USER MOD reduce.3.24.130724 H: found=0, std=0, add=669, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 668 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 Single : A 1 MET CE :methyl -160:sc= -0.0288 (180deg=-0.29) USER MOD Single : A 1 MET N :NH3+ -135:sc= 0.749 (180deg=-0.00754) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 112:sc= 1.19 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.783 X(o=-0.78,f=-0.33) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot -74:sc= 0.733 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -0.0421 X(o=-0.042,f=-0.042) USER MOD Single : A 35 SER OG : rot -46:sc= 0.00907 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.476) USER MOD Single : A 38 GLN : amide:sc= -0.0478 K(o=-0.048,f=-1.7!) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : B 101 MET CE :methyl -160:sc= -0.0358 (180deg=-0.309) USER MOD Single : B 102 THR OG1 : rot 180:sc= 0 USER MOD Single : B 105 THR OG1 : rot 101:sc= 1.22 USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 108 ASN : amide:sc= -0.458 X(o=-0.46,f=-0.15) USER MOD Single : B 113 TYR OH : rot 180:sc= 0 USER MOD Single : B 115 SER OG : rot -91:sc= 1.18 USER MOD Single : B 127 TYR OH : rot 180:sc= 0 USER MOD Single : B 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 134 ASN : amide:sc= -0.0154 X(o=-0.015,f=-0.015) USER MOD Single : B 135 SER OG : rot -46:sc= 0.0247 USER MOD Single : B 136 SER OG : rot 180:sc= 0 USER MOD Single : B 137 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.705) USER MOD Single : B 138 GLN : amide:sc= -0.0397 K(o=-0.04,f=-1.9!) USER MOD Single : B 139 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 141 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.906 17.093 0.631 1.00 0.00 N ATOM 2 CA MET A 1 -0.565 15.845 1.304 1.00 0.00 C ATOM 3 C MET A 1 -0.300 14.736 0.291 1.00 0.00 C ATOM 4 O MET A 1 -0.738 14.813 -0.858 1.00 0.00 O ATOM 5 CB MET A 1 -1.693 15.428 2.251 1.00 0.00 C ATOM 6 CG MET A 1 -3.007 15.143 1.543 1.00 0.00 C ATOM 7 SD MET A 1 -4.052 16.606 1.402 1.00 0.00 S ATOM 8 CE MET A 1 -4.599 16.795 3.096 1.00 0.00 C ATOM 0 H1 MET A 1 -0.384 17.878 1.070 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.650 17.026 -0.375 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.928 17.266 0.718 1.00 0.00 H new ATOM 0 HA MET A 1 0.344 16.009 1.882 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.385 14.538 2.800 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.850 16.217 2.986 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.801 14.751 0.547 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.547 14.367 2.086 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.501 17.407 3.121 1.00 0.00 H new ATOM 0 HE2 MET A 1 -4.814 15.814 3.521 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.816 17.279 3.679 1.00 0.00 H new ATOM 18 N THR A 2 0.420 13.705 0.722 1.00 0.00 N ATOM 19 CA THR A 2 0.745 12.582 -0.148 1.00 0.00 C ATOM 20 C THR A 2 0.700 11.264 0.617 1.00 0.00 C ATOM 21 O THR A 2 0.990 11.219 1.813 1.00 0.00 O ATOM 22 CB THR A 2 2.139 12.748 -0.781 1.00 0.00 C ATOM 23 OG1 THR A 2 3.125 12.926 0.242 1.00 0.00 O ATOM 24 CG2 THR A 2 2.164 13.936 -1.730 1.00 0.00 C ATOM 0 H THR A 2 0.789 13.625 1.669 1.00 0.00 H new ATOM 0 HA THR A 2 -0.005 12.566 -0.939 1.00 0.00 H new ATOM 0 HB THR A 2 2.366 11.845 -1.348 1.00 0.00 H new ATOM 0 HG1 THR A 2 4.008 13.029 -0.170 1.00 0.00 H new ATOM 0 HG21 THR A 2 3.159 14.033 -2.165 1.00 0.00 H new ATOM 0 HG22 THR A 2 1.434 13.782 -2.525 1.00 0.00 H new ATOM 0 HG23 THR A 2 1.917 14.845 -1.182 1.00 0.00 H new ATOM 32 N ARG A 3 0.334 10.193 -0.080 1.00 0.00 N ATOM 33 CA ARG A 3 0.251 8.874 0.534 1.00 0.00 C ATOM 34 C ARG A 3 1.218 7.901 -0.135 1.00 0.00 C ATOM 35 O ARG A 3 1.909 8.254 -1.090 1.00 0.00 O ATOM 36 CB ARG A 3 -1.177 8.334 0.442 1.00 0.00 C ATOM 37 CG ARG A 3 -1.788 8.461 -0.944 1.00 0.00 C ATOM 38 CD ARG A 3 -3.271 8.121 -0.933 1.00 0.00 C ATOM 39 NE ARG A 3 -4.034 9.031 -0.084 1.00 0.00 N ATOM 40 CZ ARG A 3 -5.243 8.754 0.390 1.00 0.00 C ATOM 41 NH1 ARG A 3 -5.824 7.597 0.100 1.00 0.00 N1+ ATOM 42 NH2 ARG A 3 -5.875 9.634 1.156 1.00 0.00 N ATOM 0 H ARG A 3 0.090 10.213 -1.070 1.00 0.00 H new ATOM 0 HA ARG A 3 0.528 8.972 1.584 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -1.179 7.284 0.736 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -1.805 8.866 1.157 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -1.649 9.478 -1.312 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -1.267 7.798 -1.635 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -3.660 8.162 -1.950 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -3.406 7.098 -0.581 1.00 0.00 H new ATOM 0 HE ARG A 3 -3.615 9.929 0.158 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -5.342 6.918 -0.488 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -6.753 7.387 0.466 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -5.432 10.525 1.381 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -6.804 9.420 1.519 1.00 0.00 H new ATOM 56 N GLY A 4 1.261 6.674 0.374 1.00 0.00 N ATOM 57 CA GLY A 4 2.146 5.669 -0.186 1.00 0.00 C ATOM 58 C GLY A 4 3.554 5.763 0.367 1.00 0.00 C ATOM 59 O GLY A 4 3.748 5.868 1.580 1.00 0.00 O ATOM 0 H GLY A 4 0.699 6.358 1.164 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.743 4.678 0.022 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.177 5.780 -1.270 1.00 0.00 H new ATOM 63 N THR A 5 4.542 5.725 -0.521 1.00 0.00 N ATOM 64 CA THR A 5 5.939 5.805 -0.115 1.00 0.00 C ATOM 65 C THR A 5 6.811 6.337 -1.248 1.00 0.00 C ATOM 66 O THR A 5 6.682 5.914 -2.397 1.00 0.00 O ATOM 67 CB THR A 5 6.475 4.430 0.326 1.00 0.00 C ATOM 68 OG1 THR A 5 5.900 3.397 -0.481 1.00 0.00 O ATOM 69 CG2 THR A 5 6.157 4.171 1.792 1.00 0.00 C ATOM 0 H THR A 5 4.400 5.639 -1.527 1.00 0.00 H new ATOM 0 HA THR A 5 5.984 6.493 0.729 1.00 0.00 H new ATOM 0 HB THR A 5 7.558 4.429 0.198 1.00 0.00 H new ATOM 0 HG1 THR A 5 6.595 2.996 -1.043 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.545 3.194 2.081 1.00 0.00 H new ATOM 0 HG22 THR A 5 6.621 4.942 2.407 1.00 0.00 H new ATOM 0 HG23 THR A 5 5.077 4.191 1.939 1.00 0.00 H new ATOM 77 N THR A 6 7.700 7.270 -0.915 1.00 0.00 N ATOM 78 CA THR A 6 8.592 7.860 -1.905 1.00 0.00 C ATOM 79 C THR A 6 9.666 6.868 -2.338 1.00 0.00 C ATOM 80 O THR A 6 10.466 7.155 -3.228 1.00 0.00 O ATOM 81 CB THR A 6 9.273 9.130 -1.359 1.00 0.00 C ATOM 82 OG1 THR A 6 8.306 9.965 -0.712 1.00 0.00 O ATOM 83 CG2 THR A 6 9.951 9.904 -2.479 1.00 0.00 C ATOM 0 H THR A 6 7.820 7.632 0.031 1.00 0.00 H new ATOM 0 HA THR A 6 7.979 8.126 -2.766 1.00 0.00 H new ATOM 0 HB THR A 6 10.032 8.827 -0.637 1.00 0.00 H new ATOM 0 HG1 THR A 6 8.747 10.769 -0.366 1.00 0.00 H new ATOM 0 HG21 THR A 6 10.425 10.796 -2.070 1.00 0.00 H new ATOM 0 HG22 THR A 6 10.707 9.275 -2.950 1.00 0.00 H new ATOM 0 HG23 THR A 6 9.208 10.196 -3.221 1.00 0.00 H new ATOM 91 N ASP A 7 9.678 5.701 -1.703 1.00 0.00 N ATOM 92 CA ASP A 7 10.652 4.666 -2.025 1.00 0.00 C ATOM 93 C ASP A 7 10.543 4.252 -3.489 1.00 0.00 C ATOM 94 O ASP A 7 9.498 3.775 -3.932 1.00 0.00 O ATOM 95 CB ASP A 7 10.452 3.448 -1.122 1.00 0.00 C ATOM 96 CG ASP A 7 9.144 2.732 -1.397 1.00 0.00 C ATOM 97 OD1 ASP A 7 8.162 3.411 -1.764 1.00 0.00 O ATOM 98 OD2 ASP A 7 9.103 1.493 -1.246 1.00 0.00 O1- ATOM 0 H ASP A 7 9.024 5.449 -0.962 1.00 0.00 H new ATOM 0 HA ASP A 7 11.648 5.075 -1.855 1.00 0.00 H new ATOM 0 HB2 ASP A 7 11.280 2.754 -1.265 1.00 0.00 H new ATOM 0 HB3 ASP A 7 10.477 3.764 -0.079 1.00 0.00 H new ATOM 103 N ASN A 8 11.626 4.440 -4.235 1.00 0.00 N ATOM 104 CA ASN A 8 11.651 4.087 -5.650 1.00 0.00 C ATOM 105 C ASN A 8 10.748 5.014 -6.457 1.00 0.00 C ATOM 106 O ASN A 8 10.485 4.773 -7.636 1.00 0.00 O ATOM 107 CB ASN A 8 11.212 2.634 -5.843 1.00 0.00 C ATOM 108 CG ASN A 8 11.800 1.709 -4.795 1.00 0.00 C ATOM 109 OD1 ASN A 8 11.143 0.773 -4.339 1.00 0.00 O ATOM 110 ND2 ASN A 8 13.043 1.968 -4.407 1.00 0.00 N ATOM 0 H ASN A 8 12.498 4.835 -3.884 1.00 0.00 H new ATOM 0 HA ASN A 8 12.674 4.201 -6.009 1.00 0.00 H new ATOM 0 HB2 ASN A 8 10.124 2.578 -5.804 1.00 0.00 H new ATOM 0 HB3 ASN A 8 11.514 2.295 -6.834 1.00 0.00 H new ATOM 0 HD21 ASN A 8 13.491 1.380 -3.704 1.00 0.00 H new ATOM 0 HD22 ASN A 8 13.550 2.755 -4.812 1.00 0.00 H new ATOM 117 N LEU A 9 10.274 6.077 -5.815 1.00 0.00 N ATOM 118 CA LEU A 9 9.401 7.042 -6.473 1.00 0.00 C ATOM 119 C LEU A 9 10.192 8.258 -6.947 1.00 0.00 C ATOM 120 O LEU A 9 9.631 9.184 -7.533 1.00 0.00 O ATOM 121 CB LEU A 9 8.287 7.483 -5.521 1.00 0.00 C ATOM 122 CG LEU A 9 6.938 6.788 -5.699 1.00 0.00 C ATOM 123 CD1 LEU A 9 5.911 7.358 -4.733 1.00 0.00 C ATOM 124 CD2 LEU A 9 6.454 6.922 -7.135 1.00 0.00 C ATOM 0 H LEU A 9 10.480 6.292 -4.839 1.00 0.00 H new ATOM 0 HA LEU A 9 8.957 6.559 -7.343 1.00 0.00 H new ATOM 0 HB2 LEU A 9 8.625 7.319 -4.498 1.00 0.00 H new ATOM 0 HB3 LEU A 9 8.139 8.556 -5.640 1.00 0.00 H new ATOM 0 HG LEU A 9 7.066 5.728 -5.477 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.957 6.850 -4.875 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.253 7.209 -3.709 1.00 0.00 H new ATOM 0 HD13 LEU A 9 5.786 8.424 -4.922 1.00 0.00 H new ATOM 0 HD21 LEU A 9 5.492 6.421 -7.243 1.00 0.00 H new ATOM 0 HD22 LEU A 9 6.344 7.977 -7.385 1.00 0.00 H new ATOM 0 HD23 LEU A 9 7.179 6.464 -7.808 1.00 0.00 H new ATOM 136 N ILE A 10 11.495 8.246 -6.690 1.00 0.00 N ATOM 137 CA ILE A 10 12.362 9.346 -7.094 1.00 0.00 C ATOM 138 C ILE A 10 12.204 9.654 -8.579 1.00 0.00 C ATOM 139 O ILE A 10 11.974 10.795 -8.980 1.00 0.00 O ATOM 140 CB ILE A 10 13.842 9.033 -6.799 1.00 0.00 C ATOM 141 CG1 ILE A 10 13.962 8.163 -5.546 1.00 0.00 C ATOM 142 CG2 ILE A 10 14.633 10.323 -6.634 1.00 0.00 C ATOM 143 CD1 ILE A 10 13.171 8.687 -4.369 1.00 0.00 C ATOM 0 H ILE A 10 11.974 7.487 -6.204 1.00 0.00 H new ATOM 0 HA ILE A 10 12.060 10.217 -6.512 1.00 0.00 H new ATOM 0 HB ILE A 10 14.257 8.481 -7.642 1.00 0.00 H new ATOM 0 HG12 ILE A 10 13.624 7.154 -5.780 1.00 0.00 H new ATOM 0 HG13 ILE A 10 15.012 8.089 -5.264 1.00 0.00 H new ATOM 0 HG21 ILE A 10 15.676 10.086 -6.426 1.00 0.00 H new ATOM 0 HG22 ILE A 10 14.570 10.908 -7.551 1.00 0.00 H new ATOM 0 HG23 ILE A 10 14.220 10.900 -5.806 1.00 0.00 H new ATOM 0 HD11 ILE A 10 13.303 8.021 -3.516 1.00 0.00 H new ATOM 0 HD12 ILE A 10 13.525 9.684 -4.108 1.00 0.00 H new ATOM 0 HD13 ILE A 10 12.114 8.734 -4.633 1.00 0.00 H new ATOM 155 N PRO A 11 12.329 8.613 -9.415 1.00 0.00 N ATOM 156 CA PRO A 11 12.202 8.747 -10.870 1.00 0.00 C ATOM 157 C PRO A 11 10.770 9.048 -11.301 1.00 0.00 C ATOM 158 O PRO A 11 10.531 9.937 -12.118 1.00 0.00 O ATOM 159 CB PRO A 11 12.640 7.377 -11.391 1.00 0.00 C ATOM 160 CG PRO A 11 12.371 6.438 -10.266 1.00 0.00 C ATOM 161 CD PRO A 11 12.603 7.226 -9.006 1.00 0.00 C ATOM 0 HA PRO A 11 12.796 9.575 -11.257 1.00 0.00 H new ATOM 0 HB2 PRO A 11 12.081 7.096 -12.283 1.00 0.00 H new ATOM 0 HB3 PRO A 11 13.695 7.376 -11.663 1.00 0.00 H new ATOM 0 HG2 PRO A 11 11.349 6.061 -10.308 1.00 0.00 H new ATOM 0 HG3 PRO A 11 13.032 5.573 -10.313 1.00 0.00 H new ATOM 0 HD2 PRO A 11 11.939 6.905 -8.204 1.00 0.00 H new ATOM 0 HD3 PRO A 11 13.623 7.109 -8.641 1.00 0.00 H new ATOM 169 N VAL A 12 9.821 8.302 -10.745 1.00 0.00 N ATOM 170 CA VAL A 12 8.412 8.490 -11.072 1.00 0.00 C ATOM 171 C VAL A 12 8.013 9.957 -10.959 1.00 0.00 C ATOM 172 O VAL A 12 7.617 10.581 -11.944 1.00 0.00 O ATOM 173 CB VAL A 12 7.506 7.651 -10.151 1.00 0.00 C ATOM 174 CG1 VAL A 12 6.043 7.848 -10.518 1.00 0.00 C ATOM 175 CG2 VAL A 12 7.889 6.181 -10.223 1.00 0.00 C ATOM 0 H VAL A 12 10.002 7.562 -10.066 1.00 0.00 H new ATOM 0 HA VAL A 12 8.279 8.158 -12.102 1.00 0.00 H new ATOM 0 HB VAL A 12 7.647 7.990 -9.125 1.00 0.00 H new ATOM 0 HG11 VAL A 12 5.418 7.248 -9.857 1.00 0.00 H new ATOM 0 HG12 VAL A 12 5.779 8.900 -10.410 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.882 7.538 -11.550 1.00 0.00 H new ATOM 0 HG21 VAL A 12 7.239 5.603 -9.566 1.00 0.00 H new ATOM 0 HG22 VAL A 12 7.778 5.826 -11.248 1.00 0.00 H new ATOM 0 HG23 VAL A 12 8.925 6.059 -9.907 1.00 0.00 H new ATOM 185 N TYR A 13 8.122 10.504 -9.753 1.00 0.00 N ATOM 186 CA TYR A 13 7.771 11.898 -9.511 1.00 0.00 C ATOM 187 C TYR A 13 8.621 12.830 -10.368 1.00 0.00 C ATOM 188 O TYR A 13 8.118 13.793 -10.946 1.00 0.00 O ATOM 189 CB TYR A 13 7.950 12.241 -8.031 1.00 0.00 C ATOM 190 CG TYR A 13 6.755 11.881 -7.177 1.00 0.00 C ATOM 191 CD1 TYR A 13 6.151 10.634 -7.284 1.00 0.00 C ATOM 192 CD2 TYR A 13 6.231 12.787 -6.263 1.00 0.00 C ATOM 193 CE1 TYR A 13 5.059 10.300 -6.507 1.00 0.00 C ATOM 194 CE2 TYR A 13 5.140 12.461 -5.481 1.00 0.00 C ATOM 195 CZ TYR A 13 4.557 11.217 -5.607 1.00 0.00 C ATOM 196 OH TYR A 13 3.470 10.889 -4.829 1.00 0.00 O ATOM 0 H TYR A 13 8.451 10.003 -8.928 1.00 0.00 H new ATOM 0 HA TYR A 13 6.725 12.036 -9.785 1.00 0.00 H new ATOM 0 HB2 TYR A 13 8.828 11.720 -7.650 1.00 0.00 H new ATOM 0 HB3 TYR A 13 8.146 13.309 -7.935 1.00 0.00 H new ATOM 0 HD1 TYR A 13 6.542 9.913 -7.987 1.00 0.00 H new ATOM 0 HD2 TYR A 13 6.684 13.762 -6.162 1.00 0.00 H new ATOM 0 HE1 TYR A 13 4.601 9.327 -6.603 1.00 0.00 H new ATOM 0 HE2 TYR A 13 4.745 13.176 -4.775 1.00 0.00 H new ATOM 0 HH TYR A 13 3.243 11.645 -4.248 1.00 0.00 H new ATOM 206 N ALA A 14 9.915 12.538 -10.443 1.00 0.00 N ATOM 207 CA ALA A 14 10.838 13.347 -11.231 1.00 0.00 C ATOM 208 C ALA A 14 10.336 13.515 -12.661 1.00 0.00 C ATOM 209 O ALA A 14 10.207 14.635 -13.156 1.00 0.00 O ATOM 210 CB ALA A 14 12.225 12.723 -11.225 1.00 0.00 C ATOM 0 H ALA A 14 10.349 11.747 -9.967 1.00 0.00 H new ATOM 0 HA ALA A 14 10.896 14.336 -10.776 1.00 0.00 H new ATOM 0 HB1 ALA A 14 12.903 13.338 -11.817 1.00 0.00 H new ATOM 0 HB2 ALA A 14 12.592 12.662 -10.200 1.00 0.00 H new ATOM 0 HB3 ALA A 14 12.175 11.722 -11.653 1.00 0.00 H new ATOM 216 N SER A 15 10.057 12.395 -13.320 1.00 0.00 N ATOM 217 CA SER A 15 9.575 12.418 -14.696 1.00 0.00 C ATOM 218 C SER A 15 8.232 13.138 -14.789 1.00 0.00 C ATOM 219 O SER A 15 8.075 14.081 -15.564 1.00 0.00 O ATOM 220 CB SER A 15 9.441 10.993 -15.236 1.00 0.00 C ATOM 221 OG SER A 15 8.835 10.141 -14.280 1.00 0.00 O ATOM 0 H SER A 15 10.156 11.461 -12.923 1.00 0.00 H new ATOM 0 HA SER A 15 10.302 12.961 -15.301 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.846 11.001 -16.149 1.00 0.00 H new ATOM 0 HB3 SER A 15 10.425 10.607 -15.500 1.00 0.00 H new ATOM 0 HG SER A 15 9.478 9.937 -13.569 1.00 0.00 H new ATOM 227 N ILE A 16 7.269 12.685 -13.993 1.00 0.00 N ATOM 228 CA ILE A 16 5.941 13.286 -13.984 1.00 0.00 C ATOM 229 C ILE A 16 6.024 14.800 -13.825 1.00 0.00 C ATOM 230 O ILE A 16 5.322 15.546 -14.509 1.00 0.00 O ATOM 231 CB ILE A 16 5.070 12.708 -12.854 1.00 0.00 C ATOM 232 CG1 ILE A 16 4.842 11.211 -13.070 1.00 0.00 C ATOM 233 CG2 ILE A 16 3.741 13.446 -12.780 1.00 0.00 C ATOM 234 CD1 ILE A 16 4.284 10.502 -11.855 1.00 0.00 C ATOM 0 H ILE A 16 7.384 11.904 -13.346 1.00 0.00 H new ATOM 0 HA ILE A 16 5.480 13.049 -14.943 1.00 0.00 H new ATOM 0 HB ILE A 16 5.593 12.844 -11.907 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.158 11.073 -13.907 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.786 10.745 -13.351 1.00 0.00 H new ATOM 0 HG21 ILE A 16 3.136 13.026 -11.976 1.00 0.00 H new ATOM 0 HG22 ILE A 16 3.922 14.503 -12.584 1.00 0.00 H new ATOM 0 HG23 ILE A 16 3.212 13.338 -13.727 1.00 0.00 H new ATOM 0 HD11 ILE A 16 4.148 9.444 -12.081 1.00 0.00 H new ATOM 0 HD12 ILE A 16 4.978 10.608 -11.021 1.00 0.00 H new ATOM 0 HD13 ILE A 16 3.324 10.942 -11.586 1.00 0.00 H new ATOM 246 N LEU A 17 6.885 15.247 -12.918 1.00 0.00 N ATOM 247 CA LEU A 17 7.062 16.674 -12.669 1.00 0.00 C ATOM 248 C LEU A 17 7.501 17.398 -13.937 1.00 0.00 C ATOM 249 O LEU A 17 6.941 18.431 -14.300 1.00 0.00 O ATOM 250 CB LEU A 17 8.090 16.894 -11.559 1.00 0.00 C ATOM 251 CG LEU A 17 7.526 17.176 -10.166 1.00 0.00 C ATOM 252 CD1 LEU A 17 6.704 15.994 -9.675 1.00 0.00 C ATOM 253 CD2 LEU A 17 8.649 17.490 -9.189 1.00 0.00 C ATOM 0 H LEU A 17 7.472 14.643 -12.343 1.00 0.00 H new ATOM 0 HA LEU A 17 6.103 17.084 -12.353 1.00 0.00 H new ATOM 0 HB2 LEU A 17 8.725 16.010 -11.500 1.00 0.00 H new ATOM 0 HB3 LEU A 17 8.731 17.728 -11.845 1.00 0.00 H new ATOM 0 HG LEU A 17 6.873 18.046 -10.228 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.310 16.212 -8.682 1.00 0.00 H new ATOM 0 HD12 LEU A 17 5.877 15.815 -10.362 1.00 0.00 H new ATOM 0 HD13 LEU A 17 7.335 15.106 -9.628 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.229 17.688 -8.203 1.00 0.00 H new ATOM 0 HD22 LEU A 17 9.328 16.640 -9.130 1.00 0.00 H new ATOM 0 HD23 LEU A 17 9.196 18.368 -9.533 1.00 0.00 H new ATOM 265 N ALA A 18 8.507 16.847 -14.608 1.00 0.00 N ATOM 266 CA ALA A 18 9.019 17.437 -15.839 1.00 0.00 C ATOM 267 C ALA A 18 7.904 17.627 -16.862 1.00 0.00 C ATOM 268 O ALA A 18 7.768 18.697 -17.454 1.00 0.00 O ATOM 269 CB ALA A 18 10.128 16.571 -16.418 1.00 0.00 C ATOM 0 H ALA A 18 8.984 15.993 -14.320 1.00 0.00 H new ATOM 0 HA ALA A 18 9.428 18.419 -15.600 1.00 0.00 H new ATOM 0 HB1 ALA A 18 10.501 17.024 -17.337 1.00 0.00 H new ATOM 0 HB2 ALA A 18 10.941 16.491 -15.697 1.00 0.00 H new ATOM 0 HB3 ALA A 18 9.737 15.577 -16.636 1.00 0.00 H new ATOM 275 N ALA A 19 7.110 16.580 -17.067 1.00 0.00 N ATOM 276 CA ALA A 19 6.007 16.633 -18.018 1.00 0.00 C ATOM 277 C ALA A 19 5.060 17.784 -17.697 1.00 0.00 C ATOM 278 O ALA A 19 4.619 18.506 -18.591 1.00 0.00 O ATOM 279 CB ALA A 19 5.252 15.312 -18.023 1.00 0.00 C ATOM 0 H ALA A 19 7.211 15.686 -16.587 1.00 0.00 H new ATOM 0 HA ALA A 19 6.423 16.806 -19.011 1.00 0.00 H new ATOM 0 HB1 ALA A 19 4.431 15.365 -18.738 1.00 0.00 H new ATOM 0 HB2 ALA A 19 5.929 14.507 -18.308 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.854 15.116 -17.027 1.00 0.00 H new ATOM 285 N VAL A 20 4.751 17.951 -16.415 1.00 0.00 N ATOM 286 CA VAL A 20 3.856 19.015 -15.977 1.00 0.00 C ATOM 287 C VAL A 20 4.440 20.388 -16.289 1.00 0.00 C ATOM 288 O VAL A 20 3.829 21.188 -16.996 1.00 0.00 O ATOM 289 CB VAL A 20 3.572 18.922 -14.465 1.00 0.00 C ATOM 290 CG1 VAL A 20 2.458 19.881 -14.071 1.00 0.00 C ATOM 291 CG2 VAL A 20 3.219 17.494 -14.077 1.00 0.00 C ATOM 0 H VAL A 20 5.107 17.363 -15.662 1.00 0.00 H new ATOM 0 HA VAL A 20 2.922 18.888 -16.524 1.00 0.00 H new ATOM 0 HB VAL A 20 4.474 19.209 -13.925 1.00 0.00 H new ATOM 0 HG11 VAL A 20 2.271 19.801 -13.000 1.00 0.00 H new ATOM 0 HG12 VAL A 20 2.754 20.902 -14.313 1.00 0.00 H new ATOM 0 HG13 VAL A 20 1.550 19.628 -14.617 1.00 0.00 H new ATOM 0 HG21 VAL A 20 3.021 17.446 -13.006 1.00 0.00 H new ATOM 0 HG22 VAL A 20 2.331 17.177 -14.624 1.00 0.00 H new ATOM 0 HG23 VAL A 20 4.051 16.834 -14.322 1.00 0.00 H new ATOM 301 N VAL A 21 5.629 20.654 -15.756 1.00 0.00 N ATOM 302 CA VAL A 21 6.298 21.930 -15.980 1.00 0.00 C ATOM 303 C VAL A 21 6.340 22.277 -17.463 1.00 0.00 C ATOM 304 O VAL A 21 5.965 23.379 -17.865 1.00 0.00 O ATOM 305 CB VAL A 21 7.736 21.915 -15.428 1.00 0.00 C ATOM 306 CG1 VAL A 21 8.428 23.241 -15.702 1.00 0.00 C ATOM 307 CG2 VAL A 21 7.731 21.604 -13.938 1.00 0.00 C ATOM 0 H VAL A 21 6.148 20.003 -15.167 1.00 0.00 H new ATOM 0 HA VAL A 21 5.720 22.686 -15.449 1.00 0.00 H new ATOM 0 HB VAL A 21 8.294 21.130 -15.938 1.00 0.00 H new ATOM 0 HG11 VAL A 21 9.443 23.211 -15.305 1.00 0.00 H new ATOM 0 HG12 VAL A 21 8.464 23.417 -16.777 1.00 0.00 H new ATOM 0 HG13 VAL A 21 7.874 24.047 -15.221 1.00 0.00 H new ATOM 0 HG21 VAL A 21 8.755 21.597 -13.564 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.157 22.365 -13.409 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.278 20.627 -13.772 1.00 0.00 H new ATOM 317 N VAL A 22 6.796 21.329 -18.275 1.00 0.00 N ATOM 318 CA VAL A 22 6.884 21.532 -19.716 1.00 0.00 C ATOM 319 C VAL A 22 5.511 21.810 -20.317 1.00 0.00 C ATOM 320 O VAL A 22 5.353 22.706 -21.144 1.00 0.00 O ATOM 321 CB VAL A 22 7.504 20.309 -20.419 1.00 0.00 C ATOM 322 CG1 VAL A 22 7.639 20.564 -21.912 1.00 0.00 C ATOM 323 CG2 VAL A 22 8.852 19.967 -19.804 1.00 0.00 C ATOM 0 H VAL A 22 7.111 20.412 -17.959 1.00 0.00 H new ATOM 0 HA VAL A 22 7.528 22.397 -19.875 1.00 0.00 H new ATOM 0 HB VAL A 22 6.840 19.456 -20.279 1.00 0.00 H new ATOM 0 HG11 VAL A 22 8.079 19.690 -22.392 1.00 0.00 H new ATOM 0 HG12 VAL A 22 6.655 20.756 -22.339 1.00 0.00 H new ATOM 0 HG13 VAL A 22 8.281 21.430 -22.077 1.00 0.00 H new ATOM 0 HG21 VAL A 22 9.275 19.101 -20.313 1.00 0.00 H new ATOM 0 HG22 VAL A 22 9.527 20.816 -19.911 1.00 0.00 H new ATOM 0 HG23 VAL A 22 8.722 19.738 -18.746 1.00 0.00 H new ATOM 333 N GLY A 23 4.518 21.033 -19.895 1.00 0.00 N ATOM 334 CA GLY A 23 3.171 21.210 -20.402 1.00 0.00 C ATOM 335 C GLY A 23 2.653 22.620 -20.194 1.00 0.00 C ATOM 336 O GLY A 23 1.979 23.177 -21.061 1.00 0.00 O ATOM 0 H GLY A 23 4.623 20.284 -19.211 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.153 20.973 -21.466 1.00 0.00 H new ATOM 0 HA3 GLY A 23 2.504 20.505 -19.906 1.00 0.00 H new ATOM 340 N LEU A 24 2.968 23.199 -19.040 1.00 0.00 N ATOM 341 CA LEU A 24 2.530 24.553 -18.719 1.00 0.00 C ATOM 342 C LEU A 24 3.273 25.582 -19.566 1.00 0.00 C ATOM 343 O LEU A 24 2.661 26.341 -20.317 1.00 0.00 O ATOM 344 CB LEU A 24 2.750 24.843 -17.234 1.00 0.00 C ATOM 345 CG LEU A 24 1.489 25.077 -16.401 1.00 0.00 C ATOM 346 CD1 LEU A 24 1.718 24.655 -14.957 1.00 0.00 C ATOM 347 CD2 LEU A 24 1.068 26.537 -16.471 1.00 0.00 C ATOM 0 H LEU A 24 3.525 22.752 -18.312 1.00 0.00 H new ATOM 0 HA LEU A 24 1.466 24.626 -18.943 1.00 0.00 H new ATOM 0 HB2 LEU A 24 3.299 24.008 -16.799 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.387 25.723 -17.147 1.00 0.00 H new ATOM 0 HG LEU A 24 0.685 24.467 -16.813 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.810 24.829 -14.379 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.973 23.596 -14.924 1.00 0.00 H new ATOM 0 HD13 LEU A 24 2.535 25.238 -14.533 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.169 26.686 -15.873 1.00 0.00 H new ATOM 0 HD22 LEU A 24 1.870 27.166 -16.084 1.00 0.00 H new ATOM 0 HD23 LEU A 24 0.863 26.807 -17.507 1.00 0.00 H new ATOM 359 N VAL A 25 4.596 25.599 -19.439 1.00 0.00 N ATOM 360 CA VAL A 25 5.424 26.531 -20.195 1.00 0.00 C ATOM 361 C VAL A 25 5.138 26.433 -21.690 1.00 0.00 C ATOM 362 O VAL A 25 4.760 27.417 -22.325 1.00 0.00 O ATOM 363 CB VAL A 25 6.923 26.274 -19.953 1.00 0.00 C ATOM 364 CG1 VAL A 25 7.769 27.224 -20.787 1.00 0.00 C ATOM 365 CG2 VAL A 25 7.254 26.410 -18.475 1.00 0.00 C ATOM 0 H VAL A 25 5.117 24.978 -18.820 1.00 0.00 H new ATOM 0 HA VAL A 25 5.173 27.532 -19.845 1.00 0.00 H new ATOM 0 HB VAL A 25 7.154 25.254 -20.261 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.825 27.028 -20.603 1.00 0.00 H new ATOM 0 HG12 VAL A 25 7.551 27.073 -21.844 1.00 0.00 H new ATOM 0 HG13 VAL A 25 7.538 28.253 -20.512 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.317 26.225 -18.322 1.00 0.00 H new ATOM 0 HG22 VAL A 25 7.009 27.417 -18.138 1.00 0.00 H new ATOM 0 HG23 VAL A 25 6.674 25.685 -17.904 1.00 0.00 H new ATOM 375 N ALA A 26 5.320 25.239 -22.244 1.00 0.00 N ATOM 376 CA ALA A 26 5.079 25.013 -23.664 1.00 0.00 C ATOM 377 C ALA A 26 3.704 25.527 -24.077 1.00 0.00 C ATOM 378 O ALA A 26 3.574 26.264 -25.055 1.00 0.00 O ATOM 379 CB ALA A 26 5.212 23.532 -23.991 1.00 0.00 C ATOM 0 H ALA A 26 5.633 24.414 -21.732 1.00 0.00 H new ATOM 0 HA ALA A 26 5.829 25.568 -24.228 1.00 0.00 H new ATOM 0 HB1 ALA A 26 5.030 23.376 -25.054 1.00 0.00 H new ATOM 0 HB2 ALA A 26 6.218 23.193 -23.742 1.00 0.00 H new ATOM 0 HB3 ALA A 26 4.484 22.965 -23.411 1.00 0.00 H new ATOM 385 N TYR A 27 2.681 25.134 -23.326 1.00 0.00 N ATOM 386 CA TYR A 27 1.315 25.552 -23.618 1.00 0.00 C ATOM 387 C TYR A 27 1.216 27.073 -23.694 1.00 0.00 C ATOM 388 O TYR A 27 0.579 27.621 -24.594 1.00 0.00 O ATOM 389 CB TYR A 27 0.358 25.021 -22.549 1.00 0.00 C ATOM 390 CG TYR A 27 -0.955 25.768 -22.486 1.00 0.00 C ATOM 391 CD1 TYR A 27 -1.107 26.877 -21.663 1.00 0.00 C ATOM 392 CD2 TYR A 27 -2.043 25.364 -23.249 1.00 0.00 C ATOM 393 CE1 TYR A 27 -2.305 27.562 -21.602 1.00 0.00 C ATOM 394 CE2 TYR A 27 -3.245 26.045 -23.195 1.00 0.00 C ATOM 395 CZ TYR A 27 -3.370 27.143 -22.370 1.00 0.00 C ATOM 396 OH TYR A 27 -4.566 27.822 -22.313 1.00 0.00 O ATOM 0 H TYR A 27 2.772 24.527 -22.511 1.00 0.00 H new ATOM 0 HA TYR A 27 1.034 25.138 -24.586 1.00 0.00 H new ATOM 0 HB2 TYR A 27 0.158 23.967 -22.744 1.00 0.00 H new ATOM 0 HB3 TYR A 27 0.846 25.078 -21.576 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -0.274 27.209 -21.061 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -1.948 24.504 -23.895 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -2.407 28.421 -20.956 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -4.081 25.719 -23.796 1.00 0.00 H new ATOM 0 HH TYR A 27 -5.212 27.398 -22.916 1.00 0.00 H new ATOM 406 N ILE A 28 1.851 27.749 -22.742 1.00 0.00 N ATOM 407 CA ILE A 28 1.837 29.206 -22.701 1.00 0.00 C ATOM 408 C ILE A 28 2.522 29.797 -23.928 1.00 0.00 C ATOM 409 O ILE A 28 1.971 30.669 -24.599 1.00 0.00 O ATOM 410 CB ILE A 28 2.529 29.741 -21.434 1.00 0.00 C ATOM 411 CG1 ILE A 28 1.823 29.216 -20.181 1.00 0.00 C ATOM 412 CG2 ILE A 28 2.546 31.262 -21.440 1.00 0.00 C ATOM 413 CD1 ILE A 28 2.764 28.937 -19.030 1.00 0.00 C ATOM 0 H ILE A 28 2.381 27.311 -21.989 1.00 0.00 H new ATOM 0 HA ILE A 28 0.790 29.511 -22.689 1.00 0.00 H new ATOM 0 HB ILE A 28 3.560 29.386 -21.424 1.00 0.00 H new ATOM 0 HG12 ILE A 28 1.077 29.944 -19.862 1.00 0.00 H new ATOM 0 HG13 ILE A 28 1.287 28.300 -20.432 1.00 0.00 H new ATOM 0 HG21 ILE A 28 3.039 31.624 -20.538 1.00 0.00 H new ATOM 0 HG22 ILE A 28 3.088 31.616 -22.317 1.00 0.00 H new ATOM 0 HG23 ILE A 28 1.523 31.637 -21.470 1.00 0.00 H new ATOM 0 HD11 ILE A 28 2.195 28.568 -18.176 1.00 0.00 H new ATOM 0 HD12 ILE A 28 3.495 28.186 -19.331 1.00 0.00 H new ATOM 0 HD13 ILE A 28 3.281 29.855 -18.752 1.00 0.00 H new ATOM 425 N ALA A 29 3.726 29.314 -24.217 1.00 0.00 N ATOM 426 CA ALA A 29 4.486 29.792 -25.365 1.00 0.00 C ATOM 427 C ALA A 29 3.701 29.600 -26.660 1.00 0.00 C ATOM 428 O ALA A 29 3.716 30.463 -27.539 1.00 0.00 O ATOM 429 CB ALA A 29 5.826 29.075 -25.447 1.00 0.00 C ATOM 0 H ALA A 29 4.196 28.592 -23.671 1.00 0.00 H new ATOM 0 HA ALA A 29 4.665 30.859 -25.233 1.00 0.00 H new ATOM 0 HB1 ALA A 29 6.383 29.442 -26.309 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.397 29.266 -24.538 1.00 0.00 H new ATOM 0 HB3 ALA A 29 5.659 28.003 -25.552 1.00 0.00 H new ATOM 435 N PHE A 30 3.019 28.466 -26.770 1.00 0.00 N ATOM 436 CA PHE A 30 2.230 28.161 -27.958 1.00 0.00 C ATOM 437 C PHE A 30 0.974 29.027 -28.015 1.00 0.00 C ATOM 438 O PHE A 30 0.435 29.290 -29.089 1.00 0.00 O ATOM 439 CB PHE A 30 1.842 26.681 -27.974 1.00 0.00 C ATOM 440 CG PHE A 30 1.055 26.279 -29.188 1.00 0.00 C ATOM 441 CD1 PHE A 30 1.693 26.026 -30.391 1.00 0.00 C ATOM 442 CD2 PHE A 30 -0.324 26.155 -29.126 1.00 0.00 C ATOM 443 CE1 PHE A 30 0.971 25.658 -31.511 1.00 0.00 C ATOM 444 CE2 PHE A 30 -1.051 25.787 -30.242 1.00 0.00 C ATOM 445 CZ PHE A 30 -0.403 25.536 -31.436 1.00 0.00 C ATOM 0 H PHE A 30 2.996 27.743 -26.051 1.00 0.00 H new ATOM 0 HA PHE A 30 2.841 28.379 -28.834 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.747 26.076 -27.921 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.257 26.458 -27.082 1.00 0.00 H new ATOM 0 HD1 PHE A 30 2.767 26.117 -30.455 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.836 26.348 -28.195 1.00 0.00 H new ATOM 0 HE1 PHE A 30 1.481 25.466 -32.444 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.125 25.696 -30.181 1.00 0.00 H new ATOM 0 HZ PHE A 30 -0.969 25.245 -32.309 1.00 0.00 H new ATOM 455 N LYS A 31 0.515 29.467 -26.848 1.00 0.00 N ATOM 456 CA LYS A 31 -0.677 30.304 -26.763 1.00 0.00 C ATOM 457 C LYS A 31 -0.334 31.767 -27.030 1.00 0.00 C ATOM 458 O LYS A 31 -1.185 32.544 -27.464 1.00 0.00 O ATOM 459 CB LYS A 31 -1.325 30.165 -25.383 1.00 0.00 C ATOM 460 CG LYS A 31 -2.187 31.352 -24.994 1.00 0.00 C ATOM 461 CD LYS A 31 -2.882 31.124 -23.662 1.00 0.00 C ATOM 462 CE LYS A 31 -3.179 32.437 -22.955 1.00 0.00 C ATOM 463 NZ LYS A 31 -4.224 33.226 -23.665 1.00 0.00 N1+ ATOM 0 H LYS A 31 0.949 29.258 -25.949 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.382 29.969 -27.524 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.936 29.262 -25.367 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.543 30.034 -24.635 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -1.569 32.248 -24.934 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -2.933 31.531 -25.769 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.812 30.579 -23.824 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -2.254 30.501 -23.025 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.507 32.234 -21.936 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -2.265 33.026 -22.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -4.398 34.114 -23.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -3.901 33.442 -24.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -5.105 32.674 -23.710 1.00 0.00 H new ATOM 477 N ARG A 32 0.915 32.134 -26.768 1.00 0.00 N ATOM 478 CA ARG A 32 1.370 33.504 -26.981 1.00 0.00 C ATOM 479 C ARG A 32 1.698 33.746 -28.451 1.00 0.00 C ATOM 480 O ARG A 32 1.299 34.758 -29.028 1.00 0.00 O ATOM 481 CB ARG A 32 2.599 33.795 -26.118 1.00 0.00 C ATOM 482 CG ARG A 32 2.326 33.722 -24.625 1.00 0.00 C ATOM 483 CD ARG A 32 1.883 35.067 -24.072 1.00 0.00 C ATOM 484 NE ARG A 32 1.703 35.032 -22.624 1.00 0.00 N ATOM 485 CZ ARG A 32 2.710 35.063 -21.757 1.00 0.00 C ATOM 486 NH1 ARG A 32 3.961 35.131 -22.191 1.00 0.00 N1+ ATOM 487 NH2 ARG A 32 2.466 35.027 -20.454 1.00 0.00 N ATOM 0 H ARG A 32 1.631 31.503 -26.408 1.00 0.00 H new ATOM 0 HA ARG A 32 0.563 34.178 -26.692 1.00 0.00 H new ATOM 0 HB2 ARG A 32 3.386 33.084 -26.370 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.977 34.788 -26.362 1.00 0.00 H new ATOM 0 HG2 ARG A 32 1.555 32.976 -24.431 1.00 0.00 H new ATOM 0 HG3 ARG A 32 3.226 33.393 -24.105 1.00 0.00 H new ATOM 0 HD2 ARG A 32 2.624 35.825 -24.327 1.00 0.00 H new ATOM 0 HD3 ARG A 32 0.947 35.363 -24.546 1.00 0.00 H new ATOM 0 HE ARG A 32 0.753 34.981 -22.257 1.00 0.00 H new ATOM 0 HH11 ARG A 32 4.153 35.160 -23.192 1.00 0.00 H new ATOM 0 HH12 ARG A 32 4.732 35.155 -21.523 1.00 0.00 H new ATOM 0 HH21 ARG A 32 1.505 34.975 -20.116 1.00 0.00 H new ATOM 0 HH22 ARG A 32 3.239 35.051 -19.789 1.00 0.00 H new ATOM 501 N TRP A 33 2.425 32.810 -29.051 1.00 0.00 N ATOM 502 CA TRP A 33 2.808 32.922 -30.455 1.00 0.00 C ATOM 503 C TRP A 33 1.577 33.063 -31.343 1.00 0.00 C ATOM 504 O TRP A 33 1.639 33.664 -32.415 1.00 0.00 O ATOM 505 CB TRP A 33 3.623 31.701 -30.881 1.00 0.00 C ATOM 506 CG TRP A 33 4.115 31.780 -32.295 1.00 0.00 C ATOM 507 CD1 TRP A 33 3.482 31.309 -33.410 1.00 0.00 C ATOM 508 CD2 TRP A 33 5.342 32.362 -32.744 1.00 0.00 C ATOM 509 NE1 TRP A 33 4.243 31.563 -34.525 1.00 0.00 N ATOM 510 CE2 TRP A 33 5.388 32.209 -34.144 1.00 0.00 C ATOM 511 CE3 TRP A 33 6.408 33.000 -32.102 1.00 0.00 C ATOM 512 CZ2 TRP A 33 6.457 32.671 -34.908 1.00 0.00 C ATOM 513 CZ3 TRP A 33 7.467 33.456 -32.861 1.00 0.00 C ATOM 514 CH2 TRP A 33 7.486 33.291 -34.253 1.00 0.00 C ATOM 0 H TRP A 33 2.761 31.966 -28.588 1.00 0.00 H new ATOM 0 HA TRP A 33 3.421 33.816 -30.570 1.00 0.00 H new ATOM 0 HB2 TRP A 33 4.477 31.591 -30.212 1.00 0.00 H new ATOM 0 HB3 TRP A 33 3.011 30.806 -30.766 1.00 0.00 H new ATOM 0 HD1 TRP A 33 2.524 30.810 -33.414 1.00 0.00 H new ATOM 0 HE1 TRP A 33 3.995 31.311 -35.482 1.00 0.00 H new ATOM 0 HE3 TRP A 33 6.403 33.134 -31.030 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 6.473 32.544 -35.980 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 8.296 33.949 -32.374 1.00 0.00 H new ATOM 0 HH2 TRP A 33 8.329 33.660 -34.819 1.00 0.00 H new ATOM 525 N ASN A 34 0.458 32.503 -30.892 1.00 0.00 N ATOM 526 CA ASN A 34 -0.787 32.567 -31.648 1.00 0.00 C ATOM 527 C ASN A 34 -1.371 33.976 -31.619 1.00 0.00 C ATOM 528 O ASN A 34 -2.100 34.376 -32.525 1.00 0.00 O ATOM 529 CB ASN A 34 -1.801 31.569 -31.084 1.00 0.00 C ATOM 530 CG ASN A 34 -3.202 31.808 -31.614 1.00 0.00 C ATOM 531 OD1 ASN A 34 -3.514 31.468 -32.755 1.00 0.00 O ATOM 532 ND2 ASN A 34 -4.056 32.398 -30.784 1.00 0.00 N ATOM 0 H ASN A 34 0.389 32.000 -30.007 1.00 0.00 H new ATOM 0 HA ASN A 34 -0.568 32.307 -32.684 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -1.488 30.556 -31.335 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -1.810 31.639 -29.996 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -5.012 32.585 -31.085 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -3.755 32.663 -29.846 1.00 0.00 H new ATOM 539 N SER A 35 -1.045 34.723 -30.568 1.00 0.00 N ATOM 540 CA SER A 35 -1.540 36.086 -30.417 1.00 0.00 C ATOM 541 C SER A 35 -0.637 37.076 -31.150 1.00 0.00 C ATOM 542 O SER A 35 -0.899 38.279 -31.164 1.00 0.00 O ATOM 543 CB SER A 35 -1.627 36.459 -28.937 1.00 0.00 C ATOM 544 OG SER A 35 -2.570 37.496 -28.726 1.00 0.00 O ATOM 0 H SER A 35 -0.441 34.407 -29.809 1.00 0.00 H new ATOM 0 HA SER A 35 -2.537 36.135 -30.856 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.909 35.582 -28.354 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.647 36.777 -28.581 1.00 0.00 H new ATOM 0 HG SER A 35 -2.438 38.200 -29.395 1.00 0.00 H new ATOM 550 N SER A 36 0.426 36.559 -31.759 1.00 0.00 N ATOM 551 CA SER A 36 1.369 37.395 -32.490 1.00 0.00 C ATOM 552 C SER A 36 1.877 38.536 -31.613 1.00 0.00 C ATOM 553 O SER A 36 2.077 39.657 -32.084 1.00 0.00 O ATOM 554 CB SER A 36 0.711 37.961 -33.751 1.00 0.00 C ATOM 555 OG SER A 36 0.662 36.988 -34.781 1.00 0.00 O ATOM 0 H SER A 36 0.655 35.565 -31.760 1.00 0.00 H new ATOM 0 HA SER A 36 2.218 36.775 -32.778 1.00 0.00 H new ATOM 0 HB2 SER A 36 -0.299 38.299 -33.518 1.00 0.00 H new ATOM 0 HB3 SER A 36 1.268 38.832 -34.096 1.00 0.00 H new ATOM 0 HG SER A 36 0.236 37.373 -35.575 1.00 0.00 H new ATOM 561 N LYS A 37 2.086 38.243 -30.334 1.00 0.00 N ATOM 562 CA LYS A 37 2.572 39.241 -29.389 1.00 0.00 C ATOM 563 C LYS A 37 3.870 39.871 -29.883 1.00 0.00 C ATOM 564 O LYS A 37 4.749 39.179 -30.396 1.00 0.00 O ATOM 565 CB LYS A 37 2.790 38.607 -28.014 1.00 0.00 C ATOM 566 CG LYS A 37 2.589 39.573 -26.859 1.00 0.00 C ATOM 567 CD LYS A 37 3.193 39.037 -25.572 1.00 0.00 C ATOM 568 CE LYS A 37 3.583 40.164 -24.628 1.00 0.00 C ATOM 569 NZ LYS A 37 4.591 39.725 -23.624 1.00 0.00 N1+ ATOM 0 H LYS A 37 1.926 37.321 -29.928 1.00 0.00 H new ATOM 0 HA LYS A 37 1.818 40.024 -29.305 1.00 0.00 H new ATOM 0 HB2 LYS A 37 2.105 37.767 -27.898 1.00 0.00 H new ATOM 0 HB3 LYS A 37 3.801 38.202 -27.966 1.00 0.00 H new ATOM 0 HG2 LYS A 37 3.044 40.533 -27.103 1.00 0.00 H new ATOM 0 HG3 LYS A 37 1.524 39.752 -26.715 1.00 0.00 H new ATOM 0 HD2 LYS A 37 2.477 38.379 -25.079 1.00 0.00 H new ATOM 0 HD3 LYS A 37 4.071 38.435 -25.804 1.00 0.00 H new ATOM 0 HE2 LYS A 37 3.984 40.998 -25.204 1.00 0.00 H new ATOM 0 HE3 LYS A 37 2.695 40.530 -24.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 5.111 40.553 -23.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 4.109 39.254 -22.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 5.257 39.062 -24.068 1.00 0.00 H new ATOM 583 N GLN A 38 3.984 41.185 -29.722 1.00 0.00 N ATOM 584 CA GLN A 38 5.176 41.906 -30.150 1.00 0.00 C ATOM 585 C GLN A 38 6.420 41.366 -29.452 1.00 0.00 C ATOM 586 O GLN A 38 7.521 41.418 -29.998 1.00 0.00 O ATOM 587 CB GLN A 38 5.025 43.401 -29.863 1.00 0.00 C ATOM 588 CG GLN A 38 5.070 43.743 -28.383 1.00 0.00 C ATOM 589 CD GLN A 38 4.482 45.108 -28.081 1.00 0.00 C ATOM 590 OE1 GLN A 38 3.911 45.758 -28.957 1.00 0.00 O ATOM 591 NE2 GLN A 38 4.619 45.550 -26.837 1.00 0.00 N ATOM 0 H GLN A 38 3.265 41.772 -29.298 1.00 0.00 H new ATOM 0 HA GLN A 38 5.292 41.759 -31.224 1.00 0.00 H new ATOM 0 HB2 GLN A 38 5.819 43.943 -30.377 1.00 0.00 H new ATOM 0 HB3 GLN A 38 4.080 43.749 -30.279 1.00 0.00 H new ATOM 0 HG2 GLN A 38 4.524 42.984 -27.822 1.00 0.00 H new ATOM 0 HG3 GLN A 38 6.104 43.712 -28.038 1.00 0.00 H new ATOM 0 HE21 GLN A 38 5.100 44.978 -26.143 1.00 0.00 H new ATOM 0 HE22 GLN A 38 4.244 46.462 -26.575 1.00 0.00 H new ATOM 600 N ASN A 39 6.235 40.848 -28.243 1.00 0.00 N ATOM 601 CA ASN A 39 7.343 40.298 -27.470 1.00 0.00 C ATOM 602 C ASN A 39 7.865 39.013 -28.104 1.00 0.00 C ATOM 603 O ASN A 39 7.239 37.957 -28.004 1.00 0.00 O ATOM 604 CB ASN A 39 6.902 40.026 -26.030 1.00 0.00 C ATOM 605 CG ASN A 39 8.065 39.664 -25.127 1.00 0.00 C ATOM 606 OD1 ASN A 39 8.809 40.536 -24.676 1.00 0.00 O ATOM 607 ND2 ASN A 39 8.229 38.373 -24.861 1.00 0.00 N ATOM 0 H ASN A 39 5.329 40.797 -27.777 1.00 0.00 H new ATOM 0 HA ASN A 39 8.148 41.032 -27.465 1.00 0.00 H new ATOM 0 HB2 ASN A 39 6.399 40.909 -25.634 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.174 39.215 -26.023 1.00 0.00 H new ATOM 0 HD21 ASN A 39 8.996 38.069 -24.261 1.00 0.00 H new ATOM 0 HD22 ASN A 39 7.588 37.685 -25.257 1.00 0.00 H new ATOM 614 N LYS A 40 9.017 39.109 -28.760 1.00 0.00 N ATOM 615 CA LYS A 40 9.626 37.954 -29.410 1.00 0.00 C ATOM 616 C LYS A 40 10.582 37.237 -28.462 1.00 0.00 C ATOM 617 O LYS A 40 10.524 36.016 -28.316 1.00 0.00 O ATOM 618 CB LYS A 40 10.375 38.391 -30.672 1.00 0.00 C ATOM 619 CG LYS A 40 9.518 39.184 -31.644 1.00 0.00 C ATOM 620 CD LYS A 40 8.418 38.326 -32.246 1.00 0.00 C ATOM 621 CE LYS A 40 8.017 38.821 -33.626 1.00 0.00 C ATOM 622 NZ LYS A 40 7.110 37.863 -34.319 1.00 0.00 N1+ ATOM 0 H LYS A 40 9.548 39.975 -28.856 1.00 0.00 H new ATOM 0 HA LYS A 40 8.830 37.262 -29.687 1.00 0.00 H new ATOM 0 HB2 LYS A 40 11.235 38.995 -30.383 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.762 37.507 -31.179 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.075 40.036 -31.128 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.145 39.584 -32.440 1.00 0.00 H new ATOM 0 HD2 LYS A 40 8.757 37.292 -32.314 1.00 0.00 H new ATOM 0 HD3 LYS A 40 7.548 38.334 -31.589 1.00 0.00 H new ATOM 0 HE2 LYS A 40 7.522 39.788 -33.535 1.00 0.00 H new ATOM 0 HE3 LYS A 40 8.911 38.976 -34.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 6.860 38.238 -35.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.591 36.947 -34.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 6.245 37.734 -33.756 1.00 0.00 H new ATOM 636 N GLN A 41 11.457 38.002 -27.820 1.00 0.00 N ATOM 637 CA GLN A 41 12.424 37.438 -26.885 1.00 0.00 C ATOM 638 C GLN A 41 12.188 37.966 -25.474 1.00 0.00 C ATOM 639 O GLN A 41 11.970 39.165 -25.308 1.00 0.00 O ATOM 640 CB GLN A 41 13.849 37.766 -27.334 1.00 0.00 C ATOM 641 CG GLN A 41 14.910 36.906 -26.666 1.00 0.00 C ATOM 642 CD GLN A 41 16.286 37.541 -26.705 1.00 0.00 C ATOM 643 OE1 GLN A 41 16.608 38.299 -27.620 1.00 0.00 O ATOM 644 NE2 GLN A 41 17.108 37.235 -25.707 1.00 0.00 N ATOM 0 H GLN A 41 11.517 39.014 -27.929 1.00 0.00 H new ATOM 0 HA GLN A 41 12.294 36.356 -26.874 1.00 0.00 H new ATOM 0 HB2 GLN A 41 13.919 37.640 -28.415 1.00 0.00 H new ATOM 0 HB3 GLN A 41 14.056 38.815 -27.121 1.00 0.00 H new ATOM 0 HG2 GLN A 41 14.626 36.726 -25.629 1.00 0.00 H new ATOM 0 HG3 GLN A 41 14.948 35.935 -27.159 1.00 0.00 H new ATOM 0 HE21 GLN A 41 16.800 36.602 -24.969 1.00 0.00 H new ATOM 0 HE22 GLN A 41 18.047 37.633 -25.679 1.00 0.00 H new TER 653 GLN A 41 ATOM 654 N MET B 101 1.766 -0.110 -13.954 1.00 0.00 N ATOM 655 CA MET B 101 0.851 -0.373 -12.848 1.00 0.00 C ATOM 656 C MET B 101 0.682 0.866 -11.977 1.00 0.00 C ATOM 657 O MET B 101 1.500 1.786 -12.020 1.00 0.00 O ATOM 658 CB MET B 101 1.363 -1.542 -12.002 1.00 0.00 C ATOM 659 CG MET B 101 2.707 -1.273 -11.345 1.00 0.00 C ATOM 660 SD MET B 101 4.097 -1.808 -12.362 1.00 0.00 S ATOM 661 CE MET B 101 3.969 -3.587 -12.200 1.00 0.00 C ATOM 0 HA MET B 101 -0.121 -0.636 -13.266 1.00 0.00 H new ATOM 0 HB2 MET B 101 0.629 -1.769 -11.229 1.00 0.00 H new ATOM 0 HB3 MET B 101 1.447 -2.427 -12.633 1.00 0.00 H new ATOM 0 HG2 MET B 101 2.800 -0.206 -11.141 1.00 0.00 H new ATOM 0 HG3 MET B 101 2.746 -1.786 -10.384 1.00 0.00 H new ATOM 0 HE1 MET B 101 4.924 -4.045 -12.457 1.00 0.00 H new ATOM 0 HE2 MET B 101 3.709 -3.841 -11.172 1.00 0.00 H new ATOM 0 HE3 MET B 101 3.196 -3.959 -12.872 1.00 0.00 H new ATOM 671 N THR B 102 -0.384 0.886 -11.184 1.00 0.00 N ATOM 672 CA THR B 102 -0.662 2.012 -10.301 1.00 0.00 C ATOM 673 C THR B 102 -1.172 1.538 -8.946 1.00 0.00 C ATOM 674 O THR B 102 -1.837 0.505 -8.849 1.00 0.00 O ATOM 675 CB THR B 102 -1.698 2.969 -10.921 1.00 0.00 C ATOM 676 OG1 THR B 102 -2.885 2.248 -11.267 1.00 0.00 O ATOM 677 CG2 THR B 102 -1.133 3.649 -12.160 1.00 0.00 C ATOM 0 H THR B 102 -1.071 0.133 -11.135 1.00 0.00 H new ATOM 0 HA THR B 102 0.279 2.545 -10.164 1.00 0.00 H new ATOM 0 HB THR B 102 -1.940 3.734 -10.184 1.00 0.00 H new ATOM 0 HG1 THR B 102 -3.539 2.864 -11.659 1.00 0.00 H new ATOM 0 HG21 THR B 102 -1.882 4.320 -12.580 1.00 0.00 H new ATOM 0 HG22 THR B 102 -0.246 4.221 -11.889 1.00 0.00 H new ATOM 0 HG23 THR B 102 -0.866 2.894 -12.900 1.00 0.00 H new ATOM 685 N ARG B 103 -0.858 2.296 -7.902 1.00 0.00 N ATOM 686 CA ARG B 103 -1.284 1.952 -6.551 1.00 0.00 C ATOM 687 C ARG B 103 -2.201 3.030 -5.980 1.00 0.00 C ATOM 688 O ARG B 103 -2.500 4.022 -6.643 1.00 0.00 O ATOM 689 CB ARG B 103 -0.069 1.766 -5.640 1.00 0.00 C ATOM 690 CG ARG B 103 0.957 2.881 -5.760 1.00 0.00 C ATOM 691 CD ARG B 103 2.223 2.558 -4.981 1.00 0.00 C ATOM 692 NE ARG B 103 2.877 1.350 -5.477 1.00 0.00 N ATOM 693 CZ ARG B 103 3.773 0.660 -4.780 1.00 0.00 C ATOM 694 NH1 ARG B 103 4.119 1.057 -3.563 1.00 0.00 N1+ ATOM 695 NH2 ARG B 103 4.324 -0.430 -5.300 1.00 0.00 N ATOM 0 H ARG B 103 -0.309 3.154 -7.965 1.00 0.00 H new ATOM 0 HA ARG B 103 -1.838 1.015 -6.600 1.00 0.00 H new ATOM 0 HB2 ARG B 103 -0.407 1.704 -4.606 1.00 0.00 H new ATOM 0 HB3 ARG B 103 0.410 0.816 -5.876 1.00 0.00 H new ATOM 0 HG2 ARG B 103 1.204 3.038 -6.810 1.00 0.00 H new ATOM 0 HG3 ARG B 103 0.529 3.813 -5.391 1.00 0.00 H new ATOM 0 HD2 ARG B 103 2.914 3.398 -5.048 1.00 0.00 H new ATOM 0 HD3 ARG B 103 1.977 2.431 -3.927 1.00 0.00 H new ATOM 0 HE ARG B 103 2.632 1.018 -6.410 1.00 0.00 H new ATOM 0 HH11 ARG B 103 3.697 1.894 -3.160 1.00 0.00 H new ATOM 0 HH12 ARG B 103 4.807 0.526 -3.030 1.00 0.00 H new ATOM 0 HH21 ARG B 103 4.060 -0.738 -6.236 1.00 0.00 H new ATOM 0 HH22 ARG B 103 5.012 -0.959 -4.764 1.00 0.00 H new ATOM 709 N GLY B 104 -2.646 2.826 -4.743 1.00 0.00 N ATOM 710 CA GLY B 104 -3.526 3.788 -4.103 1.00 0.00 C ATOM 711 C GLY B 104 -4.982 3.570 -4.461 1.00 0.00 C ATOM 712 O GLY B 104 -5.450 2.433 -4.530 1.00 0.00 O ATOM 0 H GLY B 104 -2.413 2.013 -4.173 1.00 0.00 H new ATOM 0 HA2 GLY B 104 -3.407 3.721 -3.022 1.00 0.00 H new ATOM 0 HA3 GLY B 104 -3.230 4.796 -4.394 1.00 0.00 H new ATOM 716 N THR B 105 -5.704 4.662 -4.689 1.00 0.00 N ATOM 717 CA THR B 105 -7.117 4.587 -5.039 1.00 0.00 C ATOM 718 C THR B 105 -7.571 5.845 -5.768 1.00 0.00 C ATOM 719 O THR B 105 -7.248 6.963 -5.361 1.00 0.00 O ATOM 720 CB THR B 105 -7.995 4.385 -3.790 1.00 0.00 C ATOM 721 OG1 THR B 105 -7.459 5.127 -2.689 1.00 0.00 O ATOM 722 CG2 THR B 105 -8.079 2.911 -3.421 1.00 0.00 C ATOM 0 H THR B 105 -5.333 5.611 -4.637 1.00 0.00 H new ATOM 0 HA THR B 105 -7.234 3.727 -5.699 1.00 0.00 H new ATOM 0 HB THR B 105 -8.999 4.745 -4.016 1.00 0.00 H new ATOM 0 HG1 THR B 105 -7.965 5.959 -2.578 1.00 0.00 H new ATOM 0 HG21 THR B 105 -8.704 2.793 -2.536 1.00 0.00 H new ATOM 0 HG22 THR B 105 -8.514 2.353 -4.250 1.00 0.00 H new ATOM 0 HG23 THR B 105 -7.079 2.531 -3.212 1.00 0.00 H new ATOM 730 N THR B 106 -8.325 5.660 -6.847 1.00 0.00 N ATOM 731 CA THR B 106 -8.824 6.781 -7.633 1.00 0.00 C ATOM 732 C THR B 106 -9.940 7.515 -6.897 1.00 0.00 C ATOM 733 O THR B 106 -10.397 8.569 -7.338 1.00 0.00 O ATOM 734 CB THR B 106 -9.349 6.316 -9.005 1.00 0.00 C ATOM 735 OG1 THR B 106 -8.404 5.430 -9.615 1.00 0.00 O ATOM 736 CG2 THR B 106 -9.600 7.506 -9.919 1.00 0.00 C ATOM 0 H THR B 106 -8.604 4.743 -7.197 1.00 0.00 H new ATOM 0 HA THR B 106 -7.984 7.459 -7.784 1.00 0.00 H new ATOM 0 HB THR B 106 -10.292 5.791 -8.851 1.00 0.00 H new ATOM 0 HG1 THR B 106 -8.745 5.137 -10.486 1.00 0.00 H new ATOM 0 HG21 THR B 106 -9.970 7.154 -10.882 1.00 0.00 H new ATOM 0 HG22 THR B 106 -10.340 8.164 -9.464 1.00 0.00 H new ATOM 0 HG23 THR B 106 -8.669 8.054 -10.067 1.00 0.00 H new ATOM 744 N ASP B 107 -10.371 6.952 -5.774 1.00 0.00 N ATOM 745 CA ASP B 107 -11.432 7.554 -4.976 1.00 0.00 C ATOM 746 C ASP B 107 -11.082 8.992 -4.602 1.00 0.00 C ATOM 747 O ASP B 107 -10.059 9.246 -3.968 1.00 0.00 O ATOM 748 CB ASP B 107 -11.676 6.731 -3.710 1.00 0.00 C ATOM 749 CG ASP B 107 -10.507 6.786 -2.748 1.00 0.00 C ATOM 750 OD1 ASP B 107 -9.354 6.871 -3.219 1.00 0.00 O ATOM 751 OD2 ASP B 107 -10.745 6.745 -1.523 1.00 0.00 O1- ATOM 0 H ASP B 107 -10.002 6.080 -5.396 1.00 0.00 H new ATOM 0 HA ASP B 107 -12.342 7.564 -5.575 1.00 0.00 H new ATOM 0 HB2 ASP B 107 -12.572 7.098 -3.209 1.00 0.00 H new ATOM 0 HB3 ASP B 107 -11.867 5.694 -3.986 1.00 0.00 H new ATOM 756 N ASN B 108 -11.937 9.927 -5.001 1.00 0.00 N ATOM 757 CA ASN B 108 -11.718 11.338 -4.710 1.00 0.00 C ATOM 758 C ASN B 108 -10.460 11.848 -5.407 1.00 0.00 C ATOM 759 O ASN B 108 -9.944 12.917 -5.077 1.00 0.00 O ATOM 760 CB ASN B 108 -11.602 11.557 -3.201 1.00 0.00 C ATOM 761 CG ASN B 108 -12.598 10.723 -2.417 1.00 0.00 C ATOM 762 OD1 ASN B 108 -12.273 10.178 -1.362 1.00 0.00 O ATOM 763 ND2 ASN B 108 -13.818 10.620 -2.931 1.00 0.00 N ATOM 0 H ASN B 108 -12.789 9.733 -5.527 1.00 0.00 H new ATOM 0 HA ASN B 108 -12.574 11.898 -5.087 1.00 0.00 H new ATOM 0 HB2 ASN B 108 -10.591 11.310 -2.877 1.00 0.00 H new ATOM 0 HB3 ASN B 108 -11.759 12.612 -2.977 1.00 0.00 H new ATOM 0 HD21 ASN B 108 -14.530 10.072 -2.448 1.00 0.00 H new ATOM 0 HD22 ASN B 108 -14.043 11.089 -3.808 1.00 0.00 H new ATOM 770 N LEU B 109 -9.974 11.079 -6.374 1.00 0.00 N ATOM 771 CA LEU B 109 -8.776 11.452 -7.120 1.00 0.00 C ATOM 772 C LEU B 109 -9.089 11.622 -8.602 1.00 0.00 C ATOM 773 O LEU B 109 -8.214 11.464 -9.454 1.00 0.00 O ATOM 774 CB LEU B 109 -7.685 10.396 -6.935 1.00 0.00 C ATOM 775 CG LEU B 109 -6.796 10.559 -5.702 1.00 0.00 C ATOM 776 CD1 LEU B 109 -5.777 9.432 -5.625 1.00 0.00 C ATOM 777 CD2 LEU B 109 -6.097 11.910 -5.724 1.00 0.00 C ATOM 0 H LEU B 109 -10.390 10.193 -6.661 1.00 0.00 H new ATOM 0 HA LEU B 109 -8.419 12.405 -6.731 1.00 0.00 H new ATOM 0 HB2 LEU B 109 -8.160 9.416 -6.889 1.00 0.00 H new ATOM 0 HB3 LEU B 109 -7.049 10.401 -7.820 1.00 0.00 H new ATOM 0 HG LEU B 109 -7.427 10.512 -4.815 1.00 0.00 H new ATOM 0 HD11 LEU B 109 -5.153 9.565 -4.741 1.00 0.00 H new ATOM 0 HD12 LEU B 109 -6.296 8.476 -5.562 1.00 0.00 H new ATOM 0 HD13 LEU B 109 -5.150 9.447 -6.517 1.00 0.00 H new ATOM 0 HD21 LEU B 109 -5.468 12.009 -4.839 1.00 0.00 H new ATOM 0 HD22 LEU B 109 -5.479 11.985 -6.618 1.00 0.00 H new ATOM 0 HD23 LEU B 109 -6.842 12.705 -5.730 1.00 0.00 H new ATOM 789 N ILE B 110 -10.342 11.945 -8.905 1.00 0.00 N ATOM 790 CA ILE B 110 -10.769 12.140 -10.285 1.00 0.00 C ATOM 791 C ILE B 110 -10.089 13.357 -10.904 1.00 0.00 C ATOM 792 O ILE B 110 -9.502 13.288 -11.984 1.00 0.00 O ATOM 793 CB ILE B 110 -12.296 12.314 -10.382 1.00 0.00 C ATOM 794 CG1 ILE B 110 -13.000 11.408 -9.370 1.00 0.00 C ATOM 795 CG2 ILE B 110 -12.774 12.010 -11.795 1.00 0.00 C ATOM 796 CD1 ILE B 110 -12.524 9.972 -9.410 1.00 0.00 C ATOM 0 H ILE B 110 -11.079 12.077 -8.213 1.00 0.00 H new ATOM 0 HA ILE B 110 -10.478 11.245 -10.835 1.00 0.00 H new ATOM 0 HB ILE B 110 -12.545 13.349 -10.149 1.00 0.00 H new ATOM 0 HG12 ILE B 110 -12.843 11.806 -8.368 1.00 0.00 H new ATOM 0 HG13 ILE B 110 -14.073 11.432 -9.558 1.00 0.00 H new ATOM 0 HG21 ILE B 110 -13.855 12.137 -11.849 1.00 0.00 H new ATOM 0 HG22 ILE B 110 -12.293 12.692 -12.496 1.00 0.00 H new ATOM 0 HG23 ILE B 110 -12.516 10.983 -12.053 1.00 0.00 H new ATOM 0 HD11 ILE B 110 -13.066 9.388 -8.666 1.00 0.00 H new ATOM 0 HD12 ILE B 110 -12.706 9.556 -10.401 1.00 0.00 H new ATOM 0 HD13 ILE B 110 -11.457 9.936 -9.192 1.00 0.00 H new ATOM 808 N PRO B 111 -10.170 14.499 -10.206 1.00 0.00 N ATOM 809 CA PRO B 111 -9.566 15.753 -10.666 1.00 0.00 C ATOM 810 C PRO B 111 -8.043 15.716 -10.618 1.00 0.00 C ATOM 811 O PRO B 111 -7.370 16.173 -11.542 1.00 0.00 O ATOM 812 CB PRO B 111 -10.108 16.791 -9.680 1.00 0.00 C ATOM 813 CG PRO B 111 -10.417 16.015 -8.445 1.00 0.00 C ATOM 814 CD PRO B 111 -10.856 14.654 -8.911 1.00 0.00 C ATOM 0 HA PRO B 111 -9.811 15.965 -11.707 1.00 0.00 H new ATOM 0 HB2 PRO B 111 -9.373 17.572 -9.484 1.00 0.00 H new ATOM 0 HB3 PRO B 111 -10.998 17.282 -10.072 1.00 0.00 H new ATOM 0 HG2 PRO B 111 -9.541 15.943 -7.800 1.00 0.00 H new ATOM 0 HG3 PRO B 111 -11.201 16.501 -7.865 1.00 0.00 H new ATOM 0 HD2 PRO B 111 -10.565 13.875 -8.206 1.00 0.00 H new ATOM 0 HD3 PRO B 111 -11.939 14.597 -9.021 1.00 0.00 H new ATOM 822 N VAL B 112 -7.503 15.166 -9.533 1.00 0.00 N ATOM 823 CA VAL B 112 -6.059 15.068 -9.364 1.00 0.00 C ATOM 824 C VAL B 112 -5.406 14.423 -10.582 1.00 0.00 C ATOM 825 O VAL B 112 -4.593 15.047 -11.267 1.00 0.00 O ATOM 826 CB VAL B 112 -5.694 14.254 -8.110 1.00 0.00 C ATOM 827 CG1 VAL B 112 -4.184 14.133 -7.970 1.00 0.00 C ATOM 828 CG2 VAL B 112 -6.304 14.887 -6.868 1.00 0.00 C ATOM 0 H VAL B 112 -8.045 14.782 -8.759 1.00 0.00 H new ATOM 0 HA VAL B 112 -5.685 16.085 -9.249 1.00 0.00 H new ATOM 0 HB VAL B 112 -6.105 13.250 -8.218 1.00 0.00 H new ATOM 0 HG11 VAL B 112 -3.947 13.554 -7.077 1.00 0.00 H new ATOM 0 HG12 VAL B 112 -3.776 13.631 -8.847 1.00 0.00 H new ATOM 0 HG13 VAL B 112 -3.746 15.127 -7.885 1.00 0.00 H new ATOM 0 HG21 VAL B 112 -6.036 14.298 -5.991 1.00 0.00 H new ATOM 0 HG22 VAL B 112 -5.925 15.902 -6.754 1.00 0.00 H new ATOM 0 HG23 VAL B 112 -7.389 14.914 -6.969 1.00 0.00 H new ATOM 838 N TYR B 113 -5.768 13.173 -10.848 1.00 0.00 N ATOM 839 CA TYR B 113 -5.216 12.442 -11.983 1.00 0.00 C ATOM 840 C TYR B 113 -5.586 13.120 -13.299 1.00 0.00 C ATOM 841 O TYR B 113 -4.761 13.237 -14.203 1.00 0.00 O ATOM 842 CB TYR B 113 -5.719 10.999 -11.980 1.00 0.00 C ATOM 843 CG TYR B 113 -4.927 10.083 -11.075 1.00 0.00 C ATOM 844 CD1 TYR B 113 -4.687 10.422 -9.748 1.00 0.00 C ATOM 845 CD2 TYR B 113 -4.418 8.879 -11.544 1.00 0.00 C ATOM 846 CE1 TYR B 113 -3.963 9.589 -8.917 1.00 0.00 C ATOM 847 CE2 TYR B 113 -3.693 8.039 -10.721 1.00 0.00 C ATOM 848 CZ TYR B 113 -3.469 8.399 -9.408 1.00 0.00 C ATOM 849 OH TYR B 113 -2.746 7.566 -8.585 1.00 0.00 O ATOM 0 H TYR B 113 -6.441 12.645 -10.293 1.00 0.00 H new ATOM 0 HA TYR B 113 -4.130 12.441 -11.889 1.00 0.00 H new ATOM 0 HB2 TYR B 113 -6.764 10.988 -11.669 1.00 0.00 H new ATOM 0 HB3 TYR B 113 -5.685 10.609 -12.997 1.00 0.00 H new ATOM 0 HD1 TYR B 113 -5.073 11.353 -9.360 1.00 0.00 H new ATOM 0 HD2 TYR B 113 -4.592 8.594 -12.571 1.00 0.00 H new ATOM 0 HE1 TYR B 113 -3.785 9.868 -7.889 1.00 0.00 H new ATOM 0 HE2 TYR B 113 -3.304 7.107 -11.103 1.00 0.00 H new ATOM 0 HH TYR B 113 -2.472 6.769 -9.085 1.00 0.00 H new ATOM 859 N ALA B 114 -6.835 13.565 -13.396 1.00 0.00 N ATOM 860 CA ALA B 114 -7.316 14.232 -14.599 1.00 0.00 C ATOM 861 C ALA B 114 -6.401 15.388 -14.989 1.00 0.00 C ATOM 862 O ALA B 114 -5.920 15.459 -16.120 1.00 0.00 O ATOM 863 CB ALA B 114 -8.739 14.729 -14.394 1.00 0.00 C ATOM 0 H ALA B 114 -7.531 13.475 -12.656 1.00 0.00 H new ATOM 0 HA ALA B 114 -7.310 13.507 -15.413 1.00 0.00 H new ATOM 0 HB1 ALA B 114 -9.085 15.225 -15.301 1.00 0.00 H new ATOM 0 HB2 ALA B 114 -9.391 13.884 -14.171 1.00 0.00 H new ATOM 0 HB3 ALA B 114 -8.762 15.434 -13.563 1.00 0.00 H new ATOM 869 N SER B 115 -6.165 16.294 -14.045 1.00 0.00 N ATOM 870 CA SER B 115 -5.311 17.450 -14.290 1.00 0.00 C ATOM 871 C SER B 115 -3.886 17.013 -14.616 1.00 0.00 C ATOM 872 O SER B 115 -3.340 17.368 -15.660 1.00 0.00 O ATOM 873 CB SER B 115 -5.309 18.377 -13.073 1.00 0.00 C ATOM 874 OG SER B 115 -5.183 17.638 -11.871 1.00 0.00 O ATOM 0 H SER B 115 -6.554 16.249 -13.103 1.00 0.00 H new ATOM 0 HA SER B 115 -5.711 17.991 -15.148 1.00 0.00 H new ATOM 0 HB2 SER B 115 -4.487 19.088 -13.155 1.00 0.00 H new ATOM 0 HB3 SER B 115 -6.231 18.957 -13.052 1.00 0.00 H new ATOM 0 HG SER B 115 -6.074 17.407 -11.534 1.00 0.00 H new ATOM 880 N ILE B 116 -3.290 16.242 -13.712 1.00 0.00 N ATOM 881 CA ILE B 116 -1.929 15.756 -13.903 1.00 0.00 C ATOM 882 C ILE B 116 -1.757 15.130 -15.282 1.00 0.00 C ATOM 883 O ILE B 116 -0.761 15.371 -15.965 1.00 0.00 O ATOM 884 CB ILE B 116 -1.547 14.718 -12.830 1.00 0.00 C ATOM 885 CG1 ILE B 116 -1.559 15.361 -11.441 1.00 0.00 C ATOM 886 CG2 ILE B 116 -0.180 14.123 -13.132 1.00 0.00 C ATOM 887 CD1 ILE B 116 -1.514 14.358 -10.311 1.00 0.00 C ATOM 0 H ILE B 116 -3.728 15.941 -12.841 1.00 0.00 H new ATOM 0 HA ILE B 116 -1.270 16.620 -13.814 1.00 0.00 H new ATOM 0 HB ILE B 116 -2.283 13.914 -12.844 1.00 0.00 H new ATOM 0 HG12 ILE B 116 -0.706 16.033 -11.353 1.00 0.00 H new ATOM 0 HG13 ILE B 116 -2.457 15.971 -11.339 1.00 0.00 H new ATOM 0 HG21 ILE B 116 0.076 13.392 -12.365 1.00 0.00 H new ATOM 0 HG22 ILE B 116 -0.203 13.635 -14.106 1.00 0.00 H new ATOM 0 HG23 ILE B 116 0.568 14.916 -13.141 1.00 0.00 H new ATOM 0 HD11 ILE B 116 -1.525 14.884 -9.357 1.00 0.00 H new ATOM 0 HD12 ILE B 116 -2.381 13.701 -10.373 1.00 0.00 H new ATOM 0 HD13 ILE B 116 -0.603 13.765 -10.387 1.00 0.00 H new ATOM 899 N LEU B 117 -2.734 14.328 -15.688 1.00 0.00 N ATOM 900 CA LEU B 117 -2.692 13.668 -16.989 1.00 0.00 C ATOM 901 C LEU B 117 -2.590 14.691 -18.116 1.00 0.00 C ATOM 902 O LEU B 117 -1.738 14.577 -18.996 1.00 0.00 O ATOM 903 CB LEU B 117 -3.938 12.802 -17.184 1.00 0.00 C ATOM 904 CG LEU B 117 -3.760 11.304 -16.929 1.00 0.00 C ATOM 905 CD1 LEU B 117 -3.352 11.052 -15.487 1.00 0.00 C ATOM 906 CD2 LEU B 117 -5.040 10.551 -17.262 1.00 0.00 C ATOM 0 H LEU B 117 -3.565 14.118 -15.136 1.00 0.00 H new ATOM 0 HA LEU B 117 -1.807 13.033 -17.018 1.00 0.00 H new ATOM 0 HB2 LEU B 117 -4.721 13.173 -16.522 1.00 0.00 H new ATOM 0 HB3 LEU B 117 -4.294 12.937 -18.205 1.00 0.00 H new ATOM 0 HG LEU B 117 -2.966 10.937 -17.579 1.00 0.00 H new ATOM 0 HD11 LEU B 117 -3.230 9.981 -15.325 1.00 0.00 H new ATOM 0 HD12 LEU B 117 -2.409 11.559 -15.282 1.00 0.00 H new ATOM 0 HD13 LEU B 117 -4.123 11.435 -14.818 1.00 0.00 H new ATOM 0 HD21 LEU B 117 -4.895 9.487 -17.075 1.00 0.00 H new ATOM 0 HD22 LEU B 117 -5.853 10.922 -16.638 1.00 0.00 H new ATOM 0 HD23 LEU B 117 -5.289 10.704 -18.312 1.00 0.00 H new ATOM 918 N ALA B 118 -3.463 15.693 -18.080 1.00 0.00 N ATOM 919 CA ALA B 118 -3.468 16.739 -19.094 1.00 0.00 C ATOM 920 C ALA B 118 -2.092 17.382 -19.226 1.00 0.00 C ATOM 921 O ALA B 118 -1.567 17.528 -20.330 1.00 0.00 O ATOM 922 CB ALA B 118 -4.516 17.791 -18.764 1.00 0.00 C ATOM 0 H ALA B 118 -4.176 15.802 -17.359 1.00 0.00 H new ATOM 0 HA ALA B 118 -3.719 16.281 -20.051 1.00 0.00 H new ATOM 0 HB1 ALA B 118 -4.508 18.566 -19.531 1.00 0.00 H new ATOM 0 HB2 ALA B 118 -5.501 17.325 -18.729 1.00 0.00 H new ATOM 0 HB3 ALA B 118 -4.291 18.237 -17.795 1.00 0.00 H new ATOM 928 N ALA B 119 -1.514 17.767 -18.093 1.00 0.00 N ATOM 929 CA ALA B 119 -0.198 18.395 -18.082 1.00 0.00 C ATOM 930 C ALA B 119 0.829 17.531 -18.807 1.00 0.00 C ATOM 931 O ALA B 119 1.624 18.031 -19.604 1.00 0.00 O ATOM 932 CB ALA B 119 0.249 18.659 -16.651 1.00 0.00 C ATOM 0 H ALA B 119 -1.936 17.655 -17.171 1.00 0.00 H new ATOM 0 HA ALA B 119 -0.272 19.346 -18.610 1.00 0.00 H new ATOM 0 HB1 ALA B 119 1.233 19.128 -16.658 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -0.466 19.322 -16.163 1.00 0.00 H new ATOM 0 HB3 ALA B 119 0.300 17.716 -16.106 1.00 0.00 H new ATOM 938 N VAL B 120 0.807 16.232 -18.527 1.00 0.00 N ATOM 939 CA VAL B 120 1.735 15.298 -19.153 1.00 0.00 C ATOM 940 C VAL B 120 1.529 15.247 -20.664 1.00 0.00 C ATOM 941 O VAL B 120 2.449 15.516 -21.435 1.00 0.00 O ATOM 942 CB VAL B 120 1.577 13.879 -18.578 1.00 0.00 C ATOM 943 CG1 VAL B 120 2.714 12.982 -19.046 1.00 0.00 C ATOM 944 CG2 VAL B 120 1.516 13.925 -17.058 1.00 0.00 C ATOM 0 H VAL B 120 0.156 15.802 -17.870 1.00 0.00 H new ATOM 0 HA VAL B 120 2.740 15.660 -18.938 1.00 0.00 H new ATOM 0 HB VAL B 120 0.641 13.459 -18.945 1.00 0.00 H new ATOM 0 HG11 VAL B 120 2.585 11.983 -18.629 1.00 0.00 H new ATOM 0 HG12 VAL B 120 2.708 12.924 -20.134 1.00 0.00 H new ATOM 0 HG13 VAL B 120 3.665 13.395 -18.710 1.00 0.00 H new ATOM 0 HG21 VAL B 120 1.404 12.913 -16.668 1.00 0.00 H new ATOM 0 HG22 VAL B 120 2.435 14.364 -16.670 1.00 0.00 H new ATOM 0 HG23 VAL B 120 0.665 14.530 -16.746 1.00 0.00 H new ATOM 954 N VAL B 121 0.314 14.902 -21.078 1.00 0.00 N ATOM 955 CA VAL B 121 -0.015 14.819 -22.496 1.00 0.00 C ATOM 956 C VAL B 121 0.418 16.080 -23.236 1.00 0.00 C ATOM 957 O VAL B 121 1.089 16.009 -24.265 1.00 0.00 O ATOM 958 CB VAL B 121 -1.525 14.603 -22.711 1.00 0.00 C ATOM 959 CG1 VAL B 121 -1.850 14.545 -24.195 1.00 0.00 C ATOM 960 CG2 VAL B 121 -1.987 13.338 -22.005 1.00 0.00 C ATOM 0 H VAL B 121 -0.459 14.676 -20.452 1.00 0.00 H new ATOM 0 HA VAL B 121 0.527 13.962 -22.896 1.00 0.00 H new ATOM 0 HB VAL B 121 -2.061 15.449 -22.280 1.00 0.00 H new ATOM 0 HG11 VAL B 121 -2.921 14.392 -24.327 1.00 0.00 H new ATOM 0 HG12 VAL B 121 -1.556 15.482 -24.669 1.00 0.00 H new ATOM 0 HG13 VAL B 121 -1.306 13.720 -24.655 1.00 0.00 H new ATOM 0 HG21 VAL B 121 -3.056 13.201 -22.167 1.00 0.00 H new ATOM 0 HG22 VAL B 121 -1.446 12.480 -22.405 1.00 0.00 H new ATOM 0 HG23 VAL B 121 -1.790 13.425 -20.936 1.00 0.00 H new ATOM 970 N VAL B 122 0.028 17.234 -22.704 1.00 0.00 N ATOM 971 CA VAL B 122 0.377 18.512 -23.313 1.00 0.00 C ATOM 972 C VAL B 122 1.889 18.704 -23.362 1.00 0.00 C ATOM 973 O VAL B 122 2.439 19.139 -24.372 1.00 0.00 O ATOM 974 CB VAL B 122 -0.254 19.690 -22.547 1.00 0.00 C ATOM 975 CG1 VAL B 122 0.072 21.008 -23.232 1.00 0.00 C ATOM 976 CG2 VAL B 122 -1.758 19.500 -22.426 1.00 0.00 C ATOM 0 H VAL B 122 -0.529 17.310 -21.853 1.00 0.00 H new ATOM 0 HA VAL B 122 -0.017 18.496 -24.329 1.00 0.00 H new ATOM 0 HB VAL B 122 0.168 19.717 -21.542 1.00 0.00 H new ATOM 0 HG11 VAL B 122 -0.382 21.829 -22.677 1.00 0.00 H new ATOM 0 HG12 VAL B 122 1.153 21.145 -23.262 1.00 0.00 H new ATOM 0 HG13 VAL B 122 -0.321 20.997 -24.249 1.00 0.00 H new ATOM 0 HG21 VAL B 122 -2.188 20.341 -21.882 1.00 0.00 H new ATOM 0 HG22 VAL B 122 -2.199 19.447 -23.421 1.00 0.00 H new ATOM 0 HG23 VAL B 122 -1.966 18.575 -21.888 1.00 0.00 H new ATOM 986 N GLY B 123 2.557 18.375 -22.260 1.00 0.00 N ATOM 987 CA GLY B 123 4.001 18.518 -22.198 1.00 0.00 C ATOM 988 C GLY B 123 4.707 17.754 -23.301 1.00 0.00 C ATOM 989 O GLY B 123 5.688 18.236 -23.869 1.00 0.00 O ATOM 0 H GLY B 123 2.125 18.012 -21.410 1.00 0.00 H new ATOM 0 HA2 GLY B 123 4.262 19.574 -22.267 1.00 0.00 H new ATOM 0 HA3 GLY B 123 4.357 18.165 -21.230 1.00 0.00 H new ATOM 993 N LEU B 124 4.209 16.560 -23.603 1.00 0.00 N ATOM 994 CA LEU B 124 4.800 15.728 -24.645 1.00 0.00 C ATOM 995 C LEU B 124 4.539 16.317 -26.027 1.00 0.00 C ATOM 996 O LEU B 124 5.471 16.637 -26.765 1.00 0.00 O ATOM 997 CB LEU B 124 4.239 14.307 -24.570 1.00 0.00 C ATOM 998 CG LEU B 124 5.240 13.207 -24.217 1.00 0.00 C ATOM 999 CD1 LEU B 124 4.547 12.066 -23.488 1.00 0.00 C ATOM 1000 CD2 LEU B 124 5.937 12.697 -25.470 1.00 0.00 C ATOM 0 H LEU B 124 3.398 16.147 -23.142 1.00 0.00 H new ATOM 0 HA LEU B 124 5.877 15.696 -24.482 1.00 0.00 H new ATOM 0 HB2 LEU B 124 3.438 14.293 -23.830 1.00 0.00 H new ATOM 0 HB3 LEU B 124 3.788 14.065 -25.532 1.00 0.00 H new ATOM 0 HG LEU B 124 5.994 13.629 -23.553 1.00 0.00 H new ATOM 0 HD11 LEU B 124 5.276 11.293 -23.245 1.00 0.00 H new ATOM 0 HD12 LEU B 124 4.097 12.441 -22.569 1.00 0.00 H new ATOM 0 HD13 LEU B 124 3.771 11.645 -24.126 1.00 0.00 H new ATOM 0 HD21 LEU B 124 6.646 11.915 -25.199 1.00 0.00 H new ATOM 0 HD22 LEU B 124 5.196 12.293 -26.159 1.00 0.00 H new ATOM 0 HD23 LEU B 124 6.469 13.518 -25.950 1.00 0.00 H new ATOM 1012 N VAL B 125 3.263 16.460 -26.373 1.00 0.00 N ATOM 1013 CA VAL B 125 2.878 17.015 -27.665 1.00 0.00 C ATOM 1014 C VAL B 125 3.524 18.376 -27.893 1.00 0.00 C ATOM 1015 O VAL B 125 4.251 18.575 -28.866 1.00 0.00 O ATOM 1016 CB VAL B 125 1.349 17.159 -27.781 1.00 0.00 C ATOM 1017 CG1 VAL B 125 0.970 17.778 -29.118 1.00 0.00 C ATOM 1018 CG2 VAL B 125 0.671 15.809 -27.598 1.00 0.00 C ATOM 0 H VAL B 125 2.478 16.199 -25.776 1.00 0.00 H new ATOM 0 HA VAL B 125 3.229 16.318 -28.426 1.00 0.00 H new ATOM 0 HB VAL B 125 1.004 17.824 -26.989 1.00 0.00 H new ATOM 0 HG11 VAL B 125 -0.114 17.872 -29.181 1.00 0.00 H new ATOM 0 HG12 VAL B 125 1.425 18.765 -29.204 1.00 0.00 H new ATOM 0 HG13 VAL B 125 1.327 17.142 -29.928 1.00 0.00 H new ATOM 0 HG21 VAL B 125 -0.409 15.930 -27.683 1.00 0.00 H new ATOM 0 HG22 VAL B 125 1.021 15.119 -28.366 1.00 0.00 H new ATOM 0 HG23 VAL B 125 0.915 15.410 -26.614 1.00 0.00 H new ATOM 1028 N ALA B 126 3.255 19.313 -26.989 1.00 0.00 N ATOM 1029 CA ALA B 126 3.813 20.656 -27.090 1.00 0.00 C ATOM 1030 C ALA B 126 5.321 20.609 -27.301 1.00 0.00 C ATOM 1031 O ALA B 126 5.854 21.267 -28.196 1.00 0.00 O ATOM 1032 CB ALA B 126 3.476 21.462 -25.844 1.00 0.00 C ATOM 0 H ALA B 126 2.654 19.166 -26.178 1.00 0.00 H new ATOM 0 HA ALA B 126 3.367 21.144 -27.957 1.00 0.00 H new ATOM 0 HB1 ALA B 126 3.899 22.463 -25.933 1.00 0.00 H new ATOM 0 HB2 ALA B 126 2.393 21.533 -25.739 1.00 0.00 H new ATOM 0 HB3 ALA B 126 3.894 20.968 -24.967 1.00 0.00 H new ATOM 1038 N TYR B 127 6.007 19.829 -26.472 1.00 0.00 N ATOM 1039 CA TYR B 127 7.456 19.700 -26.566 1.00 0.00 C ATOM 1040 C TYR B 127 7.875 19.282 -27.972 1.00 0.00 C ATOM 1041 O TYR B 127 8.822 19.830 -28.538 1.00 0.00 O ATOM 1042 CB TYR B 127 7.965 18.681 -25.546 1.00 0.00 C ATOM 1043 CG TYR B 127 9.332 18.125 -25.875 1.00 0.00 C ATOM 1044 CD1 TYR B 127 9.471 16.985 -26.657 1.00 0.00 C ATOM 1045 CD2 TYR B 127 10.485 18.740 -25.403 1.00 0.00 C ATOM 1046 CE1 TYR B 127 10.717 16.474 -26.960 1.00 0.00 C ATOM 1047 CE2 TYR B 127 11.737 18.237 -25.702 1.00 0.00 C ATOM 1048 CZ TYR B 127 11.848 17.103 -26.481 1.00 0.00 C ATOM 1049 OH TYR B 127 13.092 16.598 -26.780 1.00 0.00 O ATOM 0 H TYR B 127 5.582 19.277 -25.727 1.00 0.00 H new ATOM 0 HA TYR B 127 7.897 20.673 -26.349 1.00 0.00 H new ATOM 0 HB2 TYR B 127 8.000 19.150 -24.563 1.00 0.00 H new ATOM 0 HB3 TYR B 127 7.253 17.858 -25.481 1.00 0.00 H new ATOM 0 HD1 TYR B 127 8.589 16.490 -27.034 1.00 0.00 H new ATOM 0 HD2 TYR B 127 10.401 19.627 -24.792 1.00 0.00 H new ATOM 0 HE1 TYR B 127 10.806 15.586 -27.569 1.00 0.00 H new ATOM 0 HE2 TYR B 127 12.623 18.728 -25.328 1.00 0.00 H new ATOM 0 HH TYR B 127 13.781 17.159 -26.367 1.00 0.00 H new ATOM 1059 N ILE B 128 7.163 18.308 -28.530 1.00 0.00 N ATOM 1060 CA ILE B 128 7.459 17.818 -29.870 1.00 0.00 C ATOM 1061 C ILE B 128 7.253 18.910 -30.913 1.00 0.00 C ATOM 1062 O ILE B 128 8.124 19.160 -31.746 1.00 0.00 O ATOM 1063 CB ILE B 128 6.582 16.605 -30.232 1.00 0.00 C ATOM 1064 CG1 ILE B 128 6.813 15.465 -29.238 1.00 0.00 C ATOM 1065 CG2 ILE B 128 6.873 16.144 -31.652 1.00 0.00 C ATOM 1066 CD1 ILE B 128 5.568 14.659 -28.942 1.00 0.00 C ATOM 0 H ILE B 128 6.378 17.843 -28.075 1.00 0.00 H new ATOM 0 HA ILE B 128 8.505 17.512 -29.870 1.00 0.00 H new ATOM 0 HB ILE B 128 5.535 16.904 -30.176 1.00 0.00 H new ATOM 0 HG12 ILE B 128 7.581 14.800 -29.633 1.00 0.00 H new ATOM 0 HG13 ILE B 128 7.198 15.879 -28.306 1.00 0.00 H new ATOM 0 HG21 ILE B 128 6.245 15.286 -31.892 1.00 0.00 H new ATOM 0 HG22 ILE B 128 6.661 16.955 -32.349 1.00 0.00 H new ATOM 0 HG23 ILE B 128 7.922 15.860 -31.735 1.00 0.00 H new ATOM 0 HD11 ILE B 128 5.807 13.869 -28.230 1.00 0.00 H new ATOM 0 HD12 ILE B 128 4.805 15.311 -28.518 1.00 0.00 H new ATOM 0 HD13 ILE B 128 5.194 14.215 -29.865 1.00 0.00 H new ATOM 1078 N ALA B 129 6.094 19.559 -30.862 1.00 0.00 N ATOM 1079 CA ALA B 129 5.774 20.628 -31.800 1.00 0.00 C ATOM 1080 C ALA B 129 6.794 21.759 -31.712 1.00 0.00 C ATOM 1081 O ALA B 129 7.182 22.338 -32.726 1.00 0.00 O ATOM 1082 CB ALA B 129 4.372 21.156 -31.539 1.00 0.00 C ATOM 0 H ALA B 129 5.361 19.363 -30.181 1.00 0.00 H new ATOM 0 HA ALA B 129 5.813 20.217 -32.809 1.00 0.00 H new ATOM 0 HB1 ALA B 129 4.146 21.954 -32.247 1.00 0.00 H new ATOM 0 HB2 ALA B 129 3.650 20.348 -31.661 1.00 0.00 H new ATOM 0 HB3 ALA B 129 4.313 21.545 -30.523 1.00 0.00 H new ATOM 1088 N PHE B 130 7.223 22.069 -30.493 1.00 0.00 N ATOM 1089 CA PHE B 130 8.196 23.132 -30.272 1.00 0.00 C ATOM 1090 C PHE B 130 9.578 22.716 -30.770 1.00 0.00 C ATOM 1091 O PHE B 130 10.400 23.559 -31.129 1.00 0.00 O ATOM 1092 CB PHE B 130 8.262 23.491 -28.787 1.00 0.00 C ATOM 1093 CG PHE B 130 9.221 24.607 -28.483 1.00 0.00 C ATOM 1094 CD1 PHE B 130 8.853 25.928 -28.683 1.00 0.00 C ATOM 1095 CD2 PHE B 130 10.490 24.334 -27.997 1.00 0.00 C ATOM 1096 CE1 PHE B 130 9.734 26.956 -28.404 1.00 0.00 C ATOM 1097 CE2 PHE B 130 11.374 25.359 -27.716 1.00 0.00 C ATOM 1098 CZ PHE B 130 10.995 26.671 -27.918 1.00 0.00 C ATOM 0 H PHE B 130 6.912 21.599 -29.643 1.00 0.00 H new ATOM 0 HA PHE B 130 7.875 24.008 -30.836 1.00 0.00 H new ATOM 0 HB2 PHE B 130 7.267 23.775 -28.445 1.00 0.00 H new ATOM 0 HB3 PHE B 130 8.554 22.607 -28.220 1.00 0.00 H new ATOM 0 HD1 PHE B 130 7.867 26.157 -29.061 1.00 0.00 H new ATOM 0 HD2 PHE B 130 10.791 23.309 -27.836 1.00 0.00 H new ATOM 0 HE1 PHE B 130 9.436 27.981 -28.566 1.00 0.00 H new ATOM 0 HE2 PHE B 130 12.361 25.134 -27.339 1.00 0.00 H new ATOM 0 HZ PHE B 130 11.683 27.473 -27.696 1.00 0.00 H new ATOM 1108 N LYS B 131 9.825 21.411 -30.787 1.00 0.00 N ATOM 1109 CA LYS B 131 11.106 20.880 -31.239 1.00 0.00 C ATOM 1110 C LYS B 131 11.146 20.780 -32.761 1.00 0.00 C ATOM 1111 O LYS B 131 12.216 20.833 -33.368 1.00 0.00 O ATOM 1112 CB LYS B 131 11.359 19.504 -30.619 1.00 0.00 C ATOM 1113 CG LYS B 131 12.327 18.647 -31.417 1.00 0.00 C ATOM 1114 CD LYS B 131 12.619 17.333 -30.712 1.00 0.00 C ATOM 1115 CE LYS B 131 12.995 16.241 -31.702 1.00 0.00 C ATOM 1116 NZ LYS B 131 14.319 16.497 -32.333 1.00 0.00 N1+ ATOM 0 H LYS B 131 9.155 20.701 -30.493 1.00 0.00 H new ATOM 0 HA LYS B 131 11.890 21.565 -30.917 1.00 0.00 H new ATOM 0 HB2 LYS B 131 11.750 19.636 -29.610 1.00 0.00 H new ATOM 0 HB3 LYS B 131 10.410 18.976 -30.527 1.00 0.00 H new ATOM 0 HG2 LYS B 131 11.909 18.447 -32.404 1.00 0.00 H new ATOM 0 HG3 LYS B 131 13.258 19.194 -31.570 1.00 0.00 H new ATOM 0 HD2 LYS B 131 13.431 17.474 -29.999 1.00 0.00 H new ATOM 0 HD3 LYS B 131 11.744 17.023 -30.141 1.00 0.00 H new ATOM 0 HE2 LYS B 131 13.016 15.279 -31.191 1.00 0.00 H new ATOM 0 HE3 LYS B 131 12.231 16.174 -32.476 1.00 0.00 H new ATOM 0 HZ1 LYS B 131 14.539 15.731 -33.001 1.00 0.00 H new ATOM 0 HZ2 LYS B 131 14.291 17.403 -32.843 1.00 0.00 H new ATOM 0 HZ3 LYS B 131 15.053 16.536 -31.597 1.00 0.00 H new ATOM 1130 N ARG B 132 9.974 20.637 -33.371 1.00 0.00 N ATOM 1131 CA ARG B 132 9.876 20.528 -34.822 1.00 0.00 C ATOM 1132 C ARG B 132 9.909 21.908 -35.473 1.00 0.00 C ATOM 1133 O ARG B 132 10.617 22.124 -36.456 1.00 0.00 O ATOM 1134 CB ARG B 132 8.590 19.798 -35.215 1.00 0.00 C ATOM 1135 CG ARG B 132 8.537 18.357 -34.734 1.00 0.00 C ATOM 1136 CD ARG B 132 9.133 17.406 -35.759 1.00 0.00 C ATOM 1137 NE ARG B 132 9.004 16.009 -35.350 1.00 0.00 N ATOM 1138 CZ ARG B 132 7.873 15.320 -35.441 1.00 0.00 C ATOM 1139 NH1 ARG B 132 6.778 15.893 -35.922 1.00 0.00 N1+ ATOM 1140 NH2 ARG B 132 7.834 14.052 -35.047 1.00 0.00 N ATOM 0 H ARG B 132 9.079 20.594 -32.883 1.00 0.00 H new ATOM 0 HA ARG B 132 10.733 19.956 -35.177 1.00 0.00 H new ATOM 0 HB2 ARG B 132 7.736 20.340 -34.808 1.00 0.00 H new ATOM 0 HB3 ARG B 132 8.490 19.814 -36.300 1.00 0.00 H new ATOM 0 HG2 ARG B 132 9.080 18.266 -33.793 1.00 0.00 H new ATOM 0 HG3 ARG B 132 7.503 18.077 -34.534 1.00 0.00 H new ATOM 0 HD2 ARG B 132 8.637 17.550 -36.719 1.00 0.00 H new ATOM 0 HD3 ARG B 132 10.186 17.645 -35.906 1.00 0.00 H new ATOM 0 HE ARG B 132 9.827 15.538 -34.974 1.00 0.00 H new ATOM 0 HH11 ARG B 132 6.803 16.867 -36.224 1.00 0.00 H new ATOM 0 HH12 ARG B 132 5.911 15.360 -35.990 1.00 0.00 H new ATOM 0 HH21 ARG B 132 8.673 13.608 -34.674 1.00 0.00 H new ATOM 0 HH22 ARG B 132 6.965 13.523 -35.117 1.00 0.00 H new ATOM 1154 N TRP B 133 9.138 22.836 -34.918 1.00 0.00 N ATOM 1155 CA TRP B 133 9.080 24.195 -35.446 1.00 0.00 C ATOM 1156 C TRP B 133 10.466 24.828 -35.478 1.00 0.00 C ATOM 1157 O TRP B 133 10.748 25.686 -36.312 1.00 0.00 O ATOM 1158 CB TRP B 133 8.135 25.051 -34.601 1.00 0.00 C ATOM 1159 CG TRP B 133 7.972 26.447 -35.122 1.00 0.00 C ATOM 1160 CD1 TRP B 133 8.712 27.542 -34.779 1.00 0.00 C ATOM 1161 CD2 TRP B 133 7.005 26.898 -36.079 1.00 0.00 C ATOM 1162 NE1 TRP B 133 8.265 28.646 -35.464 1.00 0.00 N ATOM 1163 CE2 TRP B 133 7.220 28.277 -36.269 1.00 0.00 C ATOM 1164 CE3 TRP B 133 5.983 26.270 -36.794 1.00 0.00 C ATOM 1165 CZ2 TRP B 133 6.447 29.036 -37.143 1.00 0.00 C ATOM 1166 CZ3 TRP B 133 5.217 27.025 -37.662 1.00 0.00 C ATOM 1167 CH2 TRP B 133 5.452 28.395 -37.831 1.00 0.00 C ATOM 0 H TRP B 133 8.545 22.673 -34.104 1.00 0.00 H new ATOM 0 HA TRP B 133 8.701 24.145 -36.467 1.00 0.00 H new ATOM 0 HB2 TRP B 133 7.158 24.569 -34.561 1.00 0.00 H new ATOM 0 HB3 TRP B 133 8.511 25.094 -33.579 1.00 0.00 H new ATOM 0 HD1 TRP B 133 9.529 27.541 -34.073 1.00 0.00 H new ATOM 0 HE1 TRP B 133 8.649 29.588 -35.386 1.00 0.00 H new ATOM 0 HE3 TRP B 133 5.795 25.214 -36.671 1.00 0.00 H new ATOM 0 HZ2 TRP B 133 6.626 30.093 -37.274 1.00 0.00 H new ATOM 0 HZ3 TRP B 133 4.423 26.550 -38.220 1.00 0.00 H new ATOM 0 HH2 TRP B 133 4.836 28.957 -38.518 1.00 0.00 H new ATOM 1178 N ASN B 134 11.330 24.396 -34.564 1.00 0.00 N ATOM 1179 CA ASN B 134 12.688 24.921 -34.488 1.00 0.00 C ATOM 1180 C ASN B 134 13.534 24.412 -35.651 1.00 0.00 C ATOM 1181 O ASN B 134 14.474 25.077 -36.086 1.00 0.00 O ATOM 1182 CB ASN B 134 13.337 24.525 -33.159 1.00 0.00 C ATOM 1183 CG ASN B 134 14.835 24.761 -33.154 1.00 0.00 C ATOM 1184 OD1 ASN B 134 15.295 25.897 -33.031 1.00 0.00 O ATOM 1185 ND2 ASN B 134 15.603 23.687 -33.289 1.00 0.00 N ATOM 0 H ASN B 134 11.113 23.684 -33.866 1.00 0.00 H new ATOM 0 HA ASN B 134 12.634 26.008 -34.549 1.00 0.00 H new ATOM 0 HB2 ASN B 134 12.879 25.095 -32.350 1.00 0.00 H new ATOM 0 HB3 ASN B 134 13.137 23.472 -32.960 1.00 0.00 H new ATOM 0 HD21 ASN B 134 16.618 23.783 -33.294 1.00 0.00 H new ATOM 0 HD22 ASN B 134 15.178 22.765 -33.388 1.00 0.00 H new ATOM 1192 N SER B 135 13.191 23.229 -36.150 1.00 0.00 N ATOM 1193 CA SER B 135 13.921 22.629 -37.262 1.00 0.00 C ATOM 1194 C SER B 135 13.347 23.087 -38.599 1.00 0.00 C ATOM 1195 O SER B 135 13.776 22.631 -39.659 1.00 0.00 O ATOM 1196 CB SER B 135 13.870 21.103 -37.167 1.00 0.00 C ATOM 1197 OG SER B 135 14.960 20.513 -37.855 1.00 0.00 O ATOM 0 H SER B 135 12.414 22.667 -35.803 1.00 0.00 H new ATOM 0 HA SER B 135 14.959 22.955 -37.202 1.00 0.00 H new ATOM 0 HB2 SER B 135 13.889 20.800 -36.120 1.00 0.00 H new ATOM 0 HB3 SER B 135 12.932 20.740 -37.587 1.00 0.00 H new ATOM 0 HG SER B 135 15.057 20.933 -38.735 1.00 0.00 H new ATOM 1203 N SER B 136 12.374 23.991 -38.540 1.00 0.00 N ATOM 1204 CA SER B 136 11.738 24.508 -39.746 1.00 0.00 C ATOM 1205 C SER B 136 11.229 23.369 -40.623 1.00 0.00 C ATOM 1206 O SER B 136 11.276 23.447 -41.851 1.00 0.00 O ATOM 1207 CB SER B 136 12.721 25.375 -40.534 1.00 0.00 C ATOM 1208 OG SER B 136 12.843 26.663 -39.956 1.00 0.00 O ATOM 0 H SER B 136 12.009 24.380 -37.671 1.00 0.00 H new ATOM 0 HA SER B 136 10.887 25.119 -39.445 1.00 0.00 H new ATOM 0 HB2 SER B 136 13.697 24.891 -40.560 1.00 0.00 H new ATOM 0 HB3 SER B 136 12.383 25.467 -41.566 1.00 0.00 H new ATOM 0 HG SER B 136 13.478 27.197 -40.477 1.00 0.00 H new ATOM 1214 N LYS B 137 10.743 22.310 -39.984 1.00 0.00 N ATOM 1215 CA LYS B 137 10.223 21.153 -40.705 1.00 0.00 C ATOM 1216 C LYS B 137 9.113 21.565 -41.666 1.00 0.00 C ATOM 1217 O LYS B 137 8.252 22.376 -41.324 1.00 0.00 O ATOM 1218 CB LYS B 137 9.697 20.107 -39.719 1.00 0.00 C ATOM 1219 CG LYS B 137 9.812 18.680 -40.227 1.00 0.00 C ATOM 1220 CD LYS B 137 8.935 17.732 -39.429 1.00 0.00 C ATOM 1221 CE LYS B 137 8.528 16.520 -40.254 1.00 0.00 C ATOM 1222 NZ LYS B 137 7.317 15.855 -39.701 1.00 0.00 N1+ ATOM 0 H LYS B 137 10.698 22.229 -38.968 1.00 0.00 H new ATOM 0 HA LYS B 137 11.038 20.720 -41.284 1.00 0.00 H new ATOM 0 HB2 LYS B 137 10.246 20.195 -38.781 1.00 0.00 H new ATOM 0 HB3 LYS B 137 8.652 20.322 -39.498 1.00 0.00 H new ATOM 0 HG2 LYS B 137 9.527 18.643 -41.278 1.00 0.00 H new ATOM 0 HG3 LYS B 137 10.850 18.354 -40.167 1.00 0.00 H new ATOM 0 HD2 LYS B 137 9.470 17.404 -38.538 1.00 0.00 H new ATOM 0 HD3 LYS B 137 8.043 18.259 -39.090 1.00 0.00 H new ATOM 0 HE2 LYS B 137 8.336 16.828 -41.282 1.00 0.00 H new ATOM 0 HE3 LYS B 137 9.352 15.807 -40.284 1.00 0.00 H new ATOM 0 HZ1 LYS B 137 6.792 15.394 -40.471 1.00 0.00 H new ATOM 0 HZ2 LYS B 137 7.602 15.141 -39.001 1.00 0.00 H new ATOM 0 HZ3 LYS B 137 6.710 16.565 -39.244 1.00 0.00 H new ATOM 1236 N GLN B 138 9.139 21.000 -42.869 1.00 0.00 N ATOM 1237 CA GLN B 138 8.133 21.308 -43.878 1.00 0.00 C ATOM 1238 C GLN B 138 6.734 20.958 -43.379 1.00 0.00 C ATOM 1239 O GLN B 138 5.750 21.577 -43.778 1.00 0.00 O ATOM 1240 CB GLN B 138 8.429 20.550 -45.173 1.00 0.00 C ATOM 1241 CG GLN B 138 8.195 19.051 -45.068 1.00 0.00 C ATOM 1242 CD GLN B 138 8.901 18.272 -46.160 1.00 0.00 C ATOM 1243 OE1 GLN B 138 9.683 18.830 -46.929 1.00 0.00 O ATOM 1244 NE2 GLN B 138 8.626 16.975 -46.234 1.00 0.00 N ATOM 0 H GLN B 138 9.845 20.327 -43.168 1.00 0.00 H new ATOM 0 HA GLN B 138 8.171 22.379 -44.075 1.00 0.00 H new ATOM 0 HB2 GLN B 138 7.804 20.952 -45.970 1.00 0.00 H new ATOM 0 HB3 GLN B 138 9.465 20.728 -45.460 1.00 0.00 H new ATOM 0 HG2 GLN B 138 8.541 18.700 -44.096 1.00 0.00 H new ATOM 0 HG3 GLN B 138 7.125 18.850 -45.117 1.00 0.00 H new ATOM 0 HE21 GLN B 138 7.971 16.554 -45.575 1.00 0.00 H new ATOM 0 HE22 GLN B 138 9.070 16.400 -46.950 1.00 0.00 H new ATOM 1253 N ASN B 139 6.657 19.961 -42.504 1.00 0.00 N ATOM 1254 CA ASN B 139 5.379 19.526 -41.951 1.00 0.00 C ATOM 1255 C ASN B 139 4.803 20.587 -41.017 1.00 0.00 C ATOM 1256 O ASN B 139 5.270 20.760 -39.892 1.00 0.00 O ATOM 1257 CB ASN B 139 5.547 18.205 -41.198 1.00 0.00 C ATOM 1258 CG ASN B 139 4.219 17.596 -40.795 1.00 0.00 C ATOM 1259 OD1 ASN B 139 3.533 16.979 -41.610 1.00 0.00 O ATOM 1260 ND2 ASN B 139 3.849 17.767 -39.531 1.00 0.00 N ATOM 0 H ASN B 139 7.464 19.439 -42.162 1.00 0.00 H new ATOM 0 HA ASN B 139 4.685 19.378 -42.778 1.00 0.00 H new ATOM 0 HB2 ASN B 139 6.092 17.499 -41.825 1.00 0.00 H new ATOM 0 HB3 ASN B 139 6.152 18.372 -40.307 1.00 0.00 H new ATOM 0 HD21 ASN B 139 2.965 17.380 -39.202 1.00 0.00 H new ATOM 0 HD22 ASN B 139 4.449 18.286 -38.890 1.00 0.00 H new ATOM 1267 N LYS B 140 3.783 21.293 -41.493 1.00 0.00 N ATOM 1268 CA LYS B 140 3.140 22.337 -40.701 1.00 0.00 C ATOM 1269 C LYS B 140 1.978 21.768 -39.894 1.00 0.00 C ATOM 1270 O LYS B 140 1.865 22.016 -38.694 1.00 0.00 O ATOM 1271 CB LYS B 140 2.640 23.460 -41.612 1.00 0.00 C ATOM 1272 CG LYS B 140 3.718 24.038 -42.513 1.00 0.00 C ATOM 1273 CD LYS B 140 4.780 24.771 -41.711 1.00 0.00 C ATOM 1274 CE LYS B 140 5.432 25.875 -42.529 1.00 0.00 C ATOM 1275 NZ LYS B 140 6.305 26.744 -41.692 1.00 0.00 N1+ ATOM 0 H LYS B 140 3.384 21.162 -42.422 1.00 0.00 H new ATOM 0 HA LYS B 140 3.878 22.741 -40.008 1.00 0.00 H new ATOM 0 HB2 LYS B 140 1.827 23.080 -42.230 1.00 0.00 H new ATOM 0 HB3 LYS B 140 2.226 24.259 -40.996 1.00 0.00 H new ATOM 0 HG2 LYS B 140 4.183 23.236 -43.087 1.00 0.00 H new ATOM 0 HG3 LYS B 140 3.266 24.722 -43.231 1.00 0.00 H new ATOM 0 HD2 LYS B 140 4.331 25.198 -40.814 1.00 0.00 H new ATOM 0 HD3 LYS B 140 5.541 24.064 -41.380 1.00 0.00 H new ATOM 0 HE2 LYS B 140 6.022 25.432 -43.331 1.00 0.00 H new ATOM 0 HE3 LYS B 140 4.659 26.483 -43.000 1.00 0.00 H new ATOM 0 HZ1 LYS B 140 6.731 27.484 -42.286 1.00 0.00 H new ATOM 0 HZ2 LYS B 140 5.737 27.187 -40.942 1.00 0.00 H new ATOM 0 HZ3 LYS B 140 7.058 26.169 -41.263 1.00 0.00 H new ATOM 1289 N GLN B 141 1.118 21.003 -40.560 1.00 0.00 N ATOM 1290 CA GLN B 141 -0.035 20.399 -39.902 1.00 0.00 C ATOM 1291 C GLN B 141 0.059 18.876 -39.931 1.00 0.00 C ATOM 1292 O GLN B 141 0.394 18.283 -40.957 1.00 0.00 O ATOM 1293 CB GLN B 141 -1.330 20.854 -40.575 1.00 0.00 C ATOM 1294 CG GLN B 141 -2.573 20.604 -39.736 1.00 0.00 C ATOM 1295 CD GLN B 141 -3.841 20.571 -40.566 1.00 0.00 C ATOM 1296 OE1 GLN B 141 -3.931 21.221 -41.608 1.00 0.00 O ATOM 1297 NE2 GLN B 141 -4.827 19.809 -40.110 1.00 0.00 N ATOM 0 H GLN B 141 1.198 20.787 -41.554 1.00 0.00 H new ATOM 0 HA GLN B 141 -0.041 20.726 -38.862 1.00 0.00 H new ATOM 0 HB2 GLN B 141 -1.260 21.919 -40.797 1.00 0.00 H new ATOM 0 HB3 GLN B 141 -1.435 20.336 -41.528 1.00 0.00 H new ATOM 0 HG2 GLN B 141 -2.465 19.657 -39.207 1.00 0.00 H new ATOM 0 HG3 GLN B 141 -2.659 21.384 -38.979 1.00 0.00 H new ATOM 0 HE21 GLN B 141 -4.709 19.287 -39.241 1.00 0.00 H new ATOM 0 HE22 GLN B 141 -5.703 19.745 -40.628 1.00 0.00 H new TER 1306 GLN B 141