USER MOD reduce.3.24.130724 H: found=0, std=0, add=909, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 911 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 125 ASN : amide:sc= 1.9 K(o=2.6,f=-2) USER MOD Set 1.2: A 129 LYS NZ :NH3+ 144:sc= 0.671 (180deg=0) USER MOD Set 2.1: A 5 MET CE :methyl -149:sc= -0.109 (180deg=-1.68) USER MOD Set 2.2: A 33 THR OG1 : rot 162:sc= 0.555 USER MOD Set 2.3: A 35 CYS SG : rot -88:sc= 0.806 USER MOD Set 2.4: A 73 TYR OH : rot 177:sc= 1.66 USER MOD Set 3.1: A 16 GLN : amide:sc= 0.595 K(o=5.7,f=-4.3) USER MOD Set 3.2: A 23 LYS NZ :NH3+ 159:sc= 2.29 (180deg=1.23) USER MOD Set 3.3: A 60 GLN : amide:sc= 1.81 K(o=5.7,f=-2.7) USER MOD Set 3.4: A 62 SER OG : rot 177:sc= 1.05 USER MOD Set 4.1: A 8 CYS SG : rot 101:sc= 1.97 USER MOD Set 4.2: A 11 ASN : amide:sc= 1.06 K(o=4.4,f=-1.2!) USER MOD Set 4.3: A 15 SER OG : rot -91:sc= 1.33 USER MOD Set 5.1: A 12 SER OG : rot 170:sc= 1.26 USER MOD Set 5.2: A 13 CYS SG : rot -50:sc= 0.375 USER MOD Single : A 2 LYS NZ :NH3+ -178:sc= 1.22 (180deg=1.19) USER MOD Single : A 3 LYS NZ :NH3+ 168:sc= 1.22 (180deg=0.995) USER MOD Single : A 9 LYS NZ :NH3+ 137:sc= 1.24 (180deg=0.519) USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 86:sc= 1.21 USER MOD Single : A 34 SER OG : rot -86:sc= 1.27 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0556 USER MOD Single : A 40 SER OG : rot 6:sc= 0.618 USER MOD Single : A 43 HIS : no HD1:sc= -0.817 K(o=-0.82,f=-1.7) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 136:sc= -0.714 (180deg=-1.12) USER MOD Single : A 50 MET CE :methyl -127:sc= -4.22 (180deg=-13.9!) USER MOD Single : A 58 SER OG : rot 101:sc= 1.24 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 1 K(o=1,f=-0.41) USER MOD Single : A 69 ASN : amide:sc= 0.926 K(o=0.93,f=-0.0014) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 CYS SG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -17:sc= -0.0694 USER MOD Single : A 93 GLN : amide:sc= 0.927 K(o=0.93,f=-0.11) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.978 K(o=0.98,f=-1.1) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 75:sc= 1.27 USER MOD Single : A 118 GLN : amide:sc= 0.949 K(o=0.95,f=-5.4!) USER MOD Single : A 120 LYS NZ :NH3+ -166:sc= 1.28 (180deg=1.18) USER MOD Single : A 131 SER OG : rot 80:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 18 N LYS A 2 4.374 0.971 -2.883 1.00 0.00 N ATOM 19 CA LYS A 2 5.671 0.829 -2.213 1.00 0.00 C ATOM 20 C LYS A 2 6.185 2.204 -1.809 1.00 0.00 C ATOM 21 O LYS A 2 6.043 3.168 -2.559 1.00 0.00 O ATOM 22 CB LYS A 2 6.687 0.129 -3.140 1.00 0.00 C ATOM 23 CG LYS A 2 6.793 -1.374 -2.874 1.00 0.00 C ATOM 24 CD LYS A 2 5.721 -2.242 -3.541 1.00 0.00 C ATOM 25 CE LYS A 2 5.704 -3.665 -2.947 1.00 0.00 C ATOM 26 NZ LYS A 2 7.033 -4.336 -2.951 1.00 0.00 N ATOM 0 HA LYS A 2 5.545 0.214 -1.322 1.00 0.00 H new ATOM 0 HB2 LYS A 2 6.396 0.290 -4.178 1.00 0.00 H new ATOM 0 HB3 LYS A 2 7.667 0.587 -3.009 1.00 0.00 H new ATOM 0 HG2 LYS A 2 7.772 -1.716 -3.209 1.00 0.00 H new ATOM 0 HG3 LYS A 2 6.750 -1.538 -1.797 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.743 -1.779 -3.411 1.00 0.00 H new ATOM 0 HD3 LYS A 2 5.908 -2.295 -4.613 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.336 -3.616 -1.922 1.00 0.00 H new ATOM 0 HE3 LYS A 2 4.998 -4.275 -3.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 6.937 -5.299 -2.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 7.395 -4.384 -3.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 7.697 -3.794 -2.362 1.00 0.00 H new ATOM 40 N LYS A 3 6.814 2.301 -0.640 1.00 0.00 N ATOM 41 CA LYS A 3 7.535 3.504 -0.243 1.00 0.00 C ATOM 42 C LYS A 3 8.981 3.336 -0.650 1.00 0.00 C ATOM 43 O LYS A 3 9.591 2.333 -0.279 1.00 0.00 O ATOM 44 CB LYS A 3 7.383 3.744 1.267 1.00 0.00 C ATOM 45 CG LYS A 3 6.204 4.707 1.455 1.00 0.00 C ATOM 46 CD LYS A 3 5.898 4.949 2.931 1.00 0.00 C ATOM 47 CE LYS A 3 4.918 6.113 3.089 1.00 0.00 C ATOM 48 NZ LYS A 3 4.593 6.351 4.514 1.00 0.00 N ATOM 0 H LYS A 3 6.838 1.553 0.053 1.00 0.00 H new ATOM 0 HA LYS A 3 7.126 4.383 -0.740 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.200 2.805 1.790 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.297 4.168 1.683 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.430 5.657 0.970 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.321 4.300 0.963 1.00 0.00 H new ATOM 0 HD2 LYS A 3 5.476 4.047 3.374 1.00 0.00 H new ATOM 0 HD3 LYS A 3 6.821 5.166 3.469 1.00 0.00 H new ATOM 0 HE2 LYS A 3 5.349 7.016 2.656 1.00 0.00 H new ATOM 0 HE3 LYS A 3 4.004 5.899 2.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 4.096 7.260 4.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 3.983 5.584 4.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 5.471 6.376 5.071 1.00 0.00 H new ATOM 62 N VAL A 4 9.533 4.311 -1.365 1.00 0.00 N ATOM 63 CA VAL A 4 10.922 4.314 -1.773 1.00 0.00 C ATOM 64 C VAL A 4 11.660 5.439 -1.061 1.00 0.00 C ATOM 65 O VAL A 4 11.163 6.565 -0.971 1.00 0.00 O ATOM 66 CB VAL A 4 11.005 4.381 -3.308 1.00 0.00 C ATOM 67 CG1 VAL A 4 10.402 5.627 -3.961 1.00 0.00 C ATOM 68 CG2 VAL A 4 12.457 4.233 -3.788 1.00 0.00 C ATOM 0 H VAL A 4 9.015 5.131 -1.679 1.00 0.00 H new ATOM 0 HA VAL A 4 11.420 3.390 -1.479 1.00 0.00 H new ATOM 0 HB VAL A 4 10.387 3.543 -3.629 1.00 0.00 H new ATOM 0 HG11 VAL A 4 10.519 5.563 -5.043 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.342 5.691 -3.713 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.915 6.515 -3.592 1.00 0.00 H new ATOM 0 HG21 VAL A 4 12.487 4.284 -4.876 1.00 0.00 H new ATOM 0 HG22 VAL A 4 13.062 5.038 -3.370 1.00 0.00 H new ATOM 0 HG23 VAL A 4 12.853 3.272 -3.458 1.00 0.00 H new ATOM 78 N MET A 5 12.859 5.121 -0.583 1.00 0.00 N ATOM 79 CA MET A 5 13.788 6.115 -0.054 1.00 0.00 C ATOM 80 C MET A 5 14.997 6.197 -0.979 1.00 0.00 C ATOM 81 O MET A 5 15.485 5.159 -1.426 1.00 0.00 O ATOM 82 CB MET A 5 14.211 5.760 1.382 1.00 0.00 C ATOM 83 CG MET A 5 15.196 6.785 1.962 1.00 0.00 C ATOM 84 SD MET A 5 14.569 8.485 2.079 1.00 0.00 S ATOM 85 CE MET A 5 13.981 8.473 3.791 1.00 0.00 C ATOM 0 H MET A 5 13.215 4.166 -0.551 1.00 0.00 H new ATOM 0 HA MET A 5 13.298 7.088 -0.013 1.00 0.00 H new ATOM 0 HB2 MET A 5 13.327 5.707 2.018 1.00 0.00 H new ATOM 0 HB3 MET A 5 14.670 4.771 1.391 1.00 0.00 H new ATOM 0 HG2 MET A 5 15.493 6.456 2.958 1.00 0.00 H new ATOM 0 HG3 MET A 5 16.095 6.789 1.346 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.127 9.144 3.887 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.681 7.462 4.065 1.00 0.00 H new ATOM 0 HE3 MET A 5 14.781 8.806 4.453 1.00 0.00 H new ATOM 95 N PHE A 6 15.520 7.402 -1.204 1.00 0.00 N ATOM 96 CA PHE A 6 16.795 7.627 -1.876 1.00 0.00 C ATOM 97 C PHE A 6 17.717 8.312 -0.859 1.00 0.00 C ATOM 98 O PHE A 6 17.281 9.243 -0.182 1.00 0.00 O ATOM 99 CB PHE A 6 16.616 8.466 -3.142 1.00 0.00 C ATOM 100 CG PHE A 6 15.727 7.816 -4.182 1.00 0.00 C ATOM 101 CD1 PHE A 6 16.272 6.911 -5.115 1.00 0.00 C ATOM 102 CD2 PHE A 6 14.349 8.104 -4.204 1.00 0.00 C ATOM 103 CE1 PHE A 6 15.455 6.312 -6.091 1.00 0.00 C ATOM 104 CE2 PHE A 6 13.536 7.465 -5.160 1.00 0.00 C ATOM 105 CZ PHE A 6 14.084 6.593 -6.109 1.00 0.00 C ATOM 0 H PHE A 6 15.058 8.265 -0.918 1.00 0.00 H new ATOM 0 HA PHE A 6 17.232 6.685 -2.207 1.00 0.00 H new ATOM 0 HB2 PHE A 6 16.194 9.433 -2.870 1.00 0.00 H new ATOM 0 HB3 PHE A 6 17.595 8.658 -3.582 1.00 0.00 H new ATOM 0 HD1 PHE A 6 17.325 6.675 -5.080 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.923 8.803 -3.500 1.00 0.00 H new ATOM 0 HE1 PHE A 6 15.882 5.640 -6.821 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.472 7.651 -5.161 1.00 0.00 H new ATOM 0 HZ PHE A 6 13.449 6.138 -6.854 1.00 0.00 H new ATOM 115 N VAL A 7 18.979 7.903 -0.746 1.00 0.00 N ATOM 116 CA VAL A 7 19.914 8.402 0.262 1.00 0.00 C ATOM 117 C VAL A 7 21.270 8.596 -0.407 1.00 0.00 C ATOM 118 O VAL A 7 21.759 7.662 -1.032 1.00 0.00 O ATOM 119 CB VAL A 7 20.096 7.361 1.399 1.00 0.00 C ATOM 120 CG1 VAL A 7 20.840 7.996 2.584 1.00 0.00 C ATOM 121 CG2 VAL A 7 18.805 6.695 1.898 1.00 0.00 C ATOM 0 H VAL A 7 19.389 7.202 -1.364 1.00 0.00 H new ATOM 0 HA VAL A 7 19.527 9.332 0.678 1.00 0.00 H new ATOM 0 HB VAL A 7 20.681 6.558 0.950 1.00 0.00 H new ATOM 0 HG11 VAL A 7 20.962 7.257 3.375 1.00 0.00 H new ATOM 0 HG12 VAL A 7 21.820 8.341 2.255 1.00 0.00 H new ATOM 0 HG13 VAL A 7 20.266 8.842 2.963 1.00 0.00 H new ATOM 0 HG21 VAL A 7 19.044 5.986 2.691 1.00 0.00 H new ATOM 0 HG22 VAL A 7 18.128 7.457 2.285 1.00 0.00 H new ATOM 0 HG23 VAL A 7 18.325 6.168 1.073 1.00 0.00 H new ATOM 131 N CYS A 8 21.937 9.738 -0.247 1.00 0.00 N ATOM 132 CA CYS A 8 23.330 9.876 -0.680 1.00 0.00 C ATOM 133 C CYS A 8 24.187 10.371 0.476 1.00 0.00 C ATOM 134 O CYS A 8 23.677 10.862 1.481 1.00 0.00 O ATOM 135 CB CYS A 8 23.482 10.726 -1.962 1.00 0.00 C ATOM 136 SG CYS A 8 22.137 11.897 -2.273 1.00 0.00 S ATOM 0 H CYS A 8 21.540 10.577 0.176 1.00 0.00 H new ATOM 0 HA CYS A 8 23.695 8.889 -0.965 1.00 0.00 H new ATOM 0 HB2 CYS A 8 24.419 11.280 -1.902 1.00 0.00 H new ATOM 0 HB3 CYS A 8 23.563 10.054 -2.817 1.00 0.00 H new ATOM 0 HG CYS A 8 22.511 13.091 -1.922 1.00 0.00 H new ATOM 142 N LYS A 9 25.512 10.271 0.329 1.00 0.00 N ATOM 143 CA LYS A 9 26.462 10.750 1.337 1.00 0.00 C ATOM 144 C LYS A 9 26.383 12.268 1.567 1.00 0.00 C ATOM 145 O LYS A 9 26.953 12.776 2.531 1.00 0.00 O ATOM 146 CB LYS A 9 27.872 10.231 1.016 1.00 0.00 C ATOM 147 CG LYS A 9 28.505 10.757 -0.283 1.00 0.00 C ATOM 148 CD LYS A 9 29.819 9.993 -0.502 1.00 0.00 C ATOM 149 CE LYS A 9 30.549 10.249 -1.825 1.00 0.00 C ATOM 150 NZ LYS A 9 30.937 11.667 -2.048 1.00 0.00 N ATOM 0 H LYS A 9 25.955 9.856 -0.491 1.00 0.00 H new ATOM 0 HA LYS A 9 26.180 10.332 2.303 1.00 0.00 H new ATOM 0 HB2 LYS A 9 28.530 10.487 1.847 1.00 0.00 H new ATOM 0 HB3 LYS A 9 27.834 9.143 0.963 1.00 0.00 H new ATOM 0 HG2 LYS A 9 27.830 10.607 -1.126 1.00 0.00 H new ATOM 0 HG3 LYS A 9 28.692 11.828 -0.211 1.00 0.00 H new ATOM 0 HD2 LYS A 9 30.497 10.240 0.315 1.00 0.00 H new ATOM 0 HD3 LYS A 9 29.609 8.926 -0.430 1.00 0.00 H new ATOM 0 HE2 LYS A 9 31.446 9.630 -1.857 1.00 0.00 H new ATOM 0 HE3 LYS A 9 29.910 9.926 -2.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 31.904 11.707 -2.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 30.280 12.104 -2.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 30.899 12.183 -1.146 1.00 0.00 H new ATOM 164 N ARG A 10 25.657 12.979 0.702 1.00 0.00 N ATOM 165 CA ARG A 10 25.253 14.364 0.802 1.00 0.00 C ATOM 166 C ARG A 10 23.983 14.416 -0.035 1.00 0.00 C ATOM 167 O ARG A 10 24.019 14.129 -1.228 1.00 0.00 O ATOM 168 CB ARG A 10 26.363 15.317 0.319 1.00 0.00 C ATOM 169 CG ARG A 10 26.974 15.049 -1.075 1.00 0.00 C ATOM 170 CD ARG A 10 28.219 15.919 -1.293 1.00 0.00 C ATOM 171 NE ARG A 10 27.898 17.354 -1.215 1.00 0.00 N ATOM 172 CZ ARG A 10 28.196 18.222 -0.241 1.00 0.00 C ATOM 173 NH1 ARG A 10 28.892 17.857 0.834 1.00 0.00 N ATOM 174 NH2 ARG A 10 27.773 19.471 -0.379 1.00 0.00 N ATOM 0 H ARG A 10 25.312 12.554 -0.158 1.00 0.00 H new ATOM 0 HA ARG A 10 25.072 14.698 1.824 1.00 0.00 H new ATOM 0 HB2 ARG A 10 25.961 16.330 0.322 1.00 0.00 H new ATOM 0 HB3 ARG A 10 27.170 15.292 1.051 1.00 0.00 H new ATOM 0 HG2 ARG A 10 27.239 13.996 -1.166 1.00 0.00 H new ATOM 0 HG3 ARG A 10 26.236 15.260 -1.849 1.00 0.00 H new ATOM 0 HD2 ARG A 10 28.971 15.673 -0.544 1.00 0.00 H new ATOM 0 HD3 ARG A 10 28.654 15.695 -2.267 1.00 0.00 H new ATOM 0 HE ARG A 10 27.381 17.736 -2.007 1.00 0.00 H new ATOM 0 HH11 ARG A 10 29.213 16.894 0.931 1.00 0.00 H new ATOM 0 HH12 ARG A 10 29.104 18.541 1.561 1.00 0.00 H new ATOM 0 HH21 ARG A 10 27.240 19.741 -1.206 1.00 0.00 H new ATOM 0 HH22 ARG A 10 27.980 20.162 0.342 1.00 0.00 H new ATOM 188 N ASN A 11 22.853 14.678 0.615 1.00 0.00 N ATOM 189 CA ASN A 11 21.497 14.715 0.032 1.00 0.00 C ATOM 190 C ASN A 11 21.395 15.615 -1.212 1.00 0.00 C ATOM 191 O ASN A 11 20.532 15.382 -2.050 1.00 0.00 O ATOM 192 CB ASN A 11 20.551 15.273 1.115 1.00 0.00 C ATOM 193 CG ASN A 11 19.035 15.223 0.869 1.00 0.00 C ATOM 194 OD1 ASN A 11 18.281 15.536 1.778 1.00 0.00 O ATOM 195 ND2 ASN A 11 18.507 14.828 -0.273 1.00 0.00 N ATOM 0 H ASN A 11 22.848 14.882 1.614 1.00 0.00 H new ATOM 0 HA ASN A 11 21.235 13.705 -0.284 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.753 14.733 2.040 1.00 0.00 H new ATOM 0 HB3 ASN A 11 20.824 16.314 1.287 1.00 0.00 H new ATOM 0 HD21 ASN A 11 17.493 14.790 -0.380 1.00 0.00 H new ATOM 0 HD22 ASN A 11 19.112 14.561 -1.049 1.00 0.00 H new ATOM 202 N SER A 12 22.268 16.618 -1.337 1.00 0.00 N ATOM 203 CA SER A 12 22.195 17.713 -2.299 1.00 0.00 C ATOM 204 C SER A 12 21.741 17.399 -3.728 1.00 0.00 C ATOM 205 O SER A 12 21.045 18.240 -4.302 1.00 0.00 O ATOM 206 CB SER A 12 23.523 18.482 -2.298 1.00 0.00 C ATOM 207 OG SER A 12 24.639 17.646 -2.534 1.00 0.00 O ATOM 0 H SER A 12 23.088 16.689 -0.735 1.00 0.00 H new ATOM 0 HA SER A 12 21.367 18.321 -1.934 1.00 0.00 H new ATOM 0 HB2 SER A 12 23.489 19.259 -3.062 1.00 0.00 H new ATOM 0 HB3 SER A 12 23.647 18.984 -1.338 1.00 0.00 H new ATOM 0 HG SER A 12 25.437 18.197 -2.676 1.00 0.00 H new ATOM 213 N CYS A 13 22.101 16.252 -4.321 1.00 0.00 N ATOM 214 CA CYS A 13 21.863 16.042 -5.751 1.00 0.00 C ATOM 215 C CYS A 13 21.335 14.663 -6.157 1.00 0.00 C ATOM 216 O CYS A 13 20.307 14.648 -6.836 1.00 0.00 O ATOM 217 CB CYS A 13 23.107 16.445 -6.560 1.00 0.00 C ATOM 218 SG CYS A 13 24.648 15.887 -5.780 1.00 0.00 S ATOM 0 H CYS A 13 22.549 15.471 -3.842 1.00 0.00 H new ATOM 0 HA CYS A 13 21.030 16.700 -5.997 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.037 16.024 -7.563 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.130 17.529 -6.670 1.00 0.00 H new ATOM 0 HG CYS A 13 24.653 16.239 -4.529 1.00 0.00 H new ATOM 224 N ARG A 14 21.967 13.520 -5.813 1.00 0.00 N ATOM 225 CA ARG A 14 21.517 12.259 -6.438 1.00 0.00 C ATOM 226 C ARG A 14 20.083 11.971 -5.993 1.00 0.00 C ATOM 227 O ARG A 14 19.218 11.716 -6.827 1.00 0.00 O ATOM 228 CB ARG A 14 22.350 10.993 -6.127 1.00 0.00 C ATOM 229 CG ARG A 14 23.599 10.784 -6.976 1.00 0.00 C ATOM 230 CD ARG A 14 24.753 11.634 -6.486 1.00 0.00 C ATOM 231 NE ARG A 14 25.241 11.226 -5.156 1.00 0.00 N ATOM 232 CZ ARG A 14 25.917 12.028 -4.330 1.00 0.00 C ATOM 233 NH1 ARG A 14 25.811 13.346 -4.420 1.00 0.00 N ATOM 234 NH2 ARG A 14 26.761 11.521 -3.451 1.00 0.00 N ATOM 0 H ARG A 14 22.739 13.442 -5.151 1.00 0.00 H new ATOM 0 HA ARG A 14 21.628 12.438 -7.507 1.00 0.00 H new ATOM 0 HB2 ARG A 14 22.650 11.029 -5.080 1.00 0.00 H new ATOM 0 HB3 ARG A 14 21.706 10.122 -6.245 1.00 0.00 H new ATOM 0 HG2 ARG A 14 23.885 9.732 -6.952 1.00 0.00 H new ATOM 0 HG3 ARG A 14 23.379 11.031 -8.015 1.00 0.00 H new ATOM 0 HD2 ARG A 14 25.572 11.573 -7.202 1.00 0.00 H new ATOM 0 HD3 ARG A 14 24.439 12.677 -6.448 1.00 0.00 H new ATOM 0 HE ARG A 14 25.050 10.272 -4.848 1.00 0.00 H new ATOM 0 HH11 ARG A 14 25.206 13.762 -5.128 1.00 0.00 H new ATOM 0 HH12 ARG A 14 26.334 13.945 -3.781 1.00 0.00 H new ATOM 0 HH21 ARG A 14 26.899 10.512 -3.400 1.00 0.00 H new ATOM 0 HH22 ARG A 14 27.275 12.138 -2.822 1.00 0.00 H new ATOM 248 N SER A 15 19.845 11.992 -4.676 1.00 0.00 N ATOM 249 CA SER A 15 18.584 11.538 -4.112 1.00 0.00 C ATOM 250 C SER A 15 17.489 12.540 -4.479 1.00 0.00 C ATOM 251 O SER A 15 16.390 12.133 -4.843 1.00 0.00 O ATOM 252 CB SER A 15 18.734 11.338 -2.598 1.00 0.00 C ATOM 253 OG SER A 15 19.087 12.532 -1.934 1.00 0.00 O ATOM 0 H SER A 15 20.518 12.322 -3.984 1.00 0.00 H new ATOM 0 HA SER A 15 18.297 10.572 -4.526 1.00 0.00 H new ATOM 0 HB2 SER A 15 17.797 10.960 -2.189 1.00 0.00 H new ATOM 0 HB3 SER A 15 19.494 10.580 -2.407 1.00 0.00 H new ATOM 0 HG SER A 15 20.063 12.597 -1.874 1.00 0.00 H new ATOM 259 N GLN A 16 17.808 13.839 -4.455 1.00 0.00 N ATOM 260 CA GLN A 16 16.908 14.911 -4.862 1.00 0.00 C ATOM 261 C GLN A 16 16.408 14.697 -6.291 1.00 0.00 C ATOM 262 O GLN A 16 15.198 14.725 -6.531 1.00 0.00 O ATOM 263 CB GLN A 16 17.639 16.263 -4.735 1.00 0.00 C ATOM 264 CG GLN A 16 17.753 16.735 -3.281 1.00 0.00 C ATOM 265 CD GLN A 16 16.410 17.074 -2.632 1.00 0.00 C ATOM 266 OE1 GLN A 16 15.378 17.204 -3.286 1.00 0.00 O ATOM 267 NE2 GLN A 16 16.400 17.230 -1.322 1.00 0.00 N ATOM 0 H GLN A 16 18.719 14.176 -4.145 1.00 0.00 H new ATOM 0 HA GLN A 16 16.036 14.910 -4.208 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.637 16.174 -5.164 1.00 0.00 H new ATOM 0 HB3 GLN A 16 17.108 17.016 -5.317 1.00 0.00 H new ATOM 0 HG2 GLN A 16 18.243 15.958 -2.694 1.00 0.00 H new ATOM 0 HG3 GLN A 16 18.395 17.615 -3.244 1.00 0.00 H new ATOM 0 HE21 GLN A 16 17.262 17.120 -0.789 1.00 0.00 H new ATOM 0 HE22 GLN A 16 15.530 17.461 -0.843 1.00 0.00 H new ATOM 276 N MET A 17 17.323 14.453 -7.235 1.00 0.00 N ATOM 277 CA MET A 17 16.950 14.195 -8.619 1.00 0.00 C ATOM 278 C MET A 17 16.140 12.909 -8.728 1.00 0.00 C ATOM 279 O MET A 17 15.089 12.899 -9.371 1.00 0.00 O ATOM 280 CB MET A 17 18.198 14.128 -9.505 1.00 0.00 C ATOM 281 CG MET A 17 18.697 15.533 -9.856 1.00 0.00 C ATOM 282 SD MET A 17 19.896 15.628 -11.215 1.00 0.00 S ATOM 283 CE MET A 17 21.374 14.984 -10.392 1.00 0.00 C ATOM 0 H MET A 17 18.328 14.430 -7.060 1.00 0.00 H new ATOM 0 HA MET A 17 16.326 15.018 -8.967 1.00 0.00 H new ATOM 0 HB2 MET A 17 18.985 13.577 -8.990 1.00 0.00 H new ATOM 0 HB3 MET A 17 17.970 13.580 -10.419 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.836 16.150 -10.112 1.00 0.00 H new ATOM 0 HG3 MET A 17 19.149 15.970 -8.966 1.00 0.00 H new ATOM 0 HE1 MET A 17 22.207 14.976 -11.094 1.00 0.00 H new ATOM 0 HE2 MET A 17 21.622 15.619 -9.541 1.00 0.00 H new ATOM 0 HE3 MET A 17 21.183 13.969 -10.044 1.00 0.00 H new ATOM 293 N ALA A 18 16.597 11.838 -8.071 1.00 0.00 N ATOM 294 CA ALA A 18 15.901 10.564 -8.083 1.00 0.00 C ATOM 295 C ALA A 18 14.462 10.736 -7.602 1.00 0.00 C ATOM 296 O ALA A 18 13.555 10.149 -8.185 1.00 0.00 O ATOM 297 CB ALA A 18 16.642 9.549 -7.212 1.00 0.00 C ATOM 0 H ALA A 18 17.456 11.838 -7.521 1.00 0.00 H new ATOM 0 HA ALA A 18 15.876 10.190 -9.106 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.110 8.598 -7.229 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.652 9.407 -7.597 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.693 9.917 -6.187 1.00 0.00 H new ATOM 303 N GLU A 19 14.246 11.572 -6.584 1.00 0.00 N ATOM 304 CA GLU A 19 12.919 11.810 -6.039 1.00 0.00 C ATOM 305 C GLU A 19 12.020 12.499 -7.061 1.00 0.00 C ATOM 306 O GLU A 19 10.870 12.087 -7.232 1.00 0.00 O ATOM 307 CB GLU A 19 12.974 12.562 -4.693 1.00 0.00 C ATOM 308 CG GLU A 19 11.596 13.128 -4.294 1.00 0.00 C ATOM 309 CD GLU A 19 11.409 13.518 -2.818 1.00 0.00 C ATOM 310 OE1 GLU A 19 12.369 13.470 -2.024 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.267 13.884 -2.461 1.00 0.00 O ATOM 0 H GLU A 19 14.986 12.098 -6.120 1.00 0.00 H new ATOM 0 HA GLU A 19 12.470 10.840 -5.824 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.329 11.887 -3.914 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.695 13.377 -4.761 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.400 14.009 -4.906 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.838 12.388 -4.549 1.00 0.00 H new ATOM 318 N GLY A 20 12.528 13.527 -7.740 1.00 0.00 N ATOM 319 CA GLY A 20 11.734 14.262 -8.710 1.00 0.00 C ATOM 320 C GLY A 20 11.302 13.350 -9.859 1.00 0.00 C ATOM 321 O GLY A 20 10.138 13.389 -10.269 1.00 0.00 O ATOM 0 H GLY A 20 13.484 13.865 -7.633 1.00 0.00 H new ATOM 0 HA2 GLY A 20 10.854 14.683 -8.223 1.00 0.00 H new ATOM 0 HA3 GLY A 20 12.313 15.099 -9.101 1.00 0.00 H new ATOM 325 N PHE A 21 12.201 12.486 -10.348 1.00 0.00 N ATOM 326 CA PHE A 21 11.825 11.506 -11.360 1.00 0.00 C ATOM 327 C PHE A 21 10.824 10.524 -10.757 1.00 0.00 C ATOM 328 O PHE A 21 9.766 10.316 -11.335 1.00 0.00 O ATOM 329 CB PHE A 21 13.053 10.788 -11.952 1.00 0.00 C ATOM 330 CG PHE A 21 14.034 11.709 -12.656 1.00 0.00 C ATOM 331 CD1 PHE A 21 13.607 12.529 -13.723 1.00 0.00 C ATOM 332 CD2 PHE A 21 15.357 11.814 -12.186 1.00 0.00 C ATOM 333 CE1 PHE A 21 14.461 13.530 -14.223 1.00 0.00 C ATOM 334 CE2 PHE A 21 16.213 12.799 -12.703 1.00 0.00 C ATOM 335 CZ PHE A 21 15.744 13.680 -13.690 1.00 0.00 C ATOM 0 H PHE A 21 13.179 12.449 -10.061 1.00 0.00 H new ATOM 0 HA PHE A 21 11.352 12.024 -12.195 1.00 0.00 H new ATOM 0 HB2 PHE A 21 13.575 10.264 -11.151 1.00 0.00 H new ATOM 0 HB3 PHE A 21 12.712 10.031 -12.658 1.00 0.00 H new ATOM 0 HD1 PHE A 21 12.627 12.389 -14.155 1.00 0.00 H new ATOM 0 HD2 PHE A 21 15.714 11.135 -11.426 1.00 0.00 H new ATOM 0 HE1 PHE A 21 14.125 14.181 -15.017 1.00 0.00 H new ATOM 0 HE2 PHE A 21 17.228 12.879 -12.343 1.00 0.00 H new ATOM 0 HZ PHE A 21 16.380 14.480 -14.040 1.00 0.00 H new ATOM 345 N ALA A 22 11.095 9.961 -9.581 1.00 0.00 N ATOM 346 CA ALA A 22 10.299 8.894 -8.990 1.00 0.00 C ATOM 347 C ALA A 22 8.850 9.296 -8.792 1.00 0.00 C ATOM 348 O ALA A 22 7.972 8.504 -9.125 1.00 0.00 O ATOM 349 CB ALA A 22 10.918 8.466 -7.663 1.00 0.00 C ATOM 0 H ALA A 22 11.888 10.240 -9.004 1.00 0.00 H new ATOM 0 HA ALA A 22 10.303 8.055 -9.686 1.00 0.00 H new ATOM 0 HB1 ALA A 22 10.320 7.668 -7.223 1.00 0.00 H new ATOM 0 HB2 ALA A 22 11.933 8.107 -7.834 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.944 9.317 -6.982 1.00 0.00 H new ATOM 355 N LYS A 23 8.566 10.508 -8.306 1.00 0.00 N ATOM 356 CA LYS A 23 7.177 10.923 -8.217 1.00 0.00 C ATOM 357 C LYS A 23 6.588 11.147 -9.598 1.00 0.00 C ATOM 358 O LYS A 23 5.448 10.778 -9.820 1.00 0.00 O ATOM 359 CB LYS A 23 6.953 12.112 -7.281 1.00 0.00 C ATOM 360 CG LYS A 23 7.630 13.428 -7.681 1.00 0.00 C ATOM 361 CD LYS A 23 7.551 14.418 -6.511 1.00 0.00 C ATOM 362 CE LYS A 23 8.486 13.989 -5.384 1.00 0.00 C ATOM 363 NZ LYS A 23 8.592 15.011 -4.314 1.00 0.00 N ATOM 0 H LYS A 23 9.253 11.189 -7.982 1.00 0.00 H new ATOM 0 HA LYS A 23 6.633 10.099 -7.754 1.00 0.00 H new ATOM 0 HB2 LYS A 23 5.880 12.289 -7.203 1.00 0.00 H new ATOM 0 HB3 LYS A 23 7.303 11.835 -6.287 1.00 0.00 H new ATOM 0 HG2 LYS A 23 8.671 13.247 -7.949 1.00 0.00 H new ATOM 0 HG3 LYS A 23 7.142 13.848 -8.561 1.00 0.00 H new ATOM 0 HD2 LYS A 23 7.819 15.417 -6.854 1.00 0.00 H new ATOM 0 HD3 LYS A 23 6.527 14.472 -6.141 1.00 0.00 H new ATOM 0 HE2 LYS A 23 8.127 13.054 -4.954 1.00 0.00 H new ATOM 0 HE3 LYS A 23 9.477 13.792 -5.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 8.926 14.562 -3.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 9.265 15.749 -4.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 7.659 15.440 -4.150 1.00 0.00 H new ATOM 377 N THR A 24 7.321 11.668 -10.571 1.00 0.00 N ATOM 378 CA THR A 24 6.715 11.886 -11.863 1.00 0.00 C ATOM 379 C THR A 24 6.372 10.544 -12.530 1.00 0.00 C ATOM 380 O THR A 24 5.298 10.375 -13.112 1.00 0.00 O ATOM 381 CB THR A 24 7.708 12.704 -12.703 1.00 0.00 C ATOM 382 OG1 THR A 24 8.068 13.899 -12.032 1.00 0.00 O ATOM 383 CG2 THR A 24 7.096 13.062 -14.048 1.00 0.00 C ATOM 0 H THR A 24 8.302 11.938 -10.491 1.00 0.00 H new ATOM 0 HA THR A 24 5.777 12.433 -11.768 1.00 0.00 H new ATOM 0 HB THR A 24 8.597 12.092 -12.855 1.00 0.00 H new ATOM 0 HG1 THR A 24 8.811 13.719 -11.419 1.00 0.00 H new ATOM 0 HG21 THR A 24 7.812 13.641 -14.631 1.00 0.00 H new ATOM 0 HG22 THR A 24 6.843 12.149 -14.587 1.00 0.00 H new ATOM 0 HG23 THR A 24 6.193 13.653 -13.891 1.00 0.00 H new ATOM 391 N LEU A 25 7.293 9.589 -12.429 1.00 0.00 N ATOM 392 CA LEU A 25 7.236 8.296 -13.081 1.00 0.00 C ATOM 393 C LEU A 25 6.275 7.354 -12.366 1.00 0.00 C ATOM 394 O LEU A 25 5.574 6.575 -13.014 1.00 0.00 O ATOM 395 CB LEU A 25 8.642 7.683 -13.059 1.00 0.00 C ATOM 396 CG LEU A 25 9.698 8.459 -13.867 1.00 0.00 C ATOM 397 CD1 LEU A 25 11.066 7.903 -13.485 1.00 0.00 C ATOM 398 CD2 LEU A 25 9.456 8.337 -15.373 1.00 0.00 C ATOM 0 H LEU A 25 8.134 9.707 -11.864 1.00 0.00 H new ATOM 0 HA LEU A 25 6.880 8.433 -14.102 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.976 7.613 -12.024 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.585 6.665 -13.445 1.00 0.00 H new ATOM 0 HG LEU A 25 9.639 9.522 -13.633 1.00 0.00 H new ATOM 0 HD11 LEU A 25 11.841 8.431 -14.040 1.00 0.00 H new ATOM 0 HD12 LEU A 25 11.229 8.039 -12.416 1.00 0.00 H new ATOM 0 HD13 LEU A 25 11.107 6.841 -13.726 1.00 0.00 H new ATOM 0 HD21 LEU A 25 10.221 8.897 -15.911 1.00 0.00 H new ATOM 0 HD22 LEU A 25 9.502 7.288 -15.665 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.473 8.739 -15.617 1.00 0.00 H new ATOM 410 N GLY A 26 6.250 7.425 -11.034 1.00 0.00 N ATOM 411 CA GLY A 26 5.568 6.449 -10.199 1.00 0.00 C ATOM 412 C GLY A 26 4.623 6.980 -9.126 1.00 0.00 C ATOM 413 O GLY A 26 4.018 6.139 -8.459 1.00 0.00 O ATOM 0 H GLY A 26 6.707 8.168 -10.506 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.999 5.787 -10.851 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.326 5.838 -9.708 1.00 0.00 H new ATOM 456 N ILE A 30 4.039 4.309 -6.238 1.00 0.00 N ATOM 457 CA ILE A 30 5.069 4.512 -5.232 1.00 0.00 C ATOM 458 C ILE A 30 4.886 5.884 -4.593 1.00 0.00 C ATOM 459 O ILE A 30 4.342 6.804 -5.210 1.00 0.00 O ATOM 460 CB ILE A 30 6.503 4.339 -5.776 1.00 0.00 C ATOM 461 CG1 ILE A 30 6.815 5.196 -7.018 1.00 0.00 C ATOM 462 CG2 ILE A 30 6.769 2.862 -6.073 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.317 5.424 -7.238 1.00 0.00 C ATOM 0 HA ILE A 30 4.948 3.732 -4.480 1.00 0.00 H new ATOM 0 HB ILE A 30 7.171 4.698 -4.993 1.00 0.00 H new ATOM 0 HG12 ILE A 30 6.395 4.712 -7.900 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.319 6.161 -6.918 1.00 0.00 H new ATOM 0 HG21 ILE A 30 7.782 2.745 -6.457 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.658 2.281 -5.157 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.056 2.506 -6.817 1.00 0.00 H new ATOM 0 HD11 ILE A 30 8.466 6.035 -8.129 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.738 5.936 -6.373 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.815 4.464 -7.369 1.00 0.00 H new ATOM 475 N ALA A 31 5.382 6.009 -3.366 1.00 0.00 N ATOM 476 CA ALA A 31 5.521 7.258 -2.641 1.00 0.00 C ATOM 477 C ALA A 31 7.011 7.401 -2.360 1.00 0.00 C ATOM 478 O ALA A 31 7.623 6.459 -1.851 1.00 0.00 O ATOM 479 CB ALA A 31 4.717 7.186 -1.338 1.00 0.00 C ATOM 0 H ALA A 31 5.711 5.205 -2.831 1.00 0.00 H new ATOM 0 HA ALA A 31 5.145 8.113 -3.203 1.00 0.00 H new ATOM 0 HB1 ALA A 31 4.822 8.124 -0.794 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.665 7.015 -1.568 1.00 0.00 H new ATOM 0 HB3 ALA A 31 5.091 6.367 -0.724 1.00 0.00 H new ATOM 485 N VAL A 32 7.603 8.541 -2.712 1.00 0.00 N ATOM 486 CA VAL A 32 9.033 8.731 -2.617 1.00 0.00 C ATOM 487 C VAL A 32 9.434 9.751 -1.551 1.00 0.00 C ATOM 488 O VAL A 32 8.719 10.725 -1.298 1.00 0.00 O ATOM 489 CB VAL A 32 9.529 9.130 -4.013 1.00 0.00 C ATOM 490 CG1 VAL A 32 8.774 10.288 -4.679 1.00 0.00 C ATOM 491 CG2 VAL A 32 11.024 9.433 -3.972 1.00 0.00 C ATOM 0 H VAL A 32 7.098 9.352 -3.069 1.00 0.00 H new ATOM 0 HA VAL A 32 9.504 7.803 -2.292 1.00 0.00 H new ATOM 0 HB VAL A 32 9.323 8.263 -4.641 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.206 10.487 -5.660 1.00 0.00 H new ATOM 0 HG12 VAL A 32 7.724 10.020 -4.792 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.856 11.180 -4.058 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.366 9.715 -4.968 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.210 10.253 -3.279 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.566 8.547 -3.640 1.00 0.00 H new ATOM 501 N THR A 33 10.631 9.537 -1.004 1.00 0.00 N ATOM 502 CA THR A 33 11.356 10.458 -0.161 1.00 0.00 C ATOM 503 C THR A 33 12.841 10.360 -0.542 1.00 0.00 C ATOM 504 O THR A 33 13.336 9.282 -0.875 1.00 0.00 O ATOM 505 CB THR A 33 11.156 10.097 1.326 1.00 0.00 C ATOM 506 OG1 THR A 33 9.792 9.908 1.655 1.00 0.00 O ATOM 507 CG2 THR A 33 11.716 11.173 2.263 1.00 0.00 C ATOM 0 H THR A 33 11.139 8.665 -1.152 1.00 0.00 H new ATOM 0 HA THR A 33 10.992 11.475 -0.304 1.00 0.00 H new ATOM 0 HB THR A 33 11.701 9.163 1.465 1.00 0.00 H new ATOM 0 HG1 THR A 33 9.724 9.412 2.498 1.00 0.00 H new ATOM 0 HG21 THR A 33 11.552 10.875 3.299 1.00 0.00 H new ATOM 0 HG22 THR A 33 12.785 11.291 2.084 1.00 0.00 H new ATOM 0 HG23 THR A 33 11.210 12.120 2.074 1.00 0.00 H new ATOM 515 N SER A 34 13.557 11.477 -0.501 1.00 0.00 N ATOM 516 CA SER A 34 15.001 11.563 -0.596 1.00 0.00 C ATOM 517 C SER A 34 15.552 12.143 0.707 1.00 0.00 C ATOM 518 O SER A 34 14.867 12.901 1.403 1.00 0.00 O ATOM 519 CB SER A 34 15.405 12.404 -1.806 1.00 0.00 C ATOM 520 OG SER A 34 14.875 13.711 -1.798 1.00 0.00 O ATOM 0 H SER A 34 13.119 12.392 -0.395 1.00 0.00 H new ATOM 0 HA SER A 34 15.425 10.569 -0.740 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.493 12.464 -1.847 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.079 11.896 -2.714 1.00 0.00 H new ATOM 0 HG SER A 34 13.979 13.703 -2.194 1.00 0.00 H new ATOM 526 N CYS A 35 16.793 11.797 1.041 1.00 0.00 N ATOM 527 CA CYS A 35 17.499 12.309 2.195 1.00 0.00 C ATOM 528 C CYS A 35 18.992 12.119 1.918 1.00 0.00 C ATOM 529 O CYS A 35 19.404 11.849 0.780 1.00 0.00 O ATOM 530 CB CYS A 35 17.024 11.586 3.472 1.00 0.00 C ATOM 531 SG CYS A 35 17.433 9.822 3.448 1.00 0.00 S ATOM 0 H CYS A 35 17.344 11.134 0.496 1.00 0.00 H new ATOM 0 HA CYS A 35 17.298 13.367 2.364 1.00 0.00 H new ATOM 0 HB2 CYS A 35 17.483 12.052 4.344 1.00 0.00 H new ATOM 0 HB3 CYS A 35 15.946 11.706 3.576 1.00 0.00 H new ATOM 0 HG CYS A 35 16.472 9.162 2.873 1.00 0.00 H new ATOM 537 N GLY A 36 19.816 12.232 2.951 1.00 0.00 N ATOM 538 CA GLY A 36 21.211 11.857 2.887 1.00 0.00 C ATOM 539 C GLY A 36 21.660 11.389 4.243 1.00 0.00 C ATOM 540 O GLY A 36 21.052 11.727 5.262 1.00 0.00 O ATOM 0 H GLY A 36 19.527 12.590 3.861 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.354 11.066 2.151 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.814 12.706 2.564 1.00 0.00 H new ATOM 544 N LEU A 37 22.762 10.642 4.222 1.00 0.00 N ATOM 545 CA LEU A 37 23.526 10.244 5.384 1.00 0.00 C ATOM 546 C LEU A 37 23.770 11.462 6.287 1.00 0.00 C ATOM 547 O LEU A 37 23.746 11.363 7.512 1.00 0.00 O ATOM 548 CB LEU A 37 24.818 9.655 4.819 1.00 0.00 C ATOM 549 CG LEU A 37 25.842 9.295 5.885 1.00 0.00 C ATOM 550 CD1 LEU A 37 25.306 8.225 6.841 1.00 0.00 C ATOM 551 CD2 LEU A 37 27.106 8.800 5.179 1.00 0.00 C ATOM 0 H LEU A 37 23.157 10.286 3.352 1.00 0.00 H new ATOM 0 HA LEU A 37 23.016 9.512 6.011 1.00 0.00 H new ATOM 0 HB2 LEU A 37 24.578 8.762 4.242 1.00 0.00 H new ATOM 0 HB3 LEU A 37 25.262 10.372 4.128 1.00 0.00 H new ATOM 0 HG LEU A 37 26.063 10.176 6.488 1.00 0.00 H new ATOM 0 HD11 LEU A 37 26.064 7.993 7.589 1.00 0.00 H new ATOM 0 HD12 LEU A 37 24.409 8.596 7.337 1.00 0.00 H new ATOM 0 HD13 LEU A 37 25.063 7.323 6.279 1.00 0.00 H new ATOM 0 HD21 LEU A 37 27.858 8.535 5.922 1.00 0.00 H new ATOM 0 HD22 LEU A 37 26.867 7.924 4.576 1.00 0.00 H new ATOM 0 HD23 LEU A 37 27.495 9.588 4.535 1.00 0.00 H new ATOM 563 N GLU A 38 23.963 12.614 5.648 1.00 0.00 N ATOM 564 CA GLU A 38 23.977 13.932 6.238 1.00 0.00 C ATOM 565 C GLU A 38 23.285 14.812 5.196 1.00 0.00 C ATOM 566 O GLU A 38 23.391 14.579 3.982 1.00 0.00 O ATOM 567 CB GLU A 38 25.410 14.387 6.537 1.00 0.00 C ATOM 568 CG GLU A 38 25.446 15.655 7.401 1.00 0.00 C ATOM 569 CD GLU A 38 26.886 16.029 7.794 1.00 0.00 C ATOM 570 OE1 GLU A 38 27.584 16.712 7.011 1.00 0.00 O ATOM 571 OE2 GLU A 38 27.334 15.660 8.905 1.00 0.00 O ATOM 0 H GLU A 38 24.123 12.643 4.641 1.00 0.00 H new ATOM 0 HA GLU A 38 23.468 13.976 7.201 1.00 0.00 H new ATOM 0 HB2 GLU A 38 25.945 13.586 7.047 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.934 14.573 5.599 1.00 0.00 H new ATOM 0 HG2 GLU A 38 24.990 16.481 6.855 1.00 0.00 H new ATOM 0 HG3 GLU A 38 24.851 15.500 8.301 1.00 0.00 H new ATOM 578 N SER A 39 22.525 15.787 5.673 1.00 0.00 N ATOM 579 CA SER A 39 21.815 16.733 4.829 1.00 0.00 C ATOM 580 C SER A 39 22.786 17.748 4.207 1.00 0.00 C ATOM 581 O SER A 39 23.871 18.015 4.732 1.00 0.00 O ATOM 582 CB SER A 39 20.710 17.412 5.659 1.00 0.00 C ATOM 583 OG SER A 39 21.118 17.640 7.003 1.00 0.00 O ATOM 0 H SER A 39 22.383 15.944 6.671 1.00 0.00 H new ATOM 0 HA SER A 39 21.346 16.208 3.997 1.00 0.00 H new ATOM 0 HB2 SER A 39 20.440 18.361 5.196 1.00 0.00 H new ATOM 0 HB3 SER A 39 19.816 16.788 5.652 1.00 0.00 H new ATOM 0 HG SER A 39 20.391 18.074 7.497 1.00 0.00 H new ATOM 589 N SER A 40 22.393 18.327 3.074 1.00 0.00 N ATOM 590 CA SER A 40 23.032 19.460 2.410 1.00 0.00 C ATOM 591 C SER A 40 21.966 20.071 1.498 1.00 0.00 C ATOM 592 O SER A 40 21.088 19.338 1.031 1.00 0.00 O ATOM 593 CB SER A 40 24.228 18.989 1.571 1.00 0.00 C ATOM 594 OG SER A 40 25.237 18.414 2.381 1.00 0.00 O ATOM 0 H SER A 40 21.572 17.998 2.566 1.00 0.00 H new ATOM 0 HA SER A 40 23.407 20.181 3.136 1.00 0.00 H new ATOM 0 HB2 SER A 40 23.892 18.259 0.834 1.00 0.00 H new ATOM 0 HB3 SER A 40 24.641 19.833 1.018 1.00 0.00 H new ATOM 0 HG SER A 40 24.919 18.353 3.306 1.00 0.00 H new ATOM 600 N ARG A 41 22.026 21.383 1.240 1.00 0.00 N ATOM 601 CA ARG A 41 21.087 22.109 0.400 1.00 0.00 C ATOM 602 C ARG A 41 20.883 21.393 -0.928 1.00 0.00 C ATOM 603 O ARG A 41 21.836 20.823 -1.463 1.00 0.00 O ATOM 604 CB ARG A 41 21.681 23.504 0.136 1.00 0.00 C ATOM 605 CG ARG A 41 20.600 24.510 -0.248 1.00 0.00 C ATOM 606 CD ARG A 41 21.189 25.704 -1.008 1.00 0.00 C ATOM 607 NE ARG A 41 20.150 26.678 -1.384 1.00 0.00 N ATOM 608 CZ ARG A 41 19.377 26.651 -2.480 1.00 0.00 C ATOM 609 NH1 ARG A 41 19.439 25.648 -3.355 1.00 0.00 N ATOM 610 NH2 ARG A 41 18.524 27.647 -2.696 1.00 0.00 N ATOM 0 H ARG A 41 22.756 21.981 1.626 1.00 0.00 H new ATOM 0 HA ARG A 41 20.122 22.177 0.901 1.00 0.00 H new ATOM 0 HB2 ARG A 41 22.203 23.852 1.027 1.00 0.00 H new ATOM 0 HB3 ARG A 41 22.420 23.440 -0.663 1.00 0.00 H new ATOM 0 HG2 ARG A 41 19.848 24.019 -0.866 1.00 0.00 H new ATOM 0 HG3 ARG A 41 20.094 24.863 0.651 1.00 0.00 H new ATOM 0 HD2 ARG A 41 21.940 26.194 -0.389 1.00 0.00 H new ATOM 0 HD3 ARG A 41 21.697 25.350 -1.905 1.00 0.00 H new ATOM 0 HE ARG A 41 20.002 27.457 -0.742 1.00 0.00 H new ATOM 0 HH11 ARG A 41 20.086 24.875 -3.200 1.00 0.00 H new ATOM 0 HH12 ARG A 41 18.839 25.653 -4.180 1.00 0.00 H new ATOM 0 HH21 ARG A 41 18.463 28.419 -2.032 1.00 0.00 H new ATOM 0 HH22 ARG A 41 17.930 27.639 -3.525 1.00 0.00 H new ATOM 624 N VAL A 42 19.677 21.477 -1.490 1.00 0.00 N ATOM 625 CA VAL A 42 19.458 21.022 -2.857 1.00 0.00 C ATOM 626 C VAL A 42 20.427 21.807 -3.736 1.00 0.00 C ATOM 627 O VAL A 42 20.519 23.036 -3.627 1.00 0.00 O ATOM 628 CB VAL A 42 18.004 21.211 -3.327 1.00 0.00 C ATOM 629 CG1 VAL A 42 17.826 20.555 -4.708 1.00 0.00 C ATOM 630 CG2 VAL A 42 17.019 20.603 -2.322 1.00 0.00 C ATOM 0 H VAL A 42 18.849 21.851 -1.025 1.00 0.00 H new ATOM 0 HA VAL A 42 19.638 19.949 -2.921 1.00 0.00 H new ATOM 0 HB VAL A 42 17.794 22.278 -3.399 1.00 0.00 H new ATOM 0 HG11 VAL A 42 16.797 20.687 -5.044 1.00 0.00 H new ATOM 0 HG12 VAL A 42 18.504 21.022 -5.423 1.00 0.00 H new ATOM 0 HG13 VAL A 42 18.051 19.491 -4.637 1.00 0.00 H new ATOM 0 HG21 VAL A 42 15.999 20.750 -2.678 1.00 0.00 H new ATOM 0 HG22 VAL A 42 17.217 19.536 -2.218 1.00 0.00 H new ATOM 0 HG23 VAL A 42 17.140 21.090 -1.354 1.00 0.00 H new ATOM 640 N HIS A 43 21.175 21.092 -4.567 1.00 0.00 N ATOM 641 CA HIS A 43 22.148 21.694 -5.448 1.00 0.00 C ATOM 642 C HIS A 43 21.400 22.438 -6.561 1.00 0.00 C ATOM 643 O HIS A 43 20.428 21.896 -7.090 1.00 0.00 O ATOM 644 CB HIS A 43 23.065 20.590 -5.980 1.00 0.00 C ATOM 645 CG HIS A 43 24.443 21.108 -6.268 1.00 0.00 C ATOM 646 ND1 HIS A 43 24.931 21.483 -7.493 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.421 21.366 -5.344 1.00 0.00 C ATOM 648 CE1 HIS A 43 26.182 21.937 -7.319 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.528 21.889 -6.022 1.00 0.00 N ATOM 0 H HIS A 43 21.118 20.076 -4.644 1.00 0.00 H new ATOM 0 HA HIS A 43 22.775 22.421 -4.932 1.00 0.00 H new ATOM 0 HB2 HIS A 43 23.124 19.782 -5.250 1.00 0.00 H new ATOM 0 HB3 HIS A 43 22.637 20.167 -6.889 1.00 0.00 H new ATOM 0 HD2 HIS A 43 25.350 21.196 -4.280 1.00 0.00 H new ATOM 0 HE1 HIS A 43 26.822 22.292 -8.113 1.00 0.00 H new ATOM 0 HE2 HIS A 43 27.418 22.176 -5.614 1.00 0.00 H new ATOM 657 N PRO A 44 21.809 23.654 -6.954 1.00 0.00 N ATOM 658 CA PRO A 44 20.994 24.469 -7.843 1.00 0.00 C ATOM 659 C PRO A 44 21.007 23.932 -9.267 1.00 0.00 C ATOM 660 O PRO A 44 19.967 23.884 -9.911 1.00 0.00 O ATOM 661 CB PRO A 44 21.570 25.883 -7.730 1.00 0.00 C ATOM 662 CG PRO A 44 23.042 25.649 -7.378 1.00 0.00 C ATOM 663 CD PRO A 44 23.031 24.346 -6.575 1.00 0.00 C ATOM 0 HA PRO A 44 19.941 24.457 -7.563 1.00 0.00 H new ATOM 0 HB2 PRO A 44 21.465 26.434 -8.665 1.00 0.00 H new ATOM 0 HB3 PRO A 44 21.061 26.462 -6.959 1.00 0.00 H new ATOM 0 HG2 PRO A 44 23.657 25.560 -8.274 1.00 0.00 H new ATOM 0 HG3 PRO A 44 23.448 26.474 -6.793 1.00 0.00 H new ATOM 0 HD2 PRO A 44 23.909 23.741 -6.801 1.00 0.00 H new ATOM 0 HD3 PRO A 44 23.050 24.547 -5.504 1.00 0.00 H new ATOM 671 N THR A 45 22.137 23.443 -9.765 1.00 0.00 N ATOM 672 CA THR A 45 22.201 22.920 -11.120 1.00 0.00 C ATOM 673 C THR A 45 21.315 21.679 -11.288 1.00 0.00 C ATOM 674 O THR A 45 20.812 21.431 -12.381 1.00 0.00 O ATOM 675 CB THR A 45 23.678 22.624 -11.426 1.00 0.00 C ATOM 676 OG1 THR A 45 24.469 23.754 -11.091 1.00 0.00 O ATOM 677 CG2 THR A 45 23.950 22.202 -12.866 1.00 0.00 C ATOM 0 H THR A 45 23.017 23.399 -9.251 1.00 0.00 H new ATOM 0 HA THR A 45 21.815 23.651 -11.830 1.00 0.00 H new ATOM 0 HB THR A 45 23.950 21.765 -10.812 1.00 0.00 H new ATOM 0 HG1 THR A 45 25.411 23.563 -11.285 1.00 0.00 H new ATOM 0 HG21 THR A 45 25.016 22.013 -12.995 1.00 0.00 H new ATOM 0 HG22 THR A 45 23.391 21.294 -13.091 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.638 22.997 -13.543 1.00 0.00 H new ATOM 685 N ALA A 46 21.030 20.948 -10.203 1.00 0.00 N ATOM 686 CA ALA A 46 20.117 19.812 -10.229 1.00 0.00 C ATOM 687 C ALA A 46 18.768 20.204 -10.812 1.00 0.00 C ATOM 688 O ALA A 46 18.175 19.440 -11.577 1.00 0.00 O ATOM 689 CB ALA A 46 19.882 19.335 -8.799 1.00 0.00 C ATOM 0 H ALA A 46 21.430 21.133 -9.283 1.00 0.00 H new ATOM 0 HA ALA A 46 20.564 19.032 -10.845 1.00 0.00 H new ATOM 0 HB1 ALA A 46 19.200 18.485 -8.806 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.831 19.035 -8.355 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.447 20.144 -8.212 1.00 0.00 H new ATOM 695 N ILE A 47 18.304 21.408 -10.460 1.00 0.00 N ATOM 696 CA ILE A 47 17.049 21.937 -10.918 1.00 0.00 C ATOM 697 C ILE A 47 17.061 21.919 -12.445 1.00 0.00 C ATOM 698 O ILE A 47 16.095 21.480 -13.064 1.00 0.00 O ATOM 699 CB ILE A 47 16.907 23.376 -10.381 1.00 0.00 C ATOM 700 CG1 ILE A 47 16.911 23.426 -8.834 1.00 0.00 C ATOM 701 CG2 ILE A 47 15.664 24.043 -10.964 1.00 0.00 C ATOM 702 CD1 ILE A 47 17.236 24.822 -8.293 1.00 0.00 C ATOM 0 H ILE A 47 18.810 22.039 -9.839 1.00 0.00 H new ATOM 0 HA ILE A 47 16.205 21.346 -10.562 1.00 0.00 H new ATOM 0 HB ILE A 47 17.781 23.939 -10.708 1.00 0.00 H new ATOM 0 HG12 ILE A 47 15.936 23.113 -8.461 1.00 0.00 H new ATOM 0 HG13 ILE A 47 17.642 22.713 -8.453 1.00 0.00 H new ATOM 0 HG21 ILE A 47 15.579 25.058 -10.575 1.00 0.00 H new ATOM 0 HG22 ILE A 47 15.745 24.077 -12.050 1.00 0.00 H new ATOM 0 HG23 ILE A 47 14.779 23.472 -10.684 1.00 0.00 H new ATOM 0 HD11 ILE A 47 17.226 24.801 -7.203 1.00 0.00 H new ATOM 0 HD12 ILE A 47 18.223 25.126 -8.641 1.00 0.00 H new ATOM 0 HD13 ILE A 47 16.491 25.533 -8.649 1.00 0.00 H new ATOM 714 N ALA A 48 18.167 22.380 -13.039 1.00 0.00 N ATOM 715 CA ALA A 48 18.277 22.631 -14.456 1.00 0.00 C ATOM 716 C ALA A 48 18.160 21.327 -15.227 1.00 0.00 C ATOM 717 O ALA A 48 17.489 21.268 -16.251 1.00 0.00 O ATOM 718 CB ALA A 48 19.599 23.347 -14.758 1.00 0.00 C ATOM 0 H ALA A 48 19.023 22.590 -12.525 1.00 0.00 H new ATOM 0 HA ALA A 48 17.462 23.281 -14.775 1.00 0.00 H new ATOM 0 HB1 ALA A 48 19.675 23.533 -15.829 1.00 0.00 H new ATOM 0 HB2 ALA A 48 19.630 24.295 -14.222 1.00 0.00 H new ATOM 0 HB3 ALA A 48 20.433 22.722 -14.438 1.00 0.00 H new ATOM 724 N MET A 49 18.776 20.269 -14.706 1.00 0.00 N ATOM 725 CA MET A 49 18.803 18.968 -15.350 1.00 0.00 C ATOM 726 C MET A 49 17.394 18.347 -15.381 1.00 0.00 C ATOM 727 O MET A 49 16.926 17.797 -16.391 1.00 0.00 O ATOM 728 CB MET A 49 19.799 18.072 -14.604 1.00 0.00 C ATOM 729 CG MET A 49 21.096 18.718 -14.102 1.00 0.00 C ATOM 730 SD MET A 49 21.879 20.059 -15.062 1.00 0.00 S ATOM 731 CE MET A 49 22.166 19.269 -16.652 1.00 0.00 C ATOM 0 H MET A 49 19.274 20.296 -13.816 1.00 0.00 H new ATOM 0 HA MET A 49 19.126 19.072 -16.386 1.00 0.00 H new ATOM 0 HB2 MET A 49 19.285 17.640 -13.746 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.068 17.247 -15.263 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.899 19.107 -13.103 1.00 0.00 H new ATOM 0 HG3 MET A 49 21.834 17.923 -13.995 1.00 0.00 H new ATOM 0 HE1 MET A 49 21.880 19.950 -17.454 1.00 0.00 H new ATOM 0 HE2 MET A 49 23.222 19.018 -16.748 1.00 0.00 H new ATOM 0 HE3 MET A 49 21.570 18.359 -16.719 1.00 0.00 H new ATOM 741 N MET A 50 16.683 18.463 -14.264 1.00 0.00 N ATOM 742 CA MET A 50 15.301 18.037 -14.180 1.00 0.00 C ATOM 743 C MET A 50 14.438 18.899 -15.090 1.00 0.00 C ATOM 744 O MET A 50 13.549 18.360 -15.742 1.00 0.00 O ATOM 745 CB MET A 50 14.838 18.066 -12.723 1.00 0.00 C ATOM 746 CG MET A 50 15.610 16.996 -11.938 1.00 0.00 C ATOM 747 SD MET A 50 14.645 16.122 -10.689 1.00 0.00 S ATOM 748 CE MET A 50 13.507 15.221 -11.740 1.00 0.00 C ATOM 0 H MET A 50 17.052 18.854 -13.397 1.00 0.00 H new ATOM 0 HA MET A 50 15.203 17.008 -14.527 1.00 0.00 H new ATOM 0 HB2 MET A 50 15.013 19.051 -12.291 1.00 0.00 H new ATOM 0 HB3 MET A 50 13.766 17.878 -12.664 1.00 0.00 H new ATOM 0 HG2 MET A 50 16.009 16.267 -12.643 1.00 0.00 H new ATOM 0 HG3 MET A 50 16.463 17.469 -11.451 1.00 0.00 H new ATOM 0 HE1 MET A 50 12.484 15.418 -11.421 1.00 0.00 H new ATOM 0 HE2 MET A 50 13.633 15.543 -12.774 1.00 0.00 H new ATOM 0 HE3 MET A 50 13.711 14.153 -11.666 1.00 0.00 H new ATOM 758 N GLU A 51 14.749 20.187 -15.236 1.00 0.00 N ATOM 759 CA GLU A 51 14.086 21.068 -16.186 1.00 0.00 C ATOM 760 C GLU A 51 14.248 20.559 -17.619 1.00 0.00 C ATOM 761 O GLU A 51 13.349 20.751 -18.435 1.00 0.00 O ATOM 762 CB GLU A 51 14.647 22.493 -16.056 1.00 0.00 C ATOM 763 CG GLU A 51 13.556 23.562 -15.938 1.00 0.00 C ATOM 764 CD GLU A 51 12.690 23.700 -17.203 1.00 0.00 C ATOM 765 OE1 GLU A 51 13.169 24.261 -18.215 1.00 0.00 O ATOM 766 OE2 GLU A 51 11.502 23.307 -17.175 1.00 0.00 O ATOM 0 H GLU A 51 15.477 20.649 -14.690 1.00 0.00 H new ATOM 0 HA GLU A 51 13.021 21.081 -15.956 1.00 0.00 H new ATOM 0 HB2 GLU A 51 15.293 22.544 -15.179 1.00 0.00 H new ATOM 0 HB3 GLU A 51 15.269 22.712 -16.924 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.913 23.321 -15.092 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.022 24.523 -15.720 1.00 0.00 H new ATOM 773 N GLU A 52 15.358 19.876 -17.926 1.00 0.00 N ATOM 774 CA GLU A 52 15.563 19.291 -19.244 1.00 0.00 C ATOM 775 C GLU A 52 14.561 18.171 -19.474 1.00 0.00 C ATOM 776 O GLU A 52 14.045 18.017 -20.583 1.00 0.00 O ATOM 777 CB GLU A 52 16.975 18.728 -19.440 1.00 0.00 C ATOM 778 CG GLU A 52 18.070 19.756 -19.131 1.00 0.00 C ATOM 779 CD GLU A 52 19.395 19.440 -19.834 1.00 0.00 C ATOM 780 OE1 GLU A 52 20.101 18.492 -19.420 1.00 0.00 O ATOM 781 OE2 GLU A 52 19.758 20.159 -20.791 1.00 0.00 O ATOM 0 H GLU A 52 16.126 19.718 -17.273 1.00 0.00 H new ATOM 0 HA GLU A 52 15.423 20.098 -19.963 1.00 0.00 H new ATOM 0 HB2 GLU A 52 17.107 17.858 -18.797 1.00 0.00 H new ATOM 0 HB3 GLU A 52 17.085 18.384 -20.468 1.00 0.00 H new ATOM 0 HG2 GLU A 52 17.729 20.746 -19.435 1.00 0.00 H new ATOM 0 HG3 GLU A 52 18.235 19.792 -18.054 1.00 0.00 H new ATOM 788 N VAL A 53 14.278 17.398 -18.421 1.00 0.00 N ATOM 789 CA VAL A 53 13.269 16.338 -18.530 1.00 0.00 C ATOM 790 C VAL A 53 11.847 16.934 -18.475 1.00 0.00 C ATOM 791 O VAL A 53 10.914 16.350 -19.032 1.00 0.00 O ATOM 792 CB VAL A 53 13.542 15.250 -17.475 1.00 0.00 C ATOM 793 CG1 VAL A 53 12.527 14.098 -17.515 1.00 0.00 C ATOM 794 CG2 VAL A 53 14.939 14.646 -17.712 1.00 0.00 C ATOM 0 H VAL A 53 14.720 17.481 -17.505 1.00 0.00 H new ATOM 0 HA VAL A 53 13.338 15.847 -19.501 1.00 0.00 H new ATOM 0 HB VAL A 53 13.465 15.739 -16.504 1.00 0.00 H new ATOM 0 HG11 VAL A 53 12.777 13.366 -16.747 1.00 0.00 H new ATOM 0 HG12 VAL A 53 11.526 14.489 -17.332 1.00 0.00 H new ATOM 0 HG13 VAL A 53 12.557 13.620 -18.494 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.134 13.876 -16.966 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.981 14.205 -18.708 1.00 0.00 H new ATOM 0 HG23 VAL A 53 15.693 15.429 -17.630 1.00 0.00 H new ATOM 804 N GLY A 54 11.677 18.110 -17.865 1.00 0.00 N ATOM 805 CA GLY A 54 10.404 18.809 -17.728 1.00 0.00 C ATOM 806 C GLY A 54 9.875 18.748 -16.293 1.00 0.00 C ATOM 807 O GLY A 54 8.660 18.796 -16.091 1.00 0.00 O ATOM 0 H GLY A 54 12.453 18.617 -17.439 1.00 0.00 H new ATOM 0 HA2 GLY A 54 10.527 19.850 -18.026 1.00 0.00 H new ATOM 0 HA3 GLY A 54 9.672 18.368 -18.405 1.00 0.00 H new ATOM 811 N ILE A 55 10.765 18.597 -15.307 1.00 0.00 N ATOM 812 CA ILE A 55 10.435 18.494 -13.882 1.00 0.00 C ATOM 813 C ILE A 55 11.234 19.590 -13.140 1.00 0.00 C ATOM 814 O ILE A 55 11.987 20.344 -13.758 1.00 0.00 O ATOM 815 CB ILE A 55 10.705 17.040 -13.404 1.00 0.00 C ATOM 816 CG1 ILE A 55 10.010 15.964 -14.282 1.00 0.00 C ATOM 817 CG2 ILE A 55 10.263 16.785 -11.947 1.00 0.00 C ATOM 818 CD1 ILE A 55 10.833 14.678 -14.316 1.00 0.00 C ATOM 0 H ILE A 55 11.768 18.541 -15.485 1.00 0.00 H new ATOM 0 HA ILE A 55 9.381 18.674 -13.670 1.00 0.00 H new ATOM 0 HB ILE A 55 11.788 16.948 -13.489 1.00 0.00 H new ATOM 0 HG12 ILE A 55 9.015 15.754 -13.889 1.00 0.00 H new ATOM 0 HG13 ILE A 55 9.879 16.344 -15.295 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.480 15.752 -11.677 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.804 17.456 -11.280 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.192 16.967 -11.854 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.327 13.939 -14.937 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.819 14.888 -14.732 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.942 14.289 -13.304 1.00 0.00 H new ATOM 830 N ASP A 56 11.072 19.717 -11.823 1.00 0.00 N ATOM 831 CA ASP A 56 11.715 20.726 -10.981 1.00 0.00 C ATOM 832 C ASP A 56 12.090 20.098 -9.635 1.00 0.00 C ATOM 833 O ASP A 56 11.461 19.123 -9.216 1.00 0.00 O ATOM 834 CB ASP A 56 10.745 21.898 -10.752 1.00 0.00 C ATOM 835 CG ASP A 56 11.270 22.848 -9.669 1.00 0.00 C ATOM 836 OD1 ASP A 56 12.393 23.370 -9.844 1.00 0.00 O ATOM 837 OD2 ASP A 56 10.615 22.999 -8.614 1.00 0.00 O ATOM 0 H ASP A 56 10.464 19.094 -11.292 1.00 0.00 H new ATOM 0 HA ASP A 56 12.615 21.094 -11.474 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.606 22.446 -11.684 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.768 21.513 -10.460 1.00 0.00 H new ATOM 842 N ILE A 57 13.079 20.679 -8.946 1.00 0.00 N ATOM 843 CA ILE A 57 13.428 20.336 -7.567 1.00 0.00 C ATOM 844 C ILE A 57 13.518 21.569 -6.656 1.00 0.00 C ATOM 845 O ILE A 57 13.469 21.406 -5.440 1.00 0.00 O ATOM 846 CB ILE A 57 14.708 19.477 -7.461 1.00 0.00 C ATOM 847 CG1 ILE A 57 15.236 18.858 -8.766 1.00 0.00 C ATOM 848 CG2 ILE A 57 14.458 18.374 -6.421 1.00 0.00 C ATOM 849 CD1 ILE A 57 16.575 18.155 -8.540 1.00 0.00 C ATOM 0 H ILE A 57 13.668 21.413 -9.340 1.00 0.00 H new ATOM 0 HA ILE A 57 12.601 19.722 -7.209 1.00 0.00 H new ATOM 0 HB ILE A 57 15.499 20.167 -7.167 1.00 0.00 H new ATOM 0 HG12 ILE A 57 14.509 18.145 -9.154 1.00 0.00 H new ATOM 0 HG13 ILE A 57 15.353 19.636 -9.520 1.00 0.00 H new ATOM 0 HG21 ILE A 57 15.349 17.753 -6.328 1.00 0.00 H new ATOM 0 HG22 ILE A 57 14.230 18.828 -5.457 1.00 0.00 H new ATOM 0 HG23 ILE A 57 13.618 17.757 -6.740 1.00 0.00 H new ATOM 0 HD11 ILE A 57 16.924 17.727 -9.480 1.00 0.00 H new ATOM 0 HD12 ILE A 57 17.307 18.875 -8.175 1.00 0.00 H new ATOM 0 HD13 ILE A 57 16.449 17.361 -7.804 1.00 0.00 H new ATOM 861 N SER A 58 13.590 22.787 -7.202 1.00 0.00 N ATOM 862 CA SER A 58 13.514 24.047 -6.452 1.00 0.00 C ATOM 863 C SER A 58 12.388 24.046 -5.399 1.00 0.00 C ATOM 864 O SER A 58 12.548 24.611 -4.315 1.00 0.00 O ATOM 865 CB SER A 58 13.246 25.224 -7.403 1.00 0.00 C ATOM 866 OG SER A 58 13.876 25.071 -8.648 1.00 0.00 O ATOM 0 H SER A 58 13.706 22.929 -8.205 1.00 0.00 H new ATOM 0 HA SER A 58 14.475 24.152 -5.949 1.00 0.00 H new ATOM 0 HB2 SER A 58 12.171 25.325 -7.555 1.00 0.00 H new ATOM 0 HB3 SER A 58 13.591 26.147 -6.937 1.00 0.00 H new ATOM 0 HG SER A 58 13.223 24.758 -9.309 1.00 0.00 H new ATOM 872 N GLY A 59 11.245 23.429 -5.728 1.00 0.00 N ATOM 873 CA GLY A 59 10.039 23.427 -4.910 1.00 0.00 C ATOM 874 C GLY A 59 10.099 22.493 -3.697 1.00 0.00 C ATOM 875 O GLY A 59 9.187 22.543 -2.868 1.00 0.00 O ATOM 0 H GLY A 59 11.138 22.905 -6.596 1.00 0.00 H new ATOM 0 HA2 GLY A 59 9.849 24.442 -4.562 1.00 0.00 H new ATOM 0 HA3 GLY A 59 9.192 23.139 -5.533 1.00 0.00 H new ATOM 879 N GLN A 60 11.138 21.660 -3.564 1.00 0.00 N ATOM 880 CA GLN A 60 11.341 20.748 -2.451 1.00 0.00 C ATOM 881 C GLN A 60 12.721 20.967 -1.816 1.00 0.00 C ATOM 882 O GLN A 60 13.565 21.678 -2.366 1.00 0.00 O ATOM 883 CB GLN A 60 11.079 19.305 -2.919 1.00 0.00 C ATOM 884 CG GLN A 60 12.105 18.736 -3.912 1.00 0.00 C ATOM 885 CD GLN A 60 11.840 17.275 -4.289 1.00 0.00 C ATOM 886 OE1 GLN A 60 10.709 16.858 -4.533 1.00 0.00 O ATOM 887 NE2 GLN A 60 12.884 16.468 -4.369 1.00 0.00 N ATOM 0 H GLN A 60 11.883 21.607 -4.258 1.00 0.00 H new ATOM 0 HA GLN A 60 10.625 20.951 -1.654 1.00 0.00 H new ATOM 0 HB2 GLN A 60 11.049 18.657 -2.043 1.00 0.00 H new ATOM 0 HB3 GLN A 60 10.092 19.264 -3.380 1.00 0.00 H new ATOM 0 HG2 GLN A 60 12.100 19.344 -4.817 1.00 0.00 H new ATOM 0 HG3 GLN A 60 13.102 18.817 -3.479 1.00 0.00 H new ATOM 0 HE21 GLN A 60 13.819 16.822 -4.165 1.00 0.00 H new ATOM 0 HE22 GLN A 60 12.755 15.492 -4.635 1.00 0.00 H new ATOM 896 N THR A 61 12.948 20.371 -0.646 1.00 0.00 N ATOM 897 CA THR A 61 14.110 20.634 0.197 1.00 0.00 C ATOM 898 C THR A 61 14.807 19.333 0.609 1.00 0.00 C ATOM 899 O THR A 61 14.296 18.231 0.381 1.00 0.00 O ATOM 900 CB THR A 61 13.651 21.453 1.421 1.00 0.00 C ATOM 901 OG1 THR A 61 12.518 20.854 2.031 1.00 0.00 O ATOM 902 CG2 THR A 61 13.265 22.870 0.996 1.00 0.00 C ATOM 0 H THR A 61 12.314 19.677 -0.251 1.00 0.00 H new ATOM 0 HA THR A 61 14.848 21.209 -0.363 1.00 0.00 H new ATOM 0 HB THR A 61 14.480 21.482 2.128 1.00 0.00 H new ATOM 0 HG1 THR A 61 12.244 21.387 2.806 1.00 0.00 H new ATOM 0 HG21 THR A 61 12.943 23.437 1.870 1.00 0.00 H new ATOM 0 HG22 THR A 61 14.126 23.361 0.542 1.00 0.00 H new ATOM 0 HG23 THR A 61 12.451 22.824 0.273 1.00 0.00 H new ATOM 910 N SER A 62 15.998 19.465 1.193 1.00 0.00 N ATOM 911 CA SER A 62 16.760 18.359 1.756 1.00 0.00 C ATOM 912 C SER A 62 16.400 18.136 3.227 1.00 0.00 C ATOM 913 O SER A 62 15.863 19.024 3.895 1.00 0.00 O ATOM 914 CB SER A 62 18.246 18.661 1.589 1.00 0.00 C ATOM 915 OG SER A 62 18.608 18.582 0.221 1.00 0.00 O ATOM 0 H SER A 62 16.467 20.366 1.288 1.00 0.00 H new ATOM 0 HA SER A 62 16.515 17.437 1.228 1.00 0.00 H new ATOM 0 HB2 SER A 62 18.469 19.656 1.975 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.837 17.953 2.171 1.00 0.00 H new ATOM 0 HG SER A 62 19.553 18.819 0.119 1.00 0.00 H new ATOM 921 N ASP A 63 16.696 16.933 3.719 1.00 0.00 N ATOM 922 CA ASP A 63 16.302 16.449 5.039 1.00 0.00 C ATOM 923 C ASP A 63 17.249 15.314 5.455 1.00 0.00 C ATOM 924 O ASP A 63 17.638 14.521 4.592 1.00 0.00 O ATOM 925 CB ASP A 63 14.858 15.935 4.951 1.00 0.00 C ATOM 926 CG ASP A 63 14.186 15.909 6.326 1.00 0.00 C ATOM 927 OD1 ASP A 63 13.957 16.991 6.911 1.00 0.00 O ATOM 928 OD2 ASP A 63 13.839 14.812 6.802 1.00 0.00 O ATOM 0 H ASP A 63 17.235 16.247 3.191 1.00 0.00 H new ATOM 0 HA ASP A 63 16.360 17.246 5.780 1.00 0.00 H new ATOM 0 HB2 ASP A 63 14.285 16.571 4.277 1.00 0.00 H new ATOM 0 HB3 ASP A 63 14.853 14.932 4.524 1.00 0.00 H new ATOM 933 N PRO A 64 17.681 15.211 6.723 1.00 0.00 N ATOM 934 CA PRO A 64 18.628 14.178 7.125 1.00 0.00 C ATOM 935 C PRO A 64 17.926 12.819 7.226 1.00 0.00 C ATOM 936 O PRO A 64 16.765 12.735 7.635 1.00 0.00 O ATOM 937 CB PRO A 64 19.175 14.643 8.478 1.00 0.00 C ATOM 938 CG PRO A 64 18.020 15.446 9.075 1.00 0.00 C ATOM 939 CD PRO A 64 17.331 16.059 7.854 1.00 0.00 C ATOM 0 HA PRO A 64 19.433 14.043 6.403 1.00 0.00 H new ATOM 0 HB2 PRO A 64 19.447 13.799 9.112 1.00 0.00 H new ATOM 0 HB3 PRO A 64 20.070 15.254 8.360 1.00 0.00 H new ATOM 0 HG2 PRO A 64 17.340 14.809 9.640 1.00 0.00 H new ATOM 0 HG3 PRO A 64 18.379 16.215 9.759 1.00 0.00 H new ATOM 0 HD2 PRO A 64 16.251 16.095 7.994 1.00 0.00 H new ATOM 0 HD3 PRO A 64 17.666 17.083 7.691 1.00 0.00 H new ATOM 947 N ILE A 65 18.658 11.740 6.932 1.00 0.00 N ATOM 948 CA ILE A 65 18.183 10.363 7.090 1.00 0.00 C ATOM 949 C ILE A 65 17.630 10.115 8.502 1.00 0.00 C ATOM 950 O ILE A 65 16.648 9.394 8.681 1.00 0.00 O ATOM 951 CB ILE A 65 19.316 9.393 6.719 1.00 0.00 C ATOM 952 CG1 ILE A 65 18.738 7.974 6.621 1.00 0.00 C ATOM 953 CG2 ILE A 65 20.537 9.461 7.663 1.00 0.00 C ATOM 954 CD1 ILE A 65 19.752 7.007 6.027 1.00 0.00 C ATOM 0 H ILE A 65 19.611 11.800 6.572 1.00 0.00 H new ATOM 0 HA ILE A 65 17.348 10.188 6.412 1.00 0.00 H new ATOM 0 HB ILE A 65 19.713 9.699 5.751 1.00 0.00 H new ATOM 0 HG12 ILE A 65 18.441 7.630 7.612 1.00 0.00 H new ATOM 0 HG13 ILE A 65 17.839 7.986 6.005 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.292 8.747 7.334 1.00 0.00 H new ATOM 0 HG22 ILE A 65 20.956 10.467 7.644 1.00 0.00 H new ATOM 0 HG23 ILE A 65 20.226 9.217 8.679 1.00 0.00 H new ATOM 0 HD11 ILE A 65 19.314 6.010 5.970 1.00 0.00 H new ATOM 0 HD12 ILE A 65 20.029 7.339 5.027 1.00 0.00 H new ATOM 0 HD13 ILE A 65 20.640 6.978 6.658 1.00 0.00 H new ATOM 966 N GLU A 66 18.250 10.760 9.495 1.00 0.00 N ATOM 967 CA GLU A 66 17.982 10.618 10.919 1.00 0.00 C ATOM 968 C GLU A 66 16.522 10.941 11.273 1.00 0.00 C ATOM 969 O GLU A 66 16.025 10.510 12.315 1.00 0.00 O ATOM 970 CB GLU A 66 18.930 11.550 11.703 1.00 0.00 C ATOM 971 CG GLU A 66 20.409 11.468 11.279 1.00 0.00 C ATOM 972 CD GLU A 66 21.322 12.199 12.281 1.00 0.00 C ATOM 973 OE1 GLU A 66 21.504 13.432 12.163 1.00 0.00 O ATOM 974 OE2 GLU A 66 21.880 11.545 13.192 1.00 0.00 O ATOM 0 H GLU A 66 18.994 11.433 9.310 1.00 0.00 H new ATOM 0 HA GLU A 66 18.155 9.577 11.193 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.588 12.578 11.583 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.857 11.312 12.764 1.00 0.00 H new ATOM 0 HG2 GLU A 66 20.710 10.423 11.205 1.00 0.00 H new ATOM 0 HG3 GLU A 66 20.530 11.906 10.288 1.00 0.00 H new ATOM 981 N ASN A 67 15.837 11.712 10.420 1.00 0.00 N ATOM 982 CA ASN A 67 14.467 12.158 10.634 1.00 0.00 C ATOM 983 C ASN A 67 13.426 11.083 10.275 1.00 0.00 C ATOM 984 O ASN A 67 12.242 11.278 10.552 1.00 0.00 O ATOM 985 CB ASN A 67 14.245 13.434 9.815 1.00 0.00 C ATOM 986 CG ASN A 67 12.935 14.150 10.132 1.00 0.00 C ATOM 987 OD1 ASN A 67 12.467 14.187 11.269 1.00 0.00 O ATOM 988 ND2 ASN A 67 12.346 14.781 9.136 1.00 0.00 N ATOM 0 H ASN A 67 16.235 12.048 9.543 1.00 0.00 H new ATOM 0 HA ASN A 67 14.328 12.358 11.697 1.00 0.00 H new ATOM 0 HB2 ASN A 67 15.075 14.118 9.994 1.00 0.00 H new ATOM 0 HB3 ASN A 67 14.263 13.182 8.755 1.00 0.00 H new ATOM 0 HD21 ASN A 67 11.490 15.310 9.302 1.00 0.00 H new ATOM 0 HD22 ASN A 67 12.747 14.741 8.199 1.00 0.00 H new ATOM 995 N PHE A 68 13.825 9.945 9.689 1.00 0.00 N ATOM 996 CA PHE A 68 12.931 8.851 9.336 1.00 0.00 C ATOM 997 C PHE A 68 13.403 7.531 9.958 1.00 0.00 C ATOM 998 O PHE A 68 14.436 7.457 10.626 1.00 0.00 O ATOM 999 CB PHE A 68 12.864 8.735 7.808 1.00 0.00 C ATOM 1000 CG PHE A 68 12.169 9.885 7.115 1.00 0.00 C ATOM 1001 CD1 PHE A 68 10.771 9.856 6.955 1.00 0.00 C ATOM 1002 CD2 PHE A 68 12.913 10.971 6.619 1.00 0.00 C ATOM 1003 CE1 PHE A 68 10.114 10.923 6.316 1.00 0.00 C ATOM 1004 CE2 PHE A 68 12.256 12.026 5.964 1.00 0.00 C ATOM 1005 CZ PHE A 68 10.857 12.009 5.821 1.00 0.00 C ATOM 0 H PHE A 68 14.799 9.763 9.446 1.00 0.00 H new ATOM 0 HA PHE A 68 11.937 9.061 9.730 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.879 8.655 7.419 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.350 7.809 7.550 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.203 9.014 7.323 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.986 10.994 6.741 1.00 0.00 H new ATOM 0 HE1 PHE A 68 9.040 10.908 6.206 1.00 0.00 H new ATOM 0 HE2 PHE A 68 12.827 12.853 5.569 1.00 0.00 H new ATOM 0 HZ PHE A 68 10.354 12.830 5.331 1.00 0.00 H new ATOM 1015 N ASN A 69 12.633 6.478 9.683 1.00 0.00 N ATOM 1016 CA ASN A 69 12.918 5.081 9.978 1.00 0.00 C ATOM 1017 C ASN A 69 12.729 4.298 8.684 1.00 0.00 C ATOM 1018 O ASN A 69 11.770 4.539 7.948 1.00 0.00 O ATOM 1019 CB ASN A 69 12.001 4.524 11.089 1.00 0.00 C ATOM 1020 CG ASN A 69 10.538 4.983 11.078 1.00 0.00 C ATOM 1021 OD1 ASN A 69 9.960 5.228 12.133 1.00 0.00 O ATOM 1022 ND2 ASN A 69 9.899 5.132 9.927 1.00 0.00 N ATOM 0 H ASN A 69 11.733 6.591 9.216 1.00 0.00 H new ATOM 0 HA ASN A 69 13.938 4.986 10.349 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.015 3.436 11.026 1.00 0.00 H new ATOM 0 HB3 ASN A 69 12.434 4.794 12.052 1.00 0.00 H new ATOM 0 HD21 ASN A 69 8.930 5.449 9.919 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.376 4.929 9.049 1.00 0.00 H new ATOM 1029 N ALA A 70 13.617 3.342 8.435 1.00 0.00 N ATOM 1030 CA ALA A 70 13.623 2.498 7.251 1.00 0.00 C ATOM 1031 C ALA A 70 12.413 1.572 7.207 1.00 0.00 C ATOM 1032 O ALA A 70 12.022 1.154 6.124 1.00 0.00 O ATOM 1033 CB ALA A 70 14.902 1.659 7.222 1.00 0.00 C ATOM 0 H ALA A 70 14.380 3.128 9.077 1.00 0.00 H new ATOM 0 HA ALA A 70 13.580 3.152 6.380 1.00 0.00 H new ATOM 0 HB1 ALA A 70 14.903 1.028 6.333 1.00 0.00 H new ATOM 0 HB2 ALA A 70 15.769 2.319 7.199 1.00 0.00 H new ATOM 0 HB3 ALA A 70 14.946 1.032 8.112 1.00 0.00 H new ATOM 1039 N ASP A 71 11.810 1.262 8.358 1.00 0.00 N ATOM 1040 CA ASP A 71 10.679 0.340 8.467 1.00 0.00 C ATOM 1041 C ASP A 71 9.462 0.807 7.657 1.00 0.00 C ATOM 1042 O ASP A 71 8.629 -0.009 7.261 1.00 0.00 O ATOM 1043 CB ASP A 71 10.297 0.183 9.944 1.00 0.00 C ATOM 1044 CG ASP A 71 9.108 -0.775 10.129 1.00 0.00 C ATOM 1045 OD1 ASP A 71 9.279 -2.001 9.941 1.00 0.00 O ATOM 1046 OD2 ASP A 71 8.009 -0.317 10.514 1.00 0.00 O ATOM 0 H ASP A 71 12.100 1.652 9.255 1.00 0.00 H new ATOM 0 HA ASP A 71 10.989 -0.619 8.051 1.00 0.00 H new ATOM 0 HB2 ASP A 71 11.155 -0.190 10.503 1.00 0.00 H new ATOM 0 HB3 ASP A 71 10.046 1.159 10.360 1.00 0.00 H new ATOM 1051 N ASP A 72 9.360 2.114 7.387 1.00 0.00 N ATOM 1052 CA ASP A 72 8.259 2.708 6.651 1.00 0.00 C ATOM 1053 C ASP A 72 8.487 2.589 5.144 1.00 0.00 C ATOM 1054 O ASP A 72 7.556 2.785 4.370 1.00 0.00 O ATOM 1055 CB ASP A 72 8.099 4.174 7.073 1.00 0.00 C ATOM 1056 CG ASP A 72 6.836 4.830 6.496 1.00 0.00 C ATOM 1057 OD1 ASP A 72 5.728 4.261 6.627 1.00 0.00 O ATOM 1058 OD2 ASP A 72 6.922 5.971 5.989 1.00 0.00 O ATOM 0 H ASP A 72 10.059 2.794 7.684 1.00 0.00 H new ATOM 0 HA ASP A 72 7.339 2.171 6.884 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.067 4.232 8.161 1.00 0.00 H new ATOM 0 HB3 ASP A 72 8.974 4.737 6.749 1.00 0.00 H new ATOM 1063 N TYR A 73 9.704 2.239 4.717 1.00 0.00 N ATOM 1064 CA TYR A 73 10.134 2.196 3.341 1.00 0.00 C ATOM 1065 C TYR A 73 10.263 0.745 2.902 1.00 0.00 C ATOM 1066 O TYR A 73 10.908 -0.070 3.562 1.00 0.00 O ATOM 1067 CB TYR A 73 11.432 2.994 3.176 1.00 0.00 C ATOM 1068 CG TYR A 73 11.221 4.473 3.437 1.00 0.00 C ATOM 1069 CD1 TYR A 73 10.703 5.286 2.416 1.00 0.00 C ATOM 1070 CD2 TYR A 73 11.476 5.023 4.708 1.00 0.00 C ATOM 1071 CE1 TYR A 73 10.427 6.638 2.663 1.00 0.00 C ATOM 1072 CE2 TYR A 73 11.214 6.381 4.971 1.00 0.00 C ATOM 1073 CZ TYR A 73 10.671 7.191 3.940 1.00 0.00 C ATOM 1074 OH TYR A 73 10.391 8.508 4.139 1.00 0.00 O ATOM 0 H TYR A 73 10.443 1.967 5.365 1.00 0.00 H new ATOM 0 HA TYR A 73 9.396 2.666 2.691 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.186 2.608 3.862 1.00 0.00 H new ATOM 0 HB3 TYR A 73 11.819 2.855 2.166 1.00 0.00 H new ATOM 0 HD1 TYR A 73 10.517 4.868 1.438 1.00 0.00 H new ATOM 0 HD2 TYR A 73 11.877 4.396 5.490 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.027 7.259 1.875 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.423 6.801 5.944 1.00 0.00 H new ATOM 0 HH TYR A 73 10.561 8.741 5.076 1.00 0.00 H new ATOM 1084 N ASP A 74 9.624 0.413 1.782 1.00 0.00 N ATOM 1085 CA ASP A 74 9.713 -0.920 1.206 1.00 0.00 C ATOM 1086 C ASP A 74 11.050 -1.076 0.489 1.00 0.00 C ATOM 1087 O ASP A 74 11.666 -2.140 0.536 1.00 0.00 O ATOM 1088 CB ASP A 74 8.566 -1.175 0.226 1.00 0.00 C ATOM 1089 CG ASP A 74 8.481 -2.675 -0.105 1.00 0.00 C ATOM 1090 OD1 ASP A 74 7.949 -3.435 0.734 1.00 0.00 O ATOM 1091 OD2 ASP A 74 8.863 -3.085 -1.224 1.00 0.00 O ATOM 0 H ASP A 74 9.035 1.057 1.254 1.00 0.00 H new ATOM 0 HA ASP A 74 9.639 -1.650 2.012 1.00 0.00 H new ATOM 0 HB2 ASP A 74 7.625 -0.836 0.659 1.00 0.00 H new ATOM 0 HB3 ASP A 74 8.722 -0.601 -0.687 1.00 0.00 H new ATOM 1096 N VAL A 75 11.531 0.012 -0.119 1.00 0.00 N ATOM 1097 CA VAL A 75 12.738 0.009 -0.923 1.00 0.00 C ATOM 1098 C VAL A 75 13.617 1.178 -0.522 1.00 0.00 C ATOM 1099 O VAL A 75 13.129 2.289 -0.313 1.00 0.00 O ATOM 1100 CB VAL A 75 12.364 -0.042 -2.420 1.00 0.00 C ATOM 1101 CG1 VAL A 75 11.178 0.793 -2.898 1.00 0.00 C ATOM 1102 CG2 VAL A 75 13.567 0.181 -3.345 1.00 0.00 C ATOM 0 H VAL A 75 11.082 0.926 -0.061 1.00 0.00 H new ATOM 0 HA VAL A 75 13.336 -0.884 -0.741 1.00 0.00 H new ATOM 0 HB VAL A 75 12.010 -1.070 -2.496 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.042 0.651 -3.970 1.00 0.00 H new ATOM 0 HG12 VAL A 75 10.276 0.478 -2.373 1.00 0.00 H new ATOM 0 HG13 VAL A 75 11.368 1.846 -2.692 1.00 0.00 H new ATOM 0 HG21 VAL A 75 13.241 0.134 -4.384 1.00 0.00 H new ATOM 0 HG22 VAL A 75 14.003 1.160 -3.146 1.00 0.00 H new ATOM 0 HG23 VAL A 75 14.314 -0.592 -3.164 1.00 0.00 H new ATOM 1112 N VAL A 76 14.918 0.922 -0.421 1.00 0.00 N ATOM 1113 CA VAL A 76 15.887 1.951 -0.055 1.00 0.00 C ATOM 1114 C VAL A 76 17.069 1.921 -1.022 1.00 0.00 C ATOM 1115 O VAL A 76 17.670 0.884 -1.301 1.00 0.00 O ATOM 1116 CB VAL A 76 16.240 1.876 1.449 1.00 0.00 C ATOM 1117 CG1 VAL A 76 16.272 0.454 2.026 1.00 0.00 C ATOM 1118 CG2 VAL A 76 17.509 2.666 1.793 1.00 0.00 C ATOM 0 H VAL A 76 15.328 0.003 -0.589 1.00 0.00 H new ATOM 0 HA VAL A 76 15.452 2.944 -0.169 1.00 0.00 H new ATOM 0 HB VAL A 76 15.405 2.365 1.950 1.00 0.00 H new ATOM 0 HG11 VAL A 76 16.528 0.497 3.085 1.00 0.00 H new ATOM 0 HG12 VAL A 76 15.292 -0.009 1.908 1.00 0.00 H new ATOM 0 HG13 VAL A 76 17.019 -0.137 1.496 1.00 0.00 H new ATOM 0 HG21 VAL A 76 17.712 2.581 2.860 1.00 0.00 H new ATOM 0 HG22 VAL A 76 18.351 2.264 1.230 1.00 0.00 H new ATOM 0 HG23 VAL A 76 17.366 3.715 1.533 1.00 0.00 H new ATOM 1128 N ILE A 77 17.388 3.093 -1.557 1.00 0.00 N ATOM 1129 CA ILE A 77 18.326 3.263 -2.638 1.00 0.00 C ATOM 1130 C ILE A 77 19.382 4.234 -2.161 1.00 0.00 C ATOM 1131 O ILE A 77 19.153 5.441 -2.085 1.00 0.00 O ATOM 1132 CB ILE A 77 17.587 3.756 -3.895 1.00 0.00 C ATOM 1133 CG1 ILE A 77 16.526 2.755 -4.394 1.00 0.00 C ATOM 1134 CG2 ILE A 77 18.579 4.088 -5.016 1.00 0.00 C ATOM 1135 CD1 ILE A 77 17.072 1.369 -4.764 1.00 0.00 C ATOM 0 H ILE A 77 16.984 3.972 -1.235 1.00 0.00 H new ATOM 0 HA ILE A 77 18.806 2.325 -2.915 1.00 0.00 H new ATOM 0 HB ILE A 77 17.058 4.664 -3.608 1.00 0.00 H new ATOM 0 HG12 ILE A 77 15.767 2.636 -3.621 1.00 0.00 H new ATOM 0 HG13 ILE A 77 16.029 3.179 -5.267 1.00 0.00 H new ATOM 0 HG21 ILE A 77 18.033 4.434 -5.894 1.00 0.00 H new ATOM 0 HG22 ILE A 77 19.259 4.870 -4.680 1.00 0.00 H new ATOM 0 HG23 ILE A 77 19.150 3.196 -5.272 1.00 0.00 H new ATOM 0 HD11 ILE A 77 16.254 0.734 -5.104 1.00 0.00 H new ATOM 0 HD12 ILE A 77 17.808 1.469 -5.561 1.00 0.00 H new ATOM 0 HD13 ILE A 77 17.542 0.918 -3.890 1.00 0.00 H new ATOM 1147 N SER A 78 20.523 3.691 -1.777 1.00 0.00 N ATOM 1148 CA SER A 78 21.677 4.528 -1.551 1.00 0.00 C ATOM 1149 C SER A 78 22.181 4.953 -2.936 1.00 0.00 C ATOM 1150 O SER A 78 21.932 4.279 -3.941 1.00 0.00 O ATOM 1151 CB SER A 78 22.745 3.782 -0.769 1.00 0.00 C ATOM 1152 OG SER A 78 22.354 3.676 0.580 1.00 0.00 O ATOM 0 H SER A 78 20.670 2.694 -1.619 1.00 0.00 H new ATOM 0 HA SER A 78 21.422 5.402 -0.951 1.00 0.00 H new ATOM 0 HB2 SER A 78 22.895 2.789 -1.194 1.00 0.00 H new ATOM 0 HB3 SER A 78 23.697 4.307 -0.842 1.00 0.00 H new ATOM 0 HG SER A 78 23.043 3.193 1.083 1.00 0.00 H new ATOM 1158 N LEU A 79 22.860 6.092 -3.014 1.00 0.00 N ATOM 1159 CA LEU A 79 23.454 6.618 -4.237 1.00 0.00 C ATOM 1160 C LEU A 79 24.712 7.400 -3.842 1.00 0.00 C ATOM 1161 O LEU A 79 24.916 8.557 -4.218 1.00 0.00 O ATOM 1162 CB LEU A 79 22.445 7.386 -5.142 1.00 0.00 C ATOM 1163 CG LEU A 79 20.968 7.523 -4.696 1.00 0.00 C ATOM 1164 CD1 LEU A 79 20.798 8.737 -3.801 1.00 0.00 C ATOM 1165 CD2 LEU A 79 20.026 7.664 -5.897 1.00 0.00 C ATOM 0 H LEU A 79 23.017 6.692 -2.204 1.00 0.00 H new ATOM 0 HA LEU A 79 23.753 5.801 -4.893 1.00 0.00 H new ATOM 0 HB2 LEU A 79 22.837 8.393 -5.286 1.00 0.00 H new ATOM 0 HB3 LEU A 79 22.447 6.901 -6.118 1.00 0.00 H new ATOM 0 HG LEU A 79 20.711 6.614 -4.151 1.00 0.00 H new ATOM 0 HD11 LEU A 79 19.755 8.821 -3.495 1.00 0.00 H new ATOM 0 HD12 LEU A 79 21.427 8.629 -2.918 1.00 0.00 H new ATOM 0 HD13 LEU A 79 21.089 9.635 -4.346 1.00 0.00 H new ATOM 0 HD21 LEU A 79 18.999 7.758 -5.545 1.00 0.00 H new ATOM 0 HD22 LEU A 79 20.296 8.552 -6.469 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.113 6.783 -6.533 1.00 0.00 H new ATOM 1177 N CYS A 80 25.513 6.799 -2.959 1.00 0.00 N ATOM 1178 CA CYS A 80 26.626 7.463 -2.300 1.00 0.00 C ATOM 1179 C CYS A 80 27.717 7.868 -3.287 1.00 0.00 C ATOM 1180 O CYS A 80 27.992 9.061 -3.377 1.00 0.00 O ATOM 1181 CB CYS A 80 27.128 6.570 -1.172 1.00 0.00 C ATOM 1182 SG CYS A 80 25.826 6.435 0.090 1.00 0.00 S ATOM 0 H CYS A 80 25.400 5.824 -2.682 1.00 0.00 H new ATOM 0 HA CYS A 80 26.289 8.404 -1.865 1.00 0.00 H new ATOM 0 HB2 CYS A 80 27.384 5.583 -1.557 1.00 0.00 H new ATOM 0 HB3 CYS A 80 28.035 6.987 -0.735 1.00 0.00 H new ATOM 0 HG CYS A 80 26.239 5.673 1.059 1.00 0.00 H new ATOM 1290 N GLU A 89 19.424 -0.165 9.649 1.00 0.00 N ATOM 1291 CA GLU A 89 18.211 -0.759 9.074 1.00 0.00 C ATOM 1292 C GLU A 89 17.893 -0.345 7.627 1.00 0.00 C ATOM 1293 O GLU A 89 17.167 -1.039 6.914 1.00 0.00 O ATOM 1294 CB GLU A 89 17.026 -0.410 9.988 1.00 0.00 C ATOM 1295 CG GLU A 89 16.889 1.096 10.289 1.00 0.00 C ATOM 1296 CD GLU A 89 15.656 1.419 11.150 1.00 0.00 C ATOM 1297 OE1 GLU A 89 15.562 0.929 12.300 1.00 0.00 O ATOM 1298 OE2 GLU A 89 14.793 2.201 10.693 1.00 0.00 O ATOM 0 HA GLU A 89 18.392 -1.833 9.019 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.105 -0.762 9.523 1.00 0.00 H new ATOM 0 HB3 GLU A 89 17.135 -0.950 10.929 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.786 1.443 10.802 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.826 1.646 9.350 1.00 0.00 H new ATOM 1305 N TRP A 90 18.456 0.771 7.174 1.00 0.00 N ATOM 1306 CA TRP A 90 18.440 1.243 5.795 1.00 0.00 C ATOM 1307 C TRP A 90 19.127 0.283 4.808 1.00 0.00 C ATOM 1308 O TRP A 90 19.166 0.579 3.617 1.00 0.00 O ATOM 1309 CB TRP A 90 19.061 2.646 5.742 1.00 0.00 C ATOM 1310 CG TRP A 90 18.332 3.675 6.551 1.00 0.00 C ATOM 1311 CD1 TRP A 90 18.758 4.215 7.713 1.00 0.00 C ATOM 1312 CD2 TRP A 90 17.058 4.330 6.262 1.00 0.00 C ATOM 1313 NE1 TRP A 90 17.818 5.096 8.198 1.00 0.00 N ATOM 1314 CE2 TRP A 90 16.760 5.237 7.324 1.00 0.00 C ATOM 1315 CE3 TRP A 90 16.127 4.251 5.204 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 15.610 6.041 7.320 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 14.966 5.044 5.196 1.00 0.00 C ATOM 1318 CH2 TRP A 90 14.710 5.939 6.247 1.00 0.00 C ATOM 0 H TRP A 90 18.963 1.404 7.793 1.00 0.00 H new ATOM 0 HA TRP A 90 17.401 1.284 5.469 1.00 0.00 H new ATOM 0 HB2 TRP A 90 20.091 2.588 6.093 1.00 0.00 H new ATOM 0 HB3 TRP A 90 19.096 2.976 4.704 1.00 0.00 H new ATOM 0 HD1 TRP A 90 19.699 3.989 8.192 1.00 0.00 H new ATOM 0 HE1 TRP A 90 17.894 5.583 9.091 1.00 0.00 H new ATOM 0 HE3 TRP A 90 16.310 3.569 4.386 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 15.420 6.729 8.131 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 14.267 4.964 4.377 1.00 0.00 H new ATOM 0 HH2 TRP A 90 13.820 6.550 6.230 1.00 0.00 H new ATOM 1329 N VAL A 91 19.641 -0.865 5.259 1.00 0.00 N ATOM 1330 CA VAL A 91 20.214 -1.902 4.411 1.00 0.00 C ATOM 1331 C VAL A 91 19.496 -3.253 4.586 1.00 0.00 C ATOM 1332 O VAL A 91 19.921 -4.245 3.992 1.00 0.00 O ATOM 1333 CB VAL A 91 21.750 -1.912 4.604 1.00 0.00 C ATOM 1334 CG1 VAL A 91 22.232 -2.713 5.825 1.00 0.00 C ATOM 1335 CG2 VAL A 91 22.498 -2.389 3.352 1.00 0.00 C ATOM 0 H VAL A 91 19.668 -1.100 6.251 1.00 0.00 H new ATOM 0 HA VAL A 91 20.044 -1.681 3.357 1.00 0.00 H new ATOM 0 HB VAL A 91 21.992 -0.866 4.790 1.00 0.00 H new ATOM 0 HG11 VAL A 91 23.319 -2.667 5.884 1.00 0.00 H new ATOM 0 HG12 VAL A 91 21.801 -2.289 6.732 1.00 0.00 H new ATOM 0 HG13 VAL A 91 21.918 -3.752 5.726 1.00 0.00 H new ATOM 0 HG21 VAL A 91 23.571 -2.376 3.542 1.00 0.00 H new ATOM 0 HG22 VAL A 91 22.185 -3.404 3.106 1.00 0.00 H new ATOM 0 HG23 VAL A 91 22.270 -1.726 2.517 1.00 0.00 H new ATOM 1345 N THR A 92 18.395 -3.319 5.352 1.00 0.00 N ATOM 1346 CA THR A 92 17.736 -4.576 5.716 1.00 0.00 C ATOM 1347 C THR A 92 16.233 -4.574 5.392 1.00 0.00 C ATOM 1348 O THR A 92 15.457 -5.335 5.976 1.00 0.00 O ATOM 1349 CB THR A 92 18.057 -4.922 7.187 1.00 0.00 C ATOM 1350 OG1 THR A 92 17.594 -3.913 8.061 1.00 0.00 O ATOM 1351 CG2 THR A 92 19.562 -5.067 7.448 1.00 0.00 C ATOM 0 H THR A 92 17.937 -2.493 5.737 1.00 0.00 H new ATOM 0 HA THR A 92 18.139 -5.376 5.095 1.00 0.00 H new ATOM 0 HB THR A 92 17.555 -5.872 7.371 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.417 -3.095 7.551 1.00 0.00 H new ATOM 0 HG21 THR A 92 19.727 -5.310 8.498 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.965 -5.864 6.823 1.00 0.00 H new ATOM 0 HG23 THR A 92 20.065 -4.130 7.209 1.00 0.00 H new ATOM 1359 N GLN A 93 15.817 -3.714 4.458 1.00 0.00 N ATOM 1360 CA GLN A 93 14.447 -3.683 3.943 1.00 0.00 C ATOM 1361 C GLN A 93 14.319 -4.628 2.739 1.00 0.00 C ATOM 1362 O GLN A 93 15.271 -5.330 2.385 1.00 0.00 O ATOM 1363 CB GLN A 93 14.029 -2.242 3.599 1.00 0.00 C ATOM 1364 CG GLN A 93 14.226 -1.248 4.757 1.00 0.00 C ATOM 1365 CD GLN A 93 13.627 -1.742 6.081 1.00 0.00 C ATOM 1366 OE1 GLN A 93 12.467 -2.139 6.165 1.00 0.00 O ATOM 1367 NE2 GLN A 93 14.419 -1.777 7.143 1.00 0.00 N ATOM 0 H GLN A 93 16.427 -3.014 4.035 1.00 0.00 H new ATOM 0 HA GLN A 93 13.763 -4.036 4.715 1.00 0.00 H new ATOM 0 HB2 GLN A 93 14.604 -1.902 2.738 1.00 0.00 H new ATOM 0 HB3 GLN A 93 12.980 -2.238 3.303 1.00 0.00 H new ATOM 0 HG2 GLN A 93 15.292 -1.064 4.893 1.00 0.00 H new ATOM 0 HG3 GLN A 93 13.769 -0.295 4.492 1.00 0.00 H new ATOM 0 HE21 GLN A 93 15.382 -1.447 7.072 1.00 0.00 H new ATOM 0 HE22 GLN A 93 14.066 -2.134 8.031 1.00 0.00 H new ATOM 1376 N GLU A 94 13.135 -4.669 2.121 1.00 0.00 N ATOM 1377 CA GLU A 94 12.813 -5.637 1.078 1.00 0.00 C ATOM 1378 C GLU A 94 13.679 -5.466 -0.165 1.00 0.00 C ATOM 1379 O GLU A 94 14.000 -6.463 -0.816 1.00 0.00 O ATOM 1380 CB GLU A 94 11.325 -5.572 0.704 1.00 0.00 C ATOM 1381 CG GLU A 94 10.376 -5.895 1.870 1.00 0.00 C ATOM 1382 CD GLU A 94 10.601 -7.304 2.450 1.00 0.00 C ATOM 1383 OE1 GLU A 94 10.223 -8.305 1.799 1.00 0.00 O ATOM 1384 OE2 GLU A 94 11.137 -7.428 3.575 1.00 0.00 O ATOM 0 H GLU A 94 12.372 -4.027 2.334 1.00 0.00 H new ATOM 0 HA GLU A 94 13.030 -6.622 1.492 1.00 0.00 H new ATOM 0 HB2 GLU A 94 11.098 -4.574 0.329 1.00 0.00 H new ATOM 0 HB3 GLU A 94 11.134 -6.270 -0.111 1.00 0.00 H new ATOM 0 HG2 GLU A 94 10.513 -5.156 2.659 1.00 0.00 H new ATOM 0 HG3 GLU A 94 9.345 -5.808 1.528 1.00 0.00 H new ATOM 1391 N ILE A 95 14.094 -4.236 -0.478 1.00 0.00 N ATOM 1392 CA ILE A 95 14.954 -3.948 -1.613 1.00 0.00 C ATOM 1393 C ILE A 95 16.003 -2.969 -1.093 1.00 0.00 C ATOM 1394 O ILE A 95 15.650 -1.987 -0.430 1.00 0.00 O ATOM 1395 CB ILE A 95 14.114 -3.384 -2.767 1.00 0.00 C ATOM 1396 CG1 ILE A 95 13.077 -4.440 -3.218 1.00 0.00 C ATOM 1397 CG2 ILE A 95 15.024 -2.939 -3.936 1.00 0.00 C ATOM 1398 CD1 ILE A 95 12.378 -4.116 -4.534 1.00 0.00 C ATOM 0 H ILE A 95 13.836 -3.408 0.059 1.00 0.00 H new ATOM 0 HA ILE A 95 15.447 -4.832 -2.017 1.00 0.00 H new ATOM 0 HB ILE A 95 13.575 -2.501 -2.425 1.00 0.00 H new ATOM 0 HG12 ILE A 95 13.577 -5.404 -3.314 1.00 0.00 H new ATOM 0 HG13 ILE A 95 12.324 -4.548 -2.438 1.00 0.00 H new ATOM 0 HG21 ILE A 95 14.410 -2.542 -4.744 1.00 0.00 H new ATOM 0 HG22 ILE A 95 15.711 -2.167 -3.589 1.00 0.00 H new ATOM 0 HG23 ILE A 95 15.594 -3.794 -4.299 1.00 0.00 H new ATOM 0 HD11 ILE A 95 11.669 -4.908 -4.774 1.00 0.00 H new ATOM 0 HD12 ILE A 95 11.846 -3.169 -4.440 1.00 0.00 H new ATOM 0 HD13 ILE A 95 13.119 -4.039 -5.330 1.00 0.00 H new ATOM 1410 N PHE A 96 17.271 -3.212 -1.426 1.00 0.00 N ATOM 1411 CA PHE A 96 18.350 -2.283 -1.199 1.00 0.00 C ATOM 1412 C PHE A 96 19.284 -2.341 -2.401 1.00 0.00 C ATOM 1413 O PHE A 96 19.604 -3.429 -2.887 1.00 0.00 O ATOM 1414 CB PHE A 96 19.124 -2.576 0.095 1.00 0.00 C ATOM 1415 CG PHE A 96 20.333 -1.662 0.213 1.00 0.00 C ATOM 1416 CD1 PHE A 96 20.167 -0.339 0.666 1.00 0.00 C ATOM 1417 CD2 PHE A 96 21.577 -2.069 -0.316 1.00 0.00 C ATOM 1418 CE1 PHE A 96 21.245 0.560 0.605 1.00 0.00 C ATOM 1419 CE2 PHE A 96 22.641 -1.153 -0.413 1.00 0.00 C ATOM 1420 CZ PHE A 96 22.480 0.154 0.074 1.00 0.00 C ATOM 0 H PHE A 96 17.570 -4.081 -1.869 1.00 0.00 H new ATOM 0 HA PHE A 96 17.929 -1.285 -1.080 1.00 0.00 H new ATOM 0 HB2 PHE A 96 18.470 -2.436 0.956 1.00 0.00 H new ATOM 0 HB3 PHE A 96 19.446 -3.617 0.105 1.00 0.00 H new ATOM 0 HD1 PHE A 96 19.214 -0.016 1.059 1.00 0.00 H new ATOM 0 HD2 PHE A 96 21.713 -3.088 -0.648 1.00 0.00 H new ATOM 0 HE1 PHE A 96 21.123 1.570 0.969 1.00 0.00 H new ATOM 0 HE2 PHE A 96 23.577 -1.454 -0.860 1.00 0.00 H new ATOM 0 HZ PHE A 96 23.307 0.848 0.040 1.00 0.00 H new ATOM 1430 N GLU A 97 19.742 -1.174 -2.840 1.00 0.00 N ATOM 1431 CA GLU A 97 20.812 -1.009 -3.812 1.00 0.00 C ATOM 1432 C GLU A 97 21.601 0.243 -3.436 1.00 0.00 C ATOM 1433 O GLU A 97 21.065 1.152 -2.805 1.00 0.00 O ATOM 1434 CB GLU A 97 20.269 -0.825 -5.238 1.00 0.00 C ATOM 1435 CG GLU A 97 19.839 -2.136 -5.894 1.00 0.00 C ATOM 1436 CD GLU A 97 19.472 -1.946 -7.378 1.00 0.00 C ATOM 1437 OE1 GLU A 97 18.786 -0.958 -7.726 1.00 0.00 O ATOM 1438 OE2 GLU A 97 19.864 -2.798 -8.209 1.00 0.00 O ATOM 0 H GLU A 97 19.363 -0.285 -2.515 1.00 0.00 H new ATOM 0 HA GLU A 97 21.432 -1.905 -3.797 1.00 0.00 H new ATOM 0 HB2 GLU A 97 19.418 -0.144 -5.210 1.00 0.00 H new ATOM 0 HB3 GLU A 97 21.035 -0.353 -5.853 1.00 0.00 H new ATOM 0 HG2 GLU A 97 20.645 -2.865 -5.810 1.00 0.00 H new ATOM 0 HG3 GLU A 97 18.983 -2.546 -5.358 1.00 0.00 H new ATOM 1445 N ASP A 98 22.851 0.302 -3.890 1.00 0.00 N ATOM 1446 CA ASP A 98 23.705 1.485 -3.846 1.00 0.00 C ATOM 1447 C ASP A 98 24.125 1.854 -5.268 1.00 0.00 C ATOM 1448 O ASP A 98 24.958 1.182 -5.880 1.00 0.00 O ATOM 1449 CB ASP A 98 24.931 1.338 -2.940 1.00 0.00 C ATOM 1450 CG ASP A 98 25.814 2.599 -3.052 1.00 0.00 C ATOM 1451 OD1 ASP A 98 25.287 3.726 -2.903 1.00 0.00 O ATOM 1452 OD2 ASP A 98 27.034 2.453 -3.292 1.00 0.00 O ATOM 0 H ASP A 98 23.313 -0.502 -4.314 1.00 0.00 H new ATOM 0 HA ASP A 98 23.114 2.286 -3.401 1.00 0.00 H new ATOM 0 HB2 ASP A 98 24.616 1.193 -1.907 1.00 0.00 H new ATOM 0 HB3 ASP A 98 25.503 0.455 -3.226 1.00 0.00 H new ATOM 1457 N TRP A 99 23.488 2.883 -5.819 1.00 0.00 N ATOM 1458 CA TRP A 99 23.712 3.406 -7.155 1.00 0.00 C ATOM 1459 C TRP A 99 24.972 4.276 -7.143 1.00 0.00 C ATOM 1460 O TRP A 99 24.931 5.457 -6.803 1.00 0.00 O ATOM 1461 CB TRP A 99 22.451 4.148 -7.624 1.00 0.00 C ATOM 1462 CG TRP A 99 21.162 3.378 -7.727 1.00 0.00 C ATOM 1463 CD1 TRP A 99 20.941 2.060 -7.500 1.00 0.00 C ATOM 1464 CD2 TRP A 99 19.867 3.920 -8.107 1.00 0.00 C ATOM 1465 NE1 TRP A 99 19.610 1.759 -7.721 1.00 0.00 N ATOM 1466 CE2 TRP A 99 18.884 2.884 -8.050 1.00 0.00 C ATOM 1467 CE3 TRP A 99 19.440 5.208 -8.488 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 17.524 3.133 -8.317 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 18.087 5.474 -8.739 1.00 0.00 C ATOM 1470 CH2 TRP A 99 17.140 4.442 -8.650 1.00 0.00 C ATOM 0 H TRP A 99 22.765 3.398 -5.316 1.00 0.00 H new ATOM 0 HA TRP A 99 23.888 2.607 -7.875 1.00 0.00 H new ATOM 0 HB2 TRP A 99 22.285 4.983 -6.943 1.00 0.00 H new ATOM 0 HB3 TRP A 99 22.662 4.574 -8.605 1.00 0.00 H new ATOM 0 HD1 TRP A 99 21.694 1.350 -7.192 1.00 0.00 H new ATOM 0 HE1 TRP A 99 19.214 0.822 -7.650 1.00 0.00 H new ATOM 0 HE3 TRP A 99 20.166 6.001 -8.588 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 16.795 2.338 -8.267 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.773 6.474 -9.001 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.099 4.658 -8.841 1.00 0.00 H new ATOM 1481 N GLN A 100 26.117 3.680 -7.477 1.00 0.00 N ATOM 1482 CA GLN A 100 27.383 4.392 -7.559 1.00 0.00 C ATOM 1483 C GLN A 100 27.309 5.406 -8.713 1.00 0.00 C ATOM 1484 O GLN A 100 27.321 5.017 -9.883 1.00 0.00 O ATOM 1485 CB GLN A 100 28.526 3.371 -7.710 1.00 0.00 C ATOM 1486 CG GLN A 100 29.896 4.018 -7.478 1.00 0.00 C ATOM 1487 CD GLN A 100 31.027 2.991 -7.523 1.00 0.00 C ATOM 1488 OE1 GLN A 100 31.679 2.799 -8.547 1.00 0.00 O ATOM 1489 NE2 GLN A 100 31.286 2.302 -6.421 1.00 0.00 N ATOM 0 H GLN A 100 26.188 2.687 -7.698 1.00 0.00 H new ATOM 0 HA GLN A 100 27.585 4.958 -6.650 1.00 0.00 H new ATOM 0 HB2 GLN A 100 28.383 2.556 -7.000 1.00 0.00 H new ATOM 0 HB3 GLN A 100 28.494 2.933 -8.708 1.00 0.00 H new ATOM 0 HG2 GLN A 100 30.069 4.782 -8.236 1.00 0.00 H new ATOM 0 HG3 GLN A 100 29.901 4.521 -6.511 1.00 0.00 H new ATOM 0 HE21 GLN A 100 30.740 2.468 -5.576 1.00 0.00 H new ATOM 0 HE22 GLN A 100 32.032 1.606 -6.418 1.00 0.00 H new ATOM 1498 N LEU A 101 27.213 6.699 -8.386 1.00 0.00 N ATOM 1499 CA LEU A 101 27.043 7.805 -9.324 1.00 0.00 C ATOM 1500 C LEU A 101 28.080 8.890 -9.042 1.00 0.00 C ATOM 1501 O LEU A 101 28.577 9.010 -7.921 1.00 0.00 O ATOM 1502 CB LEU A 101 25.633 8.409 -9.155 1.00 0.00 C ATOM 1503 CG LEU A 101 24.515 7.888 -10.072 1.00 0.00 C ATOM 1504 CD1 LEU A 101 24.888 7.788 -11.553 1.00 0.00 C ATOM 1505 CD2 LEU A 101 23.933 6.555 -9.632 1.00 0.00 C ATOM 0 H LEU A 101 27.254 7.013 -7.416 1.00 0.00 H new ATOM 0 HA LEU A 101 27.171 7.431 -10.340 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.322 8.248 -8.123 1.00 0.00 H new ATOM 0 HB3 LEU A 101 25.711 9.486 -9.301 1.00 0.00 H new ATOM 0 HG LEU A 101 23.758 8.665 -9.967 1.00 0.00 H new ATOM 0 HD11 LEU A 101 24.036 7.411 -12.118 1.00 0.00 H new ATOM 0 HD12 LEU A 101 25.164 8.774 -11.926 1.00 0.00 H new ATOM 0 HD13 LEU A 101 25.731 7.107 -11.671 1.00 0.00 H new ATOM 0 HD21 LEU A 101 23.150 6.252 -10.328 1.00 0.00 H new ATOM 0 HD22 LEU A 101 24.720 5.801 -9.620 1.00 0.00 H new ATOM 0 HD23 LEU A 101 23.511 6.655 -8.632 1.00 0.00 H new ATOM 1517 N GLU A 102 28.361 9.717 -10.052 1.00 0.00 N ATOM 1518 CA GLU A 102 29.373 10.764 -10.029 1.00 0.00 C ATOM 1519 C GLU A 102 28.864 12.041 -9.366 1.00 0.00 C ATOM 1520 O GLU A 102 28.784 13.088 -10.005 1.00 0.00 O ATOM 1521 CB GLU A 102 29.966 10.993 -11.435 1.00 0.00 C ATOM 1522 CG GLU A 102 30.776 9.779 -11.908 1.00 0.00 C ATOM 1523 CD GLU A 102 31.430 10.030 -13.279 1.00 0.00 C ATOM 1524 OE1 GLU A 102 32.579 10.526 -13.329 1.00 0.00 O ATOM 1525 OE2 GLU A 102 30.816 9.706 -14.321 1.00 0.00 O ATOM 0 H GLU A 102 27.866 9.669 -10.943 1.00 0.00 H new ATOM 0 HA GLU A 102 30.196 10.424 -9.400 1.00 0.00 H new ATOM 0 HB2 GLU A 102 29.161 11.193 -12.142 1.00 0.00 H new ATOM 0 HB3 GLU A 102 30.605 11.876 -11.422 1.00 0.00 H new ATOM 0 HG2 GLU A 102 31.548 9.548 -11.174 1.00 0.00 H new ATOM 0 HG3 GLU A 102 30.124 8.908 -11.970 1.00 0.00 H new ATOM 1532 N ASP A 103 28.502 11.894 -8.086 1.00 0.00 N ATOM 1533 CA ASP A 103 28.169 12.914 -7.085 1.00 0.00 C ATOM 1534 C ASP A 103 28.163 14.348 -7.650 1.00 0.00 C ATOM 1535 O ASP A 103 29.202 15.016 -7.605 1.00 0.00 O ATOM 1536 CB ASP A 103 29.097 12.705 -5.875 1.00 0.00 C ATOM 1537 CG ASP A 103 28.798 13.575 -4.640 1.00 0.00 C ATOM 1538 OD1 ASP A 103 28.185 14.657 -4.753 1.00 0.00 O ATOM 1539 OD2 ASP A 103 29.045 13.082 -3.511 1.00 0.00 O ATOM 0 H ASP A 103 28.427 10.959 -7.684 1.00 0.00 H new ATOM 0 HA ASP A 103 27.137 12.790 -6.757 1.00 0.00 H new ATOM 0 HB2 ASP A 103 29.045 11.657 -5.579 1.00 0.00 H new ATOM 0 HB3 ASP A 103 30.123 12.897 -6.191 1.00 0.00 H new ATOM 1544 N PRO A 104 27.046 14.788 -8.282 1.00 0.00 N ATOM 1545 CA PRO A 104 26.998 16.033 -9.049 1.00 0.00 C ATOM 1546 C PRO A 104 27.309 17.335 -8.304 1.00 0.00 C ATOM 1547 O PRO A 104 27.385 18.380 -8.946 1.00 0.00 O ATOM 1548 CB PRO A 104 25.622 16.096 -9.701 1.00 0.00 C ATOM 1549 CG PRO A 104 25.290 14.627 -9.883 1.00 0.00 C ATOM 1550 CD PRO A 104 25.886 13.972 -8.643 1.00 0.00 C ATOM 0 HA PRO A 104 27.818 15.983 -9.765 1.00 0.00 H new ATOM 0 HB2 PRO A 104 24.894 16.603 -9.068 1.00 0.00 H new ATOM 0 HB3 PRO A 104 25.645 16.630 -10.651 1.00 0.00 H new ATOM 0 HG2 PRO A 104 24.214 14.463 -9.946 1.00 0.00 H new ATOM 0 HG3 PRO A 104 25.727 14.227 -10.798 1.00 0.00 H new ATOM 0 HD2 PRO A 104 25.161 13.941 -7.830 1.00 0.00 H new ATOM 0 HD3 PRO A 104 26.180 12.942 -8.847 1.00 0.00 H new ATOM 1558 N ASP A 105 27.491 17.314 -6.988 1.00 0.00 N ATOM 1559 CA ASP A 105 27.751 18.491 -6.166 1.00 0.00 C ATOM 1560 C ASP A 105 29.042 19.214 -6.592 1.00 0.00 C ATOM 1561 O ASP A 105 30.145 18.885 -6.147 1.00 0.00 O ATOM 1562 CB ASP A 105 27.764 18.081 -4.690 1.00 0.00 C ATOM 1563 CG ASP A 105 27.654 19.282 -3.746 1.00 0.00 C ATOM 1564 OD1 ASP A 105 28.544 20.159 -3.720 1.00 0.00 O ATOM 1565 OD2 ASP A 105 26.695 19.270 -2.937 1.00 0.00 O ATOM 0 H ASP A 105 27.461 16.450 -6.447 1.00 0.00 H new ATOM 0 HA ASP A 105 26.950 19.215 -6.314 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.938 17.396 -4.499 1.00 0.00 H new ATOM 0 HB3 ASP A 105 28.684 17.538 -4.475 1.00 0.00 H new ATOM 1570 N GLY A 106 28.900 20.175 -7.509 1.00 0.00 N ATOM 1571 CA GLY A 106 29.940 21.088 -7.971 1.00 0.00 C ATOM 1572 C GLY A 106 30.528 20.701 -9.332 1.00 0.00 C ATOM 1573 O GLY A 106 31.610 21.185 -9.672 1.00 0.00 O ATOM 0 H GLY A 106 28.007 20.343 -7.972 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.527 22.095 -8.035 1.00 0.00 H new ATOM 0 HA3 GLY A 106 30.741 21.118 -7.233 1.00 0.00 H new ATOM 1577 N GLN A 107 29.876 19.813 -10.092 1.00 0.00 N ATOM 1578 CA GLN A 107 30.461 19.219 -11.295 1.00 0.00 C ATOM 1579 C GLN A 107 30.130 20.006 -12.570 1.00 0.00 C ATOM 1580 O GLN A 107 29.418 21.014 -12.547 1.00 0.00 O ATOM 1581 CB GLN A 107 30.000 17.762 -11.441 1.00 0.00 C ATOM 1582 CG GLN A 107 30.165 16.902 -10.187 1.00 0.00 C ATOM 1583 CD GLN A 107 31.596 16.569 -9.763 1.00 0.00 C ATOM 1584 OE1 GLN A 107 32.585 17.022 -10.336 1.00 0.00 O ATOM 1585 NE2 GLN A 107 31.723 15.734 -8.746 1.00 0.00 N ATOM 0 H GLN A 107 28.931 19.488 -9.889 1.00 0.00 H new ATOM 0 HA GLN A 107 31.543 19.255 -11.172 1.00 0.00 H new ATOM 0 HB2 GLN A 107 28.949 17.757 -11.731 1.00 0.00 H new ATOM 0 HB3 GLN A 107 30.558 17.300 -12.256 1.00 0.00 H new ATOM 0 HG2 GLN A 107 29.675 17.413 -9.358 1.00 0.00 H new ATOM 0 HG3 GLN A 107 29.631 15.965 -10.345 1.00 0.00 H new ATOM 0 HE21 GLN A 107 30.893 15.367 -8.281 1.00 0.00 H new ATOM 0 HE22 GLN A 107 32.651 15.457 -8.426 1.00 0.00 H new ATOM 1594 N SER A 108 30.657 19.516 -13.692 1.00 0.00 N ATOM 1595 CA SER A 108 30.408 20.020 -15.035 1.00 0.00 C ATOM 1596 C SER A 108 29.019 19.581 -15.510 1.00 0.00 C ATOM 1597 O SER A 108 28.518 18.541 -15.074 1.00 0.00 O ATOM 1598 CB SER A 108 31.485 19.428 -15.953 1.00 0.00 C ATOM 1599 OG SER A 108 32.785 19.761 -15.486 1.00 0.00 O ATOM 0 H SER A 108 31.297 18.722 -13.685 1.00 0.00 H new ATOM 0 HA SER A 108 30.444 21.109 -15.050 1.00 0.00 H new ATOM 0 HB2 SER A 108 31.376 18.344 -15.997 1.00 0.00 H new ATOM 0 HB3 SER A 108 31.351 19.803 -16.968 1.00 0.00 H new ATOM 0 HG SER A 108 33.457 19.373 -16.084 1.00 0.00 H new ATOM 1605 N LEU A 109 28.417 20.316 -16.453 1.00 0.00 N ATOM 1606 CA LEU A 109 27.085 19.995 -16.976 1.00 0.00 C ATOM 1607 C LEU A 109 27.045 18.603 -17.587 1.00 0.00 C ATOM 1608 O LEU A 109 26.022 17.935 -17.505 1.00 0.00 O ATOM 1609 CB LEU A 109 26.628 20.996 -18.048 1.00 0.00 C ATOM 1610 CG LEU A 109 26.408 22.425 -17.522 1.00 0.00 C ATOM 1611 CD1 LEU A 109 26.060 23.353 -18.691 1.00 0.00 C ATOM 1612 CD2 LEU A 109 25.295 22.503 -16.467 1.00 0.00 C ATOM 0 H LEU A 109 28.837 21.145 -16.873 1.00 0.00 H new ATOM 0 HA LEU A 109 26.412 20.047 -16.120 1.00 0.00 H new ATOM 0 HB2 LEU A 109 27.372 21.024 -18.844 1.00 0.00 H new ATOM 0 HB3 LEU A 109 25.700 20.637 -18.492 1.00 0.00 H new ATOM 0 HG LEU A 109 27.336 22.738 -17.043 1.00 0.00 H new ATOM 0 HD11 LEU A 109 25.904 24.365 -18.318 1.00 0.00 H new ATOM 0 HD12 LEU A 109 26.878 23.354 -19.411 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.150 23.001 -19.176 1.00 0.00 H new ATOM 0 HD21 LEU A 109 25.183 23.534 -16.131 1.00 0.00 H new ATOM 0 HD22 LEU A 109 24.357 22.159 -16.902 1.00 0.00 H new ATOM 0 HD23 LEU A 109 25.554 21.871 -15.618 1.00 0.00 H new ATOM 1624 N GLU A 110 28.145 18.158 -18.191 1.00 0.00 N ATOM 1625 CA GLU A 110 28.235 16.827 -18.775 1.00 0.00 C ATOM 1626 C GLU A 110 28.113 15.747 -17.690 1.00 0.00 C ATOM 1627 O GLU A 110 27.427 14.745 -17.897 1.00 0.00 O ATOM 1628 CB GLU A 110 29.550 16.733 -19.559 1.00 0.00 C ATOM 1629 CG GLU A 110 29.678 15.417 -20.339 1.00 0.00 C ATOM 1630 CD GLU A 110 30.956 15.391 -21.195 1.00 0.00 C ATOM 1631 OE1 GLU A 110 32.023 14.965 -20.696 1.00 0.00 O ATOM 1632 OE2 GLU A 110 30.907 15.780 -22.385 1.00 0.00 O ATOM 0 H GLU A 110 28.996 18.711 -18.288 1.00 0.00 H new ATOM 0 HA GLU A 110 27.408 16.654 -19.464 1.00 0.00 H new ATOM 0 HB2 GLU A 110 29.616 17.571 -20.253 1.00 0.00 H new ATOM 0 HB3 GLU A 110 30.388 16.825 -18.868 1.00 0.00 H new ATOM 0 HG2 GLU A 110 29.689 14.579 -19.642 1.00 0.00 H new ATOM 0 HG3 GLU A 110 28.806 15.287 -20.980 1.00 0.00 H new ATOM 1639 N VAL A 111 28.714 15.961 -16.513 1.00 0.00 N ATOM 1640 CA VAL A 111 28.581 15.041 -15.386 1.00 0.00 C ATOM 1641 C VAL A 111 27.129 15.063 -14.921 1.00 0.00 C ATOM 1642 O VAL A 111 26.522 14.004 -14.775 1.00 0.00 O ATOM 1643 CB VAL A 111 29.545 15.414 -14.246 1.00 0.00 C ATOM 1644 CG1 VAL A 111 29.362 14.513 -13.014 1.00 0.00 C ATOM 1645 CG2 VAL A 111 31.009 15.335 -14.709 1.00 0.00 C ATOM 0 H VAL A 111 29.301 16.772 -16.320 1.00 0.00 H new ATOM 0 HA VAL A 111 28.848 14.032 -15.698 1.00 0.00 H new ATOM 0 HB VAL A 111 29.304 16.439 -13.966 1.00 0.00 H new ATOM 0 HG11 VAL A 111 30.063 14.814 -12.236 1.00 0.00 H new ATOM 0 HG12 VAL A 111 28.342 14.610 -12.641 1.00 0.00 H new ATOM 0 HG13 VAL A 111 29.550 13.476 -13.291 1.00 0.00 H new ATOM 0 HG21 VAL A 111 31.667 15.604 -13.883 1.00 0.00 H new ATOM 0 HG22 VAL A 111 31.233 14.320 -15.036 1.00 0.00 H new ATOM 0 HG23 VAL A 111 31.166 16.026 -15.537 1.00 0.00 H new ATOM 1655 N PHE A 112 26.555 16.257 -14.749 1.00 0.00 N ATOM 1656 CA PHE A 112 25.166 16.418 -14.351 1.00 0.00 C ATOM 1657 C PHE A 112 24.234 15.669 -15.300 1.00 0.00 C ATOM 1658 O PHE A 112 23.417 14.880 -14.838 1.00 0.00 O ATOM 1659 CB PHE A 112 24.803 17.904 -14.312 1.00 0.00 C ATOM 1660 CG PHE A 112 24.984 18.560 -12.967 1.00 0.00 C ATOM 1661 CD1 PHE A 112 23.989 18.420 -11.979 1.00 0.00 C ATOM 1662 CD2 PHE A 112 26.137 19.320 -12.708 1.00 0.00 C ATOM 1663 CE1 PHE A 112 24.159 19.027 -10.725 1.00 0.00 C ATOM 1664 CE2 PHE A 112 26.312 19.913 -11.452 1.00 0.00 C ATOM 1665 CZ PHE A 112 25.335 19.745 -10.462 1.00 0.00 C ATOM 0 H PHE A 112 27.049 17.139 -14.884 1.00 0.00 H new ATOM 0 HA PHE A 112 25.043 15.994 -13.354 1.00 0.00 H new ATOM 0 HB2 PHE A 112 25.413 18.433 -15.044 1.00 0.00 H new ATOM 0 HB3 PHE A 112 23.764 18.019 -14.620 1.00 0.00 H new ATOM 0 HD1 PHE A 112 23.097 17.847 -12.186 1.00 0.00 H new ATOM 0 HD2 PHE A 112 26.886 19.446 -13.476 1.00 0.00 H new ATOM 0 HE1 PHE A 112 23.392 18.942 -9.970 1.00 0.00 H new ATOM 0 HE2 PHE A 112 27.197 20.498 -11.247 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.489 20.174 -9.483 1.00 0.00 H new ATOM 1675 N ARG A 113 24.355 15.876 -16.613 1.00 0.00 N ATOM 1676 CA ARG A 113 23.537 15.202 -17.618 1.00 0.00 C ATOM 1677 C ARG A 113 23.715 13.694 -17.560 1.00 0.00 C ATOM 1678 O ARG A 113 22.709 12.985 -17.624 1.00 0.00 O ATOM 1679 CB ARG A 113 23.870 15.753 -19.020 1.00 0.00 C ATOM 1680 CG ARG A 113 23.007 16.980 -19.354 1.00 0.00 C ATOM 1681 CD ARG A 113 23.744 18.071 -20.125 1.00 0.00 C ATOM 1682 NE ARG A 113 22.820 19.155 -20.496 1.00 0.00 N ATOM 1683 CZ ARG A 113 23.162 20.297 -21.102 1.00 0.00 C ATOM 1684 NH1 ARG A 113 24.433 20.560 -21.405 1.00 0.00 N ATOM 1685 NH2 ARG A 113 22.216 21.174 -21.403 1.00 0.00 N ATOM 0 H ARG A 113 25.033 16.525 -17.011 1.00 0.00 H new ATOM 0 HA ARG A 113 22.488 15.406 -17.404 1.00 0.00 H new ATOM 0 HB2 ARG A 113 24.925 16.024 -19.066 1.00 0.00 H new ATOM 0 HB3 ARG A 113 23.707 14.976 -19.767 1.00 0.00 H new ATOM 0 HG2 ARG A 113 22.146 16.656 -19.938 1.00 0.00 H new ATOM 0 HG3 ARG A 113 22.622 17.403 -18.426 1.00 0.00 H new ATOM 0 HD2 ARG A 113 24.556 18.470 -19.516 1.00 0.00 H new ATOM 0 HD3 ARG A 113 24.196 17.648 -21.022 1.00 0.00 H new ATOM 0 HE ARG A 113 21.834 19.024 -20.272 1.00 0.00 H new ATOM 0 HH11 ARG A 113 25.162 19.885 -21.175 1.00 0.00 H new ATOM 0 HH12 ARG A 113 24.676 21.436 -21.867 1.00 0.00 H new ATOM 0 HH21 ARG A 113 21.243 20.974 -21.172 1.00 0.00 H new ATOM 0 HH22 ARG A 113 22.461 22.050 -21.865 1.00 0.00 H new ATOM 1699 N THR A 114 24.946 13.200 -17.408 1.00 0.00 N ATOM 1700 CA THR A 114 25.200 11.781 -17.331 1.00 0.00 C ATOM 1701 C THR A 114 24.486 11.220 -16.101 1.00 0.00 C ATOM 1702 O THR A 114 23.652 10.327 -16.233 1.00 0.00 O ATOM 1703 CB THR A 114 26.721 11.558 -17.309 1.00 0.00 C ATOM 1704 OG1 THR A 114 27.328 12.131 -18.452 1.00 0.00 O ATOM 1705 CG2 THR A 114 27.051 10.074 -17.294 1.00 0.00 C ATOM 0 H THR A 114 25.783 13.779 -17.336 1.00 0.00 H new ATOM 0 HA THR A 114 24.808 11.248 -18.197 1.00 0.00 H new ATOM 0 HB THR A 114 27.103 12.032 -16.405 1.00 0.00 H new ATOM 0 HG1 THR A 114 27.359 13.105 -18.352 1.00 0.00 H new ATOM 0 HG21 THR A 114 28.133 9.942 -17.279 1.00 0.00 H new ATOM 0 HG22 THR A 114 26.617 9.614 -16.407 1.00 0.00 H new ATOM 0 HG23 THR A 114 26.640 9.601 -18.186 1.00 0.00 H new ATOM 1713 N VAL A 115 24.746 11.772 -14.913 1.00 0.00 N ATOM 1714 CA VAL A 115 24.153 11.284 -13.679 1.00 0.00 C ATOM 1715 C VAL A 115 22.632 11.402 -13.739 1.00 0.00 C ATOM 1716 O VAL A 115 21.950 10.449 -13.379 1.00 0.00 O ATOM 1717 CB VAL A 115 24.777 11.998 -12.471 1.00 0.00 C ATOM 1718 CG1 VAL A 115 24.078 11.612 -11.159 1.00 0.00 C ATOM 1719 CG2 VAL A 115 26.278 11.681 -12.351 1.00 0.00 C ATOM 0 H VAL A 115 25.372 12.567 -14.786 1.00 0.00 H new ATOM 0 HA VAL A 115 24.373 10.223 -13.556 1.00 0.00 H new ATOM 0 HB VAL A 115 24.645 13.067 -12.640 1.00 0.00 H new ATOM 0 HG11 VAL A 115 24.548 12.138 -10.328 1.00 0.00 H new ATOM 0 HG12 VAL A 115 23.025 11.887 -11.213 1.00 0.00 H new ATOM 0 HG13 VAL A 115 24.164 10.537 -11.003 1.00 0.00 H new ATOM 0 HG21 VAL A 115 26.692 12.201 -11.487 1.00 0.00 H new ATOM 0 HG22 VAL A 115 26.414 10.607 -12.228 1.00 0.00 H new ATOM 0 HG23 VAL A 115 26.793 12.011 -13.253 1.00 0.00 H new ATOM 1729 N ARG A 116 22.080 12.511 -14.236 1.00 0.00 N ATOM 1730 CA ARG A 116 20.641 12.726 -14.290 1.00 0.00 C ATOM 1731 C ARG A 116 19.974 11.642 -15.126 1.00 0.00 C ATOM 1732 O ARG A 116 18.977 11.070 -14.690 1.00 0.00 O ATOM 1733 CB ARG A 116 20.385 14.154 -14.804 1.00 0.00 C ATOM 1734 CG ARG A 116 18.900 14.547 -14.840 1.00 0.00 C ATOM 1735 CD ARG A 116 18.082 14.364 -16.137 1.00 0.00 C ATOM 1736 NE ARG A 116 18.895 14.202 -17.359 1.00 0.00 N ATOM 1737 CZ ARG A 116 19.380 15.182 -18.132 1.00 0.00 C ATOM 1738 NH1 ARG A 116 19.075 16.451 -17.895 1.00 0.00 N ATOM 1739 NH2 ARG A 116 20.186 14.890 -19.145 1.00 0.00 N ATOM 0 H ARG A 116 22.625 13.286 -14.613 1.00 0.00 H new ATOM 0 HA ARG A 116 20.192 12.646 -13.300 1.00 0.00 H new ATOM 0 HB2 ARG A 116 20.922 14.859 -14.170 1.00 0.00 H new ATOM 0 HB3 ARG A 116 20.800 14.248 -15.808 1.00 0.00 H new ATOM 0 HG2 ARG A 116 18.396 13.981 -14.057 1.00 0.00 H new ATOM 0 HG3 ARG A 116 18.837 15.599 -14.563 1.00 0.00 H new ATOM 0 HD2 ARG A 116 17.439 13.491 -16.026 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.428 15.227 -16.263 1.00 0.00 H new ATOM 0 HE ARG A 116 19.109 13.246 -17.643 1.00 0.00 H new ATOM 0 HH11 ARG A 116 18.463 16.691 -17.115 1.00 0.00 H new ATOM 0 HH12 ARG A 116 19.452 17.186 -18.493 1.00 0.00 H new ATOM 0 HH21 ARG A 116 20.436 13.919 -19.335 1.00 0.00 H new ATOM 0 HH22 ARG A 116 20.556 15.636 -19.734 1.00 0.00 H new ATOM 1753 N GLY A 117 20.542 11.321 -16.290 1.00 0.00 N ATOM 1754 CA GLY A 117 20.030 10.248 -17.131 1.00 0.00 C ATOM 1755 C GLY A 117 20.154 8.893 -16.438 1.00 0.00 C ATOM 1756 O GLY A 117 19.186 8.136 -16.402 1.00 0.00 O ATOM 0 H GLY A 117 21.362 11.795 -16.670 1.00 0.00 H new ATOM 0 HA2 GLY A 117 18.985 10.440 -17.374 1.00 0.00 H new ATOM 0 HA3 GLY A 117 20.578 10.229 -18.073 1.00 0.00 H new ATOM 1760 N GLN A 118 21.315 8.597 -15.849 1.00 0.00 N ATOM 1761 CA GLN A 118 21.608 7.312 -15.224 1.00 0.00 C ATOM 1762 C GLN A 118 20.687 7.057 -14.020 1.00 0.00 C ATOM 1763 O GLN A 118 20.113 5.973 -13.901 1.00 0.00 O ATOM 1764 CB GLN A 118 23.099 7.285 -14.832 1.00 0.00 C ATOM 1765 CG GLN A 118 24.076 7.264 -16.027 1.00 0.00 C ATOM 1766 CD GLN A 118 24.322 5.893 -16.658 1.00 0.00 C ATOM 1767 OE1 GLN A 118 23.519 4.969 -16.554 1.00 0.00 O ATOM 1768 NE2 GLN A 118 25.450 5.728 -17.328 1.00 0.00 N ATOM 0 H GLN A 118 22.090 9.258 -15.794 1.00 0.00 H new ATOM 0 HA GLN A 118 21.415 6.504 -15.930 1.00 0.00 H new ATOM 0 HB2 GLN A 118 23.316 8.159 -14.217 1.00 0.00 H new ATOM 0 HB3 GLN A 118 23.283 6.407 -14.213 1.00 0.00 H new ATOM 0 HG2 GLN A 118 23.694 7.935 -16.797 1.00 0.00 H new ATOM 0 HG3 GLN A 118 25.033 7.669 -15.698 1.00 0.00 H new ATOM 0 HE21 GLN A 118 26.112 6.500 -17.410 1.00 0.00 H new ATOM 0 HE22 GLN A 118 25.658 4.829 -17.763 1.00 0.00 H new ATOM 1777 N VAL A 119 20.522 8.053 -13.151 1.00 0.00 N ATOM 1778 CA VAL A 119 19.561 8.071 -12.045 1.00 0.00 C ATOM 1779 C VAL A 119 18.144 7.855 -12.573 1.00 0.00 C ATOM 1780 O VAL A 119 17.453 6.972 -12.068 1.00 0.00 O ATOM 1781 CB VAL A 119 19.674 9.393 -11.240 1.00 0.00 C ATOM 1782 CG1 VAL A 119 18.568 9.558 -10.185 1.00 0.00 C ATOM 1783 CG2 VAL A 119 21.013 9.447 -10.485 1.00 0.00 C ATOM 0 H VAL A 119 21.078 8.907 -13.199 1.00 0.00 H new ATOM 0 HA VAL A 119 19.794 7.253 -11.363 1.00 0.00 H new ATOM 0 HB VAL A 119 19.586 10.189 -11.979 1.00 0.00 H new ATOM 0 HG11 VAL A 119 18.706 10.502 -9.658 1.00 0.00 H new ATOM 0 HG12 VAL A 119 17.594 9.554 -10.675 1.00 0.00 H new ATOM 0 HG13 VAL A 119 18.619 8.735 -9.473 1.00 0.00 H new ATOM 0 HG21 VAL A 119 21.078 10.380 -9.925 1.00 0.00 H new ATOM 0 HG22 VAL A 119 21.076 8.605 -9.796 1.00 0.00 H new ATOM 0 HG23 VAL A 119 21.835 9.394 -11.198 1.00 0.00 H new ATOM 1793 N LYS A 120 17.698 8.623 -13.576 1.00 0.00 N ATOM 1794 CA LYS A 120 16.327 8.522 -14.080 1.00 0.00 C ATOM 1795 C LYS A 120 16.044 7.108 -14.565 1.00 0.00 C ATOM 1796 O LYS A 120 15.013 6.534 -14.221 1.00 0.00 O ATOM 1797 CB LYS A 120 16.097 9.566 -15.186 1.00 0.00 C ATOM 1798 CG LYS A 120 14.727 9.417 -15.867 1.00 0.00 C ATOM 1799 CD LYS A 120 14.514 10.520 -16.914 1.00 0.00 C ATOM 1800 CE LYS A 120 13.183 10.364 -17.668 1.00 0.00 C ATOM 1801 NZ LYS A 120 13.170 9.205 -18.598 1.00 0.00 N ATOM 0 H LYS A 120 18.269 9.321 -14.053 1.00 0.00 H new ATOM 0 HA LYS A 120 15.627 8.734 -13.272 1.00 0.00 H new ATOM 0 HB2 LYS A 120 16.179 10.566 -14.759 1.00 0.00 H new ATOM 0 HB3 LYS A 120 16.883 9.474 -15.936 1.00 0.00 H new ATOM 0 HG2 LYS A 120 14.657 8.439 -16.343 1.00 0.00 H new ATOM 0 HG3 LYS A 120 13.937 9.463 -15.118 1.00 0.00 H new ATOM 0 HD2 LYS A 120 14.538 11.493 -16.423 1.00 0.00 H new ATOM 0 HD3 LYS A 120 15.337 10.503 -17.628 1.00 0.00 H new ATOM 0 HE2 LYS A 120 12.375 10.251 -16.946 1.00 0.00 H new ATOM 0 HE3 LYS A 120 12.983 11.276 -18.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 12.357 9.286 -19.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 14.050 9.194 -19.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 13.093 8.323 -18.052 1.00 0.00 H new ATOM 1815 N GLU A 121 16.977 6.536 -15.321 1.00 0.00 N ATOM 1816 CA GLU A 121 16.901 5.176 -15.804 1.00 0.00 C ATOM 1817 C GLU A 121 16.720 4.231 -14.620 1.00 0.00 C ATOM 1818 O GLU A 121 15.870 3.351 -14.670 1.00 0.00 O ATOM 1819 CB GLU A 121 18.189 4.901 -16.609 1.00 0.00 C ATOM 1820 CG GLU A 121 18.856 3.534 -16.427 1.00 0.00 C ATOM 1821 CD GLU A 121 18.022 2.326 -16.895 1.00 0.00 C ATOM 1822 OE1 GLU A 121 17.382 2.391 -17.970 1.00 0.00 O ATOM 1823 OE2 GLU A 121 18.052 1.281 -16.206 1.00 0.00 O ATOM 0 H GLU A 121 17.823 7.023 -15.617 1.00 0.00 H new ATOM 0 HA GLU A 121 16.045 5.016 -16.460 1.00 0.00 H new ATOM 0 HB2 GLU A 121 17.958 5.025 -17.667 1.00 0.00 H new ATOM 0 HB3 GLU A 121 18.918 5.669 -16.350 1.00 0.00 H new ATOM 0 HG2 GLU A 121 19.801 3.534 -16.970 1.00 0.00 H new ATOM 0 HG3 GLU A 121 19.095 3.402 -15.372 1.00 0.00 H new ATOM 1830 N ARG A 122 17.496 4.409 -13.549 1.00 0.00 N ATOM 1831 CA ARG A 122 17.473 3.492 -12.420 1.00 0.00 C ATOM 1832 C ARG A 122 16.165 3.622 -11.643 1.00 0.00 C ATOM 1833 O ARG A 122 15.621 2.596 -11.254 1.00 0.00 O ATOM 1834 CB ARG A 122 18.714 3.704 -11.553 1.00 0.00 C ATOM 1835 CG ARG A 122 19.980 3.142 -12.203 1.00 0.00 C ATOM 1836 CD ARG A 122 21.233 3.795 -11.606 1.00 0.00 C ATOM 1837 NE ARG A 122 22.474 3.222 -12.160 1.00 0.00 N ATOM 1838 CZ ARG A 122 22.919 3.356 -13.417 1.00 0.00 C ATOM 1839 NH1 ARG A 122 22.207 4.020 -14.323 1.00 0.00 N ATOM 1840 NH2 ARG A 122 24.084 2.826 -13.772 1.00 0.00 N ATOM 0 H ARG A 122 18.149 5.185 -13.445 1.00 0.00 H new ATOM 0 HA ARG A 122 17.508 2.464 -12.781 1.00 0.00 H new ATOM 0 HB2 ARG A 122 18.846 4.770 -11.367 1.00 0.00 H new ATOM 0 HB3 ARG A 122 18.563 3.227 -10.584 1.00 0.00 H new ATOM 0 HG2 ARG A 122 20.022 2.063 -12.056 1.00 0.00 H new ATOM 0 HG3 ARG A 122 19.951 3.316 -13.279 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.211 4.867 -11.801 1.00 0.00 H new ATOM 0 HD3 ARG A 122 21.227 3.668 -10.523 1.00 0.00 H new ATOM 0 HE ARG A 122 23.050 2.670 -11.524 1.00 0.00 H new ATOM 0 HH11 ARG A 122 21.311 4.434 -14.064 1.00 0.00 H new ATOM 0 HH12 ARG A 122 22.556 4.115 -15.277 1.00 0.00 H new ATOM 0 HH21 ARG A 122 24.642 2.316 -13.087 1.00 0.00 H new ATOM 0 HH22 ARG A 122 24.421 2.929 -14.729 1.00 0.00 H new ATOM 1854 N VAL A 123 15.611 4.822 -11.449 1.00 0.00 N ATOM 1855 CA VAL A 123 14.269 5.007 -10.921 1.00 0.00 C ATOM 1856 C VAL A 123 13.265 4.222 -11.779 1.00 0.00 C ATOM 1857 O VAL A 123 12.470 3.470 -11.218 1.00 0.00 O ATOM 1858 CB VAL A 123 13.949 6.511 -10.854 1.00 0.00 C ATOM 1859 CG1 VAL A 123 12.515 6.752 -10.389 1.00 0.00 C ATOM 1860 CG2 VAL A 123 14.866 7.264 -9.878 1.00 0.00 C ATOM 0 H VAL A 123 16.092 5.697 -11.658 1.00 0.00 H new ATOM 0 HA VAL A 123 14.198 4.615 -9.906 1.00 0.00 H new ATOM 0 HB VAL A 123 14.101 6.883 -11.867 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.320 7.824 -10.352 1.00 0.00 H new ATOM 0 HG12 VAL A 123 11.822 6.281 -11.086 1.00 0.00 H new ATOM 0 HG13 VAL A 123 12.378 6.324 -9.396 1.00 0.00 H new ATOM 0 HG21 VAL A 123 14.598 8.321 -9.869 1.00 0.00 H new ATOM 0 HG22 VAL A 123 14.748 6.851 -8.876 1.00 0.00 H new ATOM 0 HG23 VAL A 123 15.903 7.155 -10.196 1.00 0.00 H new ATOM 1870 N GLU A 124 13.302 4.337 -13.114 1.00 0.00 N ATOM 1871 CA GLU A 124 12.397 3.583 -13.983 1.00 0.00 C ATOM 1872 C GLU A 124 12.599 2.076 -13.804 1.00 0.00 C ATOM 1873 O GLU A 124 11.634 1.316 -13.747 1.00 0.00 O ATOM 1874 CB GLU A 124 12.576 3.958 -15.468 1.00 0.00 C ATOM 1875 CG GLU A 124 12.127 5.385 -15.798 1.00 0.00 C ATOM 1876 CD GLU A 124 12.257 5.713 -17.295 1.00 0.00 C ATOM 1877 OE1 GLU A 124 11.548 5.099 -18.126 1.00 0.00 O ATOM 1878 OE2 GLU A 124 13.041 6.622 -17.648 1.00 0.00 O ATOM 0 H GLU A 124 13.951 4.946 -13.613 1.00 0.00 H new ATOM 0 HA GLU A 124 11.382 3.848 -13.687 1.00 0.00 H new ATOM 0 HB2 GLU A 124 13.626 3.844 -15.739 1.00 0.00 H new ATOM 0 HB3 GLU A 124 12.011 3.257 -16.082 1.00 0.00 H new ATOM 0 HG2 GLU A 124 11.090 5.516 -15.489 1.00 0.00 H new ATOM 0 HG3 GLU A 124 12.723 6.092 -15.221 1.00 0.00 H new ATOM 1885 N ASN A 125 13.854 1.653 -13.675 1.00 0.00 N ATOM 1886 CA ASN A 125 14.258 0.269 -13.482 1.00 0.00 C ATOM 1887 C ASN A 125 13.663 -0.271 -12.184 1.00 0.00 C ATOM 1888 O ASN A 125 13.076 -1.350 -12.168 1.00 0.00 O ATOM 1889 CB ASN A 125 15.799 0.207 -13.473 1.00 0.00 C ATOM 1890 CG ASN A 125 16.383 -1.119 -13.929 1.00 0.00 C ATOM 1891 OD1 ASN A 125 16.029 -2.186 -13.433 1.00 0.00 O ATOM 1892 ND2 ASN A 125 17.315 -1.066 -14.868 1.00 0.00 N ATOM 0 H ASN A 125 14.647 2.294 -13.704 1.00 0.00 H new ATOM 0 HA ASN A 125 13.886 -0.356 -14.294 1.00 0.00 H new ATOM 0 HB2 ASN A 125 16.185 0.999 -14.115 1.00 0.00 H new ATOM 0 HB3 ASN A 125 16.152 0.416 -12.463 1.00 0.00 H new ATOM 0 HD21 ASN A 125 17.758 -1.924 -15.196 1.00 0.00 H new ATOM 0 HD22 ASN A 125 17.590 -0.167 -15.263 1.00 0.00 H new ATOM 1899 N LEU A 126 13.769 0.505 -11.102 1.00 0.00 N ATOM 1900 CA LEU A 126 13.243 0.151 -9.791 1.00 0.00 C ATOM 1901 C LEU A 126 11.719 0.078 -9.840 1.00 0.00 C ATOM 1902 O LEU A 126 11.164 -0.932 -9.430 1.00 0.00 O ATOM 1903 CB LEU A 126 13.869 1.006 -8.663 1.00 0.00 C ATOM 1904 CG LEU A 126 12.950 2.047 -8.008 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.036 1.430 -6.942 1.00 0.00 C ATOM 1906 CD2 LEU A 126 13.753 3.140 -7.315 1.00 0.00 C ATOM 0 H LEU A 126 14.233 1.413 -11.118 1.00 0.00 H new ATOM 0 HA LEU A 126 13.556 -0.856 -9.517 1.00 0.00 H new ATOM 0 HB2 LEU A 126 14.233 0.334 -7.886 1.00 0.00 H new ATOM 0 HB3 LEU A 126 14.738 1.524 -9.069 1.00 0.00 H new ATOM 0 HG LEU A 126 12.353 2.456 -8.823 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.406 2.207 -6.509 1.00 0.00 H new ATOM 0 HD12 LEU A 126 11.407 0.666 -7.400 1.00 0.00 H new ATOM 0 HD13 LEU A 126 12.644 0.978 -6.159 1.00 0.00 H new ATOM 0 HD21 LEU A 126 13.072 3.860 -6.862 1.00 0.00 H new ATOM 0 HD22 LEU A 126 14.379 2.696 -6.541 1.00 0.00 H new ATOM 0 HD23 LEU A 126 14.384 3.647 -8.045 1.00 0.00 H new ATOM 1918 N ILE A 127 11.048 1.082 -10.403 1.00 0.00 N ATOM 1919 CA ILE A 127 9.606 1.102 -10.615 1.00 0.00 C ATOM 1920 C ILE A 127 9.161 -0.126 -11.416 1.00 0.00 C ATOM 1921 O ILE A 127 8.106 -0.683 -11.113 1.00 0.00 O ATOM 1922 CB ILE A 127 9.245 2.433 -11.316 1.00 0.00 C ATOM 1923 CG1 ILE A 127 9.272 3.611 -10.315 1.00 0.00 C ATOM 1924 CG2 ILE A 127 7.871 2.365 -11.985 1.00 0.00 C ATOM 1925 CD1 ILE A 127 9.202 4.990 -10.989 1.00 0.00 C ATOM 0 H ILE A 127 11.510 1.929 -10.734 1.00 0.00 H new ATOM 0 HA ILE A 127 9.074 1.050 -9.665 1.00 0.00 H new ATOM 0 HB ILE A 127 9.997 2.599 -12.087 1.00 0.00 H new ATOM 0 HG12 ILE A 127 8.435 3.510 -9.625 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.184 3.552 -9.721 1.00 0.00 H new ATOM 0 HG21 ILE A 127 7.653 3.318 -12.466 1.00 0.00 H new ATOM 0 HG22 ILE A 127 7.869 1.572 -12.733 1.00 0.00 H new ATOM 0 HG23 ILE A 127 7.110 2.156 -11.233 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.225 5.769 -10.227 1.00 0.00 H new ATOM 0 HD12 ILE A 127 10.054 5.111 -11.658 1.00 0.00 H new ATOM 0 HD13 ILE A 127 8.277 5.069 -11.561 1.00 0.00 H new ATOM 1937 N ALA A 128 9.918 -0.572 -12.420 1.00 0.00 N ATOM 1938 CA ALA A 128 9.477 -1.656 -13.299 1.00 0.00 C ATOM 1939 C ALA A 128 9.250 -2.955 -12.510 1.00 0.00 C ATOM 1940 O ALA A 128 8.388 -3.764 -12.854 1.00 0.00 O ATOM 1941 CB ALA A 128 10.496 -1.871 -14.424 1.00 0.00 C ATOM 0 H ALA A 128 10.840 -0.199 -12.645 1.00 0.00 H new ATOM 0 HA ALA A 128 8.523 -1.370 -13.742 1.00 0.00 H new ATOM 0 HB1 ALA A 128 10.158 -2.680 -15.072 1.00 0.00 H new ATOM 0 HB2 ALA A 128 10.593 -0.955 -15.007 1.00 0.00 H new ATOM 0 HB3 ALA A 128 11.463 -2.131 -13.994 1.00 0.00 H new ATOM 1947 N LYS A 129 10.019 -3.133 -11.435 1.00 0.00 N ATOM 1948 CA LYS A 129 9.989 -4.290 -10.551 1.00 0.00 C ATOM 1949 C LYS A 129 8.741 -4.319 -9.658 1.00 0.00 C ATOM 1950 O LYS A 129 8.386 -5.391 -9.166 1.00 0.00 O ATOM 1951 CB LYS A 129 11.252 -4.253 -9.684 1.00 0.00 C ATOM 1952 CG LYS A 129 12.533 -4.353 -10.529 1.00 0.00 C ATOM 1953 CD LYS A 129 13.782 -4.063 -9.688 1.00 0.00 C ATOM 1954 CE LYS A 129 14.942 -3.496 -10.526 1.00 0.00 C ATOM 1955 NZ LYS A 129 15.339 -4.352 -11.672 1.00 0.00 N ATOM 0 H LYS A 129 10.710 -2.440 -11.147 1.00 0.00 H new ATOM 0 HA LYS A 129 9.953 -5.193 -11.161 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.269 -3.328 -9.107 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.225 -5.074 -8.968 1.00 0.00 H new ATOM 0 HG2 LYS A 129 12.608 -5.350 -10.962 1.00 0.00 H new ATOM 0 HG3 LYS A 129 12.479 -3.648 -11.359 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.528 -3.354 -8.900 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.107 -4.981 -9.199 1.00 0.00 H new ATOM 0 HE2 LYS A 129 14.657 -2.513 -10.902 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.807 -3.351 -9.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 15.614 -3.751 -12.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 16.144 -4.950 -11.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 14.538 -4.955 -11.949 1.00 0.00 H new ATOM 1969 N ILE A 130 8.075 -3.176 -9.449 1.00 0.00 N ATOM 1970 CA ILE A 130 7.023 -2.979 -8.464 1.00 0.00 C ATOM 1971 C ILE A 130 5.681 -2.483 -9.015 1.00 0.00 C ATOM 1972 O ILE A 130 4.653 -2.671 -8.361 1.00 0.00 O ATOM 1973 CB ILE A 130 7.554 -2.013 -7.388 1.00 0.00 C ATOM 1974 CG1 ILE A 130 8.143 -0.704 -7.940 1.00 0.00 C ATOM 1975 CG2 ILE A 130 8.559 -2.772 -6.500 1.00 0.00 C ATOM 1976 CD1 ILE A 130 8.797 0.188 -6.886 1.00 0.00 C ATOM 0 H ILE A 130 8.269 -2.332 -9.989 1.00 0.00 H new ATOM 0 HA ILE A 130 6.791 -3.963 -8.056 1.00 0.00 H new ATOM 0 HB ILE A 130 6.702 -1.682 -6.794 1.00 0.00 H new ATOM 0 HG12 ILE A 130 8.883 -0.946 -8.703 1.00 0.00 H new ATOM 0 HG13 ILE A 130 7.349 -0.142 -8.432 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.945 -2.101 -5.732 1.00 0.00 H new ATOM 0 HG22 ILE A 130 8.060 -3.617 -6.026 1.00 0.00 H new ATOM 0 HG23 ILE A 130 9.384 -3.135 -7.113 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.185 1.089 -7.362 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.058 0.465 -6.134 1.00 0.00 H new ATOM 0 HD13 ILE A 130 9.615 -0.352 -6.409 1.00 0.00 H new ATOM 1988 N SER A 131 5.702 -1.855 -10.187 1.00 0.00 N ATOM 1989 CA SER A 131 4.536 -1.378 -10.933 1.00 0.00 C ATOM 1990 C SER A 131 3.405 -2.414 -10.916 1.00 0.00 C ATOM 1991 O SER A 131 3.651 -3.589 -11.268 1.00 0.00 O ATOM 1992 CB SER A 131 4.928 -1.055 -12.376 1.00 0.00 C ATOM 1993 OG SER A 131 5.851 0.012 -12.405 1.00 0.00 O ATOM 1994 OXT SER A 131 2.263 -2.045 -10.573 1.00 0.00 O ATOM 0 H SER A 131 6.578 -1.653 -10.669 1.00 0.00 H new ATOM 0 HA SER A 131 4.174 -0.471 -10.448 1.00 0.00 H new ATOM 0 HB2 SER A 131 5.365 -1.936 -12.847 1.00 0.00 H new ATOM 0 HB3 SER A 131 4.040 -0.793 -12.951 1.00 0.00 H new ATOM 0 HG SER A 131 6.748 -0.325 -12.198 1.00 0.00 H new