc= 1.06 K(o=1.1,f=-3.6!) USER MOD Single : A 12 SER OG : rot 162:sc= 1.23 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN :FLIP amide:sc= 0 F(o=-0.55,f=0) USER MOD Single : A 22 LYS NZ :NH3+ -167:sc= 1.08 (180deg=0.889) USER MOD Single : A 24 SER OG : rot 180:sc= 0.197 USER MOD Single : A 27 CYS SG : rot 74:sc= 0.636 USER MOD Single : A 30 LYS NZ :NH3+ -151:sc= 1.19 (180deg=0.673) USER MOD Single : A 32 THR OG1 : rot 32:sc= 0.352 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 GLN : amide:sc= -1.71 K(o=-1.7,f=-2.2) USER MOD Single : A 48 ASN : amide:sc= 1.59 K(o=1.6,f=-4.2!) USER MOD Single : A 62 THR OG1 : rot 132:sc= 0 USER MOD Single : A 64 THR OG1 : rot 20:sc= 0.429 USER MOD Single : A 65 ASN : amide:sc= -0.0142 X(o=-0.014,f=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0.107 K(o=0.11,f=-2.3!) USER MOD Single : A 74 SER OG : rot 41:sc= 0.425 USER MOD Single : A 76 GLN : amide:sc= -1.37 K(o=-1.4,f=-2.9!) USER MOD Single : A 79 GLN : amide:sc= 0.294 X(o=0.29,f=0) USER MOD Single : A 81 GLN : amide:sc= -0.325 X(o=-0.32,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 104:sc= 0.797 USER MOD Single : A 87 TYR OH : rot 165:sc= -0.119 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ -176:sc= -0.377 (180deg=-0.391) USER MOD Single : A 103 MET CE :methyl 159:sc= -5.26! (180deg=-6.91!) USER MOD Single : A 106 ASN : amide:sc= 1.17 K(o=1.2,f=-1.4) USER MOD Single : A 109 CYS SG : rot -149:sc= -0.293 USER MOD Single : A 113 LYS NZ :NH3+ 166:sc= 0.627 (180deg=0.434) USER MOD Single : A 119 HIS : no HE2:sc= -2.83 X(o=-2.8,f=-2.8!) USER MOD Single : A 124 MET CE :methyl 155:sc= -0.877 (180deg=-1.89) USER MOD Single : A 126 CYS SG : rot 94:sc= 0.0037 USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 136 GLN : amide:sc= -0.228 X(o=-0.23,f=-0.34) USER MOD Single : A 142 GLN : amide:sc= -0.0106 X(o=-0.011,f=-0.065) USER MOD Single : A 143 GLN : amide:sc= 0.32 X(o=0.32,f=0) USER MOD ----------------------------------------------------------------- ATOM 36 N PRO A 4 19.240 -3.496 -9.678 1.00 1.00 N ATOM 37 CA PRO A 4 18.919 -2.760 -8.473 1.00 1.00 C ATOM 38 C PRO A 4 17.670 -3.366 -7.839 1.00 1.00 C ATOM 39 O PRO A 4 16.735 -3.805 -8.524 1.00 1.00 O ATOM 40 CB PRO A 4 18.730 -1.306 -8.896 1.00 1.00 C ATOM 41 CG PRO A 4 18.351 -1.406 -10.374 1.00 1.00 C ATOM 42 CD PRO A 4 19.111 -2.641 -10.848 1.00 1.00 C ATOM 0 HA PRO A 4 19.703 -2.812 -7.718 1.00 1.00 H new ATOM 0 HB2 PRO A 4 17.948 -0.818 -8.314 1.00 1.00 H new ATOM 0 HB3 PRO A 4 19.642 -0.726 -8.755 1.00 1.00 H new ATOM 0 HG2 PRO A 4 17.275 -1.520 -10.507 1.00 1.00 H new ATOM 0 HG3 PRO A 4 18.647 -0.514 -10.927 1.00 1.00 H new ATOM 0 HD2 PRO A 4 18.572 -3.150 -11.647 1.00 1.00 H new ATOM 0 HD3 PRO A 4 20.089 -2.370 -11.245 1.00 1.00 H new ATOM 50 N ARG A 5 17.678 -3.403 -6.511 1.00 1.00 N ATOM 51 CA ARG A 5 16.579 -3.902 -5.690 1.00 1.00 C ATOM 52 C ARG A 5 16.354 -3.017 -4.481 1.00 1.00 C ATOM 53 O ARG A 5 15.226 -2.856 -4.030 1.00 1.00 O ATOM 54 CB ARG A 5 16.927 -5.330 -5.213 1.00 1.00 C ATOM 55 CG ARG A 5 15.708 -6.251 -5.131 1.00 1.00 C ATOM 56 CD ARG A 5 15.450 -6.957 -6.467 1.00 1.00 C ATOM 57 NE ARG A 5 15.189 -6.000 -7.551 1.00 1.00 N ATOM 58 CZ ARG A 5 14.031 -5.774 -8.169 1.00 1.00 C ATOM 59 NH1 ARG A 5 12.925 -6.422 -7.820 1.00 1.00 N ATOM 60 NH2 ARG A 5 14.001 -4.863 -9.135 1.00 1.00 N ATOM 0 H ARG A 5 18.472 -3.077 -5.959 1.00 1.00 H new ATOM 0 HA ARG A 5 15.668 -3.904 -6.288 1.00 1.00 H new ATOM 0 HB2 ARG A 5 17.658 -5.766 -5.894 1.00 1.00 H new ATOM 0 HB3 ARG A 5 17.399 -5.274 -4.232 1.00 1.00 H new ATOM 0 HG2 ARG A 5 15.864 -6.994 -4.349 1.00 1.00 H new ATOM 0 HG3 ARG A 5 14.830 -5.670 -4.849 1.00 1.00 H new ATOM 0 HD2 ARG A 5 16.312 -7.572 -6.725 1.00 1.00 H new ATOM 0 HD3 ARG A 5 14.599 -7.630 -6.364 1.00 1.00 H new ATOM 0 HE ARG A 5 15.985 -5.446 -7.866 1.00 1.00 H new ATOM 0 HH11 ARG A 5 12.952 -7.108 -7.065 1.00 1.00 H new ATOM 0 HH12 ARG A 5 12.049 -6.234 -8.307 1.00 1.00 H new ATOM 0 HH21 ARG A 5 14.851 -4.358 -9.386 1.00 1.00 H new ATOM 0 HH22 ARG A 5 13.128 -4.669 -9.626 1.00 1.00 H new ATOM 74 N VAL A 6 17.419 -2.353 -4.064 1.00 1.00 N ATOM 75 CA VAL A 6 17.488 -1.424 -2.969 1.00 1.00 C ATOM 76 C VAL A 6 18.456 -0.322 -3.406 1.00 1.00 C ATOM 77 O VAL A 6 19.348 -0.558 -4.231 1.00 1.00 O ATOM 78 CB VAL A 6 17.929 -2.148 -1.678 1.00 1.00 C ATOM 79 CG1 VAL A 6 16.767 -2.940 -1.067 1.00 1.00 C ATOM 80 CG2 VAL A 6 19.074 -3.141 -1.915 1.00 1.00 C ATOM 0 H VAL A 6 18.323 -2.464 -4.524 1.00 1.00 H new ATOM 0 HA VAL A 6 16.519 -0.984 -2.734 1.00 1.00 H new ATOM 0 HB VAL A 6 18.266 -1.359 -1.006 1.00 1.00 H new ATOM 0 HG11 VAL A 6 17.105 -3.440 -0.159 1.00 1.00 H new ATOM 0 HG12 VAL A 6 15.951 -2.260 -0.824 1.00 1.00 H new ATOM 0 HG13 VAL A 6 16.418 -3.684 -1.783 1.00 1.00 H new ATOM 0 HG21 VAL A 6 19.342 -3.619 -0.973 1.00 1.00 H new ATOM 0 HG22 VAL A 6 18.755 -3.900 -2.630 1.00 1.00 H new ATOM 0 HG23 VAL A 6 19.940 -2.610 -2.311 1.00 1.00 H new ATOM 90 N VAL A 7 18.272 0.883 -2.880 1.00 1.00 N ATOM 91 CA VAL A 7 19.273 1.942 -2.842 1.00 1.00 C ATOM 92 C VAL A 7 20.136 1.685 -1.589 1.00 1.00 C ATOM 93 O VAL A 7 19.764 0.829 -0.783 1.00 1.00 O ATOM 94 CB VAL A 7 18.568 3.315 -2.849 1.00 1.00 C ATOM 95 CG1 VAL A 7 17.465 3.408 -3.913 1.00 1.00 C ATOM 96 CG2 VAL A 7 17.953 3.677 -1.496 1.00 1.00 C ATOM 0 H VAL A 7 17.388 1.160 -2.452 1.00 1.00 H new ATOM 0 HA VAL A 7 19.926 1.946 -3.715 1.00 1.00 H new ATOM 0 HB VAL A 7 19.362 4.024 -3.084 1.00 1.00 H new ATOM 0 HG11 VAL A 7 17.003 4.394 -3.873 1.00 1.00 H new ATOM 0 HG12 VAL A 7 17.898 3.250 -4.901 1.00 1.00 H new ATOM 0 HG13 VAL A 7 16.710 2.646 -3.722 1.00 1.00 H new ATOM 0 HG21 VAL A 7 17.472 4.653 -1.564 1.00 1.00 H new ATOM 0 HG22 VAL A 7 17.213 2.926 -1.220 1.00 1.00 H new ATOM 0 HG23 VAL A 7 18.735 3.710 -0.738 1.00 1.00 H new ATOM 106 N PRO A 8 21.278 2.360 -1.382 1.00 1.00 N ATOM 107 CA PRO A 8 22.122 2.082 -0.229 1.00 1.00 C ATOM 108 C PRO A 8 21.419 2.560 1.036 1.00 1.00 C ATOM 109 O PRO A 8 20.977 1.772 1.872 1.00 1.00 O ATOM 110 CB PRO A 8 23.444 2.807 -0.491 1.00 1.00 C ATOM 111 CG PRO A 8 23.126 3.874 -1.536 1.00 1.00 C ATOM 112 CD PRO A 8 21.852 3.394 -2.224 1.00 1.00 C ATOM 0 HA PRO A 8 22.315 1.019 -0.084 1.00 1.00 H new ATOM 0 HB2 PRO A 8 23.832 3.257 0.423 1.00 1.00 H new ATOM 0 HB3 PRO A 8 24.205 2.116 -0.855 1.00 1.00 H new ATOM 0 HG2 PRO A 8 22.979 4.849 -1.071 1.00 1.00 H new ATOM 0 HG3 PRO A 8 23.943 3.981 -2.250 1.00 1.00 H new ATOM 0 HD2 PRO A 8 21.151 4.218 -2.355 1.00 1.00 H new ATOM 0 HD3 PRO A 8 22.074 3.003 -3.217 1.00 1.00 H new ATOM 120 N ASP A 9 21.330 3.876 1.179 1.00 1.00 N ATOM 121 CA ASP A 9 20.792 4.544 2.356 1.00 1.00 C ATOM 122 C ASP A 9 19.276 4.703 2.223 1.00 1.00 C ATOM 123 O ASP A 9 18.764 5.786 1.911 1.00 1.00 O ATOM 124 CB ASP A 9 21.500 5.889 2.521 1.00 1.00 C ATOM 125 CG ASP A 9 21.383 6.472 3.918 1.00 1.00 C ATOM 126 OD1 ASP A 9 20.853 5.820 4.843 1.00 1.00 O ATOM 127 OD2 ASP A 9 21.880 7.611 4.083 1.00 1.00 O ATOM 0 H ASP A 9 21.640 4.527 0.457 1.00 1.00 H new ATOM 0 HA ASP A 9 20.972 3.948 3.250 1.00 1.00 H new ATOM 0 HB2 ASP A 9 22.555 5.767 2.275 1.00 1.00 H new ATOM 0 HB3 ASP A 9 21.085 6.598 1.805 1.00 1.00 H new ATOM 132 N GLN A 10 18.546 3.597 2.390 1.00 1.00 N ATOM 133 CA GLN A 10 17.116 3.532 2.119 1.00 1.00 C ATOM 134 C GLN A 10 16.354 4.620 2.882 1.00 1.00 C ATOM 135 O GLN A 10 15.525 5.304 2.279 1.00 1.00 O ATOM 136 CB GLN A 10 16.549 2.134 2.418 1.00 1.00 C ATOM 137 CG GLN A 10 16.999 1.030 1.442 1.00 1.00 C ATOM 138 CD GLN A 10 16.100 -0.208 1.526 1.00 1.00 C ATOM 139 OE1 GLN A 10 14.877 -0.108 1.425 1.00 1.00 O ATOM 140 NE2 GLN A 10 16.658 -1.395 1.694 1.00 1.00 N ATOM 0 H GLN A 10 18.939 2.716 2.720 1.00 1.00 H new ATOM 0 HA GLN A 10 16.976 3.719 1.054 1.00 1.00 H new ATOM 0 HB2 GLN A 10 16.842 1.847 3.428 1.00 1.00 H new ATOM 0 HB3 GLN A 10 15.460 2.189 2.405 1.00 1.00 H new ATOM 0 HG2 GLN A 10 16.987 1.419 0.424 1.00 1.00 H new ATOM 0 HG3 GLN A 10 18.028 0.747 1.663 1.00 1.00 H new ATOM 0 HE21 GLN A 10 17.671 -1.475 1.777 1.00 1.00 H new ATOM 0 HE22 GLN A 10 16.075 -2.231 1.740 1.00 1.00 H new ATOM 149 N ARG A 11 16.637 4.845 4.171 1.00 1.00 N ATOM 150 CA ARG A 11 15.899 5.841 4.950 1.00 1.00 C ATOM 151 C ARG A 11 16.184 7.268 4.471 1.00 1.00 C ATOM 152 O ARG A 11 15.298 8.124 4.569 1.00 1.00 O ATOM 153 CB ARG A 11 16.190 5.681 6.453 1.00 1.00 C ATOM 154 CG ARG A 11 15.105 6.348 7.320 1.00 1.00 C ATOM 155 CD ARG A 11 13.843 5.490 7.439 1.00 1.00 C ATOM 156 NE ARG A 11 14.021 4.461 8.473 1.00 1.00 N ATOM 157 CZ ARG A 11 13.793 4.604 9.783 1.00 1.00 C ATOM 158 NH1 ARG A 11 13.237 5.717 10.253 1.00 1.00 N ATOM 159 NH2 ARG A 11 14.139 3.625 10.608 1.00 1.00 N ATOM 0 H ARG A 11 17.365 4.355 4.691 1.00 1.00 H new ATOM 0 HA ARG A 11 14.836 5.663 4.791 1.00 1.00 H new ATOM 0 HB2 ARG A 11 16.252 4.621 6.700 1.00 1.00 H new ATOM 0 HB3 ARG A 11 17.161 6.120 6.684 1.00 1.00 H new ATOM 0 HG2 ARG A 11 15.506 6.539 8.315 1.00 1.00 H new ATOM 0 HG3 ARG A 11 14.844 7.315 6.890 1.00 1.00 H new ATOM 0 HD2 ARG A 11 12.989 6.120 7.687 1.00 1.00 H new ATOM 0 HD3 ARG A 11 13.624 5.018 6.481 1.00 1.00 H new ATOM 0 HE ARG A 11 14.351 3.548 8.161 1.00 1.00 H new ATOM 0 HH11 ARG A 11 12.981 6.469 9.613 1.00 1.00 H new ATOM 0 HH12 ARG A 11 13.066 5.819 11.253 1.00 1.00 H new ATOM 0 HH21 ARG A 11 14.573 2.778 10.241 1.00 1.00 H new ATOM 0 HH22 ARG A 11 13.972 3.719 11.610 1.00 1.00 H new ATOM 173 N SER A 12 17.365 7.549 3.916 1.00 1.00 N ATOM 174 CA SER A 12 17.620 8.872 3.355 1.00 1.00 C ATOM 175 C SER A 12 16.854 9.040 2.041 1.00 1.00 C ATOM 176 O SER A 12 16.269 10.097 1.800 1.00 1.00 O ATOM 177 CB SER A 12 19.124 9.089 3.189 1.00 1.00 C ATOM 178 OG SER A 12 19.724 9.003 4.469 1.00 1.00 O ATOM 0 H SER A 12 18.143 6.893 3.845 1.00 1.00 H new ATOM 0 HA SER A 12 17.258 9.640 4.039 1.00 1.00 H new ATOM 0 HB2 SER A 12 19.545 8.339 2.520 1.00 1.00 H new ATOM 0 HB3 SER A 12 19.321 10.063 2.741 1.00 1.00 H new ATOM 0 HG SER A 12 20.686 8.843 4.369 1.00 1.00 H new ATOM 184 N LYS A 13 16.791 8.008 1.191 1.00 1.00 N ATOM 185 CA LYS A 13 16.001 8.086 -0.039 1.00 1.00 C ATOM 186 C LYS A 13 14.505 8.151 0.260 1.00 1.00 C ATOM 187 O LYS A 13 13.826 8.886 -0.442 1.00 1.00 O ATOM 188 CB LYS A 13 16.351 6.932 -0.968 1.00 1.00 C ATOM 189 CG LYS A 13 15.855 7.089 -2.420 1.00 1.00 C ATOM 190 CD LYS A 13 16.891 7.699 -3.375 1.00 1.00 C ATOM 191 CE LYS A 13 17.207 9.173 -3.100 1.00 1.00 C ATOM 192 NZ LYS A 13 18.229 9.696 -4.031 1.00 1.00 N ATOM 0 H LYS A 13 17.272 7.120 1.331 1.00 1.00 H new ATOM 0 HA LYS A 13 16.255 9.013 -0.553 1.00 1.00 H new ATOM 0 HB2 LYS A 13 17.434 6.812 -0.981 1.00 1.00 H new ATOM 0 HB3 LYS A 13 15.934 6.014 -0.555 1.00 1.00 H new ATOM 0 HG2 LYS A 13 15.559 6.111 -2.799 1.00 1.00 H new ATOM 0 HG3 LYS A 13 14.963 7.715 -2.422 1.00 1.00 H new ATOM 0 HD2 LYS A 13 17.814 7.123 -3.308 1.00 1.00 H new ATOM 0 HD3 LYS A 13 16.527 7.602 -4.398 1.00 1.00 H new ATOM 0 HE2 LYS A 13 16.295 9.764 -3.191 1.00 1.00 H new ATOM 0 HE3 LYS A 13 17.558 9.285 -2.074 1.00 1.00 H new ATOM 0 HZ1 LYS A 13 18.417 10.696 -3.814 1.00 1.00 H new ATOM 0 HZ2 LYS A 13 19.107 9.148 -3.926 1.00 1.00 H new ATOM 0 HZ3 LYS A 13 17.883 9.613 -5.008 1.00 1.00 H new ATOM 206 N PHE A 14 14.004 7.461 1.289 1.00 1.00 N ATOM 207 CA PHE A 14 12.624 7.552 1.766 1.00 1.00 C ATOM 208 C PHE A 14 12.224 9.011 1.965 1.00 1.00 C ATOM 209 O PHE A 14 11.146 9.425 1.539 1.00 1.00 O ATOM 210 CB PHE A 14 12.490 6.752 3.076 1.00 1.00 C ATOM 211 CG PHE A 14 11.322 7.111 3.979 1.00 1.00 C ATOM 212 CD1 PHE A 14 10.006 7.048 3.491 1.00 1.00 C ATOM 213 CD2 PHE A 14 11.548 7.492 5.317 1.00 1.00 C ATOM 214 CE1 PHE A 14 8.918 7.312 4.342 1.00 1.00 C ATOM 215 CE2 PHE A 14 10.461 7.766 6.168 1.00 1.00 C ATOM 216 CZ PHE A 14 9.146 7.661 5.685 1.00 1.00 C ATOM 0 H PHE A 14 14.567 6.804 1.829 1.00 1.00 H new ATOM 0 HA PHE A 14 11.949 7.127 1.023 1.00 1.00 H new ATOM 0 HB2 PHE A 14 12.411 5.695 2.822 1.00 1.00 H new ATOM 0 HB3 PHE A 14 13.411 6.876 3.646 1.00 1.00 H new ATOM 0 HD1 PHE A 14 9.829 6.795 2.456 1.00 1.00 H new ATOM 0 HD2 PHE A 14 12.558 7.574 5.690 1.00 1.00 H new ATOM 0 HE1 PHE A 14 7.908 7.247 3.964 1.00 1.00 H new ATOM 0 HE2 PHE A 14 10.638 8.057 7.193 1.00 1.00 H new ATOM 0 HZ PHE A 14 8.311 7.848 6.344 1.00 1.00 H new ATOM 226 N GLU A 15 13.090 9.797 2.603 1.00 1.00 N ATOM 227 CA GLU A 15 12.830 11.205 2.833 1.00 1.00 C ATOM 228 C GLU A 15 12.995 12.003 1.536 1.00 1.00 C ATOM 229 O GLU A 15 12.196 12.898 1.274 1.00 1.00 O ATOM 230 CB GLU A 15 13.688 11.682 4.019 1.00 1.00 C ATOM 231 CG GLU A 15 14.895 12.593 3.753 1.00 1.00 C ATOM 232 CD GLU A 15 14.555 14.084 3.606 1.00 1.00 C ATOM 233 OE1 GLU A 15 13.512 14.557 4.109 1.00 1.00 O ATOM 234 OE2 GLU A 15 15.369 14.845 3.036 1.00 1.00 O ATOM 0 H GLU A 15 13.984 9.472 2.970 1.00 1.00 H new ATOM 0 HA GLU A 15 11.793 11.377 3.122 1.00 1.00 H new ATOM 0 HB2 GLU A 15 13.028 12.205 4.711 1.00 1.00 H new ATOM 0 HB3 GLU A 15 14.054 10.795 4.536 1.00 1.00 H new ATOM 0 HG2 GLU A 15 15.608 12.476 4.569 1.00 1.00 H new ATOM 0 HG3 GLU A 15 15.393 12.257 2.844 1.00 1.00 H new ATOM 241 N ASN A 16 13.991 11.668 0.708 1.00 1.00 N ATOM 242 CA ASN A 16 14.401 12.468 -0.431 1.00 1.00 C ATOM 243 C ASN A 16 13.396 12.337 -1.564 1.00 1.00 C ATOM 244 O ASN A 16 12.904 13.360 -2.035 1.00 1.00 O ATOM 245 CB ASN A 16 15.789 12.036 -0.933 1.00 1.00 C ATOM 246 CG ASN A 16 16.933 12.861 -0.371 1.00 1.00 C ATOM 247 OD1 ASN A 16 17.232 12.744 0.908 1.00 1.00 O flip ATOM 248 ND2 ASN A 16 17.610 13.562 -1.120 1.00 1.00 N flip ATOM 0 H ASN A 16 14.539 10.815 0.821 1.00 1.00 H new ATOM 0 HA ASN A 16 14.448 13.508 -0.106 1.00 1.00 H new ATOM 0 HB2 ASN A 16 15.948 10.989 -0.674 1.00 1.00 H new ATOM 0 HB3 ASN A 16 15.807 12.102 -2.021 1.00 1.00 H new ATOM 0 HD21 ASN A 16 17.363 13.640 -2.107 1.00 1.00 H new ATOM 0 HD22 ASN A 16 18.419 14.065 -0.755 1.00 1.00 H new ATOM 255 N GLU A 17 13.185 11.117 -2.079 1.00 1.00 N ATOM 256 CA GLU A 17 12.484 10.873 -3.331 1.00 1.00 C ATOM 257 C GLU A 17 11.204 11.687 -3.462 1.00 1.00 C ATOM 258 O GLU A 17 10.282 11.554 -2.658 1.00 1.00 O ATOM 259 CB GLU A 17 12.211 9.375 -3.455 1.00 1.00 C ATOM 260 CG GLU A 17 12.991 8.755 -4.594 1.00 1.00 C ATOM 261 CD GLU A 17 12.228 8.811 -5.934 1.00 1.00 C ATOM 262 OE1 GLU A 17 11.405 9.731 -6.151 1.00 1.00 O ATOM 263 OE2 GLU A 17 12.461 7.952 -6.813 1.00 1.00 O ATOM 0 H GLU A 17 13.505 10.263 -1.623 1.00 1.00 H new ATOM 0 HA GLU A 17 13.121 11.203 -4.152 1.00 1.00 H new ATOM 0 HB2 GLU A 17 12.475 8.879 -2.521 1.00 1.00 H new ATOM 0 HB3 GLU A 17 11.145 9.211 -3.613 1.00 1.00 H new ATOM 0 HG2 GLU A 17 13.944 9.272 -4.701 1.00 1.00 H new ATOM 0 HG3 GLU A 17 13.217 7.717 -4.352 1.00 1.00 H new ATOM 270 N GLU A 18 11.156 12.535 -4.488 1.00 1.00 N ATOM 271 CA GLU A 18 10.050 13.435 -4.737 1.00 1.00 C ATOM 272 C GLU A 18 8.755 12.652 -4.987 1.00 1.00 C ATOM 273 O GLU A 18 7.671 13.172 -4.738 1.00 1.00 O ATOM 274 CB GLU A 18 10.432 14.337 -5.915 1.00 1.00 C ATOM 275 CG GLU A 18 9.652 15.650 -5.939 1.00 1.00 C ATOM 276 CD GLU A 18 9.768 16.278 -7.324 1.00 1.00 C ATOM 277 OE1 GLU A 18 10.744 17.020 -7.577 1.00 1.00 O ATOM 278 OE2 GLU A 18 8.928 15.977 -8.197 1.00 1.00 O ATOM 0 H GLU A 18 11.903 12.611 -5.178 1.00 1.00 H new ATOM 0 HA GLU A 18 9.856 14.059 -3.865 1.00 1.00 H new ATOM 0 HB2 GLU A 18 11.499 14.555 -5.867 1.00 1.00 H new ATOM 0 HB3 GLU A 18 10.258 13.800 -6.848 1.00 1.00 H new ATOM 0 HG2 GLU A 18 8.605 15.469 -5.695 1.00 1.00 H new ATOM 0 HG3 GLU A 18 10.042 16.332 -5.184 1.00 1.00 H new ATOM 285 N PHE A 19 8.840 11.381 -5.404 1.00 1.00 N ATOM 286 CA PHE A 19 7.687 10.506 -5.467 1.00 1.00 C ATOM 287 C PHE A 19 7.076 10.366 -4.075 1.00 1.00 C ATOM 288 O PHE A 19 5.867 10.514 -3.919 1.00 1.00 O ATOM 289 CB PHE A 19 8.098 9.163 -6.074 1.00 1.00 C ATOM 290 CG PHE A 19 6.931 8.224 -6.277 1.00 1.00 C ATOM 291 CD1 PHE A 19 6.432 7.503 -5.182 1.00 1.00 C ATOM 292 CD2 PHE A 19 6.305 8.117 -7.531 1.00 1.00 C ATOM 293 CE1 PHE A 19 5.291 6.695 -5.326 1.00 1.00 C ATOM 294 CE2 PHE A 19 5.168 7.305 -7.680 1.00 1.00 C ATOM 295 CZ PHE A 19 4.652 6.606 -6.576 1.00 1.00 C ATOM 0 H PHE A 19 9.711 10.943 -5.703 1.00 1.00 H new ATOM 0 HA PHE A 19 6.918 10.929 -6.114 1.00 1.00 H new ATOM 0 HB2 PHE A 19 8.587 9.338 -7.032 1.00 1.00 H new ATOM 0 HB3 PHE A 19 8.832 8.686 -5.424 1.00 1.00 H new ATOM 0 HD1 PHE A 19 6.927 7.569 -4.224 1.00 1.00 H new ATOM 0 HD2 PHE A 19 6.698 8.658 -8.379 1.00 1.00 H new ATOM 0 HE1 PHE A 19 4.906 6.145 -4.480 1.00 1.00 H new ATOM 0 HE2 PHE A 19 4.690 7.218 -8.645 1.00 1.00 H new ATOM 0 HZ PHE A 19 3.765 6.000 -6.687 1.00 1.00 H new ATOM 305 N PHE A 20 7.890 10.099 -3.052 1.00 1.00 N ATOM 306 CA PHE A 20 7.410 9.979 -1.689 1.00 1.00 C ATOM 307 C PHE A 20 6.919 11.312 -1.150 1.00 1.00 C ATOM 308 O PHE A 20 5.902 11.320 -0.469 1.00 1.00 O ATOM 309 CB PHE A 20 8.516 9.381 -0.814 1.00 1.00 C ATOM 310 CG PHE A 20 9.087 8.061 -1.306 1.00 1.00 C ATOM 311 CD1 PHE A 20 8.260 7.033 -1.797 1.00 1.00 C ATOM 312 CD2 PHE A 20 10.474 7.863 -1.281 1.00 1.00 C ATOM 313 CE1 PHE A 20 8.807 5.806 -2.192 1.00 1.00 C ATOM 314 CE2 PHE A 20 11.033 6.642 -1.695 1.00 1.00 C ATOM 315 CZ PHE A 20 10.195 5.607 -2.137 1.00 1.00 C ATOM 0 H PHE A 20 8.896 9.962 -3.152 1.00 1.00 H new ATOM 0 HA PHE A 20 6.551 9.308 -1.673 1.00 1.00 H new ATOM 0 HB2 PHE A 20 9.328 10.104 -0.738 1.00 1.00 H new ATOM 0 HB3 PHE A 20 8.123 9.236 0.192 1.00 1.00 H new ATOM 0 HD1 PHE A 20 7.194 7.192 -1.870 1.00 1.00 H new ATOM 0 HD2 PHE A 20 11.121 8.658 -0.940 1.00 1.00 H new ATOM 0 HE1 PHE A 20 8.161 5.013 -2.539 1.00 1.00 H new ATOM 0 HE2 PHE A 20 12.104 6.501 -1.673 1.00 1.00 H new ATOM 0 HZ PHE A 20 10.618 4.659 -2.434 1.00 1.00 H new ATOM 325 N ARG A 21 7.546 12.438 -1.497 1.00 1.00 N ATOM 326 CA ARG A 21 7.089 13.768 -1.068 1.00 1.00 C ATOM 327 C ARG A 21 5.653 14.037 -1.502 1.00 1.00 C ATOM 328 O ARG A 21 4.864 14.606 -0.746 1.00 1.00 O ATOM 329 CB ARG A 21 8.005 14.856 -1.653 1.00 1.00 C ATOM 330 CG ARG A 21 9.487 14.685 -1.302 1.00 1.00 C ATOM 331 CD ARG A 21 9.782 15.047 0.149 1.00 1.00 C ATOM 332 NE ARG A 21 10.690 16.189 0.201 1.00 1.00 N ATOM 333 CZ ARG A 21 11.659 16.396 1.101 1.00 1.00 C ATOM 334 NH1 ARG A 21 11.769 15.618 2.172 1.00 1.00 N ATOM 335 NH2 ARG A 21 12.523 17.381 0.916 1.00 1.00 N ATOM 0 H ARG A 21 8.382 12.457 -2.081 1.00 1.00 H new ATOM 0 HA ARG A 21 7.130 13.791 0.021 1.00 1.00 H new ATOM 0 HB2 ARG A 21 7.898 14.860 -2.738 1.00 1.00 H new ATOM 0 HB3 ARG A 21 7.668 15.829 -1.296 1.00 1.00 H new ATOM 0 HG2 ARG A 21 9.785 13.652 -1.485 1.00 1.00 H new ATOM 0 HG3 ARG A 21 10.089 15.311 -1.960 1.00 1.00 H new ATOM 0 HD2 ARG A 21 8.854 15.285 0.669 1.00 1.00 H new ATOM 0 HD3 ARG A 21 10.226 14.194 0.663 1.00 1.00 H new ATOM 0 HE ARG A 21 10.574 16.900 -0.521 1.00 1.00 H new ATOM 0 HH11 ARG A 21 11.111 14.852 2.316 1.00 1.00 H new ATOM 0 HH12 ARG A 21 12.512 15.786 2.850 1.00 1.00 H new ATOM 0 HH21 ARG A 21 12.448 17.977 0.092 1.00 1.00 H new ATOM 0 HH22 ARG A 21 13.264 17.544 1.598 1.00 1.00 H new ATOM 349 N LYS A 22 5.288 13.586 -2.699 1.00 1.00 N ATOM 350 CA LYS A 22 3.957 13.786 -3.259 1.00 1.00 C ATOM 351 C LYS A 22 2.924 13.048 -2.426 1.00 1.00 C ATOM 352 O LYS A 22 1.794 13.511 -2.298 1.00 1.00 O ATOM 353 CB LYS A 22 3.949 13.308 -4.715 1.00 1.00 C ATOM 354 CG LYS A 22 4.763 14.290 -5.570 1.00 1.00 C ATOM 355 CD LYS A 22 5.246 13.652 -6.870 1.00 1.00 C ATOM 356 CE LYS A 22 6.339 14.551 -7.442 1.00 1.00 C ATOM 357 NZ LYS A 22 7.195 13.858 -8.420 1.00 1.00 N ATOM 0 H LYS A 22 5.915 13.066 -3.313 1.00 1.00 H new ATOM 0 HA LYS A 22 3.699 14.845 -3.239 1.00 1.00 H new ATOM 0 HB2 LYS A 22 4.374 12.307 -4.785 1.00 1.00 H new ATOM 0 HB3 LYS A 22 2.926 13.246 -5.085 1.00 1.00 H new ATOM 0 HG2 LYS A 22 4.152 15.163 -5.800 1.00 1.00 H new ATOM 0 HG3 LYS A 22 5.621 14.643 -4.999 1.00 1.00 H new ATOM 0 HD2 LYS A 22 5.632 12.649 -6.685 1.00 1.00 H new ATOM 0 HD3 LYS A 22 4.423 13.552 -7.577 1.00 1.00 H new ATOM 0 HE2 LYS A 22 5.879 15.417 -7.918 1.00 1.00 H new ATOM 0 HE3 LYS A 22 6.957 14.927 -6.627 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 8.041 14.432 -8.609 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 7.482 12.935 -8.037 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 6.667 13.717 -9.305 1.00 1.00 H new ATOM 371 N LEU A 23 3.267 11.865 -1.930 1.00 1.00 N ATOM 372 CA LEU A 23 2.413 11.092 -1.048 1.00 1.00 C ATOM 373 C LEU A 23 2.435 11.660 0.368 1.00 1.00 C ATOM 374 O LEU A 23 1.390 11.715 1.009 1.00 1.00 O ATOM 375 CB LEU A 23 2.799 9.613 -1.168 1.00 1.00 C ATOM 376 CG LEU A 23 2.867 9.129 -2.639 1.00 1.00 C ATOM 377 CD1 LEU A 23 2.919 7.603 -2.733 1.00 1.00 C ATOM 378 CD2 LEU A 23 1.774 9.709 -3.562 1.00 1.00 C ATOM 0 H LEU A 23 4.158 11.413 -2.134 1.00 1.00 H new ATOM 0 HA LEU A 23 1.367 11.165 -1.344 1.00 1.00 H new ATOM 0 HB2 LEU A 23 3.767 9.455 -0.693 1.00 1.00 H new ATOM 0 HB3 LEU A 23 2.074 9.007 -0.624 1.00 1.00 H new ATOM 0 HG LEU A 23 3.806 9.534 -3.018 1.00 1.00 H new ATOM 0 HD11 LEU A 23 2.966 7.304 -3.780 1.00 1.00 H new ATOM 0 HD12 LEU A 23 3.803 7.236 -2.211 1.00 1.00 H new ATOM 0 HD13 LEU A 23 2.025 7.180 -2.275 1.00 1.00 H new ATOM 0 HD21 LEU A 23 1.902 9.314 -4.570 1.00 1.00 H new ATOM 0 HD22 LEU A 23 0.791 9.427 -3.184 1.00 1.00 H new ATOM 0 HD23 LEU A 23 1.856 10.796 -3.585 1.00 1.00 H new ATOM 390 N SER A 24 3.605 12.132 0.818 1.00 1.00 N ATOM 391 CA SER A 24 3.849 12.669 2.143 1.00 1.00 C ATOM 392 C SER A 24 3.425 11.723 3.289 1.00 1.00 C ATOM 393 O SER A 24 3.238 10.509 3.131 1.00 1.00 O ATOM 394 CB SER A 24 3.245 14.085 2.235 1.00 1.00 C ATOM 395 OG SER A 24 3.780 14.868 3.295 1.00 1.00 O ATOM 0 H SER A 24 4.440 12.146 0.232 1.00 1.00 H new ATOM 0 HA SER A 24 4.926 12.752 2.288 1.00 1.00 H new ATOM 0 HB2 SER A 24 3.413 14.604 1.291 1.00 1.00 H new ATOM 0 HB3 SER A 24 2.166 14.002 2.365 1.00 1.00 H new ATOM 0 HG SER A 24 3.356 15.752 3.295 1.00 1.00 H new ATOM 401 N ARG A 25 3.374 12.305 4.491 1.00 1.00 N ATOM 402 CA ARG A 25 2.756 11.777 5.706 1.00 1.00 C ATOM 403 C ARG A 25 1.234 11.888 5.576 1.00 1.00 C ATOM 404 O ARG A 25 0.736 12.203 4.503 1.00 1.00 O ATOM 405 CB ARG A 25 3.241 12.577 6.919 1.00 1.00 C ATOM 406 CG ARG A 25 4.771 12.612 7.037 1.00 1.00 C ATOM 407 CD ARG A 25 5.198 13.417 8.263 1.00 1.00 C ATOM 408 NE ARG A 25 4.719 14.805 8.166 1.00 1.00 N ATOM 409 CZ ARG A 25 5.303 15.887 8.675 1.00 1.00 C ATOM 410 NH1 ARG A 25 6.313 15.782 9.525 1.00 1.00 N ATOM 411 NH2 ARG A 25 4.853 17.066 8.284 1.00 1.00 N ATOM 0 H ARG A 25 3.793 13.221 4.649 1.00 1.00 H new ATOM 0 HA ARG A 25 3.034 10.732 5.842 1.00 1.00 H new ATOM 0 HB2 ARG A 25 2.863 13.597 6.850 1.00 1.00 H new ATOM 0 HB3 ARG A 25 2.821 12.142 7.826 1.00 1.00 H new ATOM 0 HG2 ARG A 25 5.159 11.596 7.109 1.00 1.00 H new ATOM 0 HG3 ARG A 25 5.200 13.054 6.138 1.00 1.00 H new ATOM 0 HD2 ARG A 25 4.801 12.952 9.166 1.00 1.00 H new ATOM 0 HD3 ARG A 25 6.284 13.407 8.350 1.00 1.00 H new ATOM 0 HE ARG A 25 3.849 14.953 7.655 1.00 1.00 H new ATOM 0 HH11 ARG A 25 6.655 14.861 9.799 1.00 1.00 H new ATOM 0 HH12 ARG A 25 6.749 16.622 9.905 1.00 1.00 H new ATOM 0 HH21 ARG A 25 4.085 17.123 7.615 1.00 1.00 H new ATOM 0 HH22 ARG A 25 5.274 17.920 8.651 1.00 1.00 H new ATOM 425 N GLU A 26 0.498 11.608 6.656 1.00 1.00 N ATOM 426 CA GLU A 26 -0.956 11.506 6.714 1.00 1.00 C ATOM 427 C GLU A 26 -1.672 12.562 5.866 1.00 1.00 C ATOM 428 O GLU A 26 -1.693 13.745 6.226 1.00 1.00 O ATOM 429 CB GLU A 26 -1.396 11.472 8.181 1.00 1.00 C ATOM 430 CG GLU A 26 -1.002 12.672 9.053 1.00 1.00 C ATOM 431 CD GLU A 26 -1.231 12.292 10.509 1.00 1.00 C ATOM 432 OE1 GLU A 26 -2.400 12.248 10.952 1.00 1.00 O ATOM 433 OE2 GLU A 26 -0.252 11.907 11.189 1.00 1.00 O ATOM 0 H GLU A 26 0.930 11.437 7.564 1.00 1.00 H new ATOM 0 HA GLU A 26 -1.264 10.569 6.251 1.00 1.00 H new ATOM 0 HB2 GLU A 26 -2.481 11.376 8.207 1.00 1.00 H new ATOM 0 HB3 GLU A 26 -0.985 10.572 8.638 1.00 1.00 H new ATOM 0 HG2 GLU A 26 0.043 12.936 8.888 1.00 1.00 H new ATOM 0 HG3 GLU A 26 -1.597 13.546 8.789 1.00 1.00 H new ATOM 440 N CYS A 27 -2.254 12.119 4.748 1.00 1.00 N ATOM 441 CA CYS A 27 -3.019 12.904 3.796 1.00 1.00 C ATOM 442 C CYS A 27 -4.228 12.112 3.292 1.00 1.00 C ATOM 443 O CYS A 27 -4.405 10.936 3.592 1.00 1.00 O ATOM 444 CB CYS A 27 -2.139 13.285 2.605 1.00 1.00 C ATOM 445 SG CYS A 27 -0.847 14.482 3.048 1.00 1.00 S ATOM 0 H CYS A 27 -2.195 11.138 4.473 1.00 1.00 H new ATOM 0 HA CYS A 27 -3.367 13.805 4.300 1.00 1.00 H new ATOM 0 HB2 CYS A 27 -1.674 12.387 2.199 1.00 1.00 H new ATOM 0 HB3 CYS A 27 -2.763 13.705 1.816 1.00 1.00 H new ATOM 0 HG CYS A 27 0.086 13.883 3.727 1.00 1.00 H new ATOM 451 N GLU A 28 -5.085 12.767 2.520 1.00 1.00 N ATOM 452 CA GLU A 28 -6.278 12.139 1.967 1.00 1.00 C ATOM 453 C GLU A 28 -5.905 11.284 0.739 1.00 1.00 C ATOM 454 O GLU A 28 -5.007 11.650 -0.036 1.00 1.00 O ATOM 455 CB GLU A 28 -7.275 13.255 1.630 1.00 1.00 C ATOM 456 CG GLU A 28 -8.718 12.755 1.466 1.00 1.00 C ATOM 457 CD GLU A 28 -9.500 12.627 2.787 1.00 1.00 C ATOM 458 OE1 GLU A 28 -8.927 12.799 3.891 1.00 1.00 O ATOM 459 OE2 GLU A 28 -10.741 12.479 2.721 1.00 1.00 O ATOM 0 H GLU A 28 -4.973 13.747 2.260 1.00 1.00 H new ATOM 0 HA GLU A 28 -6.740 11.459 2.683 1.00 1.00 H new ATOM 0 HB2 GLU A 28 -7.246 14.008 2.418 1.00 1.00 H new ATOM 0 HB3 GLU A 28 -6.962 13.746 0.709 1.00 1.00 H new ATOM 0 HG2 GLU A 28 -9.253 13.437 0.805 1.00 1.00 H new ATOM 0 HG3 GLU A 28 -8.699 11.783 0.973 1.00 1.00 H new ATOM 466 N ILE A 29 -6.615 10.169 0.534 1.00 1.00 N ATOM 467 CA ILE A 29 -6.413 9.180 -0.527 1.00 1.00 C ATOM 468 C ILE A 29 -7.754 8.693 -1.076 1.00 1.00 C ATOM 469 O ILE A 29 -8.785 8.833 -0.416 1.00 1.00 O ATOM 470 CB ILE A 29 -5.591 7.968 -0.016 1.00 1.00 C ATOM 471 CG1 ILE A 29 -6.248 7.304 1.206 1.00 1.00 C ATOM 472 CG2 ILE A 29 -4.158 8.392 0.310 1.00 1.00 C ATOM 473 CD1 ILE A 29 -5.658 5.949 1.601 1.00 1.00 C ATOM 0 H ILE A 29 -7.394 9.919 1.143 1.00 1.00 H new ATOM 0 HA ILE A 29 -5.855 9.668 -1.326 1.00 1.00 H new ATOM 0 HB ILE A 29 -5.567 7.228 -0.816 1.00 1.00 H new ATOM 0 HG12 ILE A 29 -6.166 7.981 2.056 1.00 1.00 H new ATOM 0 HG13 ILE A 29 -7.311 7.175 1.003 1.00 1.00 H new ATOM 0 HG21 ILE A 29 -3.596 7.529 0.667 1.00 1.00 H new ATOM 0 HG22 ILE A 29 -3.683 8.789 -0.587 1.00 1.00 H new ATOM 0 HG23 ILE A 29 -4.173 9.161 1.083 1.00 1.00 H new ATOM 0 HD11 ILE A 29 -6.187 5.562 2.472 1.00 1.00 H new ATOM 0 HD12 ILE A 29 -5.765 5.250 0.771 1.00 1.00 H new ATOM 0 HD13 ILE A 29 -4.602 6.068 1.841 1.00 1.00 H new ATOM 485 N LYS A 30 -7.726 8.050 -2.248 1.00 1.00 N ATOM 486 CA LYS A 30 -8.863 7.244 -2.739 1.00 1.00 C ATOM 487 C LYS A 30 -8.404 5.985 -3.443 1.00 1.00 C ATOM 488 O LYS A 30 -7.339 5.981 -4.042 1.00 1.00 O ATOM 489 CB LYS A 30 -9.771 7.990 -3.736 1.00 1.00 C ATOM 490 CG LYS A 30 -10.189 9.392 -3.301 1.00 1.00 C ATOM 491 CD LYS A 30 -11.545 9.800 -3.857 1.00 1.00 C ATOM 492 CE LYS A 30 -11.894 11.184 -3.312 1.00 1.00 C ATOM 493 NZ LYS A 30 -13.296 11.535 -3.583 1.00 1.00 N ATOM 0 H LYS A 30 -6.927 8.069 -2.881 1.00 1.00 H new ATOM 0 HA LYS A 30 -9.425 7.014 -1.833 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -9.253 8.062 -4.693 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -10.669 7.395 -3.903 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -10.219 9.436 -2.212 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -9.436 10.109 -3.628 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -11.518 9.817 -4.947 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -12.307 9.076 -3.568 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -11.713 11.209 -2.237 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -11.238 11.929 -3.763 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -13.385 12.568 -3.669 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -13.601 11.086 -4.470 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -13.895 11.200 -2.802 1.00 1.00 H new ATOM 507 N TYR A 31 -9.224 4.940 -3.466 1.00 1.00 N ATOM 508 CA TYR A 31 -9.065 3.853 -4.423 1.00 1.00 C ATOM 509 C TYR A 31 -9.377 4.408 -5.822 1.00 1.00 C ATOM 510 O TYR A 31 -10.204 5.311 -5.937 1.00 1.00 O ATOM 511 CB TYR A 31 -10.024 2.733 -4.007 1.00 1.00 C ATOM 512 CG TYR A 31 -9.476 1.329 -4.144 1.00 1.00 C ATOM 513 CD1 TYR A 31 -9.186 0.741 -5.392 1.00 1.00 C ATOM 514 CD2 TYR A 31 -9.272 0.593 -2.967 1.00 1.00 C ATOM 515 CE1 TYR A 31 -8.704 -0.584 -5.460 1.00 1.00 C ATOM 516 CE2 TYR A 31 -8.831 -0.732 -3.030 1.00 1.00 C ATOM 517 CZ TYR A 31 -8.557 -1.336 -4.273 1.00 1.00 C ATOM 518 OH TYR A 31 -8.230 -2.653 -4.294 1.00 1.00 O ATOM 0 H TYR A 31 -10.011 4.823 -2.827 1.00 1.00 H new ATOM 0 HA TYR A 31 -8.053 3.447 -4.443 1.00 1.00 H new ATOM 0 HB2 TYR A 31 -10.314 2.892 -2.968 1.00 1.00 H new ATOM 0 HB3 TYR A 31 -10.931 2.812 -4.607 1.00 1.00 H new ATOM 0 HD1 TYR A 31 -9.333 1.307 -6.300 1.00 1.00 H new ATOM 0 HD2 TYR A 31 -9.457 1.053 -2.007 1.00 1.00 H new ATOM 0 HE1 TYR A 31 -8.449 -1.021 -6.414 1.00 1.00 H new ATOM 0 HE2 TYR A 31 -8.699 -1.297 -2.119 1.00 1.00 H new ATOM 0 HH TYR A 31 -7.530 -2.806 -4.963 1.00 1.00 H new ATOM 528 N THR A 32 -8.788 3.867 -6.893 1.00 1.00 N ATOM 529 CA THR A 32 -9.008 4.307 -8.264 1.00 1.00 C ATOM 530 C THR A 32 -8.859 3.044 -9.113 1.00 1.00 C ATOM 531 O THR A 32 -7.747 2.580 -9.360 1.00 1.00 O ATOM 532 CB THR A 32 -8.055 5.460 -8.664 1.00 1.00 C ATOM 533 OG1 THR A 32 -6.686 5.124 -8.550 1.00 1.00 O ATOM 534 CG2 THR A 32 -8.257 6.721 -7.813 1.00 1.00 C ATOM 0 H THR A 32 -8.129 3.091 -6.823 1.00 1.00 H new ATOM 0 HA THR A 32 -9.995 4.745 -8.410 1.00 1.00 H new ATOM 0 HB THR A 32 -8.313 5.647 -9.706 1.00 1.00 H new ATOM 0 HG1 THR A 32 -6.566 4.171 -8.742 1.00 1.00 H new ATOM 0 HG21 THR A 32 -7.562 7.495 -8.139 1.00 1.00 H new ATOM 0 HG22 THR A 32 -9.280 7.079 -7.930 1.00 1.00 H new ATOM 0 HG23 THR A 32 -8.073 6.486 -6.765 1.00 1.00 H new ATOM 542 N GLY A 33 -9.979 2.402 -9.429 1.00 1.00 N ATOM 543 CA GLY A 33 -10.058 1.119 -10.123 1.00 1.00 C ATOM 544 C GLY A 33 -11.512 0.706 -10.309 1.00 1.00 C ATOM 545 O GLY A 33 -12.373 1.565 -10.471 1.00 1.00 O ATOM 0 H GLY A 33 -10.899 2.778 -9.198 1.00 1.00 H new ATOM 0 HA2 GLY A 33 -9.567 1.192 -11.093 1.00 1.00 H new ATOM 0 HA3 GLY A 33 -9.527 0.357 -9.553 1.00 1.00 H new ATOM 549 N PHE A 34 -11.839 -0.587 -10.252 1.00 1.00 N ATOM 550 CA PHE A 34 -13.226 -1.058 -10.379 1.00 1.00 C ATOM 551 C PHE A 34 -14.170 -0.370 -9.380 1.00 1.00 C ATOM 552 O PHE A 34 -15.372 -0.317 -9.640 1.00 1.00 O ATOM 553 CB PHE A 34 -13.296 -2.574 -10.171 1.00 1.00 C ATOM 554 CG PHE A 34 -12.884 -2.929 -8.770 1.00 1.00 C ATOM 555 CD1 PHE A 34 -13.794 -2.815 -7.703 1.00 1.00 C ATOM 556 CD2 PHE A 34 -11.531 -3.138 -8.505 1.00 1.00 C ATOM 557 CE1 PHE A 34 -13.354 -2.921 -6.372 1.00 1.00 C ATOM 558 CE2 PHE A 34 -11.112 -3.173 -7.179 1.00 1.00 C ATOM 559 CZ PHE A 34 -12.001 -3.105 -6.120 1.00 1.00 C ATOM 0 H PHE A 34 -11.158 -1.334 -10.118 1.00 1.00 H new ATOM 0 HA PHE A 34 -13.554 -0.802 -11.387 1.00 1.00 H new ATOM 0 HB2 PHE A 34 -14.310 -2.927 -10.359 1.00 1.00 H new ATOM 0 HB3 PHE A 34 -12.645 -3.076 -10.887 1.00 1.00 H new ATOM 0 HD1 PHE A 34 -14.840 -2.644 -7.908 1.00 1.00 H new ATOM 0 HD2 PHE A 34 -10.824 -3.270 -9.311 1.00 1.00 H new ATOM 0 HE1 PHE A 34 -14.059 -2.860 -5.556 1.00 1.00 H new ATOM 0 HE2 PHE A 34 -10.056 -3.256 -6.968 1.00 1.00 H new ATOM 0 HZ PHE A 34 -11.645 -3.194 -5.104 1.00 1.00 H new ATOM 569 N ARG A 35 -13.638 0.199 -8.284 1.00 1.00 N ATOM 570 CA ARG A 35 -14.415 0.999 -7.326 1.00 1.00 C ATOM 571 C ARG A 35 -15.209 2.135 -7.969 1.00 1.00 C ATOM 572 O ARG A 35 -16.147 2.617 -7.348 1.00 1.00 O ATOM 573 CB ARG A 35 -13.460 1.665 -6.311 1.00 1.00 C ATOM 574 CG ARG A 35 -12.569 2.782 -6.909 1.00 1.00 C ATOM 575 CD ARG A 35 -13.065 4.212 -6.606 1.00 1.00 C ATOM 576 NE ARG A 35 -12.703 5.124 -7.701 1.00 1.00 N ATOM 577 CZ ARG A 35 -12.802 6.456 -7.759 1.00 1.00 C ATOM 578 NH1 ARG A 35 -13.116 7.184 -6.699 1.00 1.00 N ATOM 579 NH2 ARG A 35 -12.622 7.069 -8.924 1.00 1.00 N ATOM 0 H ARG A 35 -12.652 0.115 -8.038 1.00 1.00 H new ATOM 0 HA ARG A 35 -15.111 0.299 -6.865 1.00 1.00 H new ATOM 0 HB2 ARG A 35 -14.050 2.085 -5.497 1.00 1.00 H new ATOM 0 HB3 ARG A 35 -12.818 0.898 -5.877 1.00 1.00 H new ATOM 0 HG2 ARG A 35 -11.556 2.670 -6.522 1.00 1.00 H new ATOM 0 HG3 ARG A 35 -12.514 2.649 -7.989 1.00 1.00 H new ATOM 0 HD2 ARG A 35 -14.147 4.207 -6.471 1.00 1.00 H new ATOM 0 HD3 ARG A 35 -12.629 4.565 -5.672 1.00 1.00 H new ATOM 0 HE ARG A 35 -12.322 4.677 -8.535 1.00 1.00 H new ATOM 0 HH11 ARG A 35 -13.291 6.730 -5.802 1.00 1.00 H new ATOM 0 HH12 ARG A 35 -13.183 8.199 -6.779 1.00 1.00 H new ATOM 0 HH21 ARG A 35 -12.411 6.524 -9.760 1.00 1.00 H new ATOM 0 HH22 ARG A 35 -12.695 8.085 -8.982 1.00 1.00 H new ATOM 593 N ASP A 36 -14.818 2.572 -9.166 1.00 1.00 N ATOM 594 CA ASP A 36 -15.297 3.806 -9.798 1.00 1.00 C ATOM 595 C ASP A 36 -16.817 3.818 -10.023 1.00 1.00 C ATOM 596 O ASP A 36 -17.397 4.902 -10.146 1.00 1.00 O ATOM 597 CB ASP A 36 -14.560 4.048 -11.129 1.00 1.00 C ATOM 598 CG ASP A 36 -13.227 4.777 -10.963 1.00 1.00 C ATOM 599 OD1 ASP A 36 -12.329 4.292 -10.245 1.00 1.00 O ATOM 600 OD2 ASP A 36 -13.074 5.886 -11.518 1.00 1.00 O ATOM 0 H ASP A 36 -14.142 2.067 -9.739 1.00 1.00 H new ATOM 0 HA ASP A 36 -15.076 4.617 -9.103 1.00 1.00 H new ATOM 0 HB2 ASP A 36 -14.383 3.089 -11.617 1.00 1.00 H new ATOM 0 HB3 ASP A 36 -15.203 4.628 -11.791 1.00 1.00 H new ATOM 605 N ARG A 37 -17.458 2.640 -10.059 1.00 1.00 N ATOM 606 CA ARG A 37 -18.908 2.441 -10.177 1.00 1.00 C ATOM 607 C ARG A 37 -19.682 3.156 -9.052 1.00 1.00 C ATOM 608 O ARG A 37 -19.087 3.518 -8.032 1.00 1.00 O ATOM 609 CB ARG A 37 -19.212 0.924 -10.158 1.00 1.00 C ATOM 610 CG ARG A 37 -19.382 0.284 -11.547 1.00 1.00 C ATOM 611 CD ARG A 37 -18.111 0.285 -12.409 1.00 1.00 C ATOM 612 NE ARG A 37 -18.228 1.170 -13.581 1.00 1.00 N ATOM 613 CZ ARG A 37 -18.331 0.807 -14.866 1.00 1.00 C ATOM 614 NH1 ARG A 37 -18.421 -0.476 -15.200 1.00 1.00 N ATOM 615 NH2 ARG A 37 -18.328 1.720 -15.832 1.00 1.00 N ATOM 0 H ARG A 37 -16.952 1.756 -10.004 1.00 1.00 H new ATOM 0 HA ARG A 37 -19.239 2.878 -11.119 1.00 1.00 H new ATOM 0 HB2 ARG A 37 -18.405 0.412 -9.634 1.00 1.00 H new ATOM 0 HB3 ARG A 37 -20.122 0.757 -9.582 1.00 1.00 H new ATOM 0 HG2 ARG A 37 -19.719 -0.745 -11.420 1.00 1.00 H new ATOM 0 HG3 ARG A 37 -20.170 0.813 -12.083 1.00 1.00 H new ATOM 0 HD2 ARG A 37 -17.263 0.602 -11.801 1.00 1.00 H new ATOM 0 HD3 ARG A 37 -17.901 -0.731 -12.744 1.00 1.00 H new ATOM 0 HE ARG A 37 -18.231 2.172 -13.392 1.00 1.00 H new ATOM 0 HH11 ARG A 37 -18.412 -1.194 -14.475 1.00 1.00 H new ATOM 0 HH12 ARG A 37 -18.499 -0.743 -16.181 1.00 1.00 H new ATOM 0 HH21 ARG A 37 -18.247 2.710 -15.598 1.00 1.00 H new ATOM 0 HH22 ARG A 37 -18.407 1.431 -16.807 1.00 1.00 H new ATOM 629 N PRO A 38 -21.016 3.305 -9.184 1.00 1.00 N ATOM 630 CA PRO A 38 -21.884 3.666 -8.070 1.00 1.00 C ATOM 631 C PRO A 38 -21.697 2.694 -6.906 1.00 1.00 C ATOM 632 O PRO A 38 -21.202 1.571 -7.073 1.00 1.00 O ATOM 633 CB PRO A 38 -23.317 3.661 -8.611 1.00 1.00 C ATOM 634 CG PRO A 38 -23.220 2.743 -9.821 1.00 1.00 C ATOM 635 CD PRO A 38 -21.826 3.037 -10.360 1.00 1.00 C ATOM 0 HA PRO A 38 -21.642 4.652 -7.675 1.00 1.00 H new ATOM 0 HB2 PRO A 38 -24.026 3.284 -7.874 1.00 1.00 H new ATOM 0 HB3 PRO A 38 -23.648 4.662 -8.889 1.00 1.00 H new ATOM 0 HG2 PRO A 38 -23.333 1.695 -9.543 1.00 1.00 H new ATOM 0 HG3 PRO A 38 -23.993 2.963 -10.558 1.00 1.00 H new ATOM 0 HD2 PRO A 38 -21.435 2.190 -10.924 1.00 1.00 H new ATOM 0 HD3 PRO A 38 -21.836 3.893 -11.035 1.00 1.00 H new ATOM 643 N HIS A 39 -22.036 3.160 -5.707 1.00 1.00 N ATOM 644 CA HIS A 39 -21.502 2.542 -4.513 1.00 1.00 C ATOM 645 C HIS A 39 -22.211 1.242 -4.132 1.00 1.00 C ATOM 646 O HIS A 39 -23.301 0.943 -4.616 1.00 1.00 O ATOM 647 CB HIS A 39 -21.486 3.545 -3.357 1.00 1.00 C ATOM 648 CG HIS A 39 -20.520 3.083 -2.312 1.00 1.00 C ATOM 649 ND1 HIS A 39 -19.205 2.750 -2.552 1.00 1.00 N ATOM 650 CD2 HIS A 39 -20.878 2.589 -1.091 1.00 1.00 C ATOM 651 CE1 HIS A 39 -18.779 2.056 -1.483 1.00 1.00 C ATOM 652 NE2 HIS A 39 -19.776 1.888 -0.604 1.00 1.00 N ATOM 0 H HIS A 39 -22.665 3.947 -5.545 1.00 1.00 H new ATOM 0 HA HIS A 39 -20.475 2.252 -4.737 1.00 1.00 H new ATOM 0 HB2 HIS A 39 -21.200 4.532 -3.721 1.00 1.00 H new ATOM 0 HB3 HIS A 39 -22.484 3.640 -2.929 1.00 1.00 H new ATOM 0 HD1 HIS A 39 -18.660 2.985 -3.381 1.00 1.00 H new ATOM 0 HD2 HIS A 39 -21.830 2.717 -0.598 1.00 1.00 H new ATOM 0 HE1 HIS A 39 -17.773 1.685 -1.351 1.00 1.00 H new ATOM 660 N GLU A 40 -21.560 0.501 -3.233 1.00 1.00 N ATOM 661 CA GLU A 40 -21.997 -0.688 -2.499 1.00 1.00 C ATOM 662 C GLU A 40 -21.802 -1.959 -3.330 1.00 1.00 C ATOM 663 O GLU A 40 -21.721 -3.060 -2.789 1.00 1.00 O ATOM 664 CB GLU A 40 -23.433 -0.525 -1.974 1.00 1.00 C ATOM 665 CG GLU A 40 -23.742 -1.459 -0.799 1.00 1.00 C ATOM 666 CD GLU A 40 -25.164 -1.232 -0.292 1.00 1.00 C ATOM 667 OE1 GLU A 40 -25.401 -0.206 0.390 1.00 1.00 O ATOM 668 OE2 GLU A 40 -26.050 -2.069 -0.585 1.00 1.00 O ATOM 0 H GLU A 40 -20.605 0.748 -2.973 1.00 1.00 H new ATOM 0 HA GLU A 40 -21.362 -0.798 -1.620 1.00 1.00 H new ATOM 0 HB2 GLU A 40 -23.586 0.508 -1.662 1.00 1.00 H new ATOM 0 HB3 GLU A 40 -24.136 -0.721 -2.784 1.00 1.00 H new ATOM 0 HG2 GLU A 40 -23.623 -2.497 -1.111 1.00 1.00 H new ATOM 0 HG3 GLU A 40 -23.030 -1.285 0.008 1.00 1.00 H new ATOM 675 N GLU A 41 -21.623 -1.812 -4.640 1.00 1.00 N ATOM 676 CA GLU A 41 -21.580 -2.888 -5.605 1.00 1.00 C ATOM 677 C GLU A 41 -20.218 -3.555 -5.490 1.00 1.00 C ATOM 678 O GLU A 41 -20.098 -4.777 -5.636 1.00 1.00 O ATOM 679 CB GLU A 41 -21.798 -2.280 -6.998 1.00 1.00 C ATOM 680 CG GLU A 41 -21.914 -3.350 -8.088 1.00 1.00 C ATOM 681 CD GLU A 41 -21.916 -2.761 -9.499 1.00 1.00 C ATOM 682 OE1 GLU A 41 -22.305 -1.594 -9.708 1.00 1.00 O ATOM 683 OE2 GLU A 41 -21.518 -3.498 -10.430 1.00 1.00 O ATOM 0 H GLU A 41 -21.499 -0.895 -5.069 1.00 1.00 H new ATOM 0 HA GLU A 41 -22.352 -3.637 -5.430 1.00 1.00 H new ATOM 0 HB2 GLU A 41 -22.704 -1.674 -6.990 1.00 1.00 H new ATOM 0 HB3 GLU A 41 -20.969 -1.612 -7.234 1.00 1.00 H new ATOM 0 HG2 GLU A 41 -21.084 -4.050 -7.993 1.00 1.00 H new ATOM 0 HG3 GLU A 41 -22.831 -3.919 -7.936 1.00 1.00 H new ATOM 690 N ARG A 42 -19.188 -2.742 -5.213 1.00 1.00 N ATOM 691 CA ARG A 42 -17.816 -3.166 -5.039 1.00 1.00 C ATOM 692 C ARG A 42 -17.293 -3.190 -3.606 1.00 1.00 C ATOM 693 O ARG A 42 -16.205 -3.700 -3.433 1.00 1.00 O ATOM 694 CB ARG A 42 -16.842 -2.824 -6.198 1.00 1.00 C ATOM 695 CG ARG A 42 -17.384 -3.328 -7.561 1.00 1.00 C ATOM 696 CD ARG A 42 -17.991 -2.266 -8.487 1.00 1.00 C ATOM 697 NE ARG A 42 -17.331 -2.283 -9.805 1.00 1.00 N ATOM 698 CZ ARG A 42 -17.691 -2.929 -10.923 1.00 1.00 C ATOM 699 NH1 ARG A 42 -18.865 -3.530 -11.050 1.00 1.00 N ATOM 700 NH2 ARG A 42 -16.859 -2.968 -11.958 1.00 1.00 N ATOM 0 H ARG A 42 -19.306 -1.735 -5.102 1.00 1.00 H new ATOM 0 HA ARG A 42 -17.863 -4.244 -5.195 1.00 1.00 H new ATOM 0 HB2 ARG A 42 -16.691 -1.745 -6.241 1.00 1.00 H new ATOM 0 HB3 ARG A 42 -15.869 -3.275 -6.003 1.00 1.00 H new ATOM 0 HG2 ARG A 42 -16.569 -3.819 -8.092 1.00 1.00 H new ATOM 0 HG3 ARG A 42 -18.142 -4.087 -7.368 1.00 1.00 H new ATOM 0 HD2 ARG A 42 -19.059 -2.449 -8.607 1.00 1.00 H new ATOM 0 HD3 ARG A 42 -17.886 -1.280 -8.035 1.00 1.00 H new ATOM 0 HE ARG A 42 -16.480 -1.724 -9.876 1.00 1.00 H new ATOM 0 HH11 ARG A 42 -19.533 -3.512 -10.280 1.00 1.00 H new ATOM 0 HH12 ARG A 42 -19.100 -4.011 -11.918 1.00 1.00 H new ATOM 0 HH21 ARG A 42 -15.951 -2.508 -11.900 1.00 1.00 H new ATOM 0 HH22 ARG A 42 -17.129 -3.458 -12.811 1.00 1.00 H new ATOM 714 N GLN A 43 -17.948 -2.625 -2.587 1.00 1.00 N ATOM 715 CA GLN A 43 -17.445 -2.581 -1.196 1.00 1.00 C ATOM 716 C GLN A 43 -16.833 -3.915 -0.717 1.00 1.00 C ATOM 717 O GLN A 43 -15.810 -3.926 -0.038 1.00 1.00 O ATOM 718 CB GLN A 43 -18.562 -2.164 -0.225 1.00 1.00 C ATOM 719 CG GLN A 43 -18.117 -1.035 0.720 1.00 1.00 C ATOM 720 CD GLN A 43 -19.131 -0.786 1.835 1.00 1.00 C ATOM 721 OE1 GLN A 43 -19.272 -1.601 2.741 1.00 1.00 O ATOM 722 NE2 GLN A 43 -19.855 0.315 1.824 1.00 1.00 N ATOM 0 H GLN A 43 -18.857 -2.176 -2.699 1.00 1.00 H new ATOM 0 HA GLN A 43 -16.647 -1.839 -1.198 1.00 1.00 H new ATOM 0 HB2 GLN A 43 -19.433 -1.838 -0.794 1.00 1.00 H new ATOM 0 HB3 GLN A 43 -18.871 -3.028 0.364 1.00 1.00 H new ATOM 0 HG2 GLN A 43 -17.152 -1.289 1.158 1.00 1.00 H new ATOM 0 HG3 GLN A 43 -17.976 -0.118 0.148 1.00 1.00 H new ATOM 0 HE21 GLN A 43 -19.739 0.994 1.072 1.00 1.00 H new ATOM 0 HE22 GLN A 43 -20.531 0.488 2.568 1.00 1.00 H new ATOM 731 N THR A 44 -17.464 -5.048 -1.007 1.00 1.00 N ATOM 732 CA THR A 44 -16.850 -6.357 -0.740 1.00 1.00 C ATOM 733 C THR A 44 -15.663 -6.650 -1.673 1.00 1.00 C ATOM 734 O THR A 44 -14.569 -6.975 -1.203 1.00 1.00 O ATOM 735 CB THR A 44 -17.954 -7.421 -0.820 1.00 1.00 C ATOM 736 OG1 THR A 44 -18.884 -7.205 0.218 1.00 1.00 O ATOM 737 CG2 THR A 44 -17.384 -8.833 -0.734 1.00 1.00 C ATOM 0 H THR A 44 -18.394 -5.094 -1.424 1.00 1.00 H new ATOM 0 HA THR A 44 -16.416 -6.365 0.260 1.00 1.00 H new ATOM 0 HB THR A 44 -18.450 -7.330 -1.786 1.00 1.00 H new ATOM 0 HG1 THR A 44 -19.592 -7.881 0.169 1.00 1.00 H new ATOM 0 HG21 THR A 44 -18.196 -9.558 -0.794 1.00 1.00 H new ATOM 0 HG22 THR A 44 -16.690 -8.996 -1.559 1.00 1.00 H new ATOM 0 HG23 THR A 44 -16.858 -8.956 0.213 1.00 1.00 H new ATOM 745 N ARG A 45 -15.826 -6.537 -2.992 1.00 1.00 N ATOM 746 CA ARG A 45 -14.740 -6.665 -3.972 1.00 1.00 C ATOM 747 C ARG A 45 -13.551 -5.781 -3.631 1.00 1.00 C ATOM 748 O ARG A 45 -12.433 -6.171 -3.898 1.00 1.00 O ATOM 749 CB ARG A 45 -15.312 -6.319 -5.348 1.00 1.00 C ATOM 750 CG ARG A 45 -14.328 -6.222 -6.536 1.00 1.00 C ATOM 751 CD ARG A 45 -14.550 -7.253 -7.644 1.00 1.00 C ATOM 752 NE ARG A 45 -15.927 -7.202 -8.171 1.00 1.00 N ATOM 753 CZ ARG A 45 -16.382 -7.718 -9.318 1.00 1.00 C ATOM 754 NH1 ARG A 45 -15.563 -8.210 -10.239 1.00 1.00 N ATOM 755 NH2 ARG A 45 -17.688 -7.717 -9.543 1.00 1.00 N ATOM 0 H ARG A 45 -16.733 -6.350 -3.420 1.00 1.00 H new ATOM 0 HA ARG A 45 -14.361 -7.687 -3.963 1.00 1.00 H new ATOM 0 HB2 ARG A 45 -16.063 -7.069 -5.596 1.00 1.00 H new ATOM 0 HB3 ARG A 45 -15.831 -5.364 -5.264 1.00 1.00 H new ATOM 0 HG2 ARG A 45 -14.401 -5.224 -6.969 1.00 1.00 H new ATOM 0 HG3 ARG A 45 -13.312 -6.331 -6.157 1.00 1.00 H new ATOM 0 HD2 ARG A 45 -13.844 -7.074 -8.454 1.00 1.00 H new ATOM 0 HD3 ARG A 45 -14.345 -8.252 -7.258 1.00 1.00 H new ATOM 0 HE ARG A 45 -16.613 -6.716 -7.593 1.00 1.00 H new ATOM 0 HH11 ARG A 45 -14.555 -8.201 -10.082 1.00 1.00 H new ATOM 0 HH12 ARG A 45 -15.941 -8.597 -11.104 1.00 1.00 H new ATOM 0 HH21 ARG A 45 -18.325 -7.328 -8.848 1.00 1.00 H new ATOM 0 HH22 ARG A 45 -18.056 -8.106 -10.411 1.00 1.00 H new ATOM 769 N PHE A 46 -13.752 -4.645 -2.994 1.00 1.00 N ATOM 770 CA PHE A 46 -12.736 -3.736 -2.493 1.00 1.00 C ATOM 771 C PHE A 46 -11.763 -4.479 -1.599 1.00 1.00 C ATOM 772 O PHE A 46 -10.569 -4.544 -1.892 1.00 1.00 O ATOM 773 CB PHE A 46 -13.430 -2.558 -1.810 1.00 1.00 C ATOM 774 CG PHE A 46 -12.726 -1.922 -0.640 1.00 1.00 C ATOM 775 CD1 PHE A 46 -11.605 -1.121 -0.907 1.00 1.00 C ATOM 776 CD2 PHE A 46 -13.226 -2.029 0.677 1.00 1.00 C ATOM 777 CE1 PHE A 46 -11.049 -0.328 0.101 1.00 1.00 C ATOM 778 CE2 PHE A 46 -12.695 -1.194 1.664 1.00 1.00 C ATOM 779 CZ PHE A 46 -11.650 -0.313 1.362 1.00 1.00 C ATOM 0 H PHE A 46 -14.695 -4.308 -2.798 1.00 1.00 H new ATOM 0 HA PHE A 46 -12.134 -3.330 -3.306 1.00 1.00 H new ATOM 0 HB2 PHE A 46 -13.600 -1.786 -2.561 1.00 1.00 H new ATOM 0 HB3 PHE A 46 -14.410 -2.895 -1.471 1.00 1.00 H new ATOM 0 HD1 PHE A 46 -11.170 -1.117 -1.896 1.00 1.00 H new ATOM 0 HD2 PHE A 46 -14.002 -2.741 0.916 1.00 1.00 H new ATOM 0 HE1 PHE A 46 -10.167 0.265 -0.092 1.00 1.00 H new ATOM 0 HE2 PHE A 46 -13.094 -1.229 2.667 1.00 1.00 H new ATOM 0 HZ PHE A 46 -11.305 0.385 2.111 1.00 1.00 H new ATOM 789 N GLN A 47 -12.295 -5.126 -0.569 1.00 1.00 N ATOM 790 CA GLN A 47 -11.488 -5.924 0.339 1.00 1.00 C ATOM 791 C GLN A 47 -10.905 -7.142 -0.381 1.00 1.00 C ATOM 792 O GLN A 47 -9.894 -7.659 0.079 1.00 1.00 O ATOM 793 CB GLN A 47 -12.393 -6.325 1.516 1.00 1.00 C ATOM 794 CG GLN A 47 -12.633 -5.155 2.501 1.00 1.00 C ATOM 795 CD GLN A 47 -14.115 -4.963 2.840 1.00 1.00 C ATOM 796 OE1 GLN A 47 -14.914 -5.889 2.786 1.00 1.00 O ATOM 797 NE2 GLN A 47 -14.499 -3.797 3.336 1.00 1.00 N ATOM 0 H GLN A 47 -13.289 -5.112 -0.343 1.00 1.00 H new ATOM 0 HA GLN A 47 -10.634 -5.356 0.708 1.00 1.00 H new ATOM 0 HB2 GLN A 47 -13.351 -6.675 1.131 1.00 1.00 H new ATOM 0 HB3 GLN A 47 -11.940 -7.160 2.051 1.00 1.00 H new ATOM 0 HG2 GLN A 47 -12.075 -5.338 3.419 1.00 1.00 H new ATOM 0 HG3 GLN A 47 -12.241 -4.235 2.068 1.00 1.00 H new ATOM 0 HE21 GLN A 47 -13.839 -3.021 3.384 1.00 1.00 H new ATOM 0 HE22 GLN A 47 -15.455 -3.675 3.670 1.00 1.00 H new ATOM 806 N ASN A 48 -11.452 -7.581 -1.521 1.00 1.00 N ATOM 807 CA ASN A 48 -10.962 -8.772 -2.203 1.00 1.00 C ATOM 808 C ASN A 48 -9.998 -8.450 -3.346 1.00 1.00 C ATOM 809 O ASN A 48 -9.168 -9.293 -3.665 1.00 1.00 O ATOM 810 CB ASN A 48 -12.134 -9.652 -2.638 1.00 1.00 C ATOM 811 CG ASN A 48 -12.761 -10.315 -1.420 1.00 1.00 C ATOM 812 OD1 ASN A 48 -12.237 -11.304 -0.926 1.00 1.00 O ATOM 813 ND2 ASN A 48 -13.821 -9.761 -0.859 1.00 1.00 N ATOM 0 H ASN A 48 -12.236 -7.124 -1.987 1.00 1.00 H new ATOM 0 HA ASN A 48 -10.365 -9.343 -1.491 1.00 1.00 H new ATOM 0 HB2 ASN A 48 -12.878 -9.050 -3.159 1.00 1.00 H new ATOM 0 HB3 ASN A 48 -11.789 -10.411 -3.340 1.00 1.00 H new ATOM 0 HD21 ASN A 48 -14.212 -10.158 -0.004 1.00 1.00 H new ATOM 0 HD22 ASN A 48 -14.249 -8.937 -1.281 1.00 1.00 H new ATOM 820 N ALA A 49 -10.019 -7.247 -3.921 1.00 1.00 N ATOM 821 CA ALA A 49 -9.031 -6.706 -4.853 1.00 1.00 C ATOM 822 C ALA A 49 -7.774 -6.306 -4.082 1.00 1.00 C ATOM 823 O ALA A 49 -6.670 -6.362 -4.617 1.00 1.00 O ATOM 824 CB ALA A 49 -9.640 -5.490 -5.597 1.00 1.00 C ATOM 0 H ALA A 49 -10.772 -6.585 -3.737 1.00 1.00 H new ATOM 0 HA ALA A 49 -8.757 -7.460 -5.591 1.00 1.00 H new ATOM 0 HB1 ALA A 49 -8.906 -5.084 -6.293 1.00 1.00 H new ATOM 0 HB2 ALA A 49 -10.526 -5.807 -6.148 1.00 1.00 H new ATOM 0 HB3 ALA A 49 -9.918 -4.723 -4.874 1.00 1.00 H new ATOM 830 N CYS A 50 -7.942 -5.968 -2.805 1.00 1.00 N ATOM 831 CA CYS A 50 -6.880 -5.915 -1.813 1.00 1.00 C ATOM 832 C CYS A 50 -6.288 -7.308 -1.516 1.00 1.00 C ATOM 833 O CYS A 50 -5.085 -7.442 -1.335 1.00 1.00 O ATOM 834 CB CYS A 50 -7.483 -5.229 -0.570 1.00 1.00 C ATOM 835 SG CYS A 50 -7.803 -3.488 -0.938 1.00 1.00 S ATOM 0 H CYS A 50 -8.854 -5.716 -2.424 1.00 1.00 H new ATOM 0 HA CYS A 50 -6.027 -5.343 -2.179 1.00 1.00 H new ATOM 0 HB2 CYS A 50 -8.408 -5.726 -0.280 1.00 1.00 H new ATOM 0 HB3 CYS A 50 -6.798 -5.313 0.273 1.00 1.00 H new ATOM 0 HG CYS A 50 -8.998 -3.362 -1.433 1.00 1.00 H new ATOM 841 N ARG A 51 -7.097 -8.373 -1.471 1.00 1.00 N ATOM 842 CA ARG A 51 -6.606 -9.725 -1.162 1.00 1.00 C ATOM 843 C ARG A 51 -6.059 -10.407 -2.380 1.00 1.00 C ATOM 844 O ARG A 51 -5.273 -11.337 -2.234 1.00 1.00 O ATOM 845 CB ARG A 51 -7.682 -10.642 -0.568 1.00 1.00 C ATOM 846 CG ARG A 51 -7.880 -10.275 0.893 1.00 1.00 C ATOM 847 CD ARG A 51 -8.550 -11.382 1.725 1.00 1.00 C ATOM 848 NE ARG A 51 -9.789 -11.903 1.109 1.00 1.00 N ATOM 849 CZ ARG A 51 -10.150 -13.193 1.030 1.00 1.00 C ATOM 850 NH1 ARG A 51 -9.462 -14.144 1.647 1.00 1.00 N ATOM 851 NH2 ARG A 51 -11.201 -13.532 0.299 1.00 1.00 N ATOM 0 H ARG A 51 -8.101 -8.326 -1.646 1.00 1.00 H new ATOM 0 HA ARG A 51 -5.823 -9.569 -0.420 1.00 1.00 H new ATOM 0 HB2 ARG A 51 -8.618 -10.531 -1.116 1.00 1.00 H new ATOM 0 HB3 ARG A 51 -7.381 -11.686 -0.658 1.00 1.00 H new ATOM 0 HG2 ARG A 51 -6.911 -10.038 1.333 1.00 1.00 H new ATOM 0 HG3 ARG A 51 -8.486 -9.371 0.952 1.00 1.00 H new ATOM 0 HD2 ARG A 51 -7.846 -12.203 1.860 1.00 1.00 H new ATOM 0 HD3 ARG A 51 -8.780 -10.993 2.717 1.00 1.00 H new ATOM 0 HE ARG A 51 -10.429 -11.218 0.707 1.00 1.00 H new ATOM 0 HH11 ARG A 51 -8.638 -13.902 2.197 1.00 1.00 H new ATOM 0 HH12 ARG A 51 -9.757 -15.118 1.571 1.00 1.00 H new ATOM 0 HH21 ARG A 51 -11.729 -12.815 -0.198 1.00 1.00 H new ATOM 0 HH22 ARG A 51 -11.482 -14.510 0.233 1.00 1.00 H new ATOM 865 N ASP A 52 -6.443 -9.935 -3.561 1.00 1.00 N ATOM 866 CA ASP A 52 -5.920 -10.426 -4.824 1.00 1.00 C ATOM 867 C ASP A 52 -4.397 -10.344 -4.783 1.00 1.00 C ATOM 868 O ASP A 52 -3.718 -11.231 -5.305 1.00 1.00 O ATOM 869 CB ASP A 52 -6.496 -9.575 -5.961 1.00 1.00 C ATOM 870 CG ASP A 52 -6.920 -10.404 -7.168 1.00 1.00 C ATOM 871 OD1 ASP A 52 -6.216 -11.342 -7.583 1.00 1.00 O ATOM 872 OD2 ASP A 52 -8.033 -10.118 -7.671 1.00 1.00 O ATOM 0 H ASP A 52 -7.134 -9.192 -3.666 1.00 1.00 H new ATOM 0 HA ASP A 52 -6.207 -11.464 -4.993 1.00 1.00 H new ATOM 0 HB2 ASP A 52 -7.356 -9.017 -5.590 1.00 1.00 H new ATOM 0 HB3 ASP A 52 -5.751 -8.843 -6.273 1.00 1.00 H new ATOM 877 N GLY A 53 -3.865 -9.363 -4.039 1.00 1.00 N ATOM 878 CA GLY A 53 -2.432 -9.147 -3.960 1.00 1.00 C ATOM 879 C GLY A 53 -2.220 -7.673 -4.192 1.00 1.00 C ATOM 880 O GLY A 53 -2.815 -6.881 -3.477 1.00 1.00 O ATOM 0 H GLY A 53 -4.418 -8.709 -3.485 1.00 1.00 H new ATOM 0 HA2 GLY A 53 -2.045 -9.448 -2.986 1.00 1.00 H new ATOM 0 HA3 GLY A 53 -1.906 -9.739 -4.709 1.00 1.00 H new ATOM 884 N ARG A 54 -1.420 -7.281 -5.189 1.00 1.00 N ATOM 885 CA ARG A 54 -1.263 -5.874 -5.569 1.00 1.00 C ATOM 886 C ARG A 54 -2.624 -5.242 -5.854 1.00 1.00 C ATOM 887 O ARG A 54 -3.572 -5.929 -6.238 1.00 1.00 O ATOM 888 CB ARG A 54 -0.347 -5.725 -6.800 1.00 1.00 C ATOM 889 CG ARG A 54 -0.818 -6.550 -8.015 1.00 1.00 C ATOM 890 CD ARG A 54 -1.118 -5.715 -9.261 1.00 1.00 C ATOM 891 NE ARG A 54 -2.010 -4.566 -9.003 1.00 1.00 N ATOM 892 CZ ARG A 54 -2.838 -4.030 -9.908 1.00 1.00 C ATOM 893 NH1 ARG A 54 -3.352 -4.726 -10.917 1.00 1.00 N ATOM 894 NH2 ARG A 54 -3.149 -2.751 -9.786 1.00 1.00 N ATOM 0 H ARG A 54 -0.866 -7.926 -5.752 1.00 1.00 H new ATOM 0 HA ARG A 54 -0.797 -5.355 -4.731 1.00 1.00 H new ATOM 0 HB2 ARG A 54 -0.297 -4.673 -7.081 1.00 1.00 H new ATOM 0 HB3 ARG A 54 0.664 -6.032 -6.531 1.00 1.00 H new ATOM 0 HG2 ARG A 54 -0.052 -7.285 -8.260 1.00 1.00 H new ATOM 0 HG3 ARG A 54 -1.715 -7.104 -7.738 1.00 1.00 H new ATOM 0 HD2 ARG A 54 -0.179 -5.349 -9.677 1.00 1.00 H new ATOM 0 HD3 ARG A 54 -1.574 -6.355 -10.016 1.00 1.00 H new ATOM 0 HE ARG A 54 -1.994 -4.152 -8.071 1.00 1.00 H new ATOM 0 HH11 ARG A 54 -3.119 -5.713 -11.026 1.00 1.00 H new ATOM 0 HH12 ARG A 54 -3.979 -4.273 -11.582 1.00 1.00 H new ATOM 0 HH21 ARG A 54 -2.761 -2.203 -9.019 1.00 1.00 H new ATOM 0 HH22 ARG A 54 -3.777 -2.312 -10.459 1.00 1.00 H new ATOM 908 N SER A 55 -2.682 -3.918 -5.785 1.00 1.00 N ATOM 909 CA SER A 55 -3.874 -3.195 -6.247 1.00 1.00 C ATOM 910 C SER A 55 -3.500 -1.829 -6.827 1.00 1.00 C ATOM 911 O SER A 55 -2.372 -1.653 -7.288 1.00 1.00 O ATOM 912 CB SER A 55 -4.953 -3.144 -5.147 1.00 1.00 C ATOM 913 OG SER A 55 -6.153 -3.699 -5.641 1.00 1.00 O ATOM 0 H SER A 55 -1.935 -3.326 -5.421 1.00 1.00 H new ATOM 0 HA SER A 55 -4.326 -3.746 -7.072 1.00 1.00 H new ATOM 0 HB2 SER A 55 -4.619 -3.696 -4.269 1.00 1.00 H new ATOM 0 HB3 SER A 55 -5.119 -2.114 -4.832 1.00 1.00 H new ATOM 0 HG SER A 55 -6.261 -4.608 -5.291 1.00 1.00 H new ATOM 919 N GLU A 56 -4.444 -0.896 -6.924 1.00 1.00 N ATOM 920 CA GLU A 56 -4.283 0.434 -7.501 1.00 1.00 C ATOM 921 C GLU A 56 -5.082 1.401 -6.634 1.00 1.00 C ATOM 922 O GLU A 56 -6.294 1.241 -6.478 1.00 1.00 O ATOM 923 CB GLU A 56 -4.754 0.445 -8.965 1.00 1.00 C ATOM 924 CG GLU A 56 -3.588 0.515 -9.962 1.00 1.00 C ATOM 925 CD GLU A 56 -4.031 0.146 -11.383 1.00 1.00 C ATOM 926 OE1 GLU A 56 -4.283 -1.049 -11.664 1.00 1.00 O ATOM 927 OE2 GLU A 56 -4.104 1.030 -12.267 1.00 1.00 O ATOM 0 H GLU A 56 -5.392 -1.057 -6.584 1.00 1.00 H new ATOM 0 HA GLU A 56 -3.236 0.735 -7.515 1.00 1.00 H new ATOM 0 HB2 GLU A 56 -5.340 -0.453 -9.160 1.00 1.00 H new ATOM 0 HB3 GLU A 56 -5.414 1.298 -9.124 1.00 1.00 H new ATOM 0 HG2 GLU A 56 -3.169 1.521 -9.962 1.00 1.00 H new ATOM 0 HG3 GLU A 56 -2.795 -0.160 -9.642 1.00 1.00 H new ATOM 934 N ILE A 57 -4.387 2.349 -6.011 1.00 1.00 N ATOM 935 CA ILE A 57 -4.955 3.369 -5.132 1.00 1.00 C ATOM 936 C ILE A 57 -4.355 4.699 -5.628 1.00 1.00 C ATOM 937 O ILE A 57 -3.443 4.713 -6.452 1.00 1.00 O ATOM 938 CB ILE A 57 -4.727 2.972 -3.632 1.00 1.00 C ATOM 939 CG1 ILE A 57 -5.314 1.558 -3.338 1.00 1.00 C ATOM 940 CG2 ILE A 57 -5.347 3.973 -2.641 1.00 1.00 C ATOM 941 CD1 ILE A 57 -5.425 1.106 -1.866 1.00 1.00 C ATOM 0 H ILE A 57 -3.375 2.432 -6.108 1.00 1.00 H new ATOM 0 HA ILE A 57 -6.039 3.472 -5.171 1.00 1.00 H new ATOM 0 HB ILE A 57 -3.647 2.976 -3.487 1.00 1.00 H new ATOM 0 HG12 ILE A 57 -6.311 1.514 -3.776 1.00 1.00 H new ATOM 0 HG13 ILE A 57 -4.701 0.827 -3.866 1.00 1.00 H new ATOM 0 HG21 ILE A 57 -5.154 3.641 -1.621 1.00 1.00 H new ATOM 0 HG22 ILE A 57 -4.904 4.957 -2.793 1.00 1.00 H new ATOM 0 HG23 ILE A 57 -6.423 4.030 -2.807 1.00 1.00 H new ATOM 0 HD11 ILE A 57 -5.851 0.103 -1.824 1.00 1.00 H new ATOM 0 HD12 ILE A 57 -4.434 1.099 -1.412 1.00 1.00 H new ATOM 0 HD13 ILE A 57 -6.069 1.796 -1.321 1.00 1.00 H new ATOM 953 N ALA A 58 -4.880 5.841 -5.213 1.00 1.00 N ATOM 954 CA ALA A 58 -4.295 7.138 -5.485 1.00 1.00 C ATOM 955 C ALA A 58 -4.355 8.014 -4.242 1.00 1.00 C ATOM 956 O ALA A 58 -5.119 7.756 -3.315 1.00 1.00 O ATOM 957 CB ALA A 58 -5.045 7.797 -6.641 1.00 1.00 C ATOM 0 H ALA A 58 -5.741 5.890 -4.668 1.00 1.00 H new ATOM 0 HA ALA A 58 -3.248 7.013 -5.763 1.00 1.00 H new ATOM 0 HB1 ALA A 58 -4.608 8.774 -6.849 1.00 1.00 H new ATOM 0 HB2 ALA A 58 -4.969 7.169 -7.529 1.00 1.00 H new ATOM 0 HB3 ALA A 58 -6.094 7.919 -6.371 1.00 1.00 H new ATOM 963 N PHE A 59 -3.576 9.091 -4.238 1.00 1.00 N ATOM 964 CA PHE A 59 -3.714 10.156 -3.258 1.00 1.00 C ATOM 965 C PHE A 59 -4.681 11.216 -3.759 1.00 1.00 C ATOM 966 O PHE A 59 -5.073 11.207 -4.926 1.00 1.00 O ATOM 967 CB PHE A 59 -2.329 10.747 -2.891 1.00 1.00 C ATOM 968 CG PHE A 59 -1.610 9.903 -1.880 1.00 1.00 C ATOM 969 CD1 PHE A 59 -1.033 8.693 -2.296 1.00 1.00 C ATOM 970 CD2 PHE A 59 -1.556 10.303 -0.532 1.00 1.00 C ATOM 971 CE1 PHE A 59 -0.435 7.857 -1.330 1.00 1.00 C ATOM 972 CE2 PHE A 59 -0.964 9.463 0.420 1.00 1.00 C ATOM 973 CZ PHE A 59 -0.422 8.229 0.025 1.00 1.00 C ATOM 0 H PHE A 59 -2.831 9.248 -4.917 1.00 1.00 H new ATOM 0 HA PHE A 59 -4.135 9.742 -2.342 1.00 1.00 H new ATOM 0 HB2 PHE A 59 -1.721 10.832 -3.791 1.00 1.00 H new ATOM 0 HB3 PHE A 59 -2.457 11.755 -2.497 1.00 1.00 H new ATOM 0 HD1 PHE A 59 -1.047 8.407 -3.337 1.00 1.00 H new ATOM 0 HD2 PHE A 59 -1.970 11.255 -0.232 1.00 1.00 H new ATOM 0 HE1 PHE A 59 0.016 6.924 -1.634 1.00 1.00 H new ATOM 0 HE2 PHE A 59 -0.924 9.764 1.456 1.00 1.00 H new ATOM 0 HZ PHE A 59 0.005 7.566 0.763 1.00 1.00 H new ATOM 983 N VAL A 60 -5.029 12.147 -2.873 1.00 1.00 N ATOM 984 CA VAL A 60 -5.895 13.285 -3.158 1.00 1.00 C ATOM 985 C VAL A 60 -5.142 14.601 -2.946 1.00 1.00 C ATOM 986 O VAL A 60 -5.304 15.511 -3.758 1.00 1.00 O ATOM 987 CB VAL A 60 -7.160 13.175 -2.286 1.00 1.00 C ATOM 988 CG1 VAL A 60 -8.030 14.432 -2.289 1.00 1.00 C ATOM 989 CG2 VAL A 60 -8.023 11.995 -2.730 1.00 1.00 C ATOM 0 H VAL A 60 -4.704 12.128 -1.906 1.00 1.00 H new ATOM 0 HA VAL A 60 -6.202 13.276 -4.204 1.00 1.00 H new ATOM 0 HB VAL A 60 -6.790 13.032 -1.271 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -8.900 14.274 -1.652 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -7.452 15.275 -1.911 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -8.359 14.644 -3.306 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -8.911 11.936 -2.100 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -8.323 12.134 -3.769 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -7.452 11.071 -2.638 1.00 1.00 H new ATOM 999 N ALA A 61 -4.305 14.696 -1.903 1.00 1.00 N ATOM 1000 CA ALA A 61 -3.650 15.931 -1.496 1.00 1.00 C ATOM 1001 C ALA A 61 -2.850 16.511 -2.658 1.00 1.00 C ATOM 1002 O ALA A 61 -3.204 17.563 -3.187 1.00 1.00 O ATOM 1003 CB ALA A 61 -2.784 15.683 -0.259 1.00 1.00 C ATOM 0 H ALA A 61 -4.065 13.899 -1.314 1.00 1.00 H new ATOM 0 HA ALA A 61 -4.402 16.671 -1.222 1.00 1.00 H new ATOM 0 HB1 ALA A 61 -2.298 16.613 0.038 1.00 1.00 H new ATOM 0 HB2 ALA A 61 -3.410 15.324 0.558 1.00 1.00 H new ATOM 0 HB3 ALA A 61 -2.025 14.935 -0.490 1.00 1.00 H new ATOM 1009 N THR A 62 -1.824 15.785 -3.097 1.00 1.00 N ATOM 1010 CA THR A 62 -1.153 16.065 -4.359 1.00 1.00 C ATOM 1011 C THR A 62 -1.899 15.413 -5.525 1.00 1.00 C ATOM 1012 O THR A 62 -1.893 15.972 -6.622 1.00 1.00 O ATOM 1013 CB THR A 62 0.297 15.576 -4.254 1.00 1.00 C ATOM 1014 OG1 THR A 62 1.059 16.449 -3.442 1.00 1.00 O ATOM 1015 CG2 THR A 62 1.020 15.442 -5.590 1.00 1.00 C ATOM 0 H THR A 62 -1.438 14.990 -2.588 1.00 1.00 H new ATOM 0 HA THR A 62 -1.150 17.137 -4.557 1.00 1.00 H new ATOM 0 HB THR A 62 0.218 14.580 -3.819 1.00 1.00 H new ATOM 0 HG1 THR A 62 1.570 15.926 -2.789 1.00 1.00 H new ATOM 0 HG21 THR A 62 2.038 15.091 -5.419 1.00 1.00 H new ATOM 0 HG22 THR A 62 0.491 14.727 -6.220 1.00 1.00 H new ATOM 0 HG23 THR A 62 1.049 16.412 -6.087 1.00 1.00 H new ATOM 1023 N GLY A 63 -2.514 14.239 -5.330 1.00 1.00 N ATOM 1024 CA GLY A 63 -3.021 13.468 -6.446 1.00 1.00 C ATOM 1025 C GLY A 63 -1.863 12.702 -7.061 1.00 1.00 C ATOM 1026 O GLY A 63 -1.138 13.222 -7.908 1.00 1.00 O ATOM 0 H GLY A 63 -2.666 13.815 -4.415 1.00 1.00 H new ATOM 0 HA2 GLY A 63 -3.796 12.779 -6.111 1.00 1.00 H new ATOM 0 HA3 GLY A 63 -3.477 14.126 -7.186 1.00 1.00 H new ATOM 1030 N THR A 64 -1.621 11.478 -6.599 1.00 1.00 N ATOM 1031 CA THR A 64 -0.741 10.568 -7.311 1.00 1.00 C ATOM 1032 C THR A 64 -1.406 9.202 -7.278 1.00 1.00 C ATOM 1033 O THR A 64 -1.584 8.650 -6.193 1.00 1.00 O ATOM 1034 CB THR A 64 0.650 10.622 -6.666 1.00 1.00 C ATOM 1035 OG1 THR A 64 1.326 11.789 -7.104 1.00 1.00 O ATOM 1036 CG2 THR A 64 1.537 9.406 -6.955 1.00 1.00 C ATOM 0 H THR A 64 -2.021 11.099 -5.740 1.00 1.00 H new ATOM 0 HA THR A 64 -0.587 10.834 -8.357 1.00 1.00 H new ATOM 0 HB THR A 64 0.476 10.629 -5.590 1.00 1.00 H new ATOM 0 HG1 THR A 64 0.674 12.435 -7.449 1.00 1.00 H new ATOM 0 HG21 THR A 64 2.500 9.532 -6.459 1.00 1.00 H new ATOM 0 HG22 THR A 64 1.051 8.504 -6.581 1.00 1.00 H new ATOM 0 HG23 THR A 64 1.692 9.316 -8.030 1.00 1.00 H new ATOM 1044 N ASN A 65 -1.816 8.698 -8.443 1.00 1.00 N ATOM 1045 CA ASN A 65 -2.055 7.285 -8.665 1.00 1.00 C ATOM 1046 C ASN A 65 -0.791 6.529 -8.289 1.00 1.00 C ATOM 1047 O ASN A 65 0.304 6.927 -8.700 1.00 1.00 O ATOM 1048 CB ASN A 65 -2.407 7.007 -10.135 1.00 1.00 C ATOM 1049 CG ASN A 65 -1.976 5.604 -10.544 1.00 1.00 C ATOM 1050 OD1 ASN A 65 -2.628 4.622 -10.213 1.00 1.00 O ATOM 1051 ND2 ASN A 65 -0.858 5.483 -11.237 1.00 1.00 N ATOM 0 H ASN A 65 -1.992 9.274 -9.266 1.00 1.00 H new ATOM 0 HA ASN A 65 -2.897 6.960 -8.055 1.00 1.00 H new ATOM 0 HB2 ASN A 65 -3.481 7.119 -10.283 1.00 1.00 H new ATOM 0 HB3 ASN A 65 -1.919 7.742 -10.775 1.00 1.00 H new ATOM 0 HD21 ASN A 65 -0.523 4.558 -11.507 1.00 1.00 H new ATOM 0 HD22 ASN A 65 -0.330 6.314 -11.503 1.00 1.00 H new ATOM 1058 N LEU A 66 -0.930 5.432 -7.555 1.00 1.00 N ATOM 1059 CA LEU A 66 0.151 4.536 -7.256 1.00 1.00 C ATOM 1060 C LEU A 66 -0.392 3.106 -7.218 1.00 1.00 C ATOM 1061 O LEU A 66 -1.467 2.816 -6.686 1.00 1.00 O ATOM 1062 CB LEU A 66 0.933 5.094 -6.062 1.00 1.00 C ATOM 1063 CG LEU A 66 0.501 4.789 -4.630 1.00 1.00 C ATOM 1064 CD1 LEU A 66 -0.894 5.305 -4.276 1.00 1.00 C ATOM 1065 CD2 LEU A 66 0.651 3.300 -4.377 1.00 1.00 C ATOM 0 H LEU A 66 -1.820 5.145 -7.148 1.00 1.00 H new ATOM 0 HA LEU A 66 0.921 4.467 -8.024 1.00 1.00 H new ATOM 0 HB2 LEU A 66 1.962 4.751 -6.165 1.00 1.00 H new ATOM 0 HB3 LEU A 66 0.947 6.179 -6.168 1.00 1.00 H new ATOM 0 HG LEU A 66 1.160 5.340 -3.959 1.00 1.00 H new ATOM 0 HD11 LEU A 66 -1.126 5.048 -3.242 1.00 1.00 H new ATOM 0 HD12 LEU A 66 -0.923 6.388 -4.396 1.00 1.00 H new ATOM 0 HD13 LEU A 66 -1.630 4.847 -4.937 1.00 1.00 H new ATOM 0 HD21 LEU A 66 0.345 3.072 -3.356 1.00 1.00 H new ATOM 0 HD22 LEU A 66 0.024 2.747 -5.076 1.00 1.00 H new ATOM 0 HD23 LEU A 66 1.692 3.010 -4.517 1.00 1.00 H new ATOM 1077 N SER A 67 0.333 2.198 -7.853 1.00 1.00 N ATOM 1078 CA SER A 67 -0.056 0.809 -7.946 1.00 1.00 C ATOM 1079 C SER A 67 0.435 0.157 -6.662 1.00 1.00 C ATOM 1080 O SER A 67 1.640 0.041 -6.427 1.00 1.00 O ATOM 1081 CB SER A 67 0.537 0.189 -9.210 1.00 1.00 C ATOM 1082 OG SER A 67 0.091 0.902 -10.354 1.00 1.00 O ATOM 0 H SER A 67 1.214 2.411 -8.320 1.00 1.00 H new ATOM 0 HA SER A 67 -1.133 0.670 -8.035 1.00 1.00 H new ATOM 0 HB2 SER A 67 1.626 0.210 -9.159 1.00 1.00 H new ATOM 0 HB3 SER A 67 0.242 -0.858 -9.285 1.00 1.00 H new ATOM 0 HG SER A 67 0.476 0.500 -11.161 1.00 1.00 H new ATOM 1088 N LEU A 68 -0.498 -0.157 -5.767 1.00 1.00 N ATOM 1089 CA LEU A 68 -0.158 -0.634 -4.444 1.00 1.00 C ATOM 1090 C LEU A 68 0.336 -2.065 -4.515 1.00 1.00 C ATOM 1091 O LEU A 68 -0.101 -2.831 -5.372 1.00 1.00 O ATOM 1092 CB LEU A 68 -1.353 -0.544 -3.491 1.00 1.00 C ATOM 1093 CG LEU A 68 -1.208 0.554 -2.429 1.00 1.00 C ATOM 1094 CD1 LEU A 68 -2.231 0.260 -1.346 1.00 1.00 C ATOM 1095 CD2 LEU A 68 0.165 0.593 -1.759 1.00 1.00 C ATOM 0 H LEU A 68 -1.500 -0.086 -5.943 1.00 1.00 H new ATOM 0 HA LEU A 68 0.635 0.005 -4.055 1.00 1.00 H new ATOM 0 HB2 LEU A 68 -2.257 -0.360 -4.071 1.00 1.00 H new ATOM 0 HB3 LEU A 68 -1.484 -1.505 -2.993 1.00 1.00 H new ATOM 0 HG LEU A 68 -1.349 1.513 -2.928 1.00 1.00 H new ATOM 0 HD11 LEU A 68 -2.164 1.019 -0.566 1.00 1.00 H new ATOM 0 HD12 LEU A 68 -3.232 0.271 -1.778 1.00 1.00 H new ATOM 0 HD13 LEU A 68 -2.033 -0.721 -0.915 1.00 1.00 H new ATOM 0 HD21 LEU A 68 0.187 1.395 -1.022 1.00 1.00 H new ATOM 0 HD22 LEU A 68 0.356 -0.360 -1.265 1.00 1.00 H new ATOM 0 HD23 LEU A 68 0.932 0.771 -2.512 1.00 1.00 H new ATOM 1107 N GLN A 69 1.183 -2.454 -3.564 1.00 1.00 N ATOM 1108 CA GLN A 69 1.882 -3.721 -3.615 1.00 1.00 C ATOM 1109 C GLN A 69 1.749 -4.410 -2.248 1.00 1.00 C ATOM 1110 O GLN A 69 2.613 -4.251 -1.389 1.00 1.00 O ATOM 1111 CB GLN A 69 3.383 -3.465 -3.931 1.00 1.00 C ATOM 1112 CG GLN A 69 3.745 -2.613 -5.162 1.00 1.00 C ATOM 1113 CD GLN A 69 5.244 -2.251 -5.192 1.00 1.00 C ATOM 1114 OE1 GLN A 69 6.090 -2.970 -4.659 1.00 1.00 O ATOM 1115 NE2 GLN A 69 5.630 -1.127 -5.779 1.00 1.00 N ATOM 0 H GLN A 69 1.399 -1.894 -2.739 1.00 1.00 H new ATOM 0 HA GLN A 69 1.456 -4.357 -4.391 1.00 1.00 H new ATOM 0 HB2 GLN A 69 3.828 -2.989 -3.057 1.00 1.00 H new ATOM 0 HB3 GLN A 69 3.866 -4.435 -4.047 1.00 1.00 H new ATOM 0 HG2 GLN A 69 3.485 -3.158 -6.070 1.00 1.00 H new ATOM 0 HG3 GLN A 69 3.151 -1.699 -5.158 1.00 1.00 H new ATOM 0 HE21 GLN A 69 4.941 -0.522 -6.225 1.00 1.00 H new ATOM 0 HE22 GLN A 69 6.616 -0.868 -5.785 1.00 1.00 H new ATOM 1124 N PHE A 70 0.665 -5.145 -1.996 1.00 1.00 N ATOM 1125 CA PHE A 70 0.450 -5.816 -0.711 1.00 1.00 C ATOM 1126 C PHE A 70 1.314 -7.086 -0.647 1.00 1.00 C ATOM 1127 O PHE A 70 0.795 -8.200 -0.702 1.00 1.00 O ATOM 1128 CB PHE A 70 -1.050 -6.092 -0.506 1.00 1.00 C ATOM 1129 CG PHE A 70 -1.934 -4.857 -0.589 1.00 1.00 C ATOM 1130 CD1 PHE A 70 -2.362 -4.379 -1.837 1.00 1.00 C ATOM 1131 CD2 PHE A 70 -2.336 -4.177 0.571 1.00 1.00 C ATOM 1132 CE1 PHE A 70 -3.174 -3.243 -1.939 1.00 1.00 C ATOM 1133 CE2 PHE A 70 -3.201 -3.073 0.486 1.00 1.00 C ATOM 1134 CZ PHE A 70 -3.636 -2.616 -0.769 1.00 1.00 C ATOM 0 H PHE A 70 -0.085 -5.292 -2.671 1.00 1.00 H new ATOM 0 HA PHE A 70 0.762 -5.174 0.112 1.00 1.00 H new ATOM 0 HB2 PHE A 70 -1.380 -6.811 -1.256 1.00 1.00 H new ATOM 0 HB3 PHE A 70 -1.191 -6.560 0.468 1.00 1.00 H new ATOM 0 HD1 PHE A 70 -2.060 -4.897 -2.735 1.00 1.00 H new ATOM 0 HD2 PHE A 70 -1.978 -4.505 1.536 1.00 1.00 H new ATOM 0 HE1 PHE A 70 -3.443 -2.852 -2.909 1.00 1.00 H new ATOM 0 HE2 PHE A 70 -3.532 -2.576 1.386 1.00 1.00 H new ATOM 0 HZ PHE A 70 -4.323 -1.785 -0.835 1.00 1.00 H new ATOM 1144 N PHE A 71 2.639 -6.923 -0.580 1.00 1.00 N ATOM 1145 CA PHE A 71 3.614 -7.986 -0.764 1.00 1.00 C ATOM 1146 C PHE A 71 4.515 -8.128 0.459 1.00 1.00 C ATOM 1147 O PHE A 71 5.603 -7.542 0.497 1.00 1.00 O ATOM 1148 CB PHE A 71 4.381 -7.771 -2.071 1.00 1.00 C ATOM 1149 CG PHE A 71 3.620 -8.401 -3.210 1.00 1.00 C ATOM 1150 CD1 PHE A 71 3.709 -9.790 -3.409 1.00 1.00 C ATOM 1151 CD2 PHE A 71 2.718 -7.639 -3.969 1.00 1.00 C ATOM 1152 CE1 PHE A 71 2.931 -10.418 -4.394 1.00 1.00 C ATOM 1153 CE2 PHE A 71 1.908 -8.275 -4.919 1.00 1.00 C ATOM 1154 CZ PHE A 71 2.022 -9.653 -5.141 1.00 1.00 C ATOM 0 H PHE A 71 3.069 -6.018 -0.390 1.00 1.00 H new ATOM 0 HA PHE A 71 3.097 -8.941 -0.855 1.00 1.00 H new ATOM 0 HB2 PHE A 71 4.516 -6.705 -2.255 1.00 1.00 H new ATOM 0 HB3 PHE A 71 5.376 -8.210 -1.998 1.00 1.00 H new ATOM 0 HD1 PHE A 71 4.380 -10.377 -2.800 1.00 1.00 H new ATOM 0 HD2 PHE A 71 2.649 -6.571 -3.822 1.00 1.00 H new ATOM 0 HE1 PHE A 71 3.031 -11.478 -4.575 1.00 1.00 H new ATOM 0 HE2 PHE A 71 1.191 -7.698 -5.484 1.00 1.00 H new ATOM 0 HZ PHE A 71 1.407 -10.129 -5.891 1.00 1.00 H new ATOM 1164 N PRO A 72 4.080 -8.901 1.466 1.00 1.00 N ATOM 1165 CA PRO A 72 4.956 -9.348 2.536 1.00 1.00 C ATOM 1166 C PRO A 72 5.959 -10.361 1.977 1.00 1.00 C ATOM 1167 O PRO A 72 5.816 -10.861 0.859 1.00 1.00 O ATOM 1168 CB PRO A 72 4.035 -9.984 3.579 1.00 1.00 C ATOM 1169 CG PRO A 72 2.900 -10.534 2.723 1.00 1.00 C ATOM 1170 CD PRO A 72 2.779 -9.550 1.571 1.00 1.00 C ATOM 0 HA PRO A 72 5.535 -8.537 2.978 1.00 1.00 H new ATOM 0 HB2 PRO A 72 4.539 -10.771 4.140 1.00 1.00 H new ATOM 0 HB3 PRO A 72 3.679 -9.254 4.305 1.00 1.00 H new ATOM 0 HG2 PRO A 72 3.124 -11.539 2.365 1.00 1.00 H new ATOM 0 HG3 PRO A 72 1.971 -10.598 3.289 1.00 1.00 H new ATOM 0 HD2 PRO A 72 2.522 -10.063 0.644 1.00 1.00 H new ATOM 0 HD3 PRO A 72 1.992 -8.820 1.761 1.00 1.00 H new ATOM 1178 N ALA A 73 6.962 -10.685 2.786 1.00 1.00 N ATOM 1179 CA ALA A 73 8.119 -11.474 2.387 1.00 1.00 C ATOM 1180 C ALA A 73 7.791 -12.855 1.796 1.00 1.00 C ATOM 1181 O ALA A 73 8.583 -13.351 0.991 1.00 1.00 O ATOM 1182 CB ALA A 73 9.076 -11.599 3.572 1.00 1.00 C ATOM 0 H ALA A 73 6.992 -10.397 3.764 1.00 1.00 H new ATOM 0 HA ALA A 73 8.590 -10.933 1.566 1.00 1.00 H new ATOM 0 HB1 ALA A 73 9.944 -12.189 3.278 1.00 1.00 H new ATOM 0 HB2 ALA A 73 9.401 -10.606 3.884 1.00 1.00 H new ATOM 0 HB3 ALA A 73 8.567 -12.091 4.401 1.00 1.00 H new ATOM 1188 N SER A 74 6.666 -13.493 2.135 1.00 1.00 N ATOM 1189 CA SER A 74 6.169 -14.637 1.384 1.00 1.00 C ATOM 1190 C SER A 74 5.249 -14.115 0.281 1.00 1.00 C ATOM 1191 O SER A 74 4.042 -13.949 0.508 1.00 1.00 O ATOM 1192 CB SER A 74 5.479 -15.649 2.303 1.00 1.00 C ATOM 1193 OG SER A 74 4.434 -15.062 3.053 1.00 1.00 O ATOM 0 H SER A 74 6.084 -13.230 2.930 1.00 1.00 H new ATOM 0 HA SER A 74 6.996 -15.179 0.926 1.00 1.00 H new ATOM 0 HB2 SER A 74 5.079 -16.467 1.704 1.00 1.00 H new ATOM 0 HB3 SER A 74 6.214 -16.081 2.983 1.00 1.00 H new ATOM 0 HG SER A 74 3.932 -14.442 2.484 1.00 1.00 H new ATOM 1199 N TRP A 75 5.796 -13.819 -0.896 1.00 1.00 N ATOM 1200 CA TRP A 75 4.989 -13.445 -2.037 1.00 1.00 C ATOM 1201 C TRP A 75 4.262 -14.693 -2.522 1.00 1.00 C ATOM 1202 O TRP A 75 4.834 -15.784 -2.566 1.00 1.00 O ATOM 1203 CB TRP A 75 5.856 -12.936 -3.189 1.00 1.00 C ATOM 1204 CG TRP A 75 6.672 -11.688 -3.001 1.00 1.00 C ATOM 1205 CD1 TRP A 75 7.410 -11.341 -1.921 1.00 1.00 C ATOM 1206 CD2 TRP A 75 6.860 -10.606 -3.962 1.00 1.00 C ATOM 1207 NE1 TRP A 75 8.038 -10.137 -2.149 1.00 1.00 N ATOM 1208 CE2 TRP A 75 7.723 -9.627 -3.391 1.00 1.00 C ATOM 1209 CE3 TRP A 75 6.380 -10.361 -5.267 1.00 1.00 C ATOM 1210 CZ2 TRP A 75 8.093 -8.467 -4.086 1.00 1.00 C ATOM 1211 CZ3 TRP A 75 6.724 -9.187 -5.965 1.00 1.00 C ATOM 1212 CH2 TRP A 75 7.582 -8.241 -5.376 1.00 1.00 C ATOM 0 H TRP A 75 6.800 -13.833 -1.077 1.00 1.00 H new ATOM 0 HA TRP A 75 4.301 -12.654 -1.736 1.00 1.00 H new ATOM 0 HB2 TRP A 75 6.542 -13.738 -3.461 1.00 1.00 H new ATOM 0 HB3 TRP A 75 5.201 -12.773 -4.045 1.00 1.00 H new ATOM 0 HD1 TRP A 75 7.494 -11.922 -1.015 1.00 1.00 H new ATOM 0 HE1 TRP A 75 8.659 -9.679 -1.482 1.00 1.00 H new ATOM 0 HE3 TRP A 75 5.736 -11.088 -5.739 1.00 1.00 H new ATOM 0 HZ2 TRP A 75 8.765 -7.753 -3.634 1.00 1.00 H new ATOM 0 HZ3 TRP A 75 6.328 -9.013 -6.955 1.00 1.00 H new ATOM 0 HH2 TRP A 75 7.848 -7.343 -5.914 1.00 1.00 H new ATOM 1223 N GLN A 76 3.022 -14.500 -2.944 1.00 1.00 N ATOM 1224 CA GLN A 76 2.268 -15.368 -3.803 1.00 1.00 C ATOM 1225 C GLN A 76 1.540 -14.542 -4.872 1.00 1.00 C ATOM 1226 O GLN A 76 1.596 -14.882 -6.052 1.00 1.00 O ATOM 1227 CB GLN A 76 1.378 -16.284 -2.965 1.00 1.00 C ATOM 1228 CG GLN A 76 0.814 -15.778 -1.629 1.00 1.00 C ATOM 1229 CD GLN A 76 -0.040 -14.543 -1.824 1.00 1.00 C ATOM 1230 OE1 GLN A 76 0.410 -13.425 -1.586 1.00 1.00 O ATOM 1231 NE2 GLN A 76 -1.243 -14.692 -2.346 1.00 1.00 N ATOM 0 H GLN A 76 2.490 -13.674 -2.671 1.00 1.00 H new ATOM 0 HA GLN A 76 2.924 -16.038 -4.359 1.00 1.00 H new ATOM 0 HB2 GLN A 76 0.532 -16.575 -3.587 1.00 1.00 H new ATOM 0 HB3 GLN A 76 1.947 -17.190 -2.757 1.00 1.00 H new ATOM 0 HG2 GLN A 76 0.220 -16.563 -1.162 1.00 1.00 H new ATOM 0 HG3 GLN A 76 1.634 -15.551 -0.948 1.00 1.00 H new ATOM 0 HE21 GLN A 76 -1.603 -15.627 -2.538 1.00 1.00 H new ATOM 0 HE22 GLN A 76 -1.812 -13.872 -2.557 1.00 1.00 H new ATOM 1240 N GLY A 77 0.928 -13.411 -4.492 1.00 1.00 N ATOM 1241 CA GLY A 77 0.306 -12.488 -5.435 1.00 1.00 C ATOM 1242 C GLY A 77 -0.899 -13.085 -6.148 1.00 1.00 C ATOM 1243 O GLY A 77 -1.151 -12.742 -7.303 1.00 1.00 O ATOM 0 H GLY A 77 0.854 -13.116 -3.519 1.00 1.00 H new ATOM 0 HA2 GLY A 77 -0.003 -11.588 -4.903 1.00 1.00 H new ATOM 0 HA3 GLY A 77 1.045 -12.183 -6.176 1.00 1.00 H new ATOM 1247 N GLU A 78 -1.587 -14.008 -5.481 1.00 1.00 N ATOM 1248 CA GLU A 78 -2.530 -14.924 -6.090 1.00 1.00 C ATOM 1249 C GLU A 78 -3.649 -15.187 -5.081 1.00 1.00 C ATOM 1250 O GLU A 78 -3.720 -16.273 -4.505 1.00 1.00 O ATOM 1251 CB GLU A 78 -1.734 -16.188 -6.453 1.00 1.00 C ATOM 1252 CG GLU A 78 -2.537 -17.207 -7.260 1.00 1.00 C ATOM 1253 CD GLU A 78 -1.760 -18.513 -7.352 1.00 1.00 C ATOM 1254 OE1 GLU A 78 -0.840 -18.605 -8.203 1.00 1.00 O ATOM 1255 OE2 GLU A 78 -2.034 -19.434 -6.549 1.00 1.00 O ATOM 0 H GLU A 78 -1.497 -14.138 -4.473 1.00 1.00 H new ATOM 0 HA GLU A 78 -2.998 -14.536 -6.994 1.00 1.00 H new ATOM 0 HB2 GLU A 78 -0.851 -15.900 -7.024 1.00 1.00 H new ATOM 0 HB3 GLU A 78 -1.381 -16.660 -5.536 1.00 1.00 H new ATOM 0 HG2 GLU A 78 -3.504 -17.380 -6.787 1.00 1.00 H new ATOM 0 HG3 GLU A 78 -2.736 -16.819 -8.259 1.00 1.00 H new ATOM 1262 N GLN A 79 -4.469 -14.169 -4.794 1.00 1.00 N ATOM 1263 CA GLN A 79 -5.519 -14.174 -3.793 1.00 1.00 C ATOM 1264 C GLN A 79 -5.010 -14.737 -2.471 1.00 1.00 C ATOM 1265 O GLN A 79 -5.193 -15.908 -2.131 1.00 1.00 O ATOM 1266 CB GLN A 79 -6.807 -14.810 -4.322 1.00 1.00 C ATOM 1267 CG GLN A 79 -8.022 -14.372 -3.493 1.00 1.00 C ATOM 1268 CD GLN A 79 -8.415 -15.378 -2.409 1.00 1.00 C ATOM 1269 OE1 GLN A 79 -9.003 -16.417 -2.701 1.00 1.00 O ATOM 1270 NE2 GLN A 79 -8.151 -15.109 -1.139 1.00 1.00 N ATOM 0 H GLN A 79 -4.407 -13.277 -5.285 1.00 1.00 H new ATOM 0 HA GLN A 79 -5.804 -13.145 -3.571 1.00 1.00 H new ATOM 0 HB2 GLN A 79 -6.954 -14.528 -5.365 1.00 1.00 H new ATOM 0 HB3 GLN A 79 -6.717 -15.896 -4.295 1.00 1.00 H new ATOM 0 HG2 GLN A 79 -7.806 -13.412 -3.025 1.00 1.00 H new ATOM 0 HG3 GLN A 79 -8.871 -14.218 -4.160 1.00 1.00 H new ATOM 0 HE21 GLN A 79 -7.663 -14.248 -0.891 1.00 1.00 H new ATOM 0 HE22 GLN A 79 -8.435 -15.763 -0.409 1.00 1.00 H new ATOM 1279 N ARG A 80 -4.312 -13.889 -1.723 1.00 1.00 N ATOM 1280 CA ARG A 80 -3.877 -14.230 -0.373 1.00 1.00 C ATOM 1281 C ARG A 80 -5.132 -14.533 0.459 1.00 1.00 C ATOM 1282 O ARG A 80 -6.095 -13.767 0.424 1.00 1.00 O ATOM 1283 CB ARG A 80 -3.045 -13.067 0.207 1.00 1.00 C ATOM 1284 CG ARG A 80 -1.950 -13.481 1.206 1.00 1.00 C ATOM 1285 CD ARG A 80 -2.471 -14.354 2.349 1.00 1.00 C ATOM 1286 NE ARG A 80 -1.532 -14.452 3.469 1.00 1.00 N ATOM 1287 CZ ARG A 80 -0.503 -15.289 3.596 1.00 1.00 C ATOM 1288 NH1 ARG A 80 -0.174 -16.131 2.624 1.00 1.00 N ATOM 1289 NH2 ARG A 80 0.213 -15.246 4.714 1.00 1.00 N ATOM 0 H ARG A 80 -4.034 -12.957 -2.030 1.00 1.00 H new ATOM 0 HA ARG A 80 -3.235 -15.111 -0.364 1.00 1.00 H new ATOM 0 HB2 ARG A 80 -2.578 -12.529 -0.618 1.00 1.00 H new ATOM 0 HB3 ARG A 80 -3.721 -12.369 0.701 1.00 1.00 H new ATOM 0 HG2 ARG A 80 -1.168 -14.021 0.673 1.00 1.00 H new ATOM 0 HG3 ARG A 80 -1.491 -12.585 1.623 1.00 1.00 H new ATOM 0 HD2 ARG A 80 -3.416 -13.946 2.709 1.00 1.00 H new ATOM 0 HD3 ARG A 80 -2.680 -15.354 1.969 1.00 1.00 H new ATOM 0 HE ARG A 80 -1.684 -13.804 4.242 1.00 1.00 H new ATOM 0 HH11 ARG A 80 -0.713 -16.146 1.758 1.00 1.00 H new ATOM 0 HH12 ARG A 80 0.618 -16.763 2.743 1.00 1.00 H new ATOM 0 HH21 ARG A 80 -0.030 -14.583 5.450 1.00 1.00 H new ATOM 0 HH22 ARG A 80 1.006 -15.876 4.836 1.00 1.00 H new ATOM 1303 N GLN A 81 -5.100 -15.632 1.213 1.00 1.00 N ATOM 1304 CA GLN A 81 -6.146 -16.069 2.134 1.00 1.00 C ATOM 1305 C GLN A 81 -6.299 -15.075 3.293 1.00 1.00 C ATOM 1306 O GLN A 81 -7.187 -14.226 3.249 1.00 1.00 O ATOM 1307 CB GLN A 81 -5.904 -17.522 2.597 1.00 1.00 C ATOM 1308 CG GLN A 81 -4.418 -17.887 2.783 1.00 1.00 C ATOM 1309 CD GLN A 81 -4.152 -19.214 3.484 1.00 1.00 C ATOM 1310 OE1 GLN A 81 -3.201 -19.910 3.136 1.00 1.00 O ATOM 1311 NE2 GLN A 81 -4.901 -19.576 4.507 1.00 1.00 N ATOM 0 H GLN A 81 -4.305 -16.271 1.196 1.00 1.00 H new ATOM 0 HA GLN A 81 -7.101 -16.076 1.609 1.00 1.00 H new ATOM 0 HB2 GLN A 81 -6.427 -17.683 3.540 1.00 1.00 H new ATOM 0 HB3 GLN A 81 -6.345 -18.202 1.868 1.00 1.00 H new ATOM 0 HG2 GLN A 81 -3.942 -17.912 1.803 1.00 1.00 H new ATOM 0 HG3 GLN A 81 -3.935 -17.092 3.351 1.00 1.00 H new ATOM 0 HE21 GLN A 81 -5.689 -18.995 4.793 1.00 1.00 H new ATOM 0 HE22 GLN A 81 -4.692 -20.437 5.013 1.00 1.00 H new ATOM 1320 N THR A 82 -5.420 -15.131 4.294 1.00 1.00 N ATOM 1321 CA THR A 82 -5.360 -14.182 5.401 1.00 1.00 C ATOM 1322 C THR A 82 -4.058 -13.380 5.259 1.00 1.00 C ATOM 1323 O THR A 82 -3.012 -13.847 5.709 1.00 1.00 O ATOM 1324 CB THR A 82 -5.472 -14.931 6.743 1.00 1.00 C ATOM 1325 OG1 THR A 82 -6.740 -15.554 6.844 1.00 1.00 O ATOM 1326 CG2 THR A 82 -5.332 -13.995 7.946 1.00 1.00 C ATOM 0 H THR A 82 -4.710 -15.861 4.357 1.00 1.00 H new ATOM 0 HA THR A 82 -6.196 -13.483 5.378 1.00 1.00 H new ATOM 0 HB THR A 82 -4.662 -15.660 6.758 1.00 1.00 H new ATOM 0 HG1 THR A 82 -6.804 -16.030 7.698 1.00 1.00 H new ATOM 0 HG21 THR A 82 -5.418 -14.571 8.867 1.00 1.00 H new ATOM 0 HG22 THR A 82 -4.359 -13.505 7.914 1.00 1.00 H new ATOM 0 HG23 THR A 82 -6.119 -13.242 7.914 1.00 1.00 H new ATOM 1334 N PRO A 83 -4.053 -12.223 4.571 1.00 1.00 N ATOM 1335 CA PRO A 83 -2.994 -11.222 4.721 1.00 1.00 C ATOM 1336 C PRO A 83 -2.892 -10.777 6.192 1.00 1.00 C ATOM 1337 O PRO A 83 -3.714 -11.190 7.017 1.00 1.00 O ATOM 1338 CB PRO A 83 -3.360 -10.059 3.791 1.00 1.00 C ATOM 1339 CG PRO A 83 -4.653 -10.476 3.080 1.00 1.00 C ATOM 1340 CD PRO A 83 -5.158 -11.717 3.787 1.00 1.00 C ATOM 0 HA PRO A 83 -2.016 -11.620 4.452 1.00 1.00 H new ATOM 0 HB2 PRO A 83 -3.505 -9.138 4.356 1.00 1.00 H new ATOM 0 HB3 PRO A 83 -2.563 -9.869 3.072 1.00 1.00 H new ATOM 0 HG2 PRO A 83 -5.394 -9.677 3.124 1.00 1.00 H new ATOM 0 HG3 PRO A 83 -4.466 -10.680 2.026 1.00 1.00 H new ATOM 0 HD2 PRO A 83 -6.010 -11.480 4.425 1.00 1.00 H new ATOM 0 HD3 PRO A 83 -5.496 -12.463 3.067 1.00 1.00 H new ATOM 1348 N SER A 84 -1.899 -9.958 6.564 1.00 1.00 N ATOM 1349 CA SER A 84 -1.854 -9.540 7.969 1.00 1.00 C ATOM 1350 C SER A 84 -3.000 -8.550 8.221 1.00 1.00 C ATOM 1351 O SER A 84 -3.457 -7.898 7.280 1.00 1.00 O ATOM 1352 CB SER A 84 -0.497 -8.917 8.318 1.00 1.00 C ATOM 1353 OG SER A 84 0.469 -9.039 7.285 1.00 1.00 O ATOM 0 H SER A 84 -1.163 -9.593 5.959 1.00 1.00 H new ATOM 0 HA SER A 84 -1.977 -10.411 8.613 1.00 1.00 H new ATOM 0 HB2 SER A 84 -0.640 -7.861 8.547 1.00 1.00 H new ATOM 0 HB3 SER A 84 -0.112 -9.390 9.221 1.00 1.00 H new ATOM 0 HG SER A 84 0.572 -8.177 6.830 1.00 1.00 H new ATOM 1359 N ARG A 85 -3.369 -8.299 9.485 1.00 1.00 N ATOM 1360 CA ARG A 85 -4.567 -7.482 9.749 1.00 1.00 C ATOM 1361 C ARG A 85 -4.344 -6.041 9.343 1.00 1.00 C ATOM 1362 O ARG A 85 -5.281 -5.358 8.943 1.00 1.00 O ATOM 1363 CB ARG A 85 -5.005 -7.523 11.228 1.00 1.00 C ATOM 1364 CG ARG A 85 -6.415 -8.108 11.341 1.00 1.00 C ATOM 1365 CD ARG A 85 -7.125 -7.767 12.652 1.00 1.00 C ATOM 1366 NE ARG A 85 -7.470 -6.338 12.757 1.00 1.00 N ATOM 1367 CZ ARG A 85 -7.739 -5.676 13.888 1.00 1.00 C ATOM 1368 NH1 ARG A 85 -7.732 -6.297 15.063 1.00 1.00 N ATOM 1369 NH2 ARG A 85 -8.000 -4.380 13.843 1.00 1.00 N ATOM 0 H ARG A 85 -2.878 -8.634 10.314 1.00 1.00 H new ATOM 0 HA ARG A 85 -5.364 -7.919 9.147 1.00 1.00 H new ATOM 0 HB2 ARG A 85 -4.305 -8.126 11.806 1.00 1.00 H new ATOM 0 HB3 ARG A 85 -4.985 -6.518 11.650 1.00 1.00 H new ATOM 0 HG2 ARG A 85 -7.017 -7.744 10.508 1.00 1.00 H new ATOM 0 HG3 ARG A 85 -6.357 -9.192 11.242 1.00 1.00 H new ATOM 0 HD2 ARG A 85 -8.034 -8.363 12.734 1.00 1.00 H new ATOM 0 HD3 ARG A 85 -6.485 -8.045 13.490 1.00 1.00 H new ATOM 0 HE ARG A 85 -7.507 -5.805 11.888 1.00 1.00 H new ATOM 0 HH11 ARG A 85 -7.519 -7.293 15.112 1.00 1.00 H new ATOM 0 HH12 ARG A 85 -7.939 -5.777 15.916 1.00 1.00 H new ATOM 0 HH21 ARG A 85 -7.996 -3.890 12.949 1.00 1.00 H new ATOM 0 HH22 ARG A 85 -8.206 -3.871 14.703 1.00 1.00 H new ATOM 1383 N GLU A 86 -3.112 -5.563 9.478 1.00 1.00 N ATOM 1384 CA GLU A 86 -2.771 -4.221 9.060 1.00 1.00 C ATOM 1385 C GLU A 86 -2.658 -4.149 7.534 1.00 1.00 C ATOM 1386 O GLU A 86 -3.016 -3.130 6.955 1.00 1.00 O ATOM 1387 CB GLU A 86 -1.464 -3.820 9.744 1.00 1.00 C ATOM 1388 CG GLU A 86 -1.252 -2.307 9.670 1.00 1.00 C ATOM 1389 CD GLU A 86 -2.223 -1.467 10.501 1.00 1.00 C ATOM 1390 OE1 GLU A 86 -2.795 -1.971 11.493 1.00 1.00 O ATOM 1391 OE2 GLU A 86 -2.295 -0.247 10.232 1.00 1.00 O ATOM 0 H GLU A 86 -2.335 -6.092 9.875 1.00 1.00 H new ATOM 0 HA GLU A 86 -3.554 -3.522 9.354 1.00 1.00 H new ATOM 0 HB2 GLU A 86 -1.482 -4.138 10.786 1.00 1.00 H new ATOM 0 HB3 GLU A 86 -0.628 -4.332 9.268 1.00 1.00 H new ATOM 0 HG2 GLU A 86 -0.236 -2.083 9.994 1.00 1.00 H new ATOM 0 HG3 GLU A 86 -1.330 -1.997 8.628 1.00 1.00 H new ATOM 1398 N TYR A 87 -2.197 -5.225 6.884 1.00 1.00 N ATOM 1399 CA TYR A 87 -1.989 -5.298 5.442 1.00 1.00 C ATOM 1400 C TYR A 87 -3.319 -5.254 4.707 1.00 1.00 C ATOM 1401 O TYR A 87 -3.602 -4.265 4.031 1.00 1.00 O ATOM 1402 CB TYR A 87 -1.213 -6.571 5.060 1.00 1.00 C ATOM 1403 CG TYR A 87 0.299 -6.468 5.059 1.00 1.00 C ATOM 1404 CD1 TYR A 87 1.001 -5.968 6.174 1.00 1.00 C ATOM 1405 CD2 TYR A 87 1.007 -6.931 3.935 1.00 1.00 C ATOM 1406 CE1 TYR A 87 2.405 -5.937 6.163 1.00 1.00 C ATOM 1407 CE2 TYR A 87 2.409 -6.830 3.887 1.00 1.00 C ATOM 1408 CZ TYR A 87 3.109 -6.371 5.016 1.00 1.00 C ATOM 1409 OH TYR A 87 4.464 -6.391 4.983 1.00 1.00 O ATOM 0 H TYR A 87 -1.953 -6.091 7.365 1.00 1.00 H new ATOM 0 HA TYR A 87 -1.396 -4.433 5.145 1.00 1.00 H new ATOM 0 HB2 TYR A 87 -1.500 -7.365 5.749 1.00 1.00 H new ATOM 0 HB3 TYR A 87 -1.534 -6.881 4.065 1.00 1.00 H new ATOM 0 HD1 TYR A 87 0.459 -5.609 7.037 1.00 1.00 H new ATOM 0 HD2 TYR A 87 0.471 -7.366 3.105 1.00 1.00 H new ATOM 0 HE1 TYR A 87 2.946 -5.583 7.028 1.00 1.00 H new ATOM 0 HE2 TYR A 87 2.944 -7.103 2.989 1.00 1.00 H new ATOM 0 HH TYR A 87 4.765 -6.934 4.224 1.00 1.00 H new ATOM 1419 N VAL A 88 -4.101 -6.331 4.803 1.00 1.00 N ATOM 1420 CA VAL A 88 -5.430 -6.419 4.233 1.00 1.00 C ATOM 1421 C VAL A 88 -6.222 -7.401 5.098 1.00 1.00 C ATOM 1422 O VAL A 88 -5.746 -8.488 5.414 1.00 1.00 O ATOM 1423 CB VAL A 88 -5.376 -6.894 2.759 1.00 1.00 C ATOM 1424 CG1 VAL A 88 -6.784 -7.137 2.193 1.00 1.00 C ATOM 1425 CG2 VAL A 88 -4.615 -5.971 1.809 1.00 1.00 C ATOM 0 H VAL A 88 -3.814 -7.180 5.291 1.00 1.00 H new ATOM 0 HA VAL A 88 -5.909 -5.440 4.224 1.00 1.00 H new ATOM 0 HB VAL A 88 -4.815 -7.827 2.807 1.00 1.00 H new ATOM 0 HG11 VAL A 88 -6.708 -7.469 1.158 1.00 1.00 H new ATOM 0 HG12 VAL A 88 -7.286 -7.903 2.784 1.00 1.00 H new ATOM 0 HG13 VAL A 88 -7.358 -6.211 2.236 1.00 1.00 H new ATOM 0 HG21 VAL A 88 -4.634 -6.389 0.803 1.00 1.00 H new ATOM 0 HG22 VAL A 88 -5.086 -4.988 1.802 1.00 1.00 H new ATOM 0 HG23 VAL A 88 -3.582 -5.876 2.143 1.00 1.00 H new ATOM 1435 N ASP A 89 -7.481 -7.050 5.338 1.00 1.00 N ATOM 1436 CA ASP A 89 -8.542 -7.853 5.938 1.00 1.00 C ATOM 1437 C ASP A 89 -8.412 -8.008 7.455 1.00 1.00 C ATOM 1438 O ASP A 89 -7.510 -8.634 8.002 1.00 1.00 O ATOM 1439 CB ASP A 89 -8.818 -9.188 5.239 1.00 1.00 C ATOM 1440 CG ASP A 89 -10.070 -9.828 5.843 1.00 1.00 C ATOM 1441 OD1 ASP A 89 -10.995 -9.084 6.257 1.00 1.00 O ATOM 1442 OD2 ASP A 89 -10.131 -11.075 5.889 1.00 1.00 O ATOM 0 H ASP A 89 -7.814 -6.116 5.097 1.00 1.00 H new ATOM 0 HA ASP A 89 -9.436 -7.255 5.763 1.00 1.00 H new ATOM 0 HB2 ASP A 89 -8.957 -9.029 4.170 1.00 1.00 H new ATOM 0 HB3 ASP A 89 -7.964 -9.855 5.354 1.00 1.00 H new ATOM 1447 N LEU A 90 -9.369 -7.365 8.112 1.00 1.00 N ATOM 1448 CA LEU A 90 -9.501 -7.028 9.517 1.00 1.00 C ATOM 1449 C LEU A 90 -10.977 -7.086 9.922 1.00 1.00 C ATOM 1450 O LEU A 90 -11.394 -6.428 10.870 1.00 1.00 O ATOM 1451 CB LEU A 90 -8.838 -5.657 9.803 1.00 1.00 C ATOM 1452 CG LEU A 90 -9.102 -4.478 8.845 1.00 1.00 C ATOM 1453 CD1 LEU A 90 -8.431 -4.641 7.480 1.00 1.00 C ATOM 1454 CD2 LEU A 90 -10.586 -4.237 8.601 1.00 1.00 C ATOM 0 H LEU A 90 -10.180 -7.023 7.596 1.00 1.00 H new ATOM 0 HA LEU A 90 -8.974 -7.757 10.133 1.00 1.00 H new ATOM 0 HB2 LEU A 90 -9.148 -5.345 10.800 1.00 1.00 H new ATOM 0 HB3 LEU A 90 -7.760 -5.815 9.839 1.00 1.00 H new ATOM 0 HG LEU A 90 -8.665 -3.623 9.362 1.00 1.00 H new ATOM 0 HD11 LEU A 90 -8.659 -3.776 6.857 1.00 1.00 H new ATOM 0 HD12 LEU A 90 -7.352 -4.719 7.612 1.00 1.00 H new ATOM 0 HD13 LEU A 90 -8.804 -5.544 6.997 1.00 1.00 H new ATOM 0 HD21 LEU A 90 -10.711 -3.396 7.919 1.00 1.00 H new ATOM 0 HD22 LEU A 90 -11.032 -5.129 8.161 1.00 1.00 H new ATOM 0 HD23 LEU A 90 -11.079 -4.014 9.547 1.00 1.00 H new ATOM 1466 N GLU A 91 -11.796 -7.829 9.172 1.00 1.00 N ATOM 1467 CA GLU A 91 -13.226 -8.061 9.385 1.00 1.00 C ATOM 1468 C GLU A 91 -14.123 -6.813 9.224 1.00 1.00 C ATOM 1469 O GLU A 91 -15.340 -6.963 9.148 1.00 1.00 O ATOM 1470 CB GLU A 91 -13.415 -8.865 10.687 1.00 1.00 C ATOM 1471 CG GLU A 91 -14.868 -9.260 10.965 1.00 1.00 C ATOM 1472 CD GLU A 91 -14.944 -10.360 12.015 1.00 1.00 C ATOM 1473 OE1 GLU A 91 -14.653 -10.086 13.203 1.00 1.00 O ATOM 1474 OE2 GLU A 91 -15.308 -11.501 11.642 1.00 1.00 O ATOM 0 H GLU A 91 -11.454 -8.317 8.344 1.00 1.00 H new ATOM 0 HA GLU A 91 -13.603 -8.673 8.566 1.00 1.00 H new ATOM 0 HB2 GLU A 91 -12.806 -9.768 10.637 1.00 1.00 H new ATOM 0 HB3 GLU A 91 -13.042 -8.275 11.524 1.00 1.00 H new ATOM 0 HG2 GLU A 91 -15.427 -8.388 11.306 1.00 1.00 H new ATOM 0 HG3 GLU A 91 -15.339 -9.600 10.043 1.00 1.00 H new ATOM 1481 N ARG A 92 -13.524 -5.631 9.032 1.00 1.00 N ATOM 1482 CA ARG A 92 -13.978 -4.257 8.839 1.00 1.00 C ATOM 1483 C ARG A 92 -13.660 -3.539 10.150 1.00 1.00 C ATOM 1484 O ARG A 92 -14.094 -3.993 11.208 1.00 1.00 O ATOM 1485 CB ARG A 92 -15.458 -4.066 8.506 1.00 1.00 C ATOM 1486 CG ARG A 92 -15.870 -4.034 7.022 1.00 1.00 C ATOM 1487 CD ARG A 92 -15.819 -5.369 6.266 1.00 1.00 C ATOM 1488 NE ARG A 92 -14.472 -5.671 5.746 1.00 1.00 N ATOM 1489 CZ ARG A 92 -13.830 -6.845 5.872 1.00 1.00 C ATOM 1490 NH1 ARG A 92 -14.432 -7.910 6.378 1.00 1.00 N ATOM 1491 NH2 ARG A 92 -12.558 -6.960 5.508 1.00 1.00 N ATOM 0 H ARG A 92 -12.504 -5.630 9.005 1.00 1.00 H new ATOM 0 HA ARG A 92 -13.467 -3.863 7.960 1.00 1.00 H new ATOM 0 HB2 ARG A 92 -16.015 -4.869 8.989 1.00 1.00 H new ATOM 0 HB3 ARG A 92 -15.785 -3.132 8.963 1.00 1.00 H new ATOM 0 HG2 ARG A 92 -16.886 -3.645 6.959 1.00 1.00 H new ATOM 0 HG3 ARG A 92 -15.225 -3.324 6.504 1.00 1.00 H new ATOM 0 HD2 ARG A 92 -16.137 -6.172 6.931 1.00 1.00 H new ATOM 0 HD3 ARG A 92 -16.527 -5.342 5.438 1.00 1.00 H new ATOM 0 HE ARG A 92 -13.986 -4.925 5.248 1.00 1.00 H new ATOM 0 HH11 ARG A 92 -15.404 -7.850 6.682 1.00 1.00 H new ATOM 0 HH12 ARG A 92 -13.924 -8.790 6.464 1.00 1.00 H new ATOM 0 HH21 ARG A 92 -12.061 -6.154 5.130 1.00 1.00 H new ATOM 0 HH22 ARG A 92 -12.078 -7.855 5.607 1.00 1.00 H new ATOM 1505 N GLU A 93 -12.881 -2.457 10.101 1.00 1.00 N ATOM 1506 CA GLU A 93 -12.699 -1.578 11.232 1.00 1.00 C ATOM 1507 C GLU A 93 -13.941 -0.682 11.321 1.00 1.00 C ATOM 1508 O GLU A 93 -14.942 -0.932 10.644 1.00 1.00 O ATOM 1509 CB GLU A 93 -11.383 -0.797 11.074 1.00 1.00 C ATOM 1510 CG GLU A 93 -10.616 -0.724 12.396 1.00 1.00 C ATOM 1511 CD GLU A 93 -10.026 -2.068 12.842 1.00 1.00 C ATOM 1512 OE1 GLU A 93 -9.350 -2.769 12.055 1.00 1.00 O ATOM 1513 OE2 GLU A 93 -10.231 -2.401 14.031 1.00 1.00 O ATOM 0 H GLU A 93 -12.362 -2.175 9.269 1.00 1.00 H new ATOM 0 HA GLU A 93 -12.608 -2.125 12.170 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -10.762 -1.276 10.317 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -11.597 0.211 10.719 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -9.809 0.002 12.298 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -11.285 -0.355 13.174 1.00 1.00 H new ATOM 1520 N ALA A 94 -13.897 0.350 12.161 1.00 1.00 N ATOM 1521 CA ALA A 94 -15.008 1.266 12.412 1.00 1.00 C ATOM 1522 C ALA A 94 -15.390 2.021 11.137 1.00 1.00 C ATOM 1523 O ALA A 94 -14.794 3.047 10.810 1.00 1.00 O ATOM 1524 CB ALA A 94 -14.647 2.220 13.550 1.00 1.00 C ATOM 0 H ALA A 94 -13.063 0.579 12.702 1.00 1.00 H new ATOM 0 HA ALA A 94 -15.882 0.691 12.717 1.00 1.00 H new ATOM 0 HB1 ALA A 94 -15.479 2.900 13.732 1.00 1.00 H new ATOM 0 HB2 ALA A 94 -14.442 1.647 14.454 1.00 1.00 H new ATOM 0 HB3 ALA A 94 -13.762 2.794 13.276 1.00 1.00 H new ATOM 1530 N GLY A 95 -16.331 1.468 10.378 1.00 1.00 N ATOM 1531 CA GLY A 95 -16.808 1.940 9.086 1.00 1.00 C ATOM 1532 C GLY A 95 -15.727 2.201 8.043 1.00 1.00 C ATOM 1533 O GLY A 95 -16.016 2.841 7.032 1.00 1.00 O ATOM 0 H GLY A 95 -16.813 0.619 10.672 1.00 1.00 H new ATOM 0 HA2 GLY A 95 -17.505 1.205 8.685 1.00 1.00 H new ATOM 0 HA3 GLY A 95 -17.370 2.861 9.240 1.00 1.00 H new ATOM 1537 N LYS A 96 -14.499 1.723 8.243 1.00 1.00 N ATOM 1538 CA LYS A 96 -13.400 1.817 7.290 1.00 1.00 C ATOM 1539 C LYS A 96 -12.786 0.424 7.178 1.00 1.00 C ATOM 1540 O LYS A 96 -13.061 -0.457 7.997 1.00 1.00 O ATOM 1541 CB LYS A 96 -12.329 2.834 7.740 1.00 1.00 C ATOM 1542 CG LYS A 96 -11.868 2.727 9.196 1.00 1.00 C ATOM 1543 CD LYS A 96 -12.011 3.946 10.121 1.00 1.00 C ATOM 1544 CE LYS A 96 -10.759 4.827 10.151 1.00 1.00 C ATOM 1545 NZ LYS A 96 -10.558 5.446 11.478 1.00 1.00 N ATOM 0 H LYS A 96 -14.236 1.243 9.104 1.00 1.00 H new ATOM 0 HA LYS A 96 -13.777 2.168 6.329 1.00 1.00 H new ATOM 0 HB2 LYS A 96 -11.457 2.722 7.095 1.00 1.00 H new ATOM 0 HB3 LYS A 96 -12.720 3.838 7.577 1.00 1.00 H new ATOM 0 HG2 LYS A 96 -12.415 1.903 9.653 1.00 1.00 H new ATOM 0 HG3 LYS A 96 -10.815 2.444 9.187 1.00 1.00 H new ATOM 0 HD2 LYS A 96 -12.861 4.545 9.795 1.00 1.00 H new ATOM 0 HD3 LYS A 96 -12.231 3.604 11.132 1.00 1.00 H new ATOM 0 HE2 LYS A 96 -9.886 4.228 9.893 1.00 1.00 H new ATOM 0 HE3 LYS A 96 -10.845 5.607 9.395 1.00 1.00 H new ATOM 0 HZ1 LYS A 96 -9.701 6.035 11.460 1.00 1.00 H new ATOM 0 HZ2 LYS A 96 -11.380 6.038 11.713 1.00 1.00 H new ATOM 0 HZ3 LYS A 96 -10.451 4.701 12.196 1.00 1.00 H new ATOM 1559 N VAL A 97 -11.899 0.225 6.213 1.00 1.00 N ATOM 1560 CA VAL A 97 -10.938 -0.863 6.260 1.00 1.00 C ATOM 1561 C VAL A 97 -9.570 -0.203 6.389 1.00 1.00 C ATOM 1562 O VAL A 97 -9.383 0.941 5.968 1.00 1.00 O ATOM 1563 CB VAL A 97 -11.129 -1.793 5.044 1.00 1.00 C ATOM 1564 CG1 VAL A 97 -10.231 -1.472 3.858 1.00 1.00 C ATOM 1565 CG2 VAL A 97 -10.908 -3.265 5.363 1.00 1.00 C ATOM 0 H VAL A 97 -11.827 0.811 5.381 1.00 1.00 H new ATOM 0 HA VAL A 97 -11.067 -1.532 7.110 1.00 1.00 H new ATOM 0 HB VAL A 97 -12.170 -1.607 4.779 1.00 1.00 H new ATOM 0 HG11 VAL A 97 -10.432 -2.174 3.049 1.00 1.00 H new ATOM 0 HG12 VAL A 97 -10.430 -0.457 3.515 1.00 1.00 H new ATOM 0 HG13 VAL A 97 -9.187 -1.555 4.159 1.00 1.00 H new ATOM 0 HG21 VAL A 97 -11.059 -3.859 4.462 1.00 1.00 H new ATOM 0 HG22 VAL A 97 -9.891 -3.410 5.727 1.00 1.00 H new ATOM 0 HG23 VAL A 97 -11.616 -3.582 6.129 1.00 1.00 H new ATOM 1575 N TYR A 98 -8.625 -0.898 7.004 1.00 1.00 N ATOM 1576 CA TYR A 98 -7.233 -0.505 7.004 1.00 1.00 C ATOM 1577 C TYR A 98 -6.580 -1.173 5.813 1.00 1.00 C ATOM 1578 O TYR A 98 -7.128 -2.135 5.276 1.00 1.00 O ATOM 1579 CB TYR A 98 -6.591 -0.956 8.315 1.00 1.00 C ATOM 1580 CG TYR A 98 -6.893 -0.099 9.534 1.00 1.00 C ATOM 1581 CD1 TYR A 98 -8.011 0.764 9.583 1.00 1.00 C ATOM 1582 CD2 TYR A 98 -6.058 -0.214 10.660 1.00 1.00 C ATOM 1583 CE1 TYR A 98 -8.334 1.453 10.758 1.00 1.00 C ATOM 1584 CE2 TYR A 98 -6.358 0.495 11.833 1.00 1.00 C ATOM 1585 CZ TYR A 98 -7.510 1.304 11.896 1.00 1.00 C ATOM 1586 OH TYR A 98 -7.871 1.860 13.079 1.00 1.00 O ATOM 0 H TYR A 98 -8.810 -1.758 7.521 1.00 1.00 H new ATOM 0 HA TYR A 98 -7.114 0.576 6.928 1.00 1.00 H new ATOM 0 HB2 TYR A 98 -6.915 -1.976 8.523 1.00 1.00 H new ATOM 0 HB3 TYR A 98 -5.510 -0.987 8.176 1.00 1.00 H new ATOM 0 HD1 TYR A 98 -8.624 0.894 8.703 1.00 1.00 H new ATOM 0 HD2 TYR A 98 -5.185 -0.849 10.622 1.00 1.00 H new ATOM 0 HE1 TYR A 98 -9.204 2.092 10.794 1.00 1.00 H new ATOM 0 HE2 TYR A 98 -5.704 0.421 12.690 1.00 1.00 H new ATOM 0 HH TYR A 98 -7.191 1.659 13.756 1.00 1.00 H new ATOM 1596 N LEU A 99 -5.443 -0.641 5.384 1.00 1.00 N ATOM 1597 CA LEU A 99 -4.662 -1.122 4.288 1.00 1.00 C ATOM 1598 C LEU A 99 -3.199 -0.800 4.596 1.00 1.00 C ATOM 1599 O LEU A 99 -2.885 0.228 5.208 1.00 1.00 O ATOM 1600 CB LEU A 99 -5.129 -0.368 3.045 1.00 1.00 C ATOM 1601 CG LEU A 99 -6.512 -0.742 2.482 1.00 1.00 C ATOM 1602 CD1 LEU A 99 -6.739 0.083 1.216 1.00 1.00 C ATOM 1603 CD2 LEU A 99 -6.681 -2.226 2.135 1.00 1.00 C ATOM 0 H LEU A 99 -5.032 0.182 5.826 1.00 1.00 H new ATOM 0 HA LEU A 99 -4.770 -2.195 4.129 1.00 1.00 H new ATOM 0 HB2 LEU A 99 -5.134 0.697 3.276 1.00 1.00 H new ATOM 0 HB3 LEU A 99 -4.390 -0.520 2.258 1.00 1.00 H new ATOM 0 HG LEU A 99 -7.240 -0.532 3.266 1.00 1.00 H new ATOM 0 HD11 LEU A 99 -7.714 -0.161 0.793 1.00 1.00 H new ATOM 0 HD12 LEU A 99 -6.705 1.144 1.462 1.00 1.00 H new ATOM 0 HD13 LEU A 99 -5.960 -0.145 0.488 1.00 1.00 H new ATOM 0 HD21 LEU A 99 -7.685 -2.397 1.746 1.00 1.00 H new ATOM 0 HD22 LEU A 99 -5.947 -2.509 1.381 1.00 1.00 H new ATOM 0 HD23 LEU A 99 -6.532 -2.828 3.031 1.00 1.00 H new ATOM 1615 N LYS A 100 -2.288 -1.634 4.106 1.00 1.00 N ATOM 1616 CA LYS A 100 -0.846 -1.459 4.273 1.00 1.00 C ATOM 1617 C LYS A 100 -0.137 -2.310 3.247 1.00 1.00 C ATOM 1618 O LYS A 100 -0.508 -3.459 3.029 1.00 1.00 O ATOM 1619 CB LYS A 100 -0.346 -1.880 5.668 1.00 1.00 C ATOM 1620 CG LYS A 100 1.029 -1.258 5.977 1.00 1.00 C ATOM 1621 CD LYS A 100 2.068 -2.242 6.538 1.00 1.00 C ATOM 1622 CE LYS A 100 1.823 -2.688 7.983 1.00 1.00 C ATOM 1623 NZ LYS A 100 2.024 -1.607 8.973 1.00 1.00 N ATOM 0 H LYS A 100 -2.534 -2.467 3.571 1.00 1.00 H new ATOM 0 HA LYS A 100 -0.633 -0.397 4.149 1.00 1.00 H new ATOM 0 HB2 LYS A 100 -1.067 -1.570 6.425 1.00 1.00 H new ATOM 0 HB3 LYS A 100 -0.277 -2.967 5.720 1.00 1.00 H new ATOM 0 HG2 LYS A 100 1.425 -0.814 5.064 1.00 1.00 H new ATOM 0 HG3 LYS A 100 0.893 -0.447 6.693 1.00 1.00 H new ATOM 0 HD2 LYS A 100 2.091 -3.125 5.900 1.00 1.00 H new ATOM 0 HD3 LYS A 100 3.053 -1.780 6.478 1.00 1.00 H new ATOM 0 HE2 LYS A 100 0.805 -3.067 8.071 1.00 1.00 H new ATOM 0 HE3 LYS A 100 2.492 -3.516 8.219 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 1.909 -1.990 9.933 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 2.981 -1.214 8.869 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 1.323 -0.856 8.814 1.00 1.00 H new ATOM 1637 N ALA A 101 0.905 -1.763 2.647 1.00 1.00 N ATOM 1638 CA ALA A 101 1.619 -2.427 1.577 1.00 1.00 C ATOM 1639 C ALA A 101 3.046 -1.900 1.535 1.00 1.00 C ATOM 1640 O ALA A 101 3.224 -0.711 1.261 1.00 1.00 O ATOM 1641 CB ALA A 101 0.874 -2.114 0.279 1.00 1.00 C ATOM 0 H ALA A 101 1.278 -0.845 2.890 1.00 1.00 H new ATOM 0 HA ALA A 101 1.665 -3.506 1.724 1.00 1.00 H new ATOM 0 HB1 ALA A 101 1.380 -2.597 -0.557 1.00 1.00 H new ATOM 0 HB2 ALA A 101 -0.148 -2.486 0.348 1.00 1.00 H new ATOM 0 HB3 ALA A 101 0.858 -1.036 0.119 1.00 1.00 H new ATOM 1647 N PRO A 102 4.065 -2.727 1.814 1.00 1.00 N ATOM 1648 CA PRO A 102 5.430 -2.316 1.600 1.00 1.00 C ATOM 1649 C PRO A 102 5.692 -2.266 0.099 1.00 1.00 C ATOM 1650 O PRO A 102 5.520 -3.260 -0.614 1.00 1.00 O ATOM 1651 CB PRO A 102 6.315 -3.327 2.302 1.00 1.00 C ATOM 1652 CG PRO A 102 5.466 -4.599 2.296 1.00 1.00 C ATOM 1653 CD PRO A 102 4.015 -4.116 2.236 1.00 1.00 C ATOM 0 HA PRO A 102 5.636 -1.324 2.002 1.00 1.00 H new ATOM 0 HB2 PRO A 102 7.259 -3.470 1.775 1.00 1.00 H new ATOM 0 HB3 PRO A 102 6.561 -3.012 3.316 1.00 1.00 H new ATOM 0 HG2 PRO A 102 5.707 -5.228 1.439 1.00 1.00 H new ATOM 0 HG3 PRO A 102 5.645 -5.196 3.190 1.00 1.00 H new ATOM 0 HD2 PRO A 102 3.435 -4.715 1.534 1.00 1.00 H new ATOM 0 HD3 PRO A 102 3.533 -4.210 3.209 1.00 1.00 H new ATOM 1661 N MET A 103 6.100 -1.104 -0.385 1.00 1.00 N ATOM 1662 CA MET A 103 6.421 -0.897 -1.788 1.00 1.00 C ATOM 1663 C MET A 103 7.914 -0.880 -1.955 1.00 1.00 C ATOM 1664 O MET A 103 8.584 -0.261 -1.143 1.00 1.00 O ATOM 1665 CB MET A 103 5.915 0.436 -2.352 1.00 1.00 C ATOM 1666 CG MET A 103 4.852 1.216 -1.574 1.00 1.00 C ATOM 1667 SD MET A 103 3.774 2.230 -2.612 1.00 1.00 S ATOM 1668 CE MET A 103 3.119 0.913 -3.665 1.00 1.00 C ATOM 0 H MET A 103 6.219 -0.270 0.190 1.00 1.00 H new ATOM 0 HA MET A 103 5.933 -1.711 -2.324 1.00 1.00 H new ATOM 0 HB2 MET A 103 6.778 1.090 -2.475 1.00 1.00 H new ATOM 0 HB3 MET A 103 5.517 0.242 -3.348 1.00 1.00 H new ATOM 0 HG2 MET A 103 4.239 0.512 -1.011 1.00 1.00 H new ATOM 0 HG3 MET A 103 5.348 1.859 -0.847 1.00 1.00 H new ATOM 0 HE1 MET A 103 2.182 1.240 -4.116 1.00 1.00 H new ATOM 0 HE2 MET A 103 3.839 0.683 -4.450 1.00 1.00 H new ATOM 0 HE3 MET A 103 2.940 0.021 -3.064 1.00 1.00 H new ATOM 1678 N ILE A 104 8.395 -1.409 -3.074 1.00 1.00 N ATOM 1679 CA ILE A 104 9.770 -1.229 -3.514 1.00 1.00 C ATOM 1680 C ILE A 104 9.688 -0.123 -4.560 1.00 1.00 C ATOM 1681 O ILE A 104 9.268 -0.379 -5.692 1.00 1.00 O ATOM 1682 CB ILE A 104 10.368 -2.541 -4.070 1.00 1.00 C ATOM 1683 CG1 ILE A 104 10.221 -3.723 -3.084 1.00 1.00 C ATOM 1684 CG2 ILE A 104 11.856 -2.321 -4.418 1.00 1.00 C ATOM 1685 CD1 ILE A 104 10.364 -5.075 -3.795 1.00 1.00 C ATOM 0 H ILE A 104 7.834 -1.980 -3.706 1.00 1.00 H new ATOM 0 HA ILE A 104 10.441 -0.958 -2.699 1.00 1.00 H new ATOM 0 HB ILE A 104 9.808 -2.805 -4.967 1.00 1.00 H new ATOM 0 HG12 ILE A 104 10.976 -3.641 -2.302 1.00 1.00 H new ATOM 0 HG13 ILE A 104 9.249 -3.670 -2.595 1.00 1.00 H new ATOM 0 HG21 ILE A 104 12.279 -3.246 -4.810 1.00 1.00 H new ATOM 0 HG22 ILE A 104 11.942 -1.536 -5.169 1.00 1.00 H new ATOM 0 HG23 ILE A 104 12.400 -2.026 -3.521 1.00 1.00 H new ATOM 0 HD11 ILE A 104 10.255 -5.881 -3.069 1.00 1.00 H new ATOM 0 HD12 ILE A 104 9.592 -5.168 -4.559 1.00 1.00 H new ATOM 0 HD13 ILE A 104 11.347 -5.138 -4.262 1.00 1.00 H new ATOM 1697 N LEU A 105 10.020 1.111 -4.186 1.00 1.00 N ATOM 1698 CA LEU A 105 9.972 2.284 -5.059 1.00 1.00 C ATOM 1699 C LEU A 105 11.349 2.928 -5.016 1.00 1.00 C ATOM 1700 O LEU A 105 11.880 3.150 -3.933 1.00 1.00 O ATOM 1701 CB LEU A 105 8.868 3.248 -4.582 1.00 1.00 C ATOM 1702 CG LEU A 105 7.590 3.290 -5.441 1.00 1.00 C ATOM 1703 CD1 LEU A 105 7.818 4.042 -6.750 1.00 1.00 C ATOM 1704 CD2 LEU A 105 7.010 1.909 -5.763 1.00 1.00 C ATOM 0 H LEU A 105 10.339 1.329 -3.242 1.00 1.00 H new ATOM 0 HA LEU A 105 9.728 2.012 -6.086 1.00 1.00 H new ATOM 0 HB2 LEU A 105 8.589 2.974 -3.564 1.00 1.00 H new ATOM 0 HB3 LEU A 105 9.286 4.254 -4.538 1.00 1.00 H new ATOM 0 HG LEU A 105 6.863 3.818 -4.824 1.00 1.00 H new ATOM 0 HD11 LEU A 105 6.895 4.051 -7.330 1.00 1.00 H new ATOM 0 HD12 LEU A 105 8.121 5.066 -6.533 1.00 1.00 H new ATOM 0 HD13 LEU A 105 8.601 3.546 -7.323 1.00 1.00 H new ATOM 0 HD21 LEU A 105 6.112 2.024 -6.370 1.00 1.00 H new ATOM 0 HD22 LEU A 105 7.747 1.324 -6.312 1.00 1.00 H new ATOM 0 HD23 LEU A 105 6.757 1.395 -4.835 1.00 1.00 H new ATOM 1716 N ASN A 106 11.985 3.116 -6.174 1.00 1.00 N ATOM 1717 CA ASN A 106 13.397 3.478 -6.402 1.00 1.00 C ATOM 1718 C ASN A 106 14.369 2.381 -5.945 1.00 1.00 C ATOM 1719 O ASN A 106 15.468 2.250 -6.478 1.00 1.00 O ATOM 1720 CB ASN A 106 13.743 4.844 -5.775 1.00 1.00 C ATOM 1721 CG ASN A 106 14.987 5.483 -6.394 1.00 1.00 C ATOM 1722 OD1 ASN A 106 16.108 5.003 -6.267 1.00 1.00 O ATOM 1723 ND2 ASN A 106 14.842 6.613 -7.052 1.00 1.00 N ATOM 0 H ASN A 106 11.487 3.011 -7.058 1.00 1.00 H new ATOM 0 HA ASN A 106 13.522 3.571 -7.481 1.00 1.00 H new ATOM 0 HB2 ASN A 106 12.896 5.519 -5.895 1.00 1.00 H new ATOM 0 HB3 ASN A 106 13.900 4.717 -4.704 1.00 1.00 H new ATOM 0 HD21 ASN A 106 15.657 7.080 -7.450 1.00 1.00 H new ATOM 0 HD22 ASN A 106 13.915 7.022 -7.164 1.00 1.00 H new ATOM 1730 N GLY A 107 13.938 1.531 -5.018 1.00 1.00 N ATOM 1731 CA GLY A 107 14.773 0.650 -4.214 1.00 1.00 C ATOM 1732 C GLY A 107 14.679 1.013 -2.733 1.00 1.00 C ATOM 1733 O GLY A 107 15.660 0.953 -2.001 1.00 1.00 O ATOM 0 H GLY A 107 12.947 1.435 -4.798 1.00 1.00 H new ATOM 0 HA2 GLY A 107 14.463 -0.385 -4.359 1.00 1.00 H new ATOM 0 HA3 GLY A 107 15.809 0.722 -4.545 1.00 1.00 H new ATOM 1737 N VAL A 108 13.517 1.457 -2.289 1.00 1.00 N ATOM 1738 CA VAL A 108 13.219 1.783 -0.923 1.00 1.00 C ATOM 1739 C VAL A 108 11.975 0.989 -0.587 1.00 1.00 C ATOM 1740 O VAL A 108 10.954 1.197 -1.247 1.00 1.00 O ATOM 1741 CB VAL A 108 13.012 3.298 -0.750 1.00 1.00 C ATOM 1742 CG1 VAL A 108 12.932 3.681 0.728 1.00 1.00 C ATOM 1743 CG2 VAL A 108 14.129 4.131 -1.389 1.00 1.00 C ATOM 0 H VAL A 108 12.721 1.604 -2.910 1.00 1.00 H new ATOM 0 HA VAL A 108 14.037 1.529 -0.249 1.00 1.00 H new ATOM 0 HB VAL A 108 12.073 3.519 -1.257 1.00 1.00 H new ATOM 0 HG11 VAL A 108 12.786 4.757 0.818 1.00 1.00 H new ATOM 0 HG12 VAL A 108 12.095 3.161 1.194 1.00 1.00 H new ATOM 0 HG13 VAL A 108 13.858 3.398 1.228 1.00 1.00 H new ATOM 0 HG21 VAL A 108 13.927 5.191 -1.234 1.00 1.00 H new ATOM 0 HG22 VAL A 108 15.083 3.873 -0.930 1.00 1.00 H new ATOM 0 HG23 VAL A 108 14.172 3.923 -2.458 1.00 1.00 H new ATOM 1753 N CYS A 109 12.069 0.085 0.389 1.00 1.00 N ATOM 1754 CA CYS A 109 10.913 -0.514 1.030 1.00 1.00 C ATOM 1755 C CYS A 109 10.293 0.531 1.951 1.00 1.00 C ATOM 1756 O CYS A 109 10.602 0.605 3.140 1.00 1.00 O ATOM 1757 CB CYS A 109 11.287 -1.792 1.770 1.00 1.00 C ATOM 1758 SG CYS A 109 11.730 -3.056 0.544 1.00 1.00 S ATOM 0 H CYS A 109 12.960 -0.250 0.755 1.00 1.00 H new ATOM 0 HA CYS A 109 10.179 -0.813 0.282 1.00 1.00 H new ATOM 0 HB2 CYS A 109 12.123 -1.609 2.445 1.00 1.00 H new ATOM 0 HB3 CYS A 109 10.452 -2.134 2.382 1.00 1.00 H new ATOM 0 HG CYS A 109 11.423 -4.233 1.003 1.00 1.00 H new ATOM 1764 N VAL A 110 9.432 1.369 1.387 1.00 1.00 N ATOM 1765 CA VAL A 110 8.557 2.214 2.186 1.00 1.00 C ATOM 1766 C VAL A 110 7.340 1.382 2.560 1.00 1.00 C ATOM 1767 O VAL A 110 6.950 0.482 1.815 1.00 1.00 O ATOM 1768 CB VAL A 110 8.164 3.497 1.429 1.00 1.00 C ATOM 1769 CG1 VAL A 110 9.431 4.284 1.084 1.00 1.00 C ATOM 1770 CG2 VAL A 110 7.280 3.220 0.207 1.00 1.00 C ATOM 0 H VAL A 110 9.322 1.481 0.379 1.00 1.00 H new ATOM 0 HA VAL A 110 9.072 2.548 3.087 1.00 1.00 H new ATOM 0 HB VAL A 110 7.542 4.110 2.081 1.00 1.00 H new ATOM 0 HG11 VAL A 110 9.160 5.193 0.548 1.00 1.00 H new ATOM 0 HG12 VAL A 110 9.957 4.547 2.002 1.00 1.00 H new ATOM 0 HG13 VAL A 110 10.079 3.673 0.456 1.00 1.00 H new ATOM 0 HG21 VAL A 110 7.035 4.161 -0.286 1.00 1.00 H new ATOM 0 HG22 VAL A 110 7.814 2.574 -0.489 1.00 1.00 H new ATOM 0 HG23 VAL A 110 6.361 2.728 0.527 1.00 1.00 H new ATOM 1780 N ILE A 111 6.698 1.720 3.666 1.00 1.00 N ATOM 1781 CA ILE A 111 5.347 1.293 3.958 1.00 1.00 C ATOM 1782 C ILE A 111 4.435 2.325 3.324 1.00 1.00 C ATOM 1783 O ILE A 111 4.544 3.508 3.630 1.00 1.00 O ATOM 1784 CB ILE A 111 5.120 1.221 5.488 1.00 1.00 C ATOM 1785 CG1 ILE A 111 5.852 0.001 6.047 1.00 1.00 C ATOM 1786 CG2 ILE A 111 3.631 1.176 5.835 1.00 1.00 C ATOM 1787 CD1 ILE A 111 5.657 -0.336 7.523 1.00 1.00 C ATOM 0 H ILE A 111 7.109 2.306 4.393 1.00 1.00 H new ATOM 0 HA ILE A 111 5.148 0.297 3.563 1.00 1.00 H new ATOM 0 HB ILE A 111 5.523 2.125 5.946 1.00 1.00 H new ATOM 0 HG12 ILE A 111 5.548 -0.868 5.463 1.00 1.00 H new ATOM 0 HG13 ILE A 111 6.919 0.143 5.875 1.00 1.00 H new ATOM 0 HG21 ILE A 111 3.511 1.126 6.917 1.00 1.00 H new ATOM 0 HG22 ILE A 111 3.142 2.074 5.457 1.00 1.00 H new ATOM 0 HG23 ILE A 111 3.177 0.296 5.379 1.00 1.00 H new ATOM 0 HD11 ILE A 111 6.237 -1.224 7.773 1.00 1.00 H new ATOM 0 HD12 ILE A 111 5.993 0.501 8.135 1.00 1.00 H new ATOM 0 HD13 ILE A 111 4.601 -0.526 7.716 1.00 1.00 H new ATOM 1799 N TRP A 112 3.535 1.905 2.449 1.00 1.00 N ATOM 1800 CA TRP A 112 2.355 2.703 2.171 1.00 1.00 C ATOM 1801 C TRP A 112 1.361 2.213 3.218 1.00 1.00 C ATOM 1802 O TRP A 112 1.203 0.996 3.369 1.00 1.00 O ATOM 1803 CB TRP A 112 1.865 2.453 0.745 1.00 1.00 C ATOM 1804 CG TRP A 112 0.609 3.180 0.354 1.00 1.00 C ATOM 1805 CD1 TRP A 112 0.546 4.176 -0.555 1.00 1.00 C ATOM 1806 CD2 TRP A 112 -0.774 2.958 0.793 1.00 1.00 C ATOM 1807 NE1 TRP A 112 -0.757 4.617 -0.666 1.00 1.00 N ATOM 1808 CE2 TRP A 112 -1.616 3.894 0.126 1.00 1.00 C ATOM 1809 CE3 TRP A 112 -1.421 2.039 1.646 1.00 1.00 C ATOM 1810 CZ2 TRP A 112 -3.006 3.933 0.313 1.00 1.00 C ATOM 1811 CZ3 TRP A 112 -2.801 2.108 1.890 1.00 1.00 C ATOM 1812 CH2 TRP A 112 -3.602 3.048 1.224 1.00 1.00 C ATOM 0 H TRP A 112 3.598 1.031 1.927 1.00 1.00 H new ATOM 0 HA TRP A 112 2.521 3.779 2.228 1.00 1.00 H new ATOM 0 HB2 TRP A 112 2.658 2.736 0.053 1.00 1.00 H new ATOM 0 HB3 TRP A 112 1.699 1.383 0.619 1.00 1.00 H new ATOM 0 HD1 TRP A 112 1.386 4.567 -1.110 1.00 1.00 H new ATOM 0 HE1 TRP A 112 -1.048 5.389 -1.266 1.00 1.00 H new ATOM 0 HE3 TRP A 112 -0.840 1.264 2.123 1.00 1.00 H new ATOM 0 HZ2 TRP A 112 -3.611 4.637 -0.239 1.00 1.00 H new ATOM 0 HZ3 TRP A 112 -3.252 1.429 2.599 1.00 1.00 H new ATOM 0 HH2 TRP A 112 -4.665 3.090 1.410 1.00 1.00 H new ATOM 1823 N LYS A 113 0.707 3.103 3.962 1.00 1.00 N ATOM 1824 CA LYS A 113 -0.342 2.735 4.917 1.00 1.00 C ATOM 1825 C LYS A 113 -1.563 3.641 4.781 1.00 1.00 C ATOM 1826 O LYS A 113 -1.439 4.757 4.280 1.00 1.00 O ATOM 1827 CB LYS A 113 0.243 2.789 6.335 1.00 1.00 C ATOM 1828 CG LYS A 113 0.582 4.215 6.823 1.00 1.00 C ATOM 1829 CD LYS A 113 1.533 4.268 8.029 1.00 1.00 C ATOM 1830 CE LYS A 113 0.953 3.626 9.295 1.00 1.00 C ATOM 1831 NZ LYS A 113 1.817 3.852 10.472 1.00 1.00 N ATOM 0 H LYS A 113 0.889 4.106 3.921 1.00 1.00 H new ATOM 0 HA LYS A 113 -0.684 1.722 4.706 1.00 1.00 H new ATOM 0 HB2 LYS A 113 -0.468 2.339 7.027 1.00 1.00 H new ATOM 0 HB3 LYS A 113 1.147 2.181 6.367 1.00 1.00 H new ATOM 0 HG2 LYS A 113 1.030 4.770 5.999 1.00 1.00 H new ATOM 0 HG3 LYS A 113 -0.345 4.725 7.085 1.00 1.00 H new ATOM 0 HD2 LYS A 113 2.464 3.764 7.770 1.00 1.00 H new ATOM 0 HD3 LYS A 113 1.782 5.308 8.240 1.00 1.00 H new ATOM 0 HE2 LYS A 113 -0.038 4.036 9.488 1.00 1.00 H new ATOM 0 HE3 LYS A 113 0.830 2.555 9.135 1.00 1.00 H new ATOM 0 HZ1 LYS A 113 1.292 3.618 11.338 1.00 1.00 H new ATOM 0 HZ2 LYS A 113 2.661 3.247 10.405 1.00 1.00 H new ATOM 0 HZ3 LYS A 113 2.108 4.850 10.503 1.00 1.00 H new ATOM 1845 N GLY A 114 -2.714 3.227 5.309 1.00 1.00 N ATOM 1846 CA GLY A 114 -3.862 4.112 5.458 1.00 1.00 C ATOM 1847 C GLY A 114 -5.120 3.360 5.858 1.00 1.00 C ATOM 1848 O GLY A 114 -5.126 2.132 5.936 1.00 1.00 O ATOM 0 H GLY A 114 -2.874 2.276 5.642 1.00 1.00 H new ATOM 0 HA2 GLY A 114 -3.639 4.869 6.210 1.00 1.00 H new ATOM 0 HA3 GLY A 114 -4.038 4.637 4.519 1.00 1.00 H new ATOM 1852 N TRP A 115 -6.209 4.098 6.057 1.00 1.00 N ATOM 1853 CA TRP A 115 -7.552 3.567 6.136 1.00 1.00 C ATOM 1854 C TRP A 115 -8.309 4.070 4.906 1.00 1.00 C ATOM 1855 O TRP A 115 -8.381 5.273 4.654 1.00 1.00 O ATOM 1856 CB TRP A 115 -8.209 3.929 7.483 1.00 1.00 C ATOM 1857 CG TRP A 115 -8.553 5.373 7.733 1.00 1.00 C ATOM 1858 CD1 TRP A 115 -9.649 5.997 7.248 1.00 1.00 C ATOM 1859 CD2 TRP A 115 -7.838 6.393 8.503 1.00 1.00 C ATOM 1860 NE1 TRP A 115 -9.627 7.328 7.608 1.00 1.00 N ATOM 1861 CE2 TRP A 115 -8.566 7.618 8.429 1.00 1.00 C ATOM 1862 CE3 TRP A 115 -6.641 6.420 9.246 1.00 1.00 C ATOM 1863 CZ2 TRP A 115 -8.147 8.794 9.074 1.00 1.00 C ATOM 1864 CZ3 TRP A 115 -6.200 7.596 9.886 1.00 1.00 C ATOM 1865 CH2 TRP A 115 -6.959 8.776 9.821 1.00 1.00 C ATOM 0 H TRP A 115 -6.172 5.111 6.170 1.00 1.00 H new ATOM 0 HA TRP A 115 -7.561 2.477 6.119 1.00 1.00 H new ATOM 0 HB2 TRP A 115 -9.125 3.346 7.576 1.00 1.00 H new ATOM 0 HB3 TRP A 115 -7.541 3.602 8.280 1.00 1.00 H new ATOM 0 HD1 TRP A 115 -10.426 5.524 6.666 1.00 1.00 H new ATOM 0 HE1 TRP A 115 -10.316 8.014 7.301 1.00 1.00 H new ATOM 0 HE3 TRP A 115 -6.049 5.520 9.327 1.00 1.00 H new ATOM 0 HZ2 TRP A 115 -8.731 9.699 8.996 1.00 1.00 H new ATOM 0 HZ3 TRP A 115 -5.268 7.590 10.432 1.00 1.00 H new ATOM 0 HH2 TRP A 115 -6.631 9.663 10.342 1.00 1.00 H new ATOM 1876 N ILE A 116 -8.870 3.156 4.117 1.00 1.00 N ATOM 1877 CA ILE A 116 -9.858 3.513 3.112 1.00 1.00 C ATOM 1878 C ILE A 116 -11.201 3.230 3.774 1.00 1.00 C ATOM 1879 O ILE A 116 -11.566 2.085 4.057 1.00 1.00 O ATOM 1880 CB ILE A 116 -9.616 2.798 1.770 1.00 1.00 C ATOM 1881 CG1 ILE A 116 -8.417 3.376 0.981 1.00 1.00 C ATOM 1882 CG2 ILE A 116 -10.856 2.918 0.885 1.00 1.00 C ATOM 1883 CD1 ILE A 116 -8.628 4.750 0.323 1.00 1.00 C ATOM 0 H ILE A 116 -8.653 2.160 4.158 1.00 1.00 H new ATOM 0 HA ILE A 116 -9.806 4.560 2.815 1.00 1.00 H new ATOM 0 HB ILE A 116 -9.396 1.759 2.016 1.00 1.00 H new ATOM 0 HG12 ILE A 116 -7.566 3.449 1.658 1.00 1.00 H new ATOM 0 HG13 ILE A 116 -8.145 2.663 0.203 1.00 1.00 H new ATOM 0 HG21 ILE A 116 -10.677 2.410 -0.063 1.00 1.00 H new ATOM 0 HG22 ILE A 116 -11.708 2.459 1.388 1.00 1.00 H new ATOM 0 HG23 ILE A 116 -11.069 3.970 0.698 1.00 1.00 H new ATOM 0 HD11 ILE A 116 -7.718 5.047 -0.199 1.00 1.00 H new ATOM 0 HD12 ILE A 116 -9.452 4.690 -0.388 1.00 1.00 H new ATOM 0 HD13 ILE A 116 -8.864 5.488 1.090 1.00 1.00 H new ATOM 1895 N ASP A 117 -11.892 4.308 4.104 1.00 1.00 N ATOM 1896 CA ASP A 117 -13.246 4.328 4.597 1.00 1.00 C ATOM 1897 C ASP A 117 -14.215 3.656 3.620 1.00 1.00 C ATOM 1898 O ASP A 117 -14.083 3.768 2.399 1.00 1.00 O ATOM 1899 CB ASP A 117 -13.626 5.766 4.903 1.00 1.00 C ATOM 1900 CG ASP A 117 -14.910 5.766 5.709 1.00 1.00 C ATOM 1901 OD1 ASP A 117 -14.837 5.649 6.951 1.00 1.00 O ATOM 1902 OD2 ASP A 117 -16.005 5.870 5.114 1.00 1.00 O ATOM 0 H ASP A 117 -11.494 5.244 4.028 1.00 1.00 H new ATOM 0 HA ASP A 117 -13.313 3.745 5.515 1.00 1.00 H new ATOM 0 HB2 ASP A 117 -12.829 6.257 5.461 1.00 1.00 H new ATOM 0 HB3 ASP A 117 -13.760 6.327 3.978 1.00 1.00 H new ATOM 1907 N LEU A 118 -15.199 2.927 4.150 1.00 1.00 N ATOM 1908 CA LEU A 118 -16.032 2.034 3.345 1.00 1.00 C ATOM 1909 C LEU A 118 -17.011 2.808 2.459 1.00 1.00 C ATOM 1910 O LEU A 118 -17.537 2.225 1.517 1.00 1.00 O ATOM 1911 CB LEU A 118 -16.802 1.046 4.243 1.00 1.00 C ATOM 1912 CG LEU A 118 -15.920 0.214 5.192 1.00 1.00 C ATOM 1913 CD1 LEU A 118 -16.757 -0.534 6.231 1.00 1.00 C ATOM 1914 CD2 LEU A 118 -14.881 -0.663 4.487 1.00 1.00 C ATOM 0 H LEU A 118 -15.439 2.939 5.141 1.00 1.00 H new ATOM 0 HA LEU A 118 -15.361 1.475 2.693 1.00 1.00 H new ATOM 0 HB2 LEU A 118 -17.525 1.605 4.838 1.00 1.00 H new ATOM 0 HB3 LEU A 118 -17.370 0.366 3.608 1.00 1.00 H new ATOM 0 HG LEU A 118 -15.311 0.933 5.740 1.00 1.00 H new ATOM 0 HD11 LEU A 118 -16.099 -1.110 6.882 1.00 1.00 H new ATOM 0 HD12 LEU A 118 -17.322 0.182 6.828 1.00 1.00 H new ATOM 0 HD13 LEU A 118 -17.447 -1.209 5.725 1.00 1.00 H new ATOM 0 HD21 LEU A 118 -14.305 -1.214 5.231 1.00 1.00 H new ATOM 0 HD22 LEU A 118 -15.387 -1.367 3.826 1.00 1.00 H new ATOM 0 HD23 LEU A 118 -14.211 -0.034 3.902 1.00 1.00 H new ATOM 1926 N HIS A 119 -17.228 4.102 2.718 1.00 1.00 N ATOM 1927 CA HIS A 119 -18.365 4.870 2.216 1.00 1.00 C ATOM 1928 C HIS A 119 -18.388 4.994 0.687 1.00 1.00 C ATOM 1929 O HIS A 119 -19.455 4.962 0.084 1.00 1.00 O ATOM 1930 CB HIS A 119 -18.293 6.281 2.827 1.00 1.00 C ATOM 1931 CG HIS A 119 -17.151 7.126 2.291 1.00 1.00 C ATOM 1932 ND1 HIS A 119 -17.304 8.266 1.542 1.00 1.00 N ATOM 1933 CD2 HIS A 119 -15.811 6.824 2.279 1.00 1.00 C ATOM 1934 CE1 HIS A 119 -16.098 8.645 1.095 1.00 1.00 C ATOM 1935 NE2 HIS A 119 -15.162 7.782 1.510 1.00 1.00 N ATOM 0 H HIS A 119 -16.599 4.656 3.299 1.00 1.00 H new ATOM 0 HA HIS A 119 -19.274 4.341 2.503 1.00 1.00 H new ATOM 0 HB2 HIS A 119 -19.234 6.797 2.637 1.00 1.00 H new ATOM 0 HB3 HIS A 119 -18.190 6.193 3.909 1.00 1.00 H new ATOM 0 HD1 HIS A 119 -18.186 8.744 1.357 1.00 1.00 H new ATOM 0 HD2 HIS A 119 -15.344 5.989 2.779 1.00 1.00 H new ATOM 0 HE1 HIS A 119 -15.909 9.519 0.489 1.00 1.00 H new ATOM 1943 N ARG A 120 -17.221 5.201 0.069 1.00 1.00 N ATOM 1944 CA ARG A 120 -16.956 5.304 -1.365 1.00 1.00 C ATOM 1945 C ARG A 120 -15.566 4.796 -1.686 1.00 1.00 C ATOM 1946 O ARG A 120 -15.204 4.783 -2.860 1.00 1.00 O ATOM 1947 CB ARG A 120 -17.106 6.754 -1.871 1.00 1.00 C ATOM 1948 CG ARG A 120 -18.502 7.362 -1.699 1.00 1.00 C ATOM 1949 CD ARG A 120 -19.576 6.597 -2.490 1.00 1.00 C ATOM 1950 NE ARG A 120 -20.889 6.690 -1.838 1.00 1.00 N ATOM 1951 CZ ARG A 120 -21.795 7.653 -2.019 1.00 1.00 C ATOM 1952 NH1 ARG A 120 -21.622 8.592 -2.943 1.00 1.00 N ATOM 1953 NH2 ARG A 120 -22.883 7.670 -1.261 1.00 1.00 N ATOM 0 H ARG A 120 -16.363 5.310 0.610 1.00 1.00 H new ATOM 0 HA ARG A 120 -17.696 4.687 -1.875 1.00 1.00 H new ATOM 0 HB2 ARG A 120 -16.386 7.382 -1.346 1.00 1.00 H new ATOM 0 HB3 ARG A 120 -16.842 6.782 -2.928 1.00 1.00 H new ATOM 0 HG2 ARG A 120 -18.766 7.365 -0.642 1.00 1.00 H new ATOM 0 HG3 ARG A 120 -18.485 8.402 -2.026 1.00 1.00 H new ATOM 0 HD2 ARG A 120 -19.641 6.999 -3.501 1.00 1.00 H new ATOM 0 HD3 ARG A 120 -19.286 5.550 -2.581 1.00 1.00 H new ATOM 0 HE ARG A 120 -21.132 5.946 -1.183 1.00 1.00 H new ATOM 0 HH11 ARG A 120 -20.786 8.584 -3.528 1.00 1.00 H new ATOM 0 HH12 ARG A 120 -22.325 9.321 -3.068 1.00 1.00 H new ATOM 0 HH21 ARG A 120 -23.020 6.952 -0.549 1.00 1.00 H new ATOM 0 HH22 ARG A 120 -23.583 8.401 -1.390 1.00 1.00 H new ATOM 1967 N LEU A 121 -14.822 4.293 -0.697 1.00 1.00 N ATOM 1968 CA LEU A 121 -13.444 3.880 -0.859 1.00 1.00 C ATOM 1969 C LEU A 121 -12.568 5.115 -1.118 1.00 1.00 C ATOM 1970 O LEU A 121 -11.597 5.048 -1.875 1.00 1.00 O ATOM 1971 CB LEU A 121 -13.238 2.727 -1.873 1.00 1.00 C ATOM 1972 CG LEU A 121 -14.119 1.463 -1.773 1.00 1.00 C ATOM 1973 CD1 LEU A 121 -14.541 1.058 -0.356 1.00 1.00 C ATOM 1974 CD2 LEU A 121 -15.392 1.538 -2.626 1.00 1.00 C ATOM 0 H LEU A 121 -15.175 4.163 0.251 1.00 1.00 H new ATOM 0 HA LEU A 121 -13.117 3.426 0.077 1.00 1.00 H new ATOM 0 HB2 LEU A 121 -13.373 3.142 -2.872 1.00 1.00 H new ATOM 0 HB3 LEU A 121 -12.198 2.408 -1.799 1.00 1.00 H new ATOM 0 HG LEU A 121 -13.443 0.699 -2.157 1.00 1.00 H new ATOM 0 HD11 LEU A 121 -15.156 0.159 -0.402 1.00 1.00 H new ATOM 0 HD12 LEU A 121 -13.654 0.860 0.245 1.00 1.00 H new ATOM 0 HD13 LEU A 121 -15.114 1.866 0.098 1.00 1.00 H new ATOM 0 HD21 LEU A 121 -15.964 0.617 -2.508 1.00 1.00 H new ATOM 0 HD22 LEU A 121 -15.997 2.385 -2.303 1.00 1.00 H new ATOM 0 HD23 LEU A 121 -15.121 1.665 -3.674 1.00 1.00 H new ATOM 1986 N ASP A 122 -12.905 6.231 -0.467 1.00 1.00 N ATOM 1987 CA ASP A 122 -12.002 7.351 -0.229 1.00 1.00 C ATOM 1988 C ASP A 122 -11.492 7.128 1.203 1.00 1.00 C ATOM 1989 O ASP A 122 -11.957 6.223 1.904 1.00 1.00 O ATOM 1990 CB ASP A 122 -12.644 8.762 -0.337 1.00 1.00 C ATOM 1991 CG ASP A 122 -13.756 9.056 -1.348 1.00 1.00 C ATOM 1992 OD1 ASP A 122 -14.100 8.231 -2.221 1.00 1.00 O ATOM 1993 OD2 ASP A 122 -14.261 10.205 -1.356 1.00 1.00 O ATOM 0 H ASP A 122 -13.838 6.381 -0.083 1.00 1.00 H new ATOM 0 HA ASP A 122 -11.231 7.357 -0.999 1.00 1.00 H new ATOM 0 HB2 ASP A 122 -13.038 9.008 0.649 1.00 1.00 H new ATOM 0 HB3 ASP A 122 -11.835 9.464 -0.541 1.00 1.00 H new ATOM 1998 N GLY A 123 -10.563 7.941 1.692 1.00 1.00 N ATOM 1999 CA GLY A 123 -10.150 7.888 3.084 1.00 1.00 C ATOM 2000 C GLY A 123 -8.814 8.595 3.227 1.00 1.00 C ATOM 2001 O GLY A 123 -8.577 9.593 2.544 1.00 1.00 O ATOM 0 H GLY A 123 -10.080 8.649 1.138 1.00 1.00 H new ATOM 0 HA2 GLY A 123 -10.898 8.364 3.718 1.00 1.00 H new ATOM 0 HA3 GLY A 123 -10.066 6.852 3.413 1.00 1.00 H new ATOM 2005 N MET A 124 -7.949 8.117 4.116 1.00 1.00 N ATOM 2006 CA MET A 124 -6.722 8.812 4.474 1.00 1.00 C ATOM 2007 C MET A 124 -5.598 7.803 4.667 1.00 1.00 C ATOM 2008 O MET A 124 -5.808 6.693 5.148 1.00 1.00 O ATOM 2009 CB MET A 124 -7.013 9.709 5.679 1.00 1.00 C ATOM 2010 CG MET A 124 -6.093 9.584 6.889 1.00 1.00 C ATOM 2011 SD MET A 124 -4.430 10.264 6.778 1.00 1.00 S ATOM 2012 CE MET A 124 -4.906 12.007 6.761 1.00 1.00 C ATOM 0 H MET A 124 -8.082 7.234 4.609 1.00 1.00 H new ATOM 0 HA MET A 124 -6.371 9.471 3.680 1.00 1.00 H new ATOM 0 HB2 MET A 124 -6.986 10.745 5.341 1.00 1.00 H new ATOM 0 HB3 MET A 124 -8.032 9.508 6.009 1.00 1.00 H new ATOM 0 HG2 MET A 124 -6.590 10.060 7.734 1.00 1.00 H new ATOM 0 HG3 MET A 124 -6.003 8.524 7.128 1.00 1.00 H new ATOM 0 HE1 MET A 124 -4.081 12.613 7.134 1.00 1.00 H new ATOM 0 HE2 MET A 124 -5.146 12.309 5.741 1.00 1.00 H new ATOM 0 HE3 MET A 124 -5.779 12.152 7.397 1.00 1.00 H new ATOM 2022 N GLY A 125 -4.396 8.182 4.263 1.00 1.00 N ATOM 2023 CA GLY A 125 -3.213 7.348 4.279 1.00 1.00 C ATOM 2024 C GLY A 125 -1.986 8.161 3.912 1.00 1.00 C ATOM 2025 O GLY A 125 -2.045 9.384 3.786 1.00 1.00 O ATOM 0 H GLY A 125 -4.215 9.118 3.901 1.00 1.00 H new ATOM 0 HA2 GLY A 125 -3.083 6.909 5.268 1.00 1.00 H new ATOM 0 HA3 GLY A 125 -3.333 6.523 3.577 1.00 1.00 H new ATOM 2029 N CYS A 126 -0.849 7.490 3.805 1.00 1.00 N ATOM 2030 CA CYS A 126 0.454 8.109 3.661 1.00 1.00 C ATOM 2031 C CYS A 126 1.527 7.070 3.413 1.00 1.00 C ATOM 2032 O CYS A 126 1.253 5.872 3.295 1.00 1.00 O ATOM 2033 CB CYS A 126 0.784 8.890 4.933 1.00 1.00 C ATOM 2034 SG CYS A 126 0.793 7.878 6.445 1.00 1.00 S ATOM 0 H CYS A 126 -0.810 6.471 3.817 1.00 1.00 H new ATOM 0 HA CYS A 126 0.425 8.782 2.804 1.00 1.00 H new ATOM 0 HB2 CYS A 126 1.762 9.358 4.816 1.00 1.00 H new ATOM 0 HB3 CYS A 126 0.058 9.694 5.051 1.00 1.00 H new ATOM 0 HG CYS A 126 2.002 7.466 6.684 1.00 1.00 H new ATOM 2040 N LEU A 127 2.767 7.543 3.384 1.00 1.00 N ATOM 2041 CA LEU A 127 3.918 6.684 3.502 1.00 1.00 C ATOM 2042 C LEU A 127 4.452 6.696 4.924 1.00 1.00 C ATOM 2043 O LEU A 127 4.170 7.582 5.734 1.00 1.00 O ATOM 2044 CB LEU A 127 5.007 7.123 2.529 1.00 1.00 C ATOM 2045 CG LEU A 127 4.529 7.107 1.073 1.00 1.00 C ATOM 2046 CD1 LEU A 127 5.707 7.553 0.227 1.00 1.00 C ATOM 2047 CD2 LEU A 127 4.013 5.738 0.610 1.00 1.00 C ATOM 0 H LEU A 127 2.993 8.532 3.278 1.00 1.00 H new ATOM 0 HA LEU A 127 3.614 5.667 3.255 1.00 1.00 H new ATOM 0 HB2 LEU A 127 5.339 8.128 2.789 1.00 1.00 H new ATOM 0 HB3 LEU A 127 5.870 6.465 2.633 1.00 1.00 H new ATOM 0 HG LEU A 127 3.674 7.775 0.970 1.00 1.00 H new ATOM 0 HD11 LEU A 127 5.418 7.559 -0.824 1.00 1.00 H new ATOM 0 HD12 LEU A 127 6.010 8.556 0.526 1.00 1.00 H new ATOM 0 HD13 LEU A 127 6.540 6.864 0.371 1.00 1.00 H new ATOM 0 HD21 LEU A 127 3.692 5.803 -0.430 1.00 1.00 H new ATOM 0 HD22 LEU A 127 4.810 5.000 0.698 1.00 1.00 H new ATOM 0 HD23 LEU A 127 3.170 5.438 1.232 1.00 1.00 H new ATOM 2059 N GLU A 128 5.268 5.691 5.173 1.00 1.00 N ATOM 2060 CA GLU A 128 6.153 5.443 6.296 1.00 1.00 C ATOM 2061 C GLU A 128 7.306 4.582 5.743 1.00 1.00 C ATOM 2062 O GLU A 128 7.347 4.306 4.543 1.00 1.00 O ATOM 2063 CB GLU A 128 5.298 4.783 7.382 1.00 1.00 C ATOM 2064 CG GLU A 128 6.006 4.527 8.705 1.00 1.00 C ATOM 2065 CD GLU A 128 4.961 4.219 9.771 1.00 1.00 C ATOM 2066 OE1 GLU A 128 4.548 3.044 9.908 1.00 1.00 O ATOM 2067 OE2 GLU A 128 4.452 5.167 10.407 1.00 1.00 O ATOM 0 H GLU A 128 5.334 4.926 4.501 1.00 1.00 H new ATOM 0 HA GLU A 128 6.605 6.324 6.752 1.00 1.00 H new ATOM 0 HB2 GLU A 128 4.430 5.414 7.570 1.00 1.00 H new ATOM 0 HB3 GLU A 128 4.925 3.833 6.999 1.00 1.00 H new ATOM 0 HG2 GLU A 128 6.701 3.693 8.606 1.00 1.00 H new ATOM 0 HG3 GLU A 128 6.593 5.399 8.993 1.00 1.00 H new ATOM 2074 N PHE A 129 8.266 4.162 6.562 1.00 1.00 N ATOM 2075 CA PHE A 129 9.339 3.259 6.134 1.00 1.00 C ATOM 2076 C PHE A 129 9.023 1.826 6.584 1.00 1.00 C ATOM 2077 O PHE A 129 8.343 1.658 7.603 1.00 1.00 O ATOM 2078 CB PHE A 129 10.667 3.740 6.730 1.00 1.00 C ATOM 2079 CG PHE A 129 11.870 3.005 6.181 1.00 1.00 C ATOM 2080 CD1 PHE A 129 12.214 3.159 4.827 1.00 1.00 C ATOM 2081 CD2 PHE A 129 12.643 2.167 7.004 1.00 1.00 C ATOM 2082 CE1 PHE A 129 13.297 2.449 4.289 1.00 1.00 C ATOM 2083 CE2 PHE A 129 13.770 1.515 6.475 1.00 1.00 C ATOM 2084 CZ PHE A 129 14.087 1.635 5.115 1.00 1.00 C ATOM 0 H PHE A 129 8.325 4.436 7.543 1.00 1.00 H new ATOM 0 HA PHE A 129 9.419 3.263 5.047 1.00 1.00 H new ATOM 0 HB2 PHE A 129 10.780 4.806 6.534 1.00 1.00 H new ATOM 0 HB3 PHE A 129 10.637 3.617 7.813 1.00 1.00 H new ATOM 0 HD1 PHE A 129 11.642 3.826 4.199 1.00 1.00 H new ATOM 0 HD2 PHE A 129 12.371 2.025 8.040 1.00 1.00 H new ATOM 0 HE1 PHE A 129 13.524 2.529 3.236 1.00 1.00 H new ATOM 0 HE2 PHE A 129 14.396 0.917 7.121 1.00 1.00 H new ATOM 0 HZ PHE A 129 14.934 1.104 4.705 1.00 1.00 H new ATOM 2094 N ASP A 130 9.532 0.804 5.878 1.00 1.00 N ATOM 2095 CA ASP A 130 9.464 -0.594 6.320 1.00 1.00 C ATOM 2096 C ASP A 130 10.871 -1.115 6.556 1.00 1.00 C ATOM 2097 O ASP A 130 11.487 -1.646 5.639 1.00 1.00 O ATOM 2098 CB ASP A 130 8.735 -1.545 5.340 1.00 1.00 C ATOM 2099 CG ASP A 130 8.178 -2.727 6.138 1.00 1.00 C ATOM 2100 OD1 ASP A 130 8.896 -3.280 7.007 1.00 1.00 O ATOM 2101 OD2 ASP A 130 7.003 -3.096 5.925 1.00 1.00 O ATOM 0 H ASP A 130 10.003 0.927 4.982 1.00 1.00 H new ATOM 0 HA ASP A 130 8.874 -0.588 7.236 1.00 1.00 H new ATOM 0 HB2 ASP A 130 7.929 -1.018 4.830 1.00 1.00 H new ATOM 0 HB3 ASP A 130 9.423 -1.897 4.571 1.00 1.00 H new ATOM 2106 N GLU A 131 11.433 -0.964 7.754 1.00 1.00 N ATOM 2107 CA GLU A 131 12.771 -1.424 8.006 1.00 1.00 C ATOM 2108 C GLU A 131 12.879 -2.943 7.902 1.00 1.00 C ATOM 2109 O GLU A 131 13.915 -3.443 7.476 1.00 1.00 O ATOM 2110 CB GLU A 131 13.161 -0.921 9.389 1.00 1.00 C ATOM 2111 CG GLU A 131 14.644 -1.140 9.598 1.00 1.00 C ATOM 2112 CD GLU A 131 15.084 -0.566 10.934 1.00 1.00 C ATOM 2113 OE1 GLU A 131 15.369 0.652 10.996 1.00 1.00 O ATOM 2114 OE2 GLU A 131 15.019 -1.286 11.953 1.00 1.00 O ATOM 0 H GLU A 131 10.974 -0.527 8.553 1.00 1.00 H new ATOM 0 HA GLU A 131 13.455 -1.034 7.253 1.00 1.00 H new ATOM 0 HB2 GLU A 131 12.920 0.138 9.485 1.00 1.00 H new ATOM 0 HB3 GLU A 131 12.592 -1.448 10.155 1.00 1.00 H new ATOM 0 HG2 GLU A 131 14.869 -2.206 9.562 1.00 1.00 H new ATOM 0 HG3 GLU A 131 15.204 -0.669 8.791 1.00 1.00 H new ATOM 2121 N GLU A 132 11.833 -3.688 8.259 1.00 1.00 N ATOM 2122 CA GLU A 132 11.902 -5.136 8.197 1.00 1.00 C ATOM 2123 C GLU A 132 11.882 -5.568 6.738 1.00 1.00 C ATOM 2124 O GLU A 132 12.738 -6.343 6.309 1.00 1.00 O ATOM 2125 CB GLU A 132 10.741 -5.757 8.988 1.00 1.00 C ATOM 2126 CG GLU A 132 10.998 -7.232 9.328 1.00 1.00 C ATOM 2127 CD GLU A 132 12.137 -7.383 10.340 1.00 1.00 C ATOM 2128 OE1 GLU A 132 11.958 -6.939 11.497 1.00 1.00 O ATOM 2129 OE2 GLU A 132 13.203 -7.936 9.984 1.00 1.00 O ATOM 0 H GLU A 132 10.943 -3.314 8.589 1.00 1.00 H new ATOM 0 HA GLU A 132 12.828 -5.487 8.652 1.00 1.00 H new ATOM 0 HB2 GLU A 132 10.588 -5.194 9.909 1.00 1.00 H new ATOM 0 HB3 GLU A 132 9.822 -5.674 8.408 1.00 1.00 H new ATOM 0 HG2 GLU A 132 10.089 -7.677 9.732 1.00 1.00 H new ATOM 0 HG3 GLU A 132 11.243 -7.779 8.418 1.00 1.00 H new ATOM 2136 N ARG A 133 10.935 -5.062 5.940 1.00 1.00 N ATOM 2137 CA ARG A 133 10.853 -5.541 4.561 1.00 1.00 C ATOM 2138 C ARG A 133 11.979 -4.889 3.746 1.00 1.00 C ATOM 2139 O ARG A 133 12.342 -5.455 2.714 1.00 1.00 O ATOM 2140 CB ARG A 133 9.473 -5.226 3.976 1.00 1.00 C ATOM 2141 CG ARG A 133 8.573 -6.471 3.941 1.00 1.00 C ATOM 2142 CD ARG A 133 8.861 -7.484 2.832 1.00 1.00 C ATOM 2143 NE ARG A 133 8.235 -7.093 1.559 1.00 1.00 N ATOM 2144 CZ ARG A 133 8.869 -6.720 0.440 1.00 1.00 C ATOM 2145 NH1 ARG A 133 10.185 -6.513 0.430 1.00 1.00 N ATOM 2146 NH2 ARG A 133 8.147 -6.559 -0.662 1.00 1.00 N ATOM 0 H ARG A 133 10.248 -4.357 6.208 1.00 1.00 H new ATOM 0 HA ARG A 133 10.979 -6.623 4.527 1.00 1.00 H new ATOM 0 HB2 ARG A 133 8.995 -4.448 4.571 1.00 1.00 H new ATOM 0 HB3 ARG A 133 9.587 -4.831 2.967 1.00 1.00 H new ATOM 0 HG2 ARG A 133 8.657 -6.981 4.901 1.00 1.00 H new ATOM 0 HG3 ARG A 133 7.538 -6.143 3.844 1.00 1.00 H new ATOM 0 HD2 ARG A 133 9.938 -7.576 2.694 1.00 1.00 H new ATOM 0 HD3 ARG A 133 8.493 -8.465 3.132 1.00 1.00 H new ATOM 0 HE ARG A 133 7.216 -7.108 1.526 1.00 1.00 H new ATOM 0 HH11 ARG A 133 10.727 -6.638 1.285 1.00 1.00 H new ATOM 0 HH12 ARG A 133 10.650 -6.229 -0.432 1.00 1.00 H new ATOM 0 HH21 ARG A 133 7.140 -6.719 -0.640 1.00 1.00 H new ATOM 0 HH22 ARG A 133 8.599 -6.275 -1.531 1.00 1.00 H new ATOM 2160 N ALA A 134 12.548 -3.757 4.187 1.00 1.00 N ATOM 2161 CA ALA A 134 13.798 -3.203 3.679 1.00 1.00 C ATOM 2162 C ALA A 134 14.917 -4.185 3.947 1.00 1.00 C ATOM 2163 O ALA A 134 15.611 -4.532 3.001 1.00 1.00 O ATOM 2164 CB ALA A 134 14.148 -1.844 4.305 1.00 1.00 C ATOM 0 H ALA A 134 12.134 -3.191 4.928 1.00 1.00 H new ATOM 0 HA ALA A 134 13.671 -3.037 2.609 1.00 1.00 H new ATOM 0 HB1 ALA A 134 15.088 -1.483 3.888 1.00 1.00 H new ATOM 0 HB2 ALA A 134 13.355 -1.128 4.087 1.00 1.00 H new ATOM 0 HB3 ALA A 134 14.249 -1.956 5.384 1.00 1.00 H new ATOM 2170 N GLN A 135 15.091 -4.653 5.188 1.00 1.00 N ATOM 2171 CA GLN A 135 16.124 -5.626 5.503 1.00 1.00 C ATOM 2172 C GLN A 135 15.903 -6.954 4.771 1.00 1.00 C ATOM 2173 O GLN A 135 16.880 -7.669 4.535 1.00 1.00 O ATOM 2174 CB GLN A 135 16.240 -5.836 7.019 1.00 1.00 C ATOM 2175 CG GLN A 135 16.995 -4.685 7.709 1.00 1.00 C ATOM 2176 CD GLN A 135 17.629 -5.154 9.015 1.00 1.00 C ATOM 2177 OE1 GLN A 135 18.539 -5.981 8.997 1.00 1.00 O ATOM 2178 NE2 GLN A 135 17.177 -4.688 10.165 1.00 1.00 N ATOM 0 H GLN A 135 14.525 -4.368 5.987 1.00 1.00 H new ATOM 0 HA GLN A 135 17.071 -5.220 5.147 1.00 1.00 H new ATOM 0 HB2 GLN A 135 15.242 -5.924 7.449 1.00 1.00 H new ATOM 0 HB3 GLN A 135 16.756 -6.776 7.216 1.00 1.00 H new ATOM 0 HG2 GLN A 135 17.767 -4.301 7.043 1.00 1.00 H new ATOM 0 HG3 GLN A 135 16.308 -3.863 7.909 1.00 1.00 H new ATOM 0 HE21 GLN A 135 16.422 -4.002 10.176 1.00 1.00 H new ATOM 0 HE22 GLN A 135 17.583 -5.014 11.042 1.00 1.00 H new ATOM 2187 N GLN A 136 14.668 -7.299 4.384 1.00 1.00 N ATOM 2188 CA GLN A 136 14.450 -8.441 3.507 1.00 1.00 C ATOM 2189 C GLN A 136 15.008 -8.137 2.115 1.00 1.00 C ATOM 2190 O GLN A 136 15.803 -8.913 1.597 1.00 1.00 O ATOM 2191 CB GLN A 136 12.962 -8.830 3.472 1.00 1.00 C ATOM 2192 CG GLN A 136 12.509 -9.526 4.770 1.00 1.00 C ATOM 2193 CD GLN A 136 13.226 -10.861 4.967 1.00 1.00 C ATOM 2194 OE1 GLN A 136 13.289 -11.675 4.048 1.00 1.00 O ATOM 2195 NE2 GLN A 136 13.802 -11.114 6.130 1.00 1.00 N ATOM 0 H GLN A 136 13.819 -6.807 4.663 1.00 1.00 H new ATOM 0 HA GLN A 136 14.986 -9.306 3.898 1.00 1.00 H new ATOM 0 HB2 GLN A 136 12.359 -7.936 3.312 1.00 1.00 H new ATOM 0 HB3 GLN A 136 12.782 -9.492 2.625 1.00 1.00 H new ATOM 0 HG2 GLN A 136 12.708 -8.876 5.622 1.00 1.00 H new ATOM 0 HG3 GLN A 136 11.432 -9.691 4.739 1.00 1.00 H new ATOM 0 HE21 GLN A 136 13.744 -10.432 6.887 1.00 1.00 H new ATOM 0 HE22 GLN A 136 14.304 -11.991 6.270 1.00 1.00 H new ATOM 2204 N GLU A 137 14.629 -7.017 1.502 1.00 1.00 N ATOM 2205 CA GLU A 137 15.033 -6.674 0.144 1.00 1.00 C ATOM 2206 C GLU A 137 16.546 -6.422 0.042 1.00 1.00 C ATOM 2207 O GLU A 137 17.165 -6.817 -0.945 1.00 1.00 O ATOM 2208 CB GLU A 137 14.218 -5.443 -0.279 1.00 1.00 C ATOM 2209 CG GLU A 137 13.955 -5.398 -1.786 1.00 1.00 C ATOM 2210 CD GLU A 137 13.026 -6.526 -2.247 1.00 1.00 C ATOM 2211 OE1 GLU A 137 11.991 -6.785 -1.592 1.00 1.00 O ATOM 2212 OE2 GLU A 137 13.317 -7.162 -3.284 1.00 1.00 O ATOM 0 H GLU A 137 14.028 -6.318 1.939 1.00 1.00 H new ATOM 0 HA GLU A 137 14.832 -7.507 -0.529 1.00 1.00 H new ATOM 0 HB2 GLU A 137 13.266 -5.443 0.252 1.00 1.00 H new ATOM 0 HB3 GLU A 137 14.750 -4.540 0.020 1.00 1.00 H new ATOM 0 HG2 GLU A 137 13.513 -4.436 -2.047 1.00 1.00 H new ATOM 0 HG3 GLU A 137 14.902 -5.469 -2.320 1.00 1.00 H new ATOM 2219 N ASP A 138 17.145 -5.826 1.078 1.00 1.00 N ATOM 2220 CA ASP A 138 18.587 -5.642 1.253 1.00 1.00 C ATOM 2221 C ASP A 138 19.283 -6.989 1.193 1.00 1.00 C ATOM 2222 O ASP A 138 20.257 -7.154 0.461 1.00 1.00 O ATOM 2223 CB ASP A 138 18.923 -4.983 2.609 1.00 1.00 C ATOM 2224 CG ASP A 138 19.367 -3.521 2.576 1.00 1.00 C ATOM 2225 OD1 ASP A 138 19.060 -2.769 1.627 1.00 1.00 O ATOM 2226 OD2 ASP A 138 20.099 -3.129 3.512 1.00 1.00 O ATOM 0 H ASP A 138 16.609 -5.440 1.855 1.00 1.00 H new ATOM 0 HA ASP A 138 18.931 -4.988 0.452 1.00 1.00 H new ATOM 0 HB2 ASP A 138 18.044 -5.056 3.249 1.00 1.00 H new ATOM 0 HB3 ASP A 138 19.712 -5.567 3.084 1.00 1.00 H new ATOM 2231 N ALA A 139 18.800 -7.950 1.984 1.00 1.00 N ATOM 2232 CA ALA A 139 19.362 -9.286 2.024 1.00 1.00 C ATOM 2233 C ALA A 139 19.222 -9.958 0.657 1.00 1.00 C ATOM 2234 O ALA A 139 20.151 -10.605 0.165 1.00 1.00 O ATOM 2235 CB ALA A 139 18.663 -10.097 3.113 1.00 1.00 C ATOM 0 H ALA A 139 18.008 -7.815 2.612 1.00 1.00 H new ATOM 0 HA ALA A 139 20.425 -9.230 2.260 1.00 1.00 H new ATOM 0 HB1 ALA A 139 19.084 -11.102 3.145 1.00 1.00 H new ATOM 0 HB2 ALA A 139 18.809 -9.612 4.078 1.00 1.00 H new ATOM 0 HB3 ALA A 139 17.597 -10.157 2.894 1.00 1.00 H new ATOM 2241 N LEU A 140 18.049 -9.828 0.042 1.00 1.00 N ATOM 2242 CA LEU A 140 17.731 -10.420 -1.240 1.00 1.00 C ATOM 2243 C LEU A 140 18.575 -9.859 -2.377 1.00 1.00 C ATOM 2244 O LEU A 140 18.777 -10.561 -3.374 1.00 1.00 O ATOM 2245 CB LEU A 140 16.231 -10.240 -1.520 1.00 1.00 C ATOM 2246 CG LEU A 140 15.326 -11.204 -0.732 1.00 1.00 C ATOM 2247 CD1 LEU A 140 13.879 -11.012 -1.190 1.00 1.00 C ATOM 2248 CD2 LEU A 140 15.753 -12.663 -0.917 1.00 1.00 C ATOM 0 H LEU A 140 17.277 -9.292 0.439 1.00 1.00 H new ATOM 0 HA LEU A 140 17.971 -11.482 -1.189 1.00 1.00 H new ATOM 0 HB2 LEU A 140 15.948 -9.215 -1.281 1.00 1.00 H new ATOM 0 HB3 LEU A 140 16.052 -10.380 -2.586 1.00 1.00 H new ATOM 0 HG LEU A 140 15.416 -10.975 0.330 1.00 1.00 H new ATOM 0 HD11 LEU A 140 13.229 -11.691 -0.637 1.00 1.00 H new ATOM 0 HD12 LEU A 140 13.572 -9.983 -1.003 1.00 1.00 H new ATOM 0 HD13 LEU A 140 13.804 -11.225 -2.256 1.00 1.00 H new ATOM 0 HD21 LEU A 140 15.090 -13.312 -0.345 1.00 1.00 H new ATOM 0 HD22 LEU A 140 15.697 -12.927 -1.973 1.00 1.00 H new ATOM 0 HD23 LEU A 140 16.777 -12.790 -0.565 1.00 1.00 H new ATOM 2260 N ALA A 141 19.084 -8.636 -2.246 1.00 1.00 N ATOM 2261 CA ALA A 141 20.002 -7.980 -3.175 1.00 1.00 C ATOM 2262 C ALA A 141 21.401 -8.611 -3.108 1.00 1.00 C ATOM 2263 O ALA A 141 22.387 -7.960 -2.767 1.00 1.00 O ATOM 2264 CB ALA A 141 20.023 -6.477 -2.894 1.00 1.00 C ATOM 0 H ALA A 141 18.855 -8.045 -1.447 1.00 1.00 H new ATOM 0 HA ALA A 141 19.651 -8.126 -4.197 1.00 1.00 H new ATOM 0 HB1 ALA A 141 20.707 -5.987 -3.586 1.00 1.00 H new ATOM 0 HB2 ALA A 141 19.021 -6.068 -3.024 1.00 1.00 H new ATOM 0 HB3 ALA A 141 20.356 -6.303 -1.871 1.00 1.00 H new ATOM 2270 N GLN A 142 21.466 -9.891 -3.475 1.00 1.00 N ATOM 2271 CA GLN A 142 22.587 -10.812 -3.470 1.00 1.00 C ATOM 2272 C GLN A 142 23.550 -10.555 -2.304 1.00 1.00 C ATOM 2273 O GLN A 142 24.758 -10.396 -2.515 1.00 1.00 O ATOM 2274 CB GLN A 142 23.277 -10.747 -4.842 1.00 1.00 C ATOM 2275 CG GLN A 142 22.358 -10.965 -6.052 1.00 1.00 C ATOM 2276 CD GLN A 142 21.862 -9.655 -6.659 1.00 1.00 C ATOM 2277 OE1 GLN A 142 20.764 -9.177 -6.368 1.00 1.00 O ATOM 2278 NE2 GLN A 142 22.633 -9.064 -7.552 1.00 1.00 N ATOM 0 H GLN A 142 20.628 -10.356 -3.824 1.00 1.00 H new ATOM 0 HA GLN A 142 22.222 -11.826 -3.307 1.00 1.00 H new ATOM 0 HB2 GLN A 142 23.757 -9.774 -4.943 1.00 1.00 H new ATOM 0 HB3 GLN A 142 24.068 -11.497 -4.868 1.00 1.00 H new ATOM 0 HG2 GLN A 142 22.894 -11.533 -6.812 1.00 1.00 H new ATOM 0 HG3 GLN A 142 21.502 -11.567 -5.749 1.00 1.00 H new ATOM 0 HE21 GLN A 142 23.541 -9.465 -7.788 1.00 1.00 H new ATOM 0 HE22 GLN A 142 22.321 -8.206 -8.007 1.00 1.00 H new ATOM 2287 N GLN A 143 23.025 -10.521 -1.077 1.00 1.00 N ATOM 2288 CA GLN A 143 23.812 -10.122 0.081 1.00 1.00 C ATOM 2289 C GLN A 143 24.379 -11.342 0.769 1.00 1.00 C ATOM 2290 O GLN A 143 25.572 -11.301 1.134 1.00 1.00 O ATOM 2291 CB GLN A 143 22.974 -9.259 1.031 1.00 1.00 C ATOM 2292 CG GLN A 143 23.905 -8.407 1.898 1.00 1.00 C ATOM 2293 CD GLN A 143 23.197 -7.506 2.901 1.00 1.00 C ATOM 2294 OE1 GLN A 143 23.522 -7.534 4.086 1.00 1.00 O ATOM 2295 NE2 GLN A 143 22.266 -6.673 2.476 1.00 1.00 N ATOM 0 H GLN A 143 22.058 -10.766 -0.865 1.00 1.00 H new ATOM 0 HA GLN A 143 24.652 -9.511 -0.249 1.00 1.00 H new ATOM 0 HB2 GLN A 143 22.302 -8.618 0.460 1.00 1.00 H new ATOM 0 HB3 GLN A 143 22.351 -9.893 1.662 1.00 1.00 H new ATOM 0 HG2 GLN A 143 24.581 -9.069 2.439 1.00 1.00 H new ATOM 0 HG3 GLN A 143 24.520 -7.788 1.245 1.00 1.00 H new ATOM 0 HE21 GLN A 143 22.005 -6.660 1.490 1.00 1.00 H new ATOM 0 HE22 GLN A 143 21.807 -6.043 3.134 1.00 1.00 H new