USER MOD reduce.3.24.130724 H: found=0, std=0, add=753, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 751 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 36 LYS NZ :NH3+ 156:sc= 2.48 (180deg=1.91) USER MOD Set 1.2: B 104 U O2' : rot -72:sc= 0.283 USER MOD Single : A 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 51:sc= 0.84 USER MOD Single : A -1 SER OG : rot 160:sc= 0.0875 USER MOD Single : A -2 GLY N :NH3+ -143:sc= 0.00386 (180deg=0) USER MOD Single : A 11 TYR OH : rot 165:sc=-0.00133 USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HD1:sc= -0.344 X(o=-0.34,f=-0.015) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ -175:sc= 1.15 (180deg=1.13) USER MOD Single : A 31 TYR OH : rot 30:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 CYS SG : rot 180:sc= -0.272 USER MOD Single : A 40 LYS NZ :NH3+ -155:sc= 0.881 (180deg=-1.31) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0404 USER MOD Single : A 44 SER OG : rot -33:sc= 0.0257 USER MOD Single : A 64 LYS NZ :NH3+ -136:sc= 0.00149 (180deg=-0.0171) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot 31:sc= 0.0835 USER MOD Single : A 74 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 101 A O2' : rot 11:sc= 0.0855 USER MOD Single : B 101 A O5' : rot 180:sc= 0 USER MOD Single : B 102 C O2' : rot 177:sc= 1.1 USER MOD Single : B 103 A O2' : rot 23:sc= 0.0134 USER MOD Single : B 105 C O2' : rot -17:sc= 0.0519 USER MOD Single : B 106 A O2' : rot 171:sc= 0 USER MOD Single : B 106 A O3' : rot 132:sc= 0.105 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 32.264 34.559 44.813 1.00 0.00 N ATOM 2 CA GLY A -2 33.732 34.356 44.804 1.00 0.00 C ATOM 3 C GLY A -2 34.461 35.596 44.302 1.00 0.00 C ATOM 4 O GLY A -2 34.125 36.707 44.713 1.00 0.00 O ATOM 0 H1 GLY A -2 31.853 34.085 45.643 1.00 0.00 H new ATOM 0 H2 GLY A -2 32.055 35.577 44.856 1.00 0.00 H new ATOM 0 H3 GLY A -2 31.853 34.158 43.946 1.00 0.00 H new ATOM 0 HA2 GLY A -2 34.074 34.114 45.810 1.00 0.00 H new ATOM 0 HA3 GLY A -2 33.979 33.505 44.170 1.00 0.00 H new ATOM 10 N SER A -1 35.431 35.406 43.395 1.00 0.00 N ATOM 11 CA SER A -1 36.382 36.421 42.883 1.00 0.00 C ATOM 12 C SER A -1 37.346 37.003 43.940 1.00 0.00 C ATOM 13 O SER A -1 37.057 37.016 45.139 1.00 0.00 O ATOM 14 CB SER A -1 35.664 37.541 42.104 1.00 0.00 C ATOM 15 OG SER A -1 34.823 37.003 41.091 1.00 0.00 O ATOM 0 H SER A -1 35.587 34.491 42.972 1.00 0.00 H new ATOM 0 HA SER A -1 37.019 35.869 42.192 1.00 0.00 H new ATOM 0 HB2 SER A -1 35.070 38.143 42.792 1.00 0.00 H new ATOM 0 HB3 SER A -1 36.402 38.205 41.654 1.00 0.00 H new ATOM 0 HG SER A -1 34.153 37.670 40.833 1.00 0.00 H new ATOM 21 N HIS A 0 38.518 37.478 43.498 1.00 0.00 N ATOM 22 CA HIS A 0 39.573 38.043 44.361 1.00 0.00 C ATOM 23 C HIS A 0 40.396 39.115 43.622 1.00 0.00 C ATOM 24 O HIS A 0 41.488 38.854 43.111 1.00 0.00 O ATOM 25 CB HIS A 0 40.448 36.906 44.925 1.00 0.00 C ATOM 26 CG HIS A 0 41.492 37.392 45.905 1.00 0.00 C ATOM 27 ND1 HIS A 0 41.229 37.954 47.157 1.00 0.00 N ATOM 28 CD2 HIS A 0 42.843 37.362 45.712 1.00 0.00 C ATOM 29 CE1 HIS A 0 42.426 38.251 47.690 1.00 0.00 C ATOM 30 NE2 HIS A 0 43.413 37.906 46.842 1.00 0.00 N ATOM 0 H HIS A 0 38.768 37.482 42.509 1.00 0.00 H new ATOM 0 HA HIS A 0 39.107 38.555 45.203 1.00 0.00 H new ATOM 0 HB2 HIS A 0 39.809 36.174 45.418 1.00 0.00 H new ATOM 0 HB3 HIS A 0 40.943 36.393 44.100 1.00 0.00 H new ATOM 0 HD2 HIS A 0 43.363 36.986 44.844 1.00 0.00 H new ATOM 0 HE1 HIS A 0 42.575 38.702 48.660 1.00 0.00 H new ATOM 0 HE2 HIS A 0 44.412 38.027 47.008 1.00 0.00 H new ATOM 38 N MET A 1 39.838 40.326 43.532 1.00 0.00 N ATOM 39 CA MET A 1 40.467 41.518 42.936 1.00 0.00 C ATOM 40 C MET A 1 39.820 42.810 43.464 1.00 0.00 C ATOM 41 O MET A 1 38.695 42.790 43.974 1.00 0.00 O ATOM 42 CB MET A 1 40.391 41.453 41.395 1.00 0.00 C ATOM 43 CG MET A 1 38.964 41.412 40.831 1.00 0.00 C ATOM 44 SD MET A 1 38.905 41.332 39.019 1.00 0.00 S ATOM 45 CE MET A 1 37.119 41.113 38.778 1.00 0.00 C ATOM 0 H MET A 1 38.900 40.515 43.885 1.00 0.00 H new ATOM 0 HA MET A 1 41.517 41.531 43.229 1.00 0.00 H new ATOM 0 HB2 MET A 1 40.907 42.319 40.981 1.00 0.00 H new ATOM 0 HB3 MET A 1 40.929 40.568 41.054 1.00 0.00 H new ATOM 0 HG2 MET A 1 38.444 40.547 41.242 1.00 0.00 H new ATOM 0 HG3 MET A 1 38.424 42.298 41.166 1.00 0.00 H new ATOM 0 HE1 MET A 1 36.901 41.045 37.712 1.00 0.00 H new ATOM 0 HE2 MET A 1 36.794 40.198 39.274 1.00 0.00 H new ATOM 0 HE3 MET A 1 36.587 41.964 39.203 1.00 0.00 H new ATOM 55 N VAL A 2 40.514 43.946 43.316 1.00 0.00 N ATOM 56 CA VAL A 2 39.995 45.290 43.633 1.00 0.00 C ATOM 57 C VAL A 2 40.494 46.319 42.611 1.00 0.00 C ATOM 58 O VAL A 2 41.698 46.510 42.426 1.00 0.00 O ATOM 59 CB VAL A 2 40.280 45.679 45.103 1.00 0.00 C ATOM 60 CG1 VAL A 2 41.766 45.700 45.488 1.00 0.00 C ATOM 61 CG2 VAL A 2 39.669 47.044 45.446 1.00 0.00 C ATOM 0 H VAL A 2 41.472 43.961 42.966 1.00 0.00 H new ATOM 0 HA VAL A 2 38.909 45.276 43.546 1.00 0.00 H new ATOM 0 HB VAL A 2 39.810 44.885 45.683 1.00 0.00 H new ATOM 0 HG11 VAL A 2 41.866 45.983 46.536 1.00 0.00 H new ATOM 0 HG12 VAL A 2 42.195 44.709 45.337 1.00 0.00 H new ATOM 0 HG13 VAL A 2 42.293 46.422 44.865 1.00 0.00 H new ATOM 0 HG21 VAL A 2 39.886 47.289 46.486 1.00 0.00 H new ATOM 0 HG22 VAL A 2 40.096 47.808 44.796 1.00 0.00 H new ATOM 0 HG23 VAL A 2 38.589 47.006 45.300 1.00 0.00 H new ATOM 71 N ILE A 3 39.543 46.952 41.916 1.00 0.00 N ATOM 72 CA ILE A 3 39.726 47.876 40.783 1.00 0.00 C ATOM 73 C ILE A 3 38.562 48.887 40.739 1.00 0.00 C ATOM 74 O ILE A 3 37.483 48.622 41.273 1.00 0.00 O ATOM 75 CB ILE A 3 39.849 47.104 39.436 1.00 0.00 C ATOM 76 CG1 ILE A 3 38.651 46.160 39.176 1.00 0.00 C ATOM 77 CG2 ILE A 3 41.192 46.359 39.338 1.00 0.00 C ATOM 78 CD1 ILE A 3 38.732 45.353 37.872 1.00 0.00 C ATOM 0 H ILE A 3 38.557 46.826 42.143 1.00 0.00 H new ATOM 0 HA ILE A 3 40.659 48.421 40.928 1.00 0.00 H new ATOM 0 HB ILE A 3 39.825 47.853 38.644 1.00 0.00 H new ATOM 0 HG12 ILE A 3 38.568 45.465 40.011 1.00 0.00 H new ATOM 0 HG13 ILE A 3 37.737 46.753 39.162 1.00 0.00 H new ATOM 0 HG21 ILE A 3 41.246 45.830 38.386 1.00 0.00 H new ATOM 0 HG22 ILE A 3 42.011 47.075 39.402 1.00 0.00 H new ATOM 0 HG23 ILE A 3 41.271 45.643 40.156 1.00 0.00 H new ATOM 0 HD11 ILE A 3 37.848 44.722 37.779 1.00 0.00 H new ATOM 0 HD12 ILE A 3 38.781 46.036 37.024 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.625 44.728 37.886 1.00 0.00 H new ATOM 90 N ARG A 4 38.755 50.043 40.086 1.00 0.00 N ATOM 91 CA ARG A 4 37.751 51.130 39.947 1.00 0.00 C ATOM 92 C ARG A 4 36.678 50.863 38.865 1.00 0.00 C ATOM 93 O ARG A 4 36.189 51.782 38.209 1.00 0.00 O ATOM 94 CB ARG A 4 38.471 52.485 39.766 1.00 0.00 C ATOM 95 CG ARG A 4 39.210 52.915 41.047 1.00 0.00 C ATOM 96 CD ARG A 4 39.856 54.300 40.899 1.00 0.00 C ATOM 97 NE ARG A 4 41.038 54.273 40.010 1.00 0.00 N ATOM 98 CZ ARG A 4 42.295 54.055 40.360 1.00 0.00 C ATOM 99 NH1 ARG A 4 42.643 53.809 41.594 1.00 0.00 N ATOM 100 NH2 ARG A 4 43.242 54.077 39.466 1.00 0.00 N ATOM 0 H ARG A 4 39.637 50.262 39.623 1.00 0.00 H new ATOM 0 HA ARG A 4 37.177 51.165 40.873 1.00 0.00 H new ATOM 0 HB2 ARG A 4 39.182 52.412 38.943 1.00 0.00 H new ATOM 0 HB3 ARG A 4 37.744 53.249 39.492 1.00 0.00 H new ATOM 0 HG2 ARG A 4 38.510 52.929 41.882 1.00 0.00 H new ATOM 0 HG3 ARG A 4 39.978 52.180 41.287 1.00 0.00 H new ATOM 0 HD2 ARG A 4 39.121 55.001 40.503 1.00 0.00 H new ATOM 0 HD3 ARG A 4 40.151 54.668 41.882 1.00 0.00 H new ATOM 0 HE ARG A 4 40.865 54.441 39.019 1.00 0.00 H new ATOM 0 HH11 ARG A 4 41.935 53.780 42.327 1.00 0.00 H new ATOM 0 HH12 ARG A 4 43.623 53.646 41.825 1.00 0.00 H new ATOM 0 HH21 ARG A 4 43.017 54.263 38.489 1.00 0.00 H new ATOM 0 HH22 ARG A 4 44.209 53.908 39.743 1.00 0.00 H new ATOM 114 N GLU A 5 36.327 49.595 38.667 1.00 0.00 N ATOM 115 CA GLU A 5 35.339 49.091 37.700 1.00 0.00 C ATOM 116 C GLU A 5 34.831 47.693 38.122 1.00 0.00 C ATOM 117 O GLU A 5 35.194 47.179 39.183 1.00 0.00 O ATOM 118 CB GLU A 5 35.957 49.085 36.283 1.00 0.00 C ATOM 119 CG GLU A 5 37.139 48.118 36.096 1.00 0.00 C ATOM 120 CD GLU A 5 37.851 48.316 34.747 1.00 0.00 C ATOM 121 OE1 GLU A 5 37.190 48.608 33.719 1.00 0.00 O ATOM 122 OE2 GLU A 5 39.096 48.179 34.683 1.00 0.00 O ATOM 0 H GLU A 5 36.748 48.840 39.208 1.00 0.00 H new ATOM 0 HA GLU A 5 34.472 49.751 37.684 1.00 0.00 H new ATOM 0 HB2 GLU A 5 35.179 48.828 35.564 1.00 0.00 H new ATOM 0 HB3 GLU A 5 36.291 50.095 36.044 1.00 0.00 H new ATOM 0 HG2 GLU A 5 37.854 48.262 36.906 1.00 0.00 H new ATOM 0 HG3 GLU A 5 36.780 47.091 36.167 1.00 0.00 H new ATOM 129 N SER A 6 33.994 47.059 37.295 1.00 0.00 N ATOM 130 CA SER A 6 33.559 45.665 37.470 1.00 0.00 C ATOM 131 C SER A 6 33.370 44.979 36.115 1.00 0.00 C ATOM 132 O SER A 6 32.942 45.617 35.148 1.00 0.00 O ATOM 133 CB SER A 6 32.278 45.609 38.310 1.00 0.00 C ATOM 134 OG SER A 6 31.865 44.265 38.501 1.00 0.00 O ATOM 0 H SER A 6 33.592 47.505 36.471 1.00 0.00 H new ATOM 0 HA SER A 6 34.337 45.122 38.006 1.00 0.00 H new ATOM 0 HB2 SER A 6 32.449 46.083 39.276 1.00 0.00 H new ATOM 0 HB3 SER A 6 31.487 46.171 37.814 1.00 0.00 H new ATOM 0 HG SER A 6 31.047 44.248 39.041 1.00 0.00 H new ATOM 140 N VAL A 7 33.703 43.689 36.031 1.00 0.00 N ATOM 141 CA VAL A 7 33.688 42.896 34.790 1.00 0.00 C ATOM 142 C VAL A 7 32.520 41.908 34.794 1.00 0.00 C ATOM 143 O VAL A 7 32.466 40.983 35.608 1.00 0.00 O ATOM 144 CB VAL A 7 35.039 42.179 34.572 1.00 0.00 C ATOM 145 CG1 VAL A 7 35.041 41.384 33.263 1.00 0.00 C ATOM 146 CG2 VAL A 7 36.202 43.180 34.512 1.00 0.00 C ATOM 0 H VAL A 7 33.999 43.148 36.844 1.00 0.00 H new ATOM 0 HA VAL A 7 33.544 43.577 33.951 1.00 0.00 H new ATOM 0 HB VAL A 7 35.169 41.507 35.420 1.00 0.00 H new ATOM 0 HG11 VAL A 7 36.005 40.891 33.138 1.00 0.00 H new ATOM 0 HG12 VAL A 7 34.251 40.634 33.292 1.00 0.00 H new ATOM 0 HG13 VAL A 7 34.868 42.061 32.426 1.00 0.00 H new ATOM 0 HG21 VAL A 7 37.137 42.642 34.358 1.00 0.00 H new ATOM 0 HG22 VAL A 7 36.042 43.874 33.687 1.00 0.00 H new ATOM 0 HG23 VAL A 7 36.253 43.735 35.449 1.00 0.00 H new ATOM 156 N SER A 8 31.588 42.094 33.859 1.00 0.00 N ATOM 157 CA SER A 8 30.506 41.154 33.554 1.00 0.00 C ATOM 158 C SER A 8 31.041 39.918 32.818 1.00 0.00 C ATOM 159 O SER A 8 31.907 40.016 31.947 1.00 0.00 O ATOM 160 CB SER A 8 29.394 41.857 32.752 1.00 0.00 C ATOM 161 OG SER A 8 29.903 42.812 31.827 1.00 0.00 O ATOM 0 H SER A 8 31.563 42.929 33.274 1.00 0.00 H new ATOM 0 HA SER A 8 30.073 40.807 34.492 1.00 0.00 H new ATOM 0 HB2 SER A 8 28.813 41.109 32.213 1.00 0.00 H new ATOM 0 HB3 SER A 8 28.712 42.354 33.442 1.00 0.00 H new ATOM 0 HG SER A 8 30.609 42.400 31.287 1.00 0.00 H new ATOM 167 N ARG A 9 30.526 38.735 33.170 1.00 0.00 N ATOM 168 CA ARG A 9 30.888 37.449 32.553 1.00 0.00 C ATOM 169 C ARG A 9 29.729 36.454 32.608 1.00 0.00 C ATOM 170 O ARG A 9 29.142 36.239 33.664 1.00 0.00 O ATOM 171 CB ARG A 9 32.195 36.898 33.157 1.00 0.00 C ATOM 172 CG ARG A 9 32.297 36.855 34.693 1.00 0.00 C ATOM 173 CD ARG A 9 33.718 36.407 35.069 1.00 0.00 C ATOM 174 NE ARG A 9 34.052 36.662 36.485 1.00 0.00 N ATOM 175 CZ ARG A 9 35.272 36.801 36.975 1.00 0.00 C ATOM 176 NH1 ARG A 9 36.336 36.664 36.235 1.00 0.00 N ATOM 177 NH2 ARG A 9 35.473 37.071 38.231 1.00 0.00 N ATOM 0 H ARG A 9 29.829 38.640 33.909 1.00 0.00 H new ATOM 0 HA ARG A 9 31.084 37.617 31.494 1.00 0.00 H new ATOM 0 HB2 ARG A 9 32.341 35.886 32.780 1.00 0.00 H new ATOM 0 HB3 ARG A 9 33.022 37.500 32.780 1.00 0.00 H new ATOM 0 HG2 ARG A 9 32.084 37.837 35.115 1.00 0.00 H new ATOM 0 HG3 ARG A 9 31.560 36.165 35.103 1.00 0.00 H new ATOM 0 HD2 ARG A 9 33.823 35.342 34.864 1.00 0.00 H new ATOM 0 HD3 ARG A 9 34.436 36.926 34.434 1.00 0.00 H new ATOM 0 HE ARG A 9 33.275 36.737 37.141 1.00 0.00 H new ATOM 0 HH11 ARG A 9 36.243 36.442 35.244 1.00 0.00 H new ATOM 0 HH12 ARG A 9 37.262 36.778 36.647 1.00 0.00 H new ATOM 0 HH21 ARG A 9 34.679 37.180 38.862 1.00 0.00 H new ATOM 0 HH22 ARG A 9 36.424 37.173 38.585 1.00 0.00 H new ATOM 191 N ILE A 10 29.372 35.903 31.450 1.00 0.00 N ATOM 192 CA ILE A 10 28.262 34.958 31.262 1.00 0.00 C ATOM 193 C ILE A 10 28.687 33.564 31.748 1.00 0.00 C ATOM 194 O ILE A 10 29.851 33.187 31.603 1.00 0.00 O ATOM 195 CB ILE A 10 27.801 34.948 29.780 1.00 0.00 C ATOM 196 CG1 ILE A 10 27.366 36.363 29.319 1.00 0.00 C ATOM 197 CG2 ILE A 10 26.660 33.931 29.557 1.00 0.00 C ATOM 198 CD1 ILE A 10 27.046 36.472 27.822 1.00 0.00 C ATOM 0 H ILE A 10 29.864 36.107 30.580 1.00 0.00 H new ATOM 0 HA ILE A 10 27.405 35.274 31.857 1.00 0.00 H new ATOM 0 HB ILE A 10 28.653 34.640 29.174 1.00 0.00 H new ATOM 0 HG12 ILE A 10 26.487 36.663 29.889 1.00 0.00 H new ATOM 0 HG13 ILE A 10 28.159 37.070 29.561 1.00 0.00 H new ATOM 0 HG21 ILE A 10 26.358 33.947 28.510 1.00 0.00 H new ATOM 0 HG22 ILE A 10 27.007 32.932 29.820 1.00 0.00 H new ATOM 0 HG23 ILE A 10 25.809 34.196 30.184 1.00 0.00 H new ATOM 0 HD11 ILE A 10 26.751 37.495 27.587 1.00 0.00 H new ATOM 0 HD12 ILE A 10 27.929 36.206 27.241 1.00 0.00 H new ATOM 0 HD13 ILE A 10 26.231 35.793 27.574 1.00 0.00 H new ATOM 210 N TYR A 11 27.742 32.799 32.297 1.00 0.00 N ATOM 211 CA TYR A 11 27.941 31.432 32.775 1.00 0.00 C ATOM 212 C TYR A 11 26.855 30.479 32.245 1.00 0.00 C ATOM 213 O TYR A 11 25.658 30.790 32.250 1.00 0.00 O ATOM 214 CB TYR A 11 28.022 31.445 34.312 1.00 0.00 C ATOM 215 CG TYR A 11 27.639 30.147 34.998 1.00 0.00 C ATOM 216 CD1 TYR A 11 28.533 29.062 35.026 1.00 0.00 C ATOM 217 CD2 TYR A 11 26.374 30.028 35.610 1.00 0.00 C ATOM 218 CE1 TYR A 11 28.177 27.875 35.695 1.00 0.00 C ATOM 219 CE2 TYR A 11 26.011 28.839 36.273 1.00 0.00 C ATOM 220 CZ TYR A 11 26.917 27.761 36.322 1.00 0.00 C ATOM 221 OH TYR A 11 26.590 26.612 36.973 1.00 0.00 O ATOM 0 H TYR A 11 26.785 33.126 32.425 1.00 0.00 H new ATOM 0 HA TYR A 11 28.882 31.045 32.385 1.00 0.00 H new ATOM 0 HB2 TYR A 11 29.041 31.702 34.602 1.00 0.00 H new ATOM 0 HB3 TYR A 11 27.374 32.238 34.686 1.00 0.00 H new ATOM 0 HD1 TYR A 11 29.492 29.139 34.535 1.00 0.00 H new ATOM 0 HD2 TYR A 11 25.679 30.854 35.570 1.00 0.00 H new ATOM 0 HE1 TYR A 11 28.871 27.048 35.729 1.00 0.00 H new ATOM 0 HE2 TYR A 11 25.042 28.754 36.742 1.00 0.00 H new ATOM 0 HH TYR A 11 25.810 26.771 37.545 1.00 0.00 H new ATOM 231 N VAL A 12 27.284 29.287 31.829 1.00 0.00 N ATOM 232 CA VAL A 12 26.417 28.122 31.601 1.00 0.00 C ATOM 233 C VAL A 12 27.038 26.888 32.258 1.00 0.00 C ATOM 234 O VAL A 12 28.255 26.690 32.206 1.00 0.00 O ATOM 235 CB VAL A 12 26.081 27.893 30.109 1.00 0.00 C ATOM 236 CG1 VAL A 12 25.347 29.091 29.492 1.00 0.00 C ATOM 237 CG2 VAL A 12 27.308 27.607 29.239 1.00 0.00 C ATOM 0 H VAL A 12 28.267 29.096 31.636 1.00 0.00 H new ATOM 0 HA VAL A 12 25.454 28.323 32.071 1.00 0.00 H new ATOM 0 HB VAL A 12 25.439 27.012 30.116 1.00 0.00 H new ATOM 0 HG11 VAL A 12 25.132 28.885 28.444 1.00 0.00 H new ATOM 0 HG12 VAL A 12 24.413 29.261 30.028 1.00 0.00 H new ATOM 0 HG13 VAL A 12 25.974 29.979 29.566 1.00 0.00 H new ATOM 0 HG21 VAL A 12 26.995 27.457 28.206 1.00 0.00 H new ATOM 0 HG22 VAL A 12 27.995 28.451 29.291 1.00 0.00 H new ATOM 0 HG23 VAL A 12 27.809 26.709 29.600 1.00 0.00 H new ATOM 247 N GLY A 13 26.208 26.070 32.902 1.00 0.00 N ATOM 248 CA GLY A 13 26.625 24.968 33.770 1.00 0.00 C ATOM 249 C GLY A 13 25.897 23.656 33.492 1.00 0.00 C ATOM 250 O GLY A 13 24.926 23.619 32.732 1.00 0.00 O ATOM 0 H GLY A 13 25.194 26.158 32.833 1.00 0.00 H new ATOM 0 HA2 GLY A 13 27.697 24.810 33.652 1.00 0.00 H new ATOM 0 HA3 GLY A 13 26.458 25.253 34.809 1.00 0.00 H new ATOM 254 N ASN A 14 26.390 22.567 34.086 1.00 0.00 N ATOM 255 CA ASN A 14 25.947 21.197 33.786 1.00 0.00 C ATOM 256 C ASN A 14 26.000 20.892 32.266 1.00 0.00 C ATOM 257 O ASN A 14 25.174 20.151 31.738 1.00 0.00 O ATOM 258 CB ASN A 14 24.574 20.922 34.438 1.00 0.00 C ATOM 259 CG ASN A 14 24.508 21.310 35.910 1.00 0.00 C ATOM 260 OD1 ASN A 14 23.981 22.351 36.283 1.00 0.00 O ATOM 261 ND2 ASN A 14 25.049 20.497 36.792 1.00 0.00 N ATOM 0 H ASN A 14 27.118 22.609 34.799 1.00 0.00 H new ATOM 0 HA ASN A 14 26.648 20.492 34.234 1.00 0.00 H new ATOM 0 HB2 ASN A 14 23.806 21.470 33.892 1.00 0.00 H new ATOM 0 HB3 ASN A 14 24.340 19.862 34.340 1.00 0.00 H new ATOM 0 HD21 ASN A 14 25.029 20.734 37.784 1.00 0.00 H new ATOM 0 HD22 ASN A 14 25.488 19.630 36.484 1.00 0.00 H new ATOM 268 N LEU A 15 26.931 21.528 31.550 1.00 0.00 N ATOM 269 CA LEU A 15 26.964 21.617 30.094 1.00 0.00 C ATOM 270 C LEU A 15 27.484 20.301 29.468 1.00 0.00 C ATOM 271 O LEU A 15 28.622 19.917 29.756 1.00 0.00 O ATOM 272 CB LEU A 15 27.840 22.833 29.723 1.00 0.00 C ATOM 273 CG LEU A 15 27.874 23.163 28.218 1.00 0.00 C ATOM 274 CD1 LEU A 15 26.572 23.817 27.753 1.00 0.00 C ATOM 275 CD2 LEU A 15 29.028 24.117 27.914 1.00 0.00 C ATOM 0 H LEU A 15 27.713 22.014 31.990 1.00 0.00 H new ATOM 0 HA LEU A 15 25.961 21.758 29.692 1.00 0.00 H new ATOM 0 HB2 LEU A 15 27.476 23.706 30.265 1.00 0.00 H new ATOM 0 HB3 LEU A 15 28.859 22.648 30.064 1.00 0.00 H new ATOM 0 HG LEU A 15 28.007 22.221 27.686 1.00 0.00 H new ATOM 0 HD11 LEU A 15 26.635 24.035 26.687 1.00 0.00 H new ATOM 0 HD12 LEU A 15 25.738 23.139 27.937 1.00 0.00 H new ATOM 0 HD13 LEU A 15 26.414 24.744 28.304 1.00 0.00 H new ATOM 0 HD21 LEU A 15 29.042 24.343 26.848 1.00 0.00 H new ATOM 0 HD22 LEU A 15 28.896 25.040 28.479 1.00 0.00 H new ATOM 0 HD23 LEU A 15 29.971 23.650 28.198 1.00 0.00 H new ATOM 287 N PRO A 16 26.708 19.606 28.612 1.00 0.00 N ATOM 288 CA PRO A 16 27.195 18.447 27.859 1.00 0.00 C ATOM 289 C PRO A 16 28.178 18.865 26.750 1.00 0.00 C ATOM 290 O PRO A 16 28.221 20.031 26.349 1.00 0.00 O ATOM 291 CB PRO A 16 25.935 17.788 27.284 1.00 0.00 C ATOM 292 CG PRO A 16 24.993 18.972 27.073 1.00 0.00 C ATOM 293 CD PRO A 16 25.323 19.887 28.252 1.00 0.00 C ATOM 0 HA PRO A 16 27.756 17.759 28.491 1.00 0.00 H new ATOM 0 HB2 PRO A 16 26.143 17.266 26.350 1.00 0.00 H new ATOM 0 HB3 PRO A 16 25.514 17.055 27.972 1.00 0.00 H new ATOM 0 HG2 PRO A 16 25.172 19.465 26.117 1.00 0.00 H new ATOM 0 HG3 PRO A 16 23.948 18.663 27.082 1.00 0.00 H new ATOM 0 HD2 PRO A 16 25.197 20.935 27.978 1.00 0.00 H new ATOM 0 HD3 PRO A 16 24.656 19.695 29.092 1.00 0.00 H new ATOM 301 N SER A 17 28.943 17.914 26.212 1.00 0.00 N ATOM 302 CA SER A 17 29.833 18.146 25.061 1.00 0.00 C ATOM 303 C SER A 17 29.022 18.580 23.829 1.00 0.00 C ATOM 304 O SER A 17 28.268 17.790 23.254 1.00 0.00 O ATOM 305 CB SER A 17 30.658 16.892 24.745 1.00 0.00 C ATOM 306 OG SER A 17 31.434 16.511 25.872 1.00 0.00 O ATOM 0 H SER A 17 28.967 16.955 26.560 1.00 0.00 H new ATOM 0 HA SER A 17 30.522 18.949 25.323 1.00 0.00 H new ATOM 0 HB2 SER A 17 29.995 16.075 24.460 1.00 0.00 H new ATOM 0 HB3 SER A 17 31.311 17.084 23.894 1.00 0.00 H new ATOM 0 HG SER A 17 31.953 15.709 25.655 1.00 0.00 H new ATOM 312 N HIS A 18 29.151 19.856 23.451 1.00 0.00 N ATOM 313 CA HIS A 18 28.298 20.531 22.460 1.00 0.00 C ATOM 314 C HIS A 18 29.070 21.646 21.747 1.00 0.00 C ATOM 315 O HIS A 18 29.402 21.514 20.568 1.00 0.00 O ATOM 316 CB HIS A 18 27.032 21.057 23.173 1.00 0.00 C ATOM 317 CG HIS A 18 26.147 21.982 22.368 1.00 0.00 C ATOM 318 ND1 HIS A 18 25.300 22.947 22.922 1.00 0.00 N ATOM 319 CD2 HIS A 18 26.000 22.004 21.008 1.00 0.00 C ATOM 320 CE1 HIS A 18 24.681 23.541 21.887 1.00 0.00 C ATOM 321 NE2 HIS A 18 25.084 22.995 20.728 1.00 0.00 N ATOM 0 H HIS A 18 29.871 20.467 23.835 1.00 0.00 H new ATOM 0 HA HIS A 18 27.993 19.827 21.686 1.00 0.00 H new ATOM 0 HB2 HIS A 18 26.436 20.201 23.488 1.00 0.00 H new ATOM 0 HB3 HIS A 18 27.341 21.580 24.078 1.00 0.00 H new ATOM 0 HD2 HIS A 18 26.503 21.369 20.294 1.00 0.00 H new ATOM 0 HE1 HIS A 18 23.963 24.343 21.975 1.00 0.00 H new ATOM 0 HE2 HIS A 18 24.766 23.268 19.798 1.00 0.00 H new ATOM 329 N VAL A 19 29.391 22.723 22.472 1.00 0.00 N ATOM 330 CA VAL A 19 30.163 23.874 21.986 1.00 0.00 C ATOM 331 C VAL A 19 31.602 23.821 22.521 1.00 0.00 C ATOM 332 O VAL A 19 31.833 23.896 23.728 1.00 0.00 O ATOM 333 CB VAL A 19 29.459 25.211 22.327 1.00 0.00 C ATOM 334 CG1 VAL A 19 28.283 25.466 21.381 1.00 0.00 C ATOM 335 CG2 VAL A 19 28.919 25.309 23.765 1.00 0.00 C ATOM 0 H VAL A 19 29.111 22.822 23.448 1.00 0.00 H new ATOM 0 HA VAL A 19 30.215 23.820 20.899 1.00 0.00 H new ATOM 0 HB VAL A 19 30.244 25.959 22.213 1.00 0.00 H new ATOM 0 HG11 VAL A 19 27.805 26.411 21.641 1.00 0.00 H new ATOM 0 HG12 VAL A 19 28.646 25.513 20.354 1.00 0.00 H new ATOM 0 HG13 VAL A 19 27.560 24.656 21.473 1.00 0.00 H new ATOM 0 HG21 VAL A 19 28.444 26.279 23.910 1.00 0.00 H new ATOM 0 HG22 VAL A 19 28.188 24.518 23.934 1.00 0.00 H new ATOM 0 HG23 VAL A 19 29.742 25.199 24.471 1.00 0.00 H new ATOM 345 N SER A 20 32.579 23.678 21.622 1.00 0.00 N ATOM 346 CA SER A 20 34.009 23.874 21.919 1.00 0.00 C ATOM 347 C SER A 20 34.333 25.368 22.059 1.00 0.00 C ATOM 348 O SER A 20 33.544 26.207 21.627 1.00 0.00 O ATOM 349 CB SER A 20 34.861 23.242 20.809 1.00 0.00 C ATOM 350 OG SER A 20 34.671 23.921 19.576 1.00 0.00 O ATOM 0 H SER A 20 32.401 23.419 20.652 1.00 0.00 H new ATOM 0 HA SER A 20 34.241 23.387 22.866 1.00 0.00 H new ATOM 0 HB2 SER A 20 35.914 23.276 21.089 1.00 0.00 H new ATOM 0 HB3 SER A 20 34.595 22.191 20.695 1.00 0.00 H new ATOM 0 HG SER A 20 35.224 23.503 18.884 1.00 0.00 H new ATOM 356 N SER A 21 35.491 25.737 22.617 1.00 0.00 N ATOM 357 CA SER A 21 35.858 27.145 22.885 1.00 0.00 C ATOM 358 C SER A 21 35.691 28.079 21.669 1.00 0.00 C ATOM 359 O SER A 21 35.157 29.188 21.791 1.00 0.00 O ATOM 360 CB SER A 21 37.307 27.184 23.395 1.00 0.00 C ATOM 361 OG SER A 21 37.739 28.513 23.617 1.00 0.00 O ATOM 0 H SER A 21 36.208 25.069 22.899 1.00 0.00 H new ATOM 0 HA SER A 21 35.166 27.523 23.637 1.00 0.00 H new ATOM 0 HB2 SER A 21 37.384 26.615 24.321 1.00 0.00 H new ATOM 0 HB3 SER A 21 37.963 26.703 22.670 1.00 0.00 H new ATOM 0 HG SER A 21 38.663 28.506 23.942 1.00 0.00 H new ATOM 367 N ARG A 22 36.054 27.601 20.468 1.00 0.00 N ATOM 368 CA ARG A 22 35.910 28.342 19.197 1.00 0.00 C ATOM 369 C ARG A 22 34.443 28.519 18.784 1.00 0.00 C ATOM 370 O ARG A 22 34.067 29.568 18.263 1.00 0.00 O ATOM 371 CB ARG A 22 36.707 27.653 18.070 1.00 0.00 C ATOM 372 CG ARG A 22 38.182 27.377 18.423 1.00 0.00 C ATOM 373 CD ARG A 22 38.415 25.924 18.876 1.00 0.00 C ATOM 374 NE ARG A 22 39.654 25.774 19.667 1.00 0.00 N ATOM 375 CZ ARG A 22 40.901 25.707 19.224 1.00 0.00 C ATOM 376 NH1 ARG A 22 41.202 25.786 17.955 1.00 0.00 N ATOM 377 NH2 ARG A 22 41.884 25.555 20.067 1.00 0.00 N ATOM 0 H ARG A 22 36.463 26.674 20.347 1.00 0.00 H new ATOM 0 HA ARG A 22 36.319 29.338 19.364 1.00 0.00 H new ATOM 0 HB2 ARG A 22 36.221 26.710 17.820 1.00 0.00 H new ATOM 0 HB3 ARG A 22 36.668 28.278 17.178 1.00 0.00 H new ATOM 0 HG2 ARG A 22 38.806 27.589 17.555 1.00 0.00 H new ATOM 0 HG3 ARG A 22 38.497 28.057 19.215 1.00 0.00 H new ATOM 0 HD2 ARG A 22 37.565 25.591 19.471 1.00 0.00 H new ATOM 0 HD3 ARG A 22 38.465 25.277 18.001 1.00 0.00 H new ATOM 0 HE ARG A 22 39.535 25.715 20.678 1.00 0.00 H new ATOM 0 HH11 ARG A 22 40.463 25.904 17.262 1.00 0.00 H new ATOM 0 HH12 ARG A 22 42.176 25.730 17.657 1.00 0.00 H new ATOM 0 HH21 ARG A 22 41.693 25.488 21.067 1.00 0.00 H new ATOM 0 HH22 ARG A 22 42.844 25.503 19.727 1.00 0.00 H new ATOM 391 N ASP A 23 33.608 27.515 19.041 1.00 0.00 N ATOM 392 CA ASP A 23 32.166 27.554 18.770 1.00 0.00 C ATOM 393 C ASP A 23 31.402 28.397 19.813 1.00 0.00 C ATOM 394 O ASP A 23 30.488 29.136 19.451 1.00 0.00 O ATOM 395 CB ASP A 23 31.632 26.110 18.704 1.00 0.00 C ATOM 396 CG ASP A 23 30.343 25.941 17.873 1.00 0.00 C ATOM 397 OD1 ASP A 23 29.934 26.864 17.129 1.00 0.00 O ATOM 398 OD2 ASP A 23 29.758 24.834 17.922 1.00 0.00 O ATOM 0 H ASP A 23 33.917 26.634 19.451 1.00 0.00 H new ATOM 0 HA ASP A 23 32.001 28.044 17.810 1.00 0.00 H new ATOM 0 HB2 ASP A 23 32.407 25.469 18.284 1.00 0.00 H new ATOM 0 HB3 ASP A 23 31.444 25.759 19.719 1.00 0.00 H new ATOM 403 N VAL A 24 31.820 28.368 21.090 1.00 0.00 N ATOM 404 CA VAL A 24 31.329 29.276 22.145 1.00 0.00 C ATOM 405 C VAL A 24 31.616 30.730 21.754 1.00 0.00 C ATOM 406 O VAL A 24 30.708 31.557 21.779 1.00 0.00 O ATOM 407 CB VAL A 24 31.956 28.974 23.529 1.00 0.00 C ATOM 408 CG1 VAL A 24 31.451 29.938 24.611 1.00 0.00 C ATOM 409 CG2 VAL A 24 31.629 27.578 24.066 1.00 0.00 C ATOM 0 H VAL A 24 32.518 27.704 21.425 1.00 0.00 H new ATOM 0 HA VAL A 24 30.255 29.115 22.234 1.00 0.00 H new ATOM 0 HB VAL A 24 33.026 29.074 23.346 1.00 0.00 H new ATOM 0 HG11 VAL A 24 31.916 29.690 25.565 1.00 0.00 H new ATOM 0 HG12 VAL A 24 31.709 30.961 24.336 1.00 0.00 H new ATOM 0 HG13 VAL A 24 30.368 29.849 24.701 1.00 0.00 H new ATOM 0 HG21 VAL A 24 32.103 27.442 25.038 1.00 0.00 H new ATOM 0 HG22 VAL A 24 30.549 27.472 24.171 1.00 0.00 H new ATOM 0 HG23 VAL A 24 32.001 26.825 23.372 1.00 0.00 H new ATOM 419 N GLU A 25 32.843 31.044 21.323 1.00 0.00 N ATOM 420 CA GLU A 25 33.206 32.383 20.835 1.00 0.00 C ATOM 421 C GLU A 25 32.322 32.813 19.651 1.00 0.00 C ATOM 422 O GLU A 25 31.701 33.876 19.700 1.00 0.00 O ATOM 423 CB GLU A 25 34.704 32.406 20.473 1.00 0.00 C ATOM 424 CG GLU A 25 35.162 33.747 19.873 1.00 0.00 C ATOM 425 CD GLU A 25 36.679 33.797 19.594 1.00 0.00 C ATOM 426 OE1 GLU A 25 37.291 32.761 19.233 1.00 0.00 O ATOM 427 OE2 GLU A 25 37.271 34.899 19.699 1.00 0.00 O ATOM 0 H GLU A 25 33.615 30.377 21.302 1.00 0.00 H new ATOM 0 HA GLU A 25 33.028 33.110 21.628 1.00 0.00 H new ATOM 0 HB2 GLU A 25 35.291 32.196 21.367 1.00 0.00 H new ATOM 0 HB3 GLU A 25 34.911 31.607 19.761 1.00 0.00 H new ATOM 0 HG2 GLU A 25 34.621 33.926 18.944 1.00 0.00 H new ATOM 0 HG3 GLU A 25 34.897 34.554 20.557 1.00 0.00 H new ATOM 434 N ASN A 26 32.211 31.982 18.607 1.00 0.00 N ATOM 435 CA ASN A 26 31.423 32.305 17.415 1.00 0.00 C ATOM 436 C ASN A 26 29.916 32.473 17.711 1.00 0.00 C ATOM 437 O ASN A 26 29.259 33.323 17.107 1.00 0.00 O ATOM 438 CB ASN A 26 31.680 31.220 16.356 1.00 0.00 C ATOM 439 CG ASN A 26 31.099 31.602 15.003 1.00 0.00 C ATOM 440 OD1 ASN A 26 31.428 32.629 14.428 1.00 0.00 O ATOM 441 ND2 ASN A 26 30.223 30.794 14.448 1.00 0.00 N ATOM 0 H ASN A 26 32.665 31.069 18.567 1.00 0.00 H new ATOM 0 HA ASN A 26 31.744 33.276 17.039 1.00 0.00 H new ATOM 0 HB2 ASN A 26 32.753 31.055 16.257 1.00 0.00 H new ATOM 0 HB3 ASN A 26 31.242 30.278 16.687 1.00 0.00 H new ATOM 0 HD21 ASN A 26 29.820 31.025 13.540 1.00 0.00 H new ATOM 0 HD22 ASN A 26 29.946 29.936 14.925 1.00 0.00 H new ATOM 448 N GLU A 27 29.367 31.706 18.659 1.00 0.00 N ATOM 449 CA GLU A 27 27.985 31.843 19.138 1.00 0.00 C ATOM 450 C GLU A 27 27.780 33.148 19.927 1.00 0.00 C ATOM 451 O GLU A 27 26.880 33.931 19.612 1.00 0.00 O ATOM 452 CB GLU A 27 27.625 30.603 19.982 1.00 0.00 C ATOM 453 CG GLU A 27 26.217 30.598 20.605 1.00 0.00 C ATOM 454 CD GLU A 27 25.054 30.383 19.605 1.00 0.00 C ATOM 455 OE1 GLU A 27 25.273 30.370 18.366 1.00 0.00 O ATOM 456 OE2 GLU A 27 23.898 30.215 20.069 1.00 0.00 O ATOM 0 H GLU A 27 29.880 30.957 19.125 1.00 0.00 H new ATOM 0 HA GLU A 27 27.314 31.900 18.281 1.00 0.00 H new ATOM 0 HB2 GLU A 27 27.726 29.718 19.354 1.00 0.00 H new ATOM 0 HB3 GLU A 27 28.356 30.509 20.785 1.00 0.00 H new ATOM 0 HG2 GLU A 27 26.174 29.814 21.361 1.00 0.00 H new ATOM 0 HG3 GLU A 27 26.062 31.546 21.120 1.00 0.00 H new ATOM 463 N PHE A 28 28.616 33.413 20.938 1.00 0.00 N ATOM 464 CA PHE A 28 28.444 34.564 21.832 1.00 0.00 C ATOM 465 C PHE A 28 28.763 35.925 21.191 1.00 0.00 C ATOM 466 O PHE A 28 28.235 36.932 21.661 1.00 0.00 O ATOM 467 CB PHE A 28 29.171 34.341 23.165 1.00 0.00 C ATOM 468 CG PHE A 28 28.332 33.547 24.153 1.00 0.00 C ATOM 469 CD1 PHE A 28 27.282 34.182 24.843 1.00 0.00 C ATOM 470 CD2 PHE A 28 28.551 32.171 24.345 1.00 0.00 C ATOM 471 CE1 PHE A 28 26.455 33.447 25.709 1.00 0.00 C ATOM 472 CE2 PHE A 28 27.737 31.436 25.226 1.00 0.00 C ATOM 473 CZ PHE A 28 26.685 32.074 25.910 1.00 0.00 C ATOM 0 H PHE A 28 29.429 32.837 21.159 1.00 0.00 H new ATOM 0 HA PHE A 28 27.376 34.624 22.043 1.00 0.00 H new ATOM 0 HB2 PHE A 28 30.108 33.815 22.982 1.00 0.00 H new ATOM 0 HB3 PHE A 28 29.428 35.306 23.602 1.00 0.00 H new ATOM 0 HD1 PHE A 28 27.111 35.240 24.706 1.00 0.00 H new ATOM 0 HD2 PHE A 28 29.349 31.675 23.813 1.00 0.00 H new ATOM 0 HE1 PHE A 28 25.641 33.937 26.222 1.00 0.00 H new ATOM 0 HE2 PHE A 28 27.919 30.382 25.378 1.00 0.00 H new ATOM 0 HZ PHE A 28 26.058 31.512 26.586 1.00 0.00 H new ATOM 483 N ARG A 29 29.508 35.991 20.077 1.00 0.00 N ATOM 484 CA ARG A 29 29.748 37.257 19.347 1.00 0.00 C ATOM 485 C ARG A 29 28.466 37.994 18.909 1.00 0.00 C ATOM 486 O ARG A 29 28.507 39.220 18.784 1.00 0.00 O ATOM 487 CB ARG A 29 30.682 37.018 18.144 1.00 0.00 C ATOM 488 CG ARG A 29 32.163 36.999 18.567 1.00 0.00 C ATOM 489 CD ARG A 29 33.092 36.743 17.375 1.00 0.00 C ATOM 490 NE ARG A 29 33.210 37.936 16.511 1.00 0.00 N ATOM 491 CZ ARG A 29 33.775 37.999 15.315 1.00 0.00 C ATOM 492 NH1 ARG A 29 34.265 36.942 14.720 1.00 0.00 N ATOM 493 NH2 ARG A 29 33.862 39.141 14.691 1.00 0.00 N ATOM 0 H ARG A 29 29.960 35.179 19.655 1.00 0.00 H new ATOM 0 HA ARG A 29 30.233 37.922 20.062 1.00 0.00 H new ATOM 0 HB2 ARG A 29 30.427 36.071 17.668 1.00 0.00 H new ATOM 0 HB3 ARG A 29 30.526 37.800 17.401 1.00 0.00 H new ATOM 0 HG2 ARG A 29 32.421 37.951 19.031 1.00 0.00 H new ATOM 0 HG3 ARG A 29 32.316 36.226 19.320 1.00 0.00 H new ATOM 0 HD2 ARG A 29 34.079 36.457 17.737 1.00 0.00 H new ATOM 0 HD3 ARG A 29 32.712 35.906 16.790 1.00 0.00 H new ATOM 0 HE ARG A 29 32.814 38.803 16.874 1.00 0.00 H new ATOM 0 HH11 ARG A 29 34.219 36.032 15.178 1.00 0.00 H new ATOM 0 HH12 ARG A 29 34.693 37.028 13.798 1.00 0.00 H new ATOM 0 HH21 ARG A 29 33.494 39.988 15.124 1.00 0.00 H new ATOM 0 HH22 ARG A 29 34.298 39.187 13.770 1.00 0.00 H new ATOM 507 N LYS A 30 27.327 37.303 18.725 1.00 0.00 N ATOM 508 CA LYS A 30 26.021 37.955 18.448 1.00 0.00 C ATOM 509 C LYS A 30 25.366 38.572 19.698 1.00 0.00 C ATOM 510 O LYS A 30 24.587 39.517 19.573 1.00 0.00 O ATOM 511 CB LYS A 30 25.094 37.008 17.646 1.00 0.00 C ATOM 512 CG LYS A 30 24.182 36.051 18.443 1.00 0.00 C ATOM 513 CD LYS A 30 22.792 36.648 18.741 1.00 0.00 C ATOM 514 CE LYS A 30 21.931 35.714 19.602 1.00 0.00 C ATOM 515 NZ LYS A 30 20.560 36.266 19.780 1.00 0.00 N ATOM 0 H LYS A 30 27.278 36.285 18.762 1.00 0.00 H new ATOM 0 HA LYS A 30 26.213 38.818 17.810 1.00 0.00 H new ATOM 0 HB2 LYS A 30 24.459 37.622 17.007 1.00 0.00 H new ATOM 0 HB3 LYS A 30 25.719 36.405 16.988 1.00 0.00 H new ATOM 0 HG2 LYS A 30 24.060 35.124 17.883 1.00 0.00 H new ATOM 0 HG3 LYS A 30 24.669 35.793 19.383 1.00 0.00 H new ATOM 0 HD2 LYS A 30 22.911 37.603 19.252 1.00 0.00 H new ATOM 0 HD3 LYS A 30 22.277 36.851 17.802 1.00 0.00 H new ATOM 0 HE2 LYS A 30 21.873 34.732 19.133 1.00 0.00 H new ATOM 0 HE3 LYS A 30 22.400 35.576 20.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 20.024 35.660 20.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 20.621 37.228 20.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 20.076 36.296 18.860 1.00 0.00 H new ATOM 529 N TYR A 31 25.688 38.067 20.893 1.00 0.00 N ATOM 530 CA TYR A 31 25.215 38.580 22.187 1.00 0.00 C ATOM 531 C TYR A 31 25.975 39.866 22.566 1.00 0.00 C ATOM 532 O TYR A 31 25.386 40.800 23.106 1.00 0.00 O ATOM 533 CB TYR A 31 25.396 37.529 23.310 1.00 0.00 C ATOM 534 CG TYR A 31 24.673 36.190 23.196 1.00 0.00 C ATOM 535 CD1 TYR A 31 24.905 35.325 22.108 1.00 0.00 C ATOM 536 CD2 TYR A 31 23.839 35.751 24.248 1.00 0.00 C ATOM 537 CE1 TYR A 31 24.284 34.066 22.033 1.00 0.00 C ATOM 538 CE2 TYR A 31 23.225 34.482 24.187 1.00 0.00 C ATOM 539 CZ TYR A 31 23.438 33.639 23.076 1.00 0.00 C ATOM 540 OH TYR A 31 22.841 32.418 23.015 1.00 0.00 O ATOM 0 H TYR A 31 26.306 37.262 20.992 1.00 0.00 H new ATOM 0 HA TYR A 31 24.153 38.800 22.083 1.00 0.00 H new ATOM 0 HB2 TYR A 31 26.462 37.320 23.396 1.00 0.00 H new ATOM 0 HB3 TYR A 31 25.085 37.992 24.247 1.00 0.00 H new ATOM 0 HD1 TYR A 31 25.572 35.635 21.317 1.00 0.00 H new ATOM 0 HD2 TYR A 31 23.671 36.389 25.103 1.00 0.00 H new ATOM 0 HE1 TYR A 31 24.455 33.428 21.179 1.00 0.00 H new ATOM 0 HE2 TYR A 31 22.588 34.154 24.995 1.00 0.00 H new ATOM 0 HH TYR A 31 23.411 31.800 22.511 1.00 0.00 H new ATOM 550 N GLY A 32 27.283 39.920 22.279 1.00 0.00 N ATOM 551 CA GLY A 32 28.153 41.070 22.546 1.00 0.00 C ATOM 552 C GLY A 32 29.646 40.743 22.406 1.00 0.00 C ATOM 553 O GLY A 32 30.025 39.640 22.007 1.00 0.00 O ATOM 0 H GLY A 32 27.777 39.142 21.842 1.00 0.00 H new ATOM 0 HA2 GLY A 32 27.898 41.877 21.859 1.00 0.00 H new ATOM 0 HA3 GLY A 32 27.961 41.437 23.554 1.00 0.00 H new ATOM 557 N ASN A 33 30.508 41.714 22.720 1.00 0.00 N ATOM 558 CA ASN A 33 31.964 41.559 22.627 1.00 0.00 C ATOM 559 C ASN A 33 32.527 40.702 23.779 1.00 0.00 C ATOM 560 O ASN A 33 32.485 41.095 24.949 1.00 0.00 O ATOM 561 CB ASN A 33 32.634 42.944 22.552 1.00 0.00 C ATOM 562 CG ASN A 33 32.243 43.718 21.305 1.00 0.00 C ATOM 563 OD1 ASN A 33 31.235 44.411 21.259 1.00 0.00 O ATOM 564 ND2 ASN A 33 33.019 43.624 20.247 1.00 0.00 N ATOM 0 H ASN A 33 30.215 42.634 23.048 1.00 0.00 H new ATOM 0 HA ASN A 33 32.196 41.018 21.710 1.00 0.00 H new ATOM 0 HB2 ASN A 33 32.361 43.523 23.434 1.00 0.00 H new ATOM 0 HB3 ASN A 33 33.717 42.821 22.574 1.00 0.00 H new ATOM 0 HD21 ASN A 33 32.780 44.127 19.393 1.00 0.00 H new ATOM 0 HD22 ASN A 33 33.860 43.048 20.281 1.00 0.00 H new ATOM 571 N ILE A 34 33.083 39.544 23.417 1.00 0.00 N ATOM 572 CA ILE A 34 33.819 38.611 24.285 1.00 0.00 C ATOM 573 C ILE A 34 35.296 39.024 24.422 1.00 0.00 C ATOM 574 O ILE A 34 35.935 39.384 23.430 1.00 0.00 O ATOM 575 CB ILE A 34 33.614 37.150 23.794 1.00 0.00 C ATOM 576 CG1 ILE A 34 34.511 36.097 24.493 1.00 0.00 C ATOM 577 CG2 ILE A 34 33.662 36.975 22.262 1.00 0.00 C ATOM 578 CD1 ILE A 34 35.913 35.851 23.906 1.00 0.00 C ATOM 0 H ILE A 34 33.031 39.209 22.455 1.00 0.00 H new ATOM 0 HA ILE A 34 33.414 38.657 25.296 1.00 0.00 H new ATOM 0 HB ILE A 34 32.590 36.947 24.106 1.00 0.00 H new ATOM 0 HG12 ILE A 34 34.631 36.396 25.534 1.00 0.00 H new ATOM 0 HG13 ILE A 34 33.976 35.147 24.494 1.00 0.00 H new ATOM 0 HG21 ILE A 34 33.510 35.925 22.011 1.00 0.00 H new ATOM 0 HG22 ILE A 34 32.877 37.576 21.802 1.00 0.00 H new ATOM 0 HG23 ILE A 34 34.633 37.300 21.889 1.00 0.00 H new ATOM 0 HD11 ILE A 34 36.426 35.091 24.495 1.00 0.00 H new ATOM 0 HD12 ILE A 34 35.821 35.510 22.875 1.00 0.00 H new ATOM 0 HD13 ILE A 34 36.486 36.778 23.932 1.00 0.00 H new ATOM 590 N LEU A 35 35.844 38.952 25.643 1.00 0.00 N ATOM 591 CA LEU A 35 37.262 39.214 25.953 1.00 0.00 C ATOM 592 C LEU A 35 38.070 37.927 26.229 1.00 0.00 C ATOM 593 O LEU A 35 39.233 37.831 25.827 1.00 0.00 O ATOM 594 CB LEU A 35 37.394 40.159 27.167 1.00 0.00 C ATOM 595 CG LEU A 35 36.794 41.576 27.084 1.00 0.00 C ATOM 596 CD1 LEU A 35 37.063 42.276 25.750 1.00 0.00 C ATOM 597 CD2 LEU A 35 35.297 41.615 27.382 1.00 0.00 C ATOM 0 H LEU A 35 35.299 38.703 26.469 1.00 0.00 H new ATOM 0 HA LEU A 35 37.678 39.685 25.062 1.00 0.00 H new ATOM 0 HB2 LEU A 35 36.940 39.660 28.023 1.00 0.00 H new ATOM 0 HB3 LEU A 35 38.456 40.265 27.387 1.00 0.00 H new ATOM 0 HG LEU A 35 37.316 42.125 27.867 1.00 0.00 H new ATOM 0 HD11 LEU A 35 36.612 43.268 25.762 1.00 0.00 H new ATOM 0 HD12 LEU A 35 38.138 42.368 25.598 1.00 0.00 H new ATOM 0 HD13 LEU A 35 36.630 41.691 24.938 1.00 0.00 H new ATOM 0 HD21 LEU A 35 34.938 42.641 27.307 1.00 0.00 H new ATOM 0 HD22 LEU A 35 34.766 40.991 26.663 1.00 0.00 H new ATOM 0 HD23 LEU A 35 35.117 41.241 28.390 1.00 0.00 H new ATOM 609 N LYS A 36 37.459 36.945 26.906 1.00 0.00 N ATOM 610 CA LYS A 36 38.046 35.652 27.309 1.00 0.00 C ATOM 611 C LYS A 36 36.950 34.586 27.352 1.00 0.00 C ATOM 612 O LYS A 36 35.822 34.877 27.747 1.00 0.00 O ATOM 613 CB LYS A 36 38.767 35.818 28.666 1.00 0.00 C ATOM 614 CG LYS A 36 39.363 34.523 29.255 1.00 0.00 C ATOM 615 CD LYS A 36 40.205 34.838 30.506 1.00 0.00 C ATOM 616 CE LYS A 36 40.648 33.607 31.316 1.00 0.00 C ATOM 617 NZ LYS A 36 41.504 32.667 30.546 1.00 0.00 N ATOM 0 H LYS A 36 36.488 37.033 27.205 1.00 0.00 H new ATOM 0 HA LYS A 36 38.789 35.323 26.583 1.00 0.00 H new ATOM 0 HB2 LYS A 36 39.569 36.547 28.547 1.00 0.00 H new ATOM 0 HB3 LYS A 36 38.062 36.235 29.385 1.00 0.00 H new ATOM 0 HG2 LYS A 36 38.561 33.831 29.514 1.00 0.00 H new ATOM 0 HG3 LYS A 36 39.983 34.028 28.507 1.00 0.00 H new ATOM 0 HD2 LYS A 36 41.093 35.391 30.199 1.00 0.00 H new ATOM 0 HD3 LYS A 36 39.629 35.495 31.157 1.00 0.00 H new ATOM 0 HE2 LYS A 36 41.192 33.940 32.200 1.00 0.00 H new ATOM 0 HE3 LYS A 36 39.764 33.076 31.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 42.086 32.109 31.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 40.903 32.028 29.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 42.123 33.205 29.907 1.00 0.00 H new ATOM 631 N CYS A 37 37.267 33.365 26.936 1.00 0.00 N ATOM 632 CA CYS A 37 36.312 32.264 26.807 1.00 0.00 C ATOM 633 C CYS A 37 37.002 30.929 27.124 1.00 0.00 C ATOM 634 O CYS A 37 37.952 30.543 26.443 1.00 0.00 O ATOM 635 CB CYS A 37 35.746 32.289 25.380 1.00 0.00 C ATOM 636 SG CYS A 37 34.621 30.891 25.144 1.00 0.00 S ATOM 0 H CYS A 37 38.217 33.104 26.672 1.00 0.00 H new ATOM 0 HA CYS A 37 35.492 32.376 27.517 1.00 0.00 H new ATOM 0 HB2 CYS A 37 35.218 33.226 25.204 1.00 0.00 H new ATOM 0 HB3 CYS A 37 36.559 32.240 24.655 1.00 0.00 H new ATOM 0 HG CYS A 37 34.143 30.918 23.935 1.00 0.00 H new ATOM 642 N ASP A 38 36.529 30.234 28.163 1.00 0.00 N ATOM 643 CA ASP A 38 37.108 28.979 28.661 1.00 0.00 C ATOM 644 C ASP A 38 36.053 28.067 29.311 1.00 0.00 C ATOM 645 O ASP A 38 35.018 28.528 29.805 1.00 0.00 O ATOM 646 CB ASP A 38 38.253 29.271 29.646 1.00 0.00 C ATOM 647 CG ASP A 38 39.500 29.866 28.966 1.00 0.00 C ATOM 648 OD1 ASP A 38 40.255 29.097 28.324 1.00 0.00 O ATOM 649 OD2 ASP A 38 39.743 31.092 29.100 1.00 0.00 O ATOM 0 H ASP A 38 35.713 30.535 28.695 1.00 0.00 H new ATOM 0 HA ASP A 38 37.507 28.442 27.800 1.00 0.00 H new ATOM 0 HB2 ASP A 38 37.899 29.963 30.410 1.00 0.00 H new ATOM 0 HB3 ASP A 38 38.530 28.348 30.155 1.00 0.00 H new ATOM 654 N VAL A 39 36.337 26.761 29.325 1.00 0.00 N ATOM 655 CA VAL A 39 35.458 25.704 29.854 1.00 0.00 C ATOM 656 C VAL A 39 36.205 24.883 30.912 1.00 0.00 C ATOM 657 O VAL A 39 37.344 24.468 30.690 1.00 0.00 O ATOM 658 CB VAL A 39 34.909 24.800 28.725 1.00 0.00 C ATOM 659 CG1 VAL A 39 33.820 23.849 29.240 1.00 0.00 C ATOM 660 CG2 VAL A 39 34.315 25.613 27.563 1.00 0.00 C ATOM 0 H VAL A 39 37.215 26.394 28.957 1.00 0.00 H new ATOM 0 HA VAL A 39 34.597 26.179 30.325 1.00 0.00 H new ATOM 0 HB VAL A 39 35.766 24.229 28.367 1.00 0.00 H new ATOM 0 HG11 VAL A 39 33.459 23.230 28.418 1.00 0.00 H new ATOM 0 HG12 VAL A 39 34.234 23.210 30.020 1.00 0.00 H new ATOM 0 HG13 VAL A 39 32.993 24.430 29.647 1.00 0.00 H new ATOM 0 HG21 VAL A 39 33.943 24.933 26.796 1.00 0.00 H new ATOM 0 HG22 VAL A 39 33.494 26.228 27.932 1.00 0.00 H new ATOM 0 HG23 VAL A 39 35.086 26.255 27.136 1.00 0.00 H new ATOM 670 N LYS A 40 35.563 24.645 32.061 1.00 0.00 N ATOM 671 CA LYS A 40 36.104 23.908 33.220 1.00 0.00 C ATOM 672 C LYS A 40 35.204 22.714 33.577 1.00 0.00 C ATOM 673 O LYS A 40 34.069 22.636 33.104 1.00 0.00 O ATOM 674 CB LYS A 40 36.309 24.851 34.429 1.00 0.00 C ATOM 675 CG LYS A 40 37.041 26.172 34.102 1.00 0.00 C ATOM 676 CD LYS A 40 36.079 27.355 33.867 1.00 0.00 C ATOM 677 CE LYS A 40 35.839 28.245 35.103 1.00 0.00 C ATOM 678 NZ LYS A 40 35.551 27.476 36.335 1.00 0.00 N ATOM 0 H LYS A 40 34.610 24.973 32.221 1.00 0.00 H new ATOM 0 HA LYS A 40 37.082 23.512 32.947 1.00 0.00 H new ATOM 0 HB2 LYS A 40 35.335 25.088 34.857 1.00 0.00 H new ATOM 0 HB3 LYS A 40 36.873 24.319 35.195 1.00 0.00 H new ATOM 0 HG2 LYS A 40 37.717 26.418 34.921 1.00 0.00 H new ATOM 0 HG3 LYS A 40 37.656 26.029 33.213 1.00 0.00 H new ATOM 0 HD2 LYS A 40 36.475 27.974 33.062 1.00 0.00 H new ATOM 0 HD3 LYS A 40 35.120 26.964 33.526 1.00 0.00 H new ATOM 0 HE2 LYS A 40 36.718 28.867 35.269 1.00 0.00 H new ATOM 0 HE3 LYS A 40 35.006 28.918 34.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 35.003 28.066 36.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 35.003 26.626 36.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 36.445 27.195 36.786 1.00 0.00 H new ATOM 692 N LYS A 41 35.689 21.790 34.414 1.00 0.00 N ATOM 693 CA LYS A 41 34.943 20.595 34.865 1.00 0.00 C ATOM 694 C LYS A 41 35.216 20.221 36.326 1.00 0.00 C ATOM 695 O LYS A 41 36.288 20.511 36.854 1.00 0.00 O ATOM 696 CB LYS A 41 35.146 19.410 33.892 1.00 0.00 C ATOM 697 CG LYS A 41 36.450 18.597 34.033 1.00 0.00 C ATOM 698 CD LYS A 41 37.769 19.338 33.752 1.00 0.00 C ATOM 699 CE LYS A 41 37.845 19.867 32.313 1.00 0.00 C ATOM 700 NZ LYS A 41 39.180 20.450 32.014 1.00 0.00 N ATOM 0 H LYS A 41 36.628 21.847 34.808 1.00 0.00 H new ATOM 0 HA LYS A 41 33.885 20.858 34.840 1.00 0.00 H new ATOM 0 HB2 LYS A 41 34.306 18.726 34.013 1.00 0.00 H new ATOM 0 HB3 LYS A 41 35.097 19.797 32.874 1.00 0.00 H new ATOM 0 HG2 LYS A 41 36.494 18.200 35.047 1.00 0.00 H new ATOM 0 HG3 LYS A 41 36.391 17.743 33.359 1.00 0.00 H new ATOM 0 HD2 LYS A 41 37.871 20.170 34.449 1.00 0.00 H new ATOM 0 HD3 LYS A 41 38.607 18.665 33.934 1.00 0.00 H new ATOM 0 HE2 LYS A 41 37.637 19.056 31.615 1.00 0.00 H new ATOM 0 HE3 LYS A 41 37.075 20.623 32.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 39.196 20.797 31.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 39.367 21.240 32.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 39.912 19.721 32.135 1.00 0.00 H new ATOM 714 N THR A 42 34.242 19.569 36.962 1.00 0.00 N ATOM 715 CA THR A 42 34.345 19.020 38.332 1.00 0.00 C ATOM 716 C THR A 42 34.659 17.516 38.321 1.00 0.00 C ATOM 717 O THR A 42 34.388 16.818 37.342 1.00 0.00 O ATOM 718 CB THR A 42 33.081 19.339 39.157 1.00 0.00 C ATOM 719 OG1 THR A 42 33.186 18.792 40.451 1.00 0.00 O ATOM 720 CG2 THR A 42 31.785 18.788 38.564 1.00 0.00 C ATOM 0 H THR A 42 33.332 19.399 36.535 1.00 0.00 H new ATOM 0 HA THR A 42 35.185 19.512 38.821 1.00 0.00 H new ATOM 0 HB THR A 42 33.029 20.428 39.162 1.00 0.00 H new ATOM 0 HG1 THR A 42 32.377 19.004 40.962 1.00 0.00 H new ATOM 0 HG21 THR A 42 30.947 19.058 39.207 1.00 0.00 H new ATOM 0 HG22 THR A 42 31.631 19.210 37.571 1.00 0.00 H new ATOM 0 HG23 THR A 42 31.851 17.702 38.491 1.00 0.00 H new ATOM 728 N VAL A 43 35.183 16.993 39.435 1.00 0.00 N ATOM 729 CA VAL A 43 35.407 15.554 39.677 1.00 0.00 C ATOM 730 C VAL A 43 34.109 14.724 39.602 1.00 0.00 C ATOM 731 O VAL A 43 34.147 13.540 39.267 1.00 0.00 O ATOM 732 CB VAL A 43 36.141 15.369 41.025 1.00 0.00 C ATOM 733 CG1 VAL A 43 35.280 15.748 42.241 1.00 0.00 C ATOM 734 CG2 VAL A 43 36.655 13.940 41.223 1.00 0.00 C ATOM 0 H VAL A 43 35.474 17.574 40.221 1.00 0.00 H new ATOM 0 HA VAL A 43 36.037 15.169 38.875 1.00 0.00 H new ATOM 0 HB VAL A 43 36.986 16.054 40.967 1.00 0.00 H new ATOM 0 HG11 VAL A 43 35.854 15.595 43.155 1.00 0.00 H new ATOM 0 HG12 VAL A 43 34.987 16.795 42.167 1.00 0.00 H new ATOM 0 HG13 VAL A 43 34.388 15.123 42.264 1.00 0.00 H new ATOM 0 HG21 VAL A 43 37.162 13.866 42.185 1.00 0.00 H new ATOM 0 HG22 VAL A 43 35.816 13.245 41.201 1.00 0.00 H new ATOM 0 HG23 VAL A 43 37.354 13.691 40.424 1.00 0.00 H new ATOM 744 N SER A 44 32.947 15.353 39.831 1.00 0.00 N ATOM 745 CA SER A 44 31.613 14.747 39.643 1.00 0.00 C ATOM 746 C SER A 44 31.246 14.497 38.159 1.00 0.00 C ATOM 747 O SER A 44 30.291 13.777 37.857 1.00 0.00 O ATOM 748 CB SER A 44 30.572 15.631 40.351 1.00 0.00 C ATOM 749 OG SER A 44 29.304 15.001 40.431 1.00 0.00 O ATOM 0 H SER A 44 32.903 16.318 40.159 1.00 0.00 H new ATOM 0 HA SER A 44 31.626 13.753 40.090 1.00 0.00 H new ATOM 0 HB2 SER A 44 30.922 15.869 41.355 1.00 0.00 H new ATOM 0 HB3 SER A 44 30.474 16.575 39.815 1.00 0.00 H new ATOM 0 HG SER A 44 29.170 14.435 39.642 1.00 0.00 H new ATOM 755 N GLY A 45 32.018 15.051 37.214 1.00 0.00 N ATOM 756 CA GLY A 45 31.899 14.831 35.764 1.00 0.00 C ATOM 757 C GLY A 45 31.108 15.898 34.993 1.00 0.00 C ATOM 758 O GLY A 45 31.134 15.903 33.760 1.00 0.00 O ATOM 0 H GLY A 45 32.776 15.693 37.448 1.00 0.00 H new ATOM 0 HA2 GLY A 45 32.902 14.771 35.340 1.00 0.00 H new ATOM 0 HA3 GLY A 45 31.425 13.863 35.599 1.00 0.00 H new ATOM 762 N ALA A 46 30.429 16.823 35.684 1.00 0.00 N ATOM 763 CA ALA A 46 29.787 17.989 35.072 1.00 0.00 C ATOM 764 C ALA A 46 30.815 19.032 34.581 1.00 0.00 C ATOM 765 O ALA A 46 31.924 19.129 35.117 1.00 0.00 O ATOM 766 CB ALA A 46 28.792 18.592 36.072 1.00 0.00 C ATOM 0 H ALA A 46 30.310 16.780 36.696 1.00 0.00 H new ATOM 0 HA ALA A 46 29.248 17.666 34.181 1.00 0.00 H new ATOM 0 HB1 ALA A 46 28.309 19.461 35.625 1.00 0.00 H new ATOM 0 HB2 ALA A 46 28.037 17.848 36.327 1.00 0.00 H new ATOM 0 HB3 ALA A 46 29.322 18.896 36.975 1.00 0.00 H new ATOM 772 N ALA A 47 30.433 19.832 33.580 1.00 0.00 N ATOM 773 CA ALA A 47 31.262 20.886 32.989 1.00 0.00 C ATOM 774 C ALA A 47 30.533 22.238 32.905 1.00 0.00 C ATOM 775 O ALA A 47 29.301 22.313 32.971 1.00 0.00 O ATOM 776 CB ALA A 47 31.789 20.405 31.629 1.00 0.00 C ATOM 0 H ALA A 47 29.512 19.762 33.147 1.00 0.00 H new ATOM 0 HA ALA A 47 32.112 21.074 33.645 1.00 0.00 H new ATOM 0 HB1 ALA A 47 32.407 21.184 31.182 1.00 0.00 H new ATOM 0 HB2 ALA A 47 32.386 19.503 31.768 1.00 0.00 H new ATOM 0 HB3 ALA A 47 30.949 20.186 30.970 1.00 0.00 H new ATOM 782 N PHE A 48 31.309 23.316 32.782 1.00 0.00 N ATOM 783 CA PHE A 48 30.860 24.698 32.945 1.00 0.00 C ATOM 784 C PHE A 48 31.645 25.626 32.007 1.00 0.00 C ATOM 785 O PHE A 48 32.876 25.650 32.059 1.00 0.00 O ATOM 786 CB PHE A 48 31.063 25.141 34.407 1.00 0.00 C ATOM 787 CG PHE A 48 30.684 24.127 35.475 1.00 0.00 C ATOM 788 CD1 PHE A 48 31.654 23.215 35.936 1.00 0.00 C ATOM 789 CD2 PHE A 48 29.380 24.078 36.003 1.00 0.00 C ATOM 790 CE1 PHE A 48 31.317 22.248 36.899 1.00 0.00 C ATOM 791 CE2 PHE A 48 29.040 23.106 36.961 1.00 0.00 C ATOM 792 CZ PHE A 48 30.008 22.189 37.409 1.00 0.00 C ATOM 0 H PHE A 48 32.302 23.248 32.558 1.00 0.00 H new ATOM 0 HA PHE A 48 29.801 24.757 32.693 1.00 0.00 H new ATOM 0 HB2 PHE A 48 32.112 25.405 34.542 1.00 0.00 H new ATOM 0 HB3 PHE A 48 30.482 26.048 34.574 1.00 0.00 H new ATOM 0 HD1 PHE A 48 32.661 23.259 35.548 1.00 0.00 H new ATOM 0 HD2 PHE A 48 28.638 24.789 35.671 1.00 0.00 H new ATOM 0 HE1 PHE A 48 32.064 21.550 37.247 1.00 0.00 H new ATOM 0 HE2 PHE A 48 28.035 23.064 37.353 1.00 0.00 H new ATOM 0 HZ PHE A 48 29.746 21.441 38.143 1.00 0.00 H new ATOM 802 N ALA A 49 30.957 26.402 31.168 1.00 0.00 N ATOM 803 CA ALA A 49 31.575 27.404 30.299 1.00 0.00 C ATOM 804 C ALA A 49 31.358 28.821 30.851 1.00 0.00 C ATOM 805 O ALA A 49 30.257 29.171 31.287 1.00 0.00 O ATOM 806 CB ALA A 49 31.059 27.243 28.865 1.00 0.00 C ATOM 0 H ALA A 49 29.943 26.351 31.072 1.00 0.00 H new ATOM 0 HA ALA A 49 32.653 27.245 30.278 1.00 0.00 H new ATOM 0 HB1 ALA A 49 31.524 27.993 28.225 1.00 0.00 H new ATOM 0 HB2 ALA A 49 31.308 26.247 28.498 1.00 0.00 H new ATOM 0 HB3 ALA A 49 29.977 27.374 28.851 1.00 0.00 H new ATOM 812 N PHE A 50 32.412 29.637 30.803 1.00 0.00 N ATOM 813 CA PHE A 50 32.414 31.024 31.268 1.00 0.00 C ATOM 814 C PHE A 50 32.978 31.948 30.184 1.00 0.00 C ATOM 815 O PHE A 50 34.015 31.654 29.578 1.00 0.00 O ATOM 816 CB PHE A 50 33.212 31.152 32.572 1.00 0.00 C ATOM 817 CG PHE A 50 32.607 30.494 33.799 1.00 0.00 C ATOM 818 CD1 PHE A 50 32.756 29.110 34.017 1.00 0.00 C ATOM 819 CD2 PHE A 50 31.959 31.281 34.770 1.00 0.00 C ATOM 820 CE1 PHE A 50 32.308 28.532 35.218 1.00 0.00 C ATOM 821 CE2 PHE A 50 31.503 30.701 35.967 1.00 0.00 C ATOM 822 CZ PHE A 50 31.693 29.328 36.198 1.00 0.00 C ATOM 0 H PHE A 50 33.314 29.342 30.429 1.00 0.00 H new ATOM 0 HA PHE A 50 31.387 31.327 31.471 1.00 0.00 H new ATOM 0 HB2 PHE A 50 34.203 30.727 32.410 1.00 0.00 H new ATOM 0 HB3 PHE A 50 33.350 32.212 32.786 1.00 0.00 H new ATOM 0 HD1 PHE A 50 33.215 28.492 33.260 1.00 0.00 H new ATOM 0 HD2 PHE A 50 31.811 32.336 34.594 1.00 0.00 H new ATOM 0 HE1 PHE A 50 32.437 27.473 35.387 1.00 0.00 H new ATOM 0 HE2 PHE A 50 31.007 31.310 36.708 1.00 0.00 H new ATOM 0 HZ PHE A 50 31.367 28.886 37.128 1.00 0.00 H new ATOM 832 N ILE A 51 32.290 33.068 29.941 1.00 0.00 N ATOM 833 CA ILE A 51 32.548 33.968 28.809 1.00 0.00 C ATOM 834 C ILE A 51 32.592 35.422 29.298 1.00 0.00 C ATOM 835 O ILE A 51 31.568 36.002 29.657 1.00 0.00 O ATOM 836 CB ILE A 51 31.510 33.761 27.672 1.00 0.00 C ATOM 837 CG1 ILE A 51 31.153 32.288 27.344 1.00 0.00 C ATOM 838 CG2 ILE A 51 32.078 34.398 26.396 1.00 0.00 C ATOM 839 CD1 ILE A 51 29.966 31.731 28.143 1.00 0.00 C ATOM 0 H ILE A 51 31.523 33.382 30.536 1.00 0.00 H new ATOM 0 HA ILE A 51 33.522 33.727 28.382 1.00 0.00 H new ATOM 0 HB ILE A 51 30.587 34.220 28.027 1.00 0.00 H new ATOM 0 HG12 ILE A 51 30.928 32.209 26.280 1.00 0.00 H new ATOM 0 HG13 ILE A 51 32.027 31.664 27.532 1.00 0.00 H new ATOM 0 HG21 ILE A 51 31.369 34.268 25.578 1.00 0.00 H new ATOM 0 HG22 ILE A 51 32.247 35.462 26.564 1.00 0.00 H new ATOM 0 HG23 ILE A 51 33.022 33.917 26.138 1.00 0.00 H new ATOM 0 HD11 ILE A 51 29.785 30.696 27.852 1.00 0.00 H new ATOM 0 HD12 ILE A 51 30.192 31.774 29.208 1.00 0.00 H new ATOM 0 HD13 ILE A 51 29.077 32.327 27.937 1.00 0.00 H new ATOM 851 N GLU A 52 33.786 36.010 29.352 1.00 0.00 N ATOM 852 CA GLU A 52 34.029 37.372 29.842 1.00 0.00 C ATOM 853 C GLU A 52 33.581 38.432 28.824 1.00 0.00 C ATOM 854 O GLU A 52 33.895 38.307 27.639 1.00 0.00 O ATOM 855 CB GLU A 52 35.513 37.511 30.206 1.00 0.00 C ATOM 856 CG GLU A 52 35.808 38.777 31.011 1.00 0.00 C ATOM 857 CD GLU A 52 37.282 38.814 31.453 1.00 0.00 C ATOM 858 OE1 GLU A 52 38.154 39.177 30.629 1.00 0.00 O ATOM 859 OE2 GLU A 52 37.572 38.481 32.628 1.00 0.00 O ATOM 0 H GLU A 52 34.639 35.540 29.048 1.00 0.00 H new ATOM 0 HA GLU A 52 33.429 37.546 30.735 1.00 0.00 H new ATOM 0 HB2 GLU A 52 35.825 36.639 30.781 1.00 0.00 H new ATOM 0 HB3 GLU A 52 36.108 37.520 29.292 1.00 0.00 H new ATOM 0 HG2 GLU A 52 35.582 39.657 30.409 1.00 0.00 H new ATOM 0 HG3 GLU A 52 35.160 38.815 31.887 1.00 0.00 H new ATOM 866 N PHE A 53 32.844 39.455 29.267 1.00 0.00 N ATOM 867 CA PHE A 53 31.979 40.274 28.407 1.00 0.00 C ATOM 868 C PHE A 53 32.098 41.785 28.655 1.00 0.00 C ATOM 869 O PHE A 53 32.134 42.249 29.797 1.00 0.00 O ATOM 870 CB PHE A 53 30.523 39.806 28.582 1.00 0.00 C ATOM 871 CG PHE A 53 29.956 39.158 27.338 1.00 0.00 C ATOM 872 CD1 PHE A 53 30.517 37.968 26.843 1.00 0.00 C ATOM 873 CD2 PHE A 53 28.881 39.760 26.659 1.00 0.00 C ATOM 874 CE1 PHE A 53 30.025 37.394 25.662 1.00 0.00 C ATOM 875 CE2 PHE A 53 28.369 39.168 25.492 1.00 0.00 C ATOM 876 CZ PHE A 53 28.954 37.996 24.985 1.00 0.00 C ATOM 0 H PHE A 53 32.830 39.743 30.245 1.00 0.00 H new ATOM 0 HA PHE A 53 32.313 40.128 27.380 1.00 0.00 H new ATOM 0 HB2 PHE A 53 30.472 39.098 29.409 1.00 0.00 H new ATOM 0 HB3 PHE A 53 29.903 40.660 28.855 1.00 0.00 H new ATOM 0 HD1 PHE A 53 31.329 37.494 27.374 1.00 0.00 H new ATOM 0 HD2 PHE A 53 28.450 40.676 27.034 1.00 0.00 H new ATOM 0 HE1 PHE A 53 30.470 36.490 25.274 1.00 0.00 H new ATOM 0 HE2 PHE A 53 27.526 39.614 24.985 1.00 0.00 H new ATOM 0 HZ PHE A 53 28.579 37.557 24.072 1.00 0.00 H new ATOM 886 N GLU A 54 32.108 42.566 27.573 1.00 0.00 N ATOM 887 CA GLU A 54 32.276 44.028 27.615 1.00 0.00 C ATOM 888 C GLU A 54 31.004 44.781 28.059 1.00 0.00 C ATOM 889 O GLU A 54 31.098 45.772 28.787 1.00 0.00 O ATOM 890 CB GLU A 54 32.731 44.495 26.221 1.00 0.00 C ATOM 891 CG GLU A 54 33.046 45.995 26.072 1.00 0.00 C ATOM 892 CD GLU A 54 34.318 46.484 26.803 1.00 0.00 C ATOM 893 OE1 GLU A 54 34.966 45.713 27.551 1.00 0.00 O ATOM 894 OE2 GLU A 54 34.690 47.669 26.613 1.00 0.00 O ATOM 0 H GLU A 54 31.998 42.200 26.627 1.00 0.00 H new ATOM 0 HA GLU A 54 33.026 44.263 28.370 1.00 0.00 H new ATOM 0 HB2 GLU A 54 33.621 43.930 25.945 1.00 0.00 H new ATOM 0 HB3 GLU A 54 31.953 44.236 25.503 1.00 0.00 H new ATOM 0 HG2 GLU A 54 33.147 46.223 25.011 1.00 0.00 H new ATOM 0 HG3 GLU A 54 32.194 46.566 26.441 1.00 0.00 H new ATOM 901 N ASP A 55 29.821 44.317 27.643 1.00 0.00 N ATOM 902 CA ASP A 55 28.526 44.992 27.834 1.00 0.00 C ATOM 903 C ASP A 55 27.439 44.042 28.364 1.00 0.00 C ATOM 904 O ASP A 55 26.989 43.131 27.666 1.00 0.00 O ATOM 905 CB ASP A 55 28.065 45.641 26.516 1.00 0.00 C ATOM 906 CG ASP A 55 28.977 46.786 26.042 1.00 0.00 C ATOM 907 OD1 ASP A 55 29.125 47.789 26.779 1.00 0.00 O ATOM 908 OD2 ASP A 55 29.496 46.714 24.902 1.00 0.00 O ATOM 0 H ASP A 55 29.732 43.431 27.146 1.00 0.00 H new ATOM 0 HA ASP A 55 28.676 45.763 28.589 1.00 0.00 H new ATOM 0 HB2 ASP A 55 28.022 44.877 25.740 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.052 46.023 26.644 1.00 0.00 H new ATOM 913 N ALA A 56 26.978 44.289 29.594 1.00 0.00 N ATOM 914 CA ALA A 56 25.930 43.504 30.250 1.00 0.00 C ATOM 915 C ALA A 56 24.534 43.714 29.636 1.00 0.00 C ATOM 916 O ALA A 56 23.825 42.744 29.370 1.00 0.00 O ATOM 917 CB ALA A 56 25.922 43.884 31.734 1.00 0.00 C ATOM 0 H ALA A 56 27.329 45.053 30.171 1.00 0.00 H new ATOM 0 HA ALA A 56 26.156 42.447 30.110 1.00 0.00 H new ATOM 0 HB1 ALA A 56 25.150 43.315 32.251 1.00 0.00 H new ATOM 0 HB2 ALA A 56 26.894 43.659 32.173 1.00 0.00 H new ATOM 0 HB3 ALA A 56 25.716 44.950 31.836 1.00 0.00 H new ATOM 923 N ARG A 57 24.131 44.973 29.409 1.00 0.00 N ATOM 924 CA ARG A 57 22.774 45.328 28.941 1.00 0.00 C ATOM 925 C ARG A 57 22.480 44.831 27.525 1.00 0.00 C ATOM 926 O ARG A 57 21.373 44.365 27.258 1.00 0.00 O ATOM 927 CB ARG A 57 22.566 46.852 29.034 1.00 0.00 C ATOM 928 CG ARG A 57 22.377 47.316 30.485 1.00 0.00 C ATOM 929 CD ARG A 57 22.135 48.830 30.548 1.00 0.00 C ATOM 930 NE ARG A 57 21.729 49.242 31.906 1.00 0.00 N ATOM 931 CZ ARG A 57 20.605 49.826 32.285 1.00 0.00 C ATOM 932 NH1 ARG A 57 19.672 50.186 31.447 1.00 0.00 N ATOM 933 NH2 ARG A 57 20.408 50.049 33.550 1.00 0.00 N ATOM 0 H ARG A 57 24.738 45.782 29.544 1.00 0.00 H new ATOM 0 HA ARG A 57 22.067 44.821 29.598 1.00 0.00 H new ATOM 0 HB2 ARG A 57 23.425 47.363 28.598 1.00 0.00 H new ATOM 0 HB3 ARG A 57 21.694 47.136 28.445 1.00 0.00 H new ATOM 0 HG2 ARG A 57 21.534 46.790 30.932 1.00 0.00 H new ATOM 0 HG3 ARG A 57 23.260 47.060 31.071 1.00 0.00 H new ATOM 0 HD2 ARG A 57 23.043 49.360 30.259 1.00 0.00 H new ATOM 0 HD3 ARG A 57 21.362 49.109 29.832 1.00 0.00 H new ATOM 0 HE ARG A 57 22.403 49.052 32.648 1.00 0.00 H new ATOM 0 HH11 ARG A 57 19.792 50.020 30.448 1.00 0.00 H new ATOM 0 HH12 ARG A 57 18.822 50.634 31.791 1.00 0.00 H new ATOM 0 HH21 ARG A 57 21.115 49.775 34.232 1.00 0.00 H new ATOM 0 HH22 ARG A 57 19.547 50.499 33.861 1.00 0.00 H new ATOM 947 N ASP A 58 23.474 44.884 26.637 1.00 0.00 N ATOM 948 CA ASP A 58 23.367 44.353 25.271 1.00 0.00 C ATOM 949 C ASP A 58 23.257 42.814 25.274 1.00 0.00 C ATOM 950 O ASP A 58 22.411 42.239 24.583 1.00 0.00 O ATOM 951 CB ASP A 58 24.587 44.826 24.462 1.00 0.00 C ATOM 952 CG ASP A 58 24.456 44.627 22.938 1.00 0.00 C ATOM 953 OD1 ASP A 58 23.322 44.517 22.414 1.00 0.00 O ATOM 954 OD2 ASP A 58 25.503 44.646 22.248 1.00 0.00 O ATOM 0 H ASP A 58 24.383 45.298 26.844 1.00 0.00 H new ATOM 0 HA ASP A 58 22.456 44.730 24.806 1.00 0.00 H new ATOM 0 HB2 ASP A 58 24.755 45.884 24.665 1.00 0.00 H new ATOM 0 HB3 ASP A 58 25.470 44.290 24.812 1.00 0.00 H new ATOM 959 N ALA A 59 24.055 42.150 26.118 1.00 0.00 N ATOM 960 CA ALA A 59 24.042 40.697 26.272 1.00 0.00 C ATOM 961 C ALA A 59 22.750 40.162 26.912 1.00 0.00 C ATOM 962 O ALA A 59 22.268 39.110 26.497 1.00 0.00 O ATOM 963 CB ALA A 59 25.263 40.289 27.098 1.00 0.00 C ATOM 0 H ALA A 59 24.735 42.615 26.719 1.00 0.00 H new ATOM 0 HA ALA A 59 24.081 40.253 25.277 1.00 0.00 H new ATOM 0 HB1 ALA A 59 25.272 39.206 27.224 1.00 0.00 H new ATOM 0 HB2 ALA A 59 26.172 40.601 26.583 1.00 0.00 H new ATOM 0 HB3 ALA A 59 25.217 40.768 28.076 1.00 0.00 H new ATOM 969 N ALA A 60 22.173 40.867 27.890 1.00 0.00 N ATOM 970 CA ALA A 60 21.037 40.390 28.682 1.00 0.00 C ATOM 971 C ALA A 60 19.805 40.012 27.834 1.00 0.00 C ATOM 972 O ALA A 60 19.193 38.975 28.080 1.00 0.00 O ATOM 973 CB ALA A 60 20.690 41.456 29.728 1.00 0.00 C ATOM 0 H ALA A 60 22.488 41.800 28.157 1.00 0.00 H new ATOM 0 HA ALA A 60 21.335 39.462 29.170 1.00 0.00 H new ATOM 0 HB1 ALA A 60 19.845 41.116 30.327 1.00 0.00 H new ATOM 0 HB2 ALA A 60 21.550 41.624 30.376 1.00 0.00 H new ATOM 0 HB3 ALA A 60 20.428 42.387 29.225 1.00 0.00 H new ATOM 979 N ASP A 61 19.474 40.789 26.795 1.00 0.00 N ATOM 980 CA ASP A 61 18.359 40.476 25.884 1.00 0.00 C ATOM 981 C ASP A 61 18.603 39.232 25.007 1.00 0.00 C ATOM 982 O ASP A 61 17.650 38.541 24.640 1.00 0.00 O ATOM 983 CB ASP A 61 18.036 41.699 25.007 1.00 0.00 C ATOM 984 CG ASP A 61 17.317 42.832 25.766 1.00 0.00 C ATOM 985 OD1 ASP A 61 16.564 42.550 26.731 1.00 0.00 O ATOM 986 OD2 ASP A 61 17.453 44.008 25.349 1.00 0.00 O ATOM 0 H ASP A 61 19.968 41.650 26.560 1.00 0.00 H new ATOM 0 HA ASP A 61 17.504 40.234 26.515 1.00 0.00 H new ATOM 0 HB2 ASP A 61 18.963 42.087 24.585 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.413 41.381 24.171 1.00 0.00 H new ATOM 991 N ALA A 62 19.865 38.910 24.702 1.00 0.00 N ATOM 992 CA ALA A 62 20.253 37.680 24.008 1.00 0.00 C ATOM 993 C ALA A 62 20.408 36.477 24.967 1.00 0.00 C ATOM 994 O ALA A 62 20.172 35.336 24.577 1.00 0.00 O ATOM 995 CB ALA A 62 21.541 37.968 23.227 1.00 0.00 C ATOM 0 H ALA A 62 20.658 39.508 24.935 1.00 0.00 H new ATOM 0 HA ALA A 62 19.459 37.387 23.321 1.00 0.00 H new ATOM 0 HB1 ALA A 62 21.855 37.068 22.699 1.00 0.00 H new ATOM 0 HB2 ALA A 62 21.359 38.766 22.508 1.00 0.00 H new ATOM 0 HB3 ALA A 62 22.325 38.275 23.919 1.00 0.00 H new ATOM 1001 N ILE A 63 20.765 36.713 26.235 1.00 0.00 N ATOM 1002 CA ILE A 63 20.882 35.672 27.269 1.00 0.00 C ATOM 1003 C ILE A 63 19.504 35.223 27.787 1.00 0.00 C ATOM 1004 O ILE A 63 19.294 34.030 28.007 1.00 0.00 O ATOM 1005 CB ILE A 63 21.862 36.138 28.381 1.00 0.00 C ATOM 1006 CG1 ILE A 63 23.056 35.168 28.518 1.00 0.00 C ATOM 1007 CG2 ILE A 63 21.206 36.446 29.740 1.00 0.00 C ATOM 1008 CD1 ILE A 63 22.724 33.780 29.086 1.00 0.00 C ATOM 0 H ILE A 63 20.985 37.648 26.579 1.00 0.00 H new ATOM 0 HA ILE A 63 21.314 34.773 26.830 1.00 0.00 H new ATOM 0 HB ILE A 63 22.238 37.103 28.042 1.00 0.00 H new ATOM 0 HG12 ILE A 63 23.511 35.039 27.536 1.00 0.00 H new ATOM 0 HG13 ILE A 63 23.806 35.632 29.158 1.00 0.00 H new ATOM 0 HG21 ILE A 63 21.970 36.763 30.449 1.00 0.00 H new ATOM 0 HG22 ILE A 63 20.472 37.242 29.618 1.00 0.00 H new ATOM 0 HG23 ILE A 63 20.711 35.551 30.116 1.00 0.00 H new ATOM 0 HD11 ILE A 63 23.633 33.182 29.139 1.00 0.00 H new ATOM 0 HD12 ILE A 63 22.301 33.887 30.085 1.00 0.00 H new ATOM 0 HD13 ILE A 63 22.001 33.285 28.438 1.00 0.00 H new ATOM 1020 N LYS A 64 18.536 36.136 27.947 1.00 0.00 N ATOM 1021 CA LYS A 64 17.216 35.817 28.524 1.00 0.00 C ATOM 1022 C LYS A 64 16.333 34.945 27.625 1.00 0.00 C ATOM 1023 O LYS A 64 15.487 34.221 28.134 1.00 0.00 O ATOM 1024 CB LYS A 64 16.518 37.095 29.029 1.00 0.00 C ATOM 1025 CG LYS A 64 16.086 38.115 27.960 1.00 0.00 C ATOM 1026 CD LYS A 64 14.673 37.878 27.398 1.00 0.00 C ATOM 1027 CE LYS A 64 14.260 38.971 26.399 1.00 0.00 C ATOM 1028 NZ LYS A 64 14.025 40.292 27.051 1.00 0.00 N ATOM 0 H LYS A 64 18.642 37.115 27.682 1.00 0.00 H new ATOM 0 HA LYS A 64 17.395 35.182 29.391 1.00 0.00 H new ATOM 0 HB2 LYS A 64 15.634 36.799 29.594 1.00 0.00 H new ATOM 0 HB3 LYS A 64 17.189 37.596 29.726 1.00 0.00 H new ATOM 0 HG2 LYS A 64 16.131 39.116 28.389 1.00 0.00 H new ATOM 0 HG3 LYS A 64 16.801 38.088 27.138 1.00 0.00 H new ATOM 0 HD2 LYS A 64 14.636 36.906 26.907 1.00 0.00 H new ATOM 0 HD3 LYS A 64 13.957 37.848 28.219 1.00 0.00 H new ATOM 0 HE2 LYS A 64 15.037 39.078 25.642 1.00 0.00 H new ATOM 0 HE3 LYS A 64 13.352 38.660 25.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 13.157 40.718 26.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 13.923 40.159 28.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 14.831 40.921 26.862 1.00 0.00 H new ATOM 1042 N GLU A 65 16.559 34.934 26.309 1.00 0.00 N ATOM 1043 CA GLU A 65 15.906 33.971 25.398 1.00 0.00 C ATOM 1044 C GLU A 65 16.453 32.529 25.533 1.00 0.00 C ATOM 1045 O GLU A 65 15.838 31.593 25.017 1.00 0.00 O ATOM 1046 CB GLU A 65 15.941 34.474 23.942 1.00 0.00 C ATOM 1047 CG GLU A 65 17.352 34.719 23.386 1.00 0.00 C ATOM 1048 CD GLU A 65 17.417 34.940 21.858 1.00 0.00 C ATOM 1049 OE1 GLU A 65 16.380 34.851 21.157 1.00 0.00 O ATOM 1050 OE2 GLU A 65 18.534 35.198 21.345 1.00 0.00 O ATOM 0 H GLU A 65 17.192 35.583 25.842 1.00 0.00 H new ATOM 0 HA GLU A 65 14.862 33.911 25.706 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.436 33.746 23.307 1.00 0.00 H new ATOM 0 HB3 GLU A 65 15.373 35.402 23.878 1.00 0.00 H new ATOM 0 HG2 GLU A 65 17.777 35.591 23.883 1.00 0.00 H new ATOM 0 HG3 GLU A 65 17.982 33.867 23.643 1.00 0.00 H new ATOM 1057 N LYS A 66 17.578 32.330 26.240 1.00 0.00 N ATOM 1058 CA LYS A 66 18.147 31.017 26.609 1.00 0.00 C ATOM 1059 C LYS A 66 17.763 30.561 28.036 1.00 0.00 C ATOM 1060 O LYS A 66 18.308 29.569 28.523 1.00 0.00 O ATOM 1061 CB LYS A 66 19.683 31.047 26.453 1.00 0.00 C ATOM 1062 CG LYS A 66 20.254 31.470 25.088 1.00 0.00 C ATOM 1063 CD LYS A 66 19.924 30.523 23.922 1.00 0.00 C ATOM 1064 CE LYS A 66 18.621 30.909 23.207 1.00 0.00 C ATOM 1065 NZ LYS A 66 18.352 30.024 22.043 1.00 0.00 N ATOM 0 H LYS A 66 18.140 33.108 26.585 1.00 0.00 H new ATOM 0 HA LYS A 66 17.716 30.285 25.926 1.00 0.00 H new ATOM 0 HB2 LYS A 66 20.084 31.723 27.208 1.00 0.00 H new ATOM 0 HB3 LYS A 66 20.063 30.051 26.682 1.00 0.00 H new ATOM 0 HG2 LYS A 66 19.878 32.464 24.846 1.00 0.00 H new ATOM 0 HG3 LYS A 66 21.338 31.552 25.174 1.00 0.00 H new ATOM 0 HD2 LYS A 66 20.745 30.533 23.206 1.00 0.00 H new ATOM 0 HD3 LYS A 66 19.841 29.503 24.298 1.00 0.00 H new ATOM 0 HE2 LYS A 66 17.789 30.851 23.909 1.00 0.00 H new ATOM 0 HE3 LYS A 66 18.683 31.944 22.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 17.465 30.314 21.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 19.134 30.099 21.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 18.269 29.039 22.367 1.00 0.00 H new ATOM 1079 N ASP A 67 16.876 31.281 28.733 1.00 0.00 N ATOM 1080 CA ASP A 67 16.536 31.025 30.143 1.00 0.00 C ATOM 1081 C ASP A 67 15.757 29.708 30.396 1.00 0.00 C ATOM 1082 O ASP A 67 15.336 29.005 29.469 1.00 0.00 O ATOM 1083 CB ASP A 67 15.825 32.245 30.767 1.00 0.00 C ATOM 1084 CG ASP A 67 14.338 32.460 30.399 1.00 0.00 C ATOM 1085 OD1 ASP A 67 13.774 31.758 29.526 1.00 0.00 O ATOM 1086 OD2 ASP A 67 13.704 33.334 31.040 1.00 0.00 O ATOM 0 H ASP A 67 16.366 32.068 28.331 1.00 0.00 H new ATOM 0 HA ASP A 67 17.489 30.875 30.651 1.00 0.00 H new ATOM 0 HB2 ASP A 67 15.896 32.159 31.851 1.00 0.00 H new ATOM 0 HB3 ASP A 67 16.377 33.140 30.481 1.00 0.00 H new ATOM 1091 N GLY A 68 15.575 29.373 31.681 1.00 0.00 N ATOM 1092 CA GLY A 68 14.937 28.140 32.155 1.00 0.00 C ATOM 1093 C GLY A 68 15.919 26.962 32.185 1.00 0.00 C ATOM 1094 O GLY A 68 16.162 26.317 31.164 1.00 0.00 O ATOM 0 H GLY A 68 15.880 29.976 32.445 1.00 0.00 H new ATOM 0 HA2 GLY A 68 14.533 28.301 33.155 1.00 0.00 H new ATOM 0 HA3 GLY A 68 14.096 27.895 31.507 1.00 0.00 H new ATOM 1098 N CYS A 69 16.500 26.691 33.358 1.00 0.00 N ATOM 1099 CA CYS A 69 17.498 25.635 33.543 1.00 0.00 C ATOM 1100 C CYS A 69 16.894 24.215 33.470 1.00 0.00 C ATOM 1101 O CYS A 69 15.835 23.925 34.032 1.00 0.00 O ATOM 1102 CB CYS A 69 18.279 25.887 34.846 1.00 0.00 C ATOM 1103 SG CYS A 69 17.186 25.996 36.296 1.00 0.00 S ATOM 0 H CYS A 69 16.288 27.204 34.214 1.00 0.00 H new ATOM 0 HA CYS A 69 18.199 25.678 32.709 1.00 0.00 H new ATOM 0 HB2 CYS A 69 18.999 25.083 34.996 1.00 0.00 H new ATOM 0 HB3 CYS A 69 18.848 26.812 34.753 1.00 0.00 H new ATOM 0 HG CYS A 69 16.140 25.247 36.108 1.00 0.00 H new ATOM 1109 N ASP A 70 17.603 23.319 32.786 1.00 0.00 N ATOM 1110 CA ASP A 70 17.328 21.883 32.692 1.00 0.00 C ATOM 1111 C ASP A 70 18.048 21.107 33.807 1.00 0.00 C ATOM 1112 O ASP A 70 19.272 21.207 33.961 1.00 0.00 O ATOM 1113 CB ASP A 70 17.753 21.371 31.305 1.00 0.00 C ATOM 1114 CG ASP A 70 16.758 21.657 30.165 1.00 0.00 C ATOM 1115 OD1 ASP A 70 15.641 22.179 30.399 1.00 0.00 O ATOM 1116 OD2 ASP A 70 17.091 21.320 29.004 1.00 0.00 O ATOM 0 H ASP A 70 18.430 23.588 32.253 1.00 0.00 H new ATOM 0 HA ASP A 70 16.258 21.719 32.821 1.00 0.00 H new ATOM 0 HB2 ASP A 70 18.713 21.820 31.049 1.00 0.00 H new ATOM 0 HB3 ASP A 70 17.911 20.294 31.366 1.00 0.00 H new ATOM 1121 N PHE A 71 17.278 20.317 34.560 1.00 0.00 N ATOM 1122 CA PHE A 71 17.723 19.413 35.626 1.00 0.00 C ATOM 1123 C PHE A 71 16.752 18.220 35.761 1.00 0.00 C ATOM 1124 O PHE A 71 15.584 18.317 35.374 1.00 0.00 O ATOM 1125 CB PHE A 71 17.870 20.179 36.953 1.00 0.00 C ATOM 1126 CG PHE A 71 16.567 20.649 37.583 1.00 0.00 C ATOM 1127 CD1 PHE A 71 16.003 21.886 37.212 1.00 0.00 C ATOM 1128 CD2 PHE A 71 15.920 19.851 38.550 1.00 0.00 C ATOM 1129 CE1 PHE A 71 14.796 22.315 37.796 1.00 0.00 C ATOM 1130 CE2 PHE A 71 14.714 20.281 39.131 1.00 0.00 C ATOM 1131 CZ PHE A 71 14.152 21.515 38.755 1.00 0.00 C ATOM 0 H PHE A 71 16.266 20.289 34.435 1.00 0.00 H new ATOM 0 HA PHE A 71 18.703 19.013 35.365 1.00 0.00 H new ATOM 0 HB2 PHE A 71 18.389 19.539 37.667 1.00 0.00 H new ATOM 0 HB3 PHE A 71 18.506 21.048 36.783 1.00 0.00 H new ATOM 0 HD1 PHE A 71 16.497 22.506 36.479 1.00 0.00 H new ATOM 0 HD2 PHE A 71 16.353 18.906 38.845 1.00 0.00 H new ATOM 0 HE1 PHE A 71 14.364 23.261 37.506 1.00 0.00 H new ATOM 0 HE2 PHE A 71 14.219 19.664 39.866 1.00 0.00 H new ATOM 0 HZ PHE A 71 13.227 21.847 39.203 1.00 0.00 H new ATOM 1141 N GLU A 72 17.224 17.108 36.341 1.00 0.00 N ATOM 1142 CA GLU A 72 16.502 15.828 36.496 1.00 0.00 C ATOM 1143 C GLU A 72 16.031 15.220 35.151 1.00 0.00 C ATOM 1144 O GLU A 72 14.919 15.457 34.674 1.00 0.00 O ATOM 1145 CB GLU A 72 15.385 15.958 37.554 1.00 0.00 C ATOM 1146 CG GLU A 72 14.775 14.597 37.935 1.00 0.00 C ATOM 1147 CD GLU A 72 13.614 14.722 38.944 1.00 0.00 C ATOM 1148 OE1 GLU A 72 13.677 15.557 39.880 1.00 0.00 O ATOM 1149 OE2 GLU A 72 12.626 13.953 38.825 1.00 0.00 O ATOM 0 H GLU A 72 18.164 17.070 36.735 1.00 0.00 H new ATOM 0 HA GLU A 72 17.212 15.093 36.875 1.00 0.00 H new ATOM 0 HB2 GLU A 72 15.788 16.435 38.447 1.00 0.00 H new ATOM 0 HB3 GLU A 72 14.600 16.610 37.171 1.00 0.00 H new ATOM 0 HG2 GLU A 72 14.415 14.101 37.034 1.00 0.00 H new ATOM 0 HG3 GLU A 72 15.552 13.962 38.360 1.00 0.00 H new ATOM 1156 N GLY A 73 16.905 14.419 34.525 1.00 0.00 N ATOM 1157 CA GLY A 73 16.676 13.772 33.220 1.00 0.00 C ATOM 1158 C GLY A 73 17.100 14.605 31.998 1.00 0.00 C ATOM 1159 O GLY A 73 17.125 14.088 30.880 1.00 0.00 O ATOM 0 H GLY A 73 17.818 14.195 34.922 1.00 0.00 H new ATOM 0 HA2 GLY A 73 17.216 12.826 33.201 1.00 0.00 H new ATOM 0 HA3 GLY A 73 15.616 13.536 33.130 1.00 0.00 H new ATOM 1163 N ASN A 74 17.490 15.867 32.204 1.00 0.00 N ATOM 1164 CA ASN A 74 18.134 16.751 31.225 1.00 0.00 C ATOM 1165 C ASN A 74 19.139 17.691 31.929 1.00 0.00 C ATOM 1166 O ASN A 74 19.084 17.863 33.149 1.00 0.00 O ATOM 1167 CB ASN A 74 17.078 17.485 30.370 1.00 0.00 C ATOM 1168 CG ASN A 74 15.914 18.088 31.146 1.00 0.00 C ATOM 1169 OD1 ASN A 74 16.066 18.706 32.187 1.00 0.00 O ATOM 1170 ND2 ASN A 74 14.703 17.939 30.658 1.00 0.00 N ATOM 0 H ASN A 74 17.358 16.324 33.106 1.00 0.00 H new ATOM 0 HA ASN A 74 18.718 16.156 30.522 1.00 0.00 H new ATOM 0 HB2 ASN A 74 17.574 18.281 29.815 1.00 0.00 H new ATOM 0 HB3 ASN A 74 16.679 16.785 29.636 1.00 0.00 H new ATOM 0 HD21 ASN A 74 13.903 18.338 31.149 1.00 0.00 H new ATOM 0 HD22 ASN A 74 14.563 17.424 29.788 1.00 0.00 H new ATOM 1177 N LYS A 75 20.110 18.225 31.175 1.00 0.00 N ATOM 1178 CA LYS A 75 21.321 18.896 31.691 1.00 0.00 C ATOM 1179 C LYS A 75 21.652 20.156 30.872 1.00 0.00 C ATOM 1180 O LYS A 75 22.187 20.042 29.769 1.00 0.00 O ATOM 1181 CB LYS A 75 22.508 17.898 31.670 1.00 0.00 C ATOM 1182 CG LYS A 75 22.791 17.190 33.004 1.00 0.00 C ATOM 1183 CD LYS A 75 21.861 16.001 33.313 1.00 0.00 C ATOM 1184 CE LYS A 75 21.209 16.110 34.702 1.00 0.00 C ATOM 1185 NZ LYS A 75 22.195 15.913 35.803 1.00 0.00 N ATOM 0 H LYS A 75 20.077 18.203 30.156 1.00 0.00 H new ATOM 0 HA LYS A 75 21.137 19.216 32.717 1.00 0.00 H new ATOM 0 HB2 LYS A 75 22.313 17.142 30.910 1.00 0.00 H new ATOM 0 HB3 LYS A 75 23.407 18.433 31.363 1.00 0.00 H new ATOM 0 HG2 LYS A 75 23.822 16.836 33.000 1.00 0.00 H new ATOM 0 HG3 LYS A 75 22.707 17.918 33.811 1.00 0.00 H new ATOM 0 HD2 LYS A 75 21.082 15.946 32.553 1.00 0.00 H new ATOM 0 HD3 LYS A 75 22.430 15.073 33.254 1.00 0.00 H new ATOM 0 HE2 LYS A 75 20.741 17.089 34.806 1.00 0.00 H new ATOM 0 HE3 LYS A 75 20.416 15.367 34.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 21.712 15.995 36.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 22.624 14.969 35.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 22.938 16.638 35.737 1.00 0.00 H new ATOM 1199 N LEU A 76 21.318 21.339 31.401 1.00 0.00 N ATOM 1200 CA LEU A 76 21.710 22.660 30.873 1.00 0.00 C ATOM 1201 C LEU A 76 21.259 23.783 31.834 1.00 0.00 C ATOM 1202 O LEU A 76 20.101 24.204 31.814 1.00 0.00 O ATOM 1203 CB LEU A 76 21.102 22.877 29.455 1.00 0.00 C ATOM 1204 CG LEU A 76 22.168 22.999 28.351 1.00 0.00 C ATOM 1205 CD1 LEU A 76 21.525 22.835 26.973 1.00 0.00 C ATOM 1206 CD2 LEU A 76 22.857 24.369 28.402 1.00 0.00 C ATOM 0 H LEU A 76 20.745 21.410 32.242 1.00 0.00 H new ATOM 0 HA LEU A 76 22.797 22.694 30.793 1.00 0.00 H new ATOM 0 HB2 LEU A 76 20.438 22.045 29.220 1.00 0.00 H new ATOM 0 HB3 LEU A 76 20.491 23.780 29.463 1.00 0.00 H new ATOM 0 HG LEU A 76 22.906 22.214 28.518 1.00 0.00 H new ATOM 0 HD11 LEU A 76 22.290 22.924 26.202 1.00 0.00 H new ATOM 0 HD12 LEU A 76 21.054 21.854 26.906 1.00 0.00 H new ATOM 0 HD13 LEU A 76 20.772 23.610 26.828 1.00 0.00 H new ATOM 0 HD21 LEU A 76 23.605 24.429 27.612 1.00 0.00 H new ATOM 0 HD22 LEU A 76 22.115 25.155 28.260 1.00 0.00 H new ATOM 0 HD23 LEU A 76 23.341 24.497 29.370 1.00 0.00 H new ATOM 1218 N ARG A 77 22.163 24.299 32.675 1.00 0.00 N ATOM 1219 CA ARG A 77 21.950 25.523 33.474 1.00 0.00 C ATOM 1220 C ARG A 77 22.447 26.753 32.707 1.00 0.00 C ATOM 1221 O ARG A 77 23.523 26.719 32.115 1.00 0.00 O ATOM 1222 CB ARG A 77 22.605 25.365 34.862 1.00 0.00 C ATOM 1223 CG ARG A 77 22.532 26.640 35.723 1.00 0.00 C ATOM 1224 CD ARG A 77 22.901 26.378 37.190 1.00 0.00 C ATOM 1225 NE ARG A 77 21.790 25.739 37.925 1.00 0.00 N ATOM 1226 CZ ARG A 77 20.814 26.346 38.577 1.00 0.00 C ATOM 1227 NH1 ARG A 77 20.722 27.645 38.668 1.00 0.00 N ATOM 1228 NH2 ARG A 77 19.879 25.644 39.152 1.00 0.00 N ATOM 0 H ARG A 77 23.079 23.875 32.826 1.00 0.00 H new ATOM 0 HA ARG A 77 20.884 25.676 33.643 1.00 0.00 H new ATOM 0 HB2 ARG A 77 22.118 24.548 35.394 1.00 0.00 H new ATOM 0 HB3 ARG A 77 23.650 25.083 34.732 1.00 0.00 H new ATOM 0 HG2 ARG A 77 23.205 27.392 35.311 1.00 0.00 H new ATOM 0 HG3 ARG A 77 21.524 27.052 35.673 1.00 0.00 H new ATOM 0 HD2 ARG A 77 23.783 25.739 37.235 1.00 0.00 H new ATOM 0 HD3 ARG A 77 23.164 27.319 37.673 1.00 0.00 H new ATOM 0 HE ARG A 77 21.775 24.719 37.930 1.00 0.00 H new ATOM 0 HH11 ARG A 77 21.423 28.238 38.224 1.00 0.00 H new ATOM 0 HH12 ARG A 77 19.949 28.067 39.183 1.00 0.00 H new ATOM 0 HH21 ARG A 77 19.900 24.626 39.099 1.00 0.00 H new ATOM 0 HH22 ARG A 77 19.126 26.113 39.655 1.00 0.00 H new ATOM 1242 N VAL A 78 21.686 27.847 32.753 1.00 0.00 N ATOM 1243 CA VAL A 78 22.001 29.131 32.096 1.00 0.00 C ATOM 1244 C VAL A 78 21.696 30.276 33.060 1.00 0.00 C ATOM 1245 O VAL A 78 20.555 30.415 33.505 1.00 0.00 O ATOM 1246 CB VAL A 78 21.201 29.292 30.782 1.00 0.00 C ATOM 1247 CG1 VAL A 78 21.512 30.630 30.096 1.00 0.00 C ATOM 1248 CG2 VAL A 78 21.484 28.159 29.782 1.00 0.00 C ATOM 0 H VAL A 78 20.803 27.872 33.263 1.00 0.00 H new ATOM 0 HA VAL A 78 23.060 29.149 31.838 1.00 0.00 H new ATOM 0 HB VAL A 78 20.150 29.257 31.070 1.00 0.00 H new ATOM 0 HG11 VAL A 78 20.933 30.710 29.176 1.00 0.00 H new ATOM 0 HG12 VAL A 78 21.249 31.451 30.763 1.00 0.00 H new ATOM 0 HG13 VAL A 78 22.575 30.680 29.861 1.00 0.00 H new ATOM 0 HG21 VAL A 78 20.898 28.318 28.877 1.00 0.00 H new ATOM 0 HG22 VAL A 78 22.545 28.151 29.531 1.00 0.00 H new ATOM 0 HG23 VAL A 78 21.210 27.203 30.228 1.00 0.00 H new ATOM 1258 N GLU A 79 22.702 31.081 33.412 1.00 0.00 N ATOM 1259 CA GLU A 79 22.574 32.147 34.417 1.00 0.00 C ATOM 1260 C GLU A 79 23.669 33.214 34.267 1.00 0.00 C ATOM 1261 O GLU A 79 24.858 32.901 34.226 1.00 0.00 O ATOM 1262 CB GLU A 79 22.600 31.505 35.819 1.00 0.00 C ATOM 1263 CG GLU A 79 22.637 32.503 36.988 1.00 0.00 C ATOM 1264 CD GLU A 79 22.557 31.805 38.365 1.00 0.00 C ATOM 1265 OE1 GLU A 79 22.134 30.625 38.440 1.00 0.00 O ATOM 1266 OE2 GLU A 79 22.902 32.463 39.380 1.00 0.00 O ATOM 0 H GLU A 79 23.636 31.013 33.007 1.00 0.00 H new ATOM 0 HA GLU A 79 21.627 32.665 34.268 1.00 0.00 H new ATOM 0 HB2 GLU A 79 21.720 30.872 35.929 1.00 0.00 H new ATOM 0 HB3 GLU A 79 23.472 30.854 35.888 1.00 0.00 H new ATOM 0 HG2 GLU A 79 23.555 33.088 36.933 1.00 0.00 H new ATOM 0 HG3 GLU A 79 21.807 33.203 36.890 1.00 0.00 H new ATOM 1273 N VAL A 80 23.280 34.494 34.236 1.00 0.00 N ATOM 1274 CA VAL A 80 24.220 35.624 34.322 1.00 0.00 C ATOM 1275 C VAL A 80 24.370 36.087 35.782 1.00 0.00 C ATOM 1276 O VAL A 80 23.402 36.593 36.351 1.00 0.00 O ATOM 1277 CB VAL A 80 23.821 36.789 33.393 1.00 0.00 C ATOM 1278 CG1 VAL A 80 24.274 36.461 31.968 1.00 0.00 C ATOM 1279 CG2 VAL A 80 22.321 37.120 33.360 1.00 0.00 C ATOM 0 H VAL A 80 22.304 34.779 34.151 1.00 0.00 H new ATOM 0 HA VAL A 80 25.191 35.274 33.972 1.00 0.00 H new ATOM 0 HB VAL A 80 24.314 37.671 33.802 1.00 0.00 H new ATOM 0 HG11 VAL A 80 23.997 37.278 31.301 1.00 0.00 H new ATOM 0 HG12 VAL A 80 25.356 36.330 31.951 1.00 0.00 H new ATOM 0 HG13 VAL A 80 23.792 35.542 31.635 1.00 0.00 H new ATOM 0 HG21 VAL A 80 22.147 37.952 32.678 1.00 0.00 H new ATOM 0 HG22 VAL A 80 21.763 36.248 33.018 1.00 0.00 H new ATOM 0 HG23 VAL A 80 21.987 37.395 34.360 1.00 0.00 H new ATOM 1289 N PRO A 81 25.556 35.959 36.413 1.00 0.00 N ATOM 1290 CA PRO A 81 25.757 36.365 37.810 1.00 0.00 C ATOM 1291 C PRO A 81 25.670 37.891 38.009 1.00 0.00 C ATOM 1292 O PRO A 81 25.283 38.354 39.084 1.00 0.00 O ATOM 1293 CB PRO A 81 27.139 35.816 38.189 1.00 0.00 C ATOM 1294 CG PRO A 81 27.886 35.742 36.857 1.00 0.00 C ATOM 1295 CD PRO A 81 26.778 35.377 35.873 1.00 0.00 C ATOM 0 HA PRO A 81 24.969 35.969 38.451 1.00 0.00 H new ATOM 0 HB2 PRO A 81 27.648 36.471 38.896 1.00 0.00 H new ATOM 0 HB3 PRO A 81 27.064 34.836 38.659 1.00 0.00 H new ATOM 0 HG2 PRO A 81 28.357 36.692 36.603 1.00 0.00 H new ATOM 0 HG3 PRO A 81 28.675 34.990 36.876 1.00 0.00 H new ATOM 0 HD2 PRO A 81 26.992 35.771 34.880 1.00 0.00 H new ATOM 0 HD3 PRO A 81 26.685 34.296 35.774 1.00 0.00 H new ATOM 1303 N PHE A 82 25.995 38.677 36.976 1.00 0.00 N ATOM 1304 CA PHE A 82 25.908 40.142 36.985 1.00 0.00 C ATOM 1305 C PHE A 82 24.470 40.670 36.802 1.00 0.00 C ATOM 1306 O PHE A 82 24.134 41.718 37.354 1.00 0.00 O ATOM 1307 CB PHE A 82 26.847 40.700 35.899 1.00 0.00 C ATOM 1308 CG PHE A 82 26.542 40.260 34.476 1.00 0.00 C ATOM 1309 CD1 PHE A 82 25.621 40.982 33.695 1.00 0.00 C ATOM 1310 CD2 PHE A 82 27.173 39.127 33.929 1.00 0.00 C ATOM 1311 CE1 PHE A 82 25.324 40.572 32.383 1.00 0.00 C ATOM 1312 CE2 PHE A 82 26.899 38.735 32.605 1.00 0.00 C ATOM 1313 CZ PHE A 82 25.977 39.459 31.831 1.00 0.00 C ATOM 0 H PHE A 82 26.334 38.303 36.090 1.00 0.00 H new ATOM 0 HA PHE A 82 26.220 40.490 37.969 1.00 0.00 H new ATOM 0 HB2 PHE A 82 26.812 41.789 35.939 1.00 0.00 H new ATOM 0 HB3 PHE A 82 27.868 40.405 36.140 1.00 0.00 H new ATOM 0 HD1 PHE A 82 25.139 41.857 34.106 1.00 0.00 H new ATOM 0 HD2 PHE A 82 27.869 38.557 34.526 1.00 0.00 H new ATOM 0 HE1 PHE A 82 24.594 41.113 31.800 1.00 0.00 H new ATOM 0 HE2 PHE A 82 27.399 37.876 32.183 1.00 0.00 H new ATOM 0 HZ PHE A 82 25.771 39.160 30.814 1.00 0.00 H new ATOM 1323 N ASN A 83 23.624 39.947 36.052 1.00 0.00 N ATOM 1324 CA ASN A 83 22.271 40.311 35.588 1.00 0.00 C ATOM 1325 C ASN A 83 22.172 41.581 34.710 1.00 0.00 C ATOM 1326 O ASN A 83 21.622 41.514 33.609 1.00 0.00 O ATOM 1327 CB ASN A 83 21.278 40.332 36.767 1.00 0.00 C ATOM 1328 CG ASN A 83 21.125 38.973 37.433 1.00 0.00 C ATOM 1329 OD1 ASN A 83 20.368 38.124 36.987 1.00 0.00 O ATOM 1330 ND2 ASN A 83 21.816 38.731 38.526 1.00 0.00 N ATOM 0 H ASN A 83 23.887 39.017 35.727 1.00 0.00 H new ATOM 0 HA ASN A 83 21.989 39.517 34.897 1.00 0.00 H new ATOM 0 HB2 ASN A 83 21.615 41.058 37.507 1.00 0.00 H new ATOM 0 HB3 ASN A 83 20.305 40.668 36.410 1.00 0.00 H new ATOM 0 HD21 ASN A 83 21.720 37.834 39.002 1.00 0.00 H new ATOM 0 HD22 ASN A 83 22.448 39.440 38.898 1.00 0.00 H new ATOM 1337 N ALA A 84 22.682 42.725 35.173 1.00 0.00 N ATOM 1338 CA ALA A 84 22.597 44.036 34.518 1.00 0.00 C ATOM 1339 C ALA A 84 23.730 44.989 34.974 1.00 0.00 C ATOM 1340 O ALA A 84 24.564 44.635 35.811 1.00 0.00 O ATOM 1341 CB ALA A 84 21.208 44.625 34.823 1.00 0.00 C ATOM 0 H ALA A 84 23.190 42.766 36.057 1.00 0.00 H new ATOM 0 HA ALA A 84 22.727 43.916 33.442 1.00 0.00 H new ATOM 0 HB1 ALA A 84 21.115 45.602 34.348 1.00 0.00 H new ATOM 0 HB2 ALA A 84 20.437 43.958 34.436 1.00 0.00 H new ATOM 0 HB3 ALA A 84 21.087 44.732 35.901 1.00 0.00 H new ATOM 1347 N ARG A 85 23.745 46.214 34.428 1.00 0.00 N ATOM 1348 CA ARG A 85 24.626 47.337 34.816 1.00 0.00 C ATOM 1349 C ARG A 85 23.797 48.571 35.184 1.00 0.00 C ATOM 1350 O ARG A 85 22.766 48.827 34.559 1.00 0.00 O ATOM 1351 CB ARG A 85 25.609 47.657 33.668 1.00 0.00 C ATOM 1352 CG ARG A 85 27.082 47.332 33.964 1.00 0.00 C ATOM 1353 CD ARG A 85 27.346 45.861 34.330 1.00 0.00 C ATOM 1354 NE ARG A 85 28.573 45.344 33.685 1.00 0.00 N ATOM 1355 CZ ARG A 85 29.825 45.626 33.995 1.00 0.00 C ATOM 1356 NH1 ARG A 85 30.159 46.382 34.997 1.00 0.00 N ATOM 1357 NH2 ARG A 85 30.794 45.141 33.283 1.00 0.00 N ATOM 0 H ARG A 85 23.114 46.466 33.667 1.00 0.00 H new ATOM 0 HA ARG A 85 25.201 47.046 35.695 1.00 0.00 H new ATOM 0 HB2 ARG A 85 25.301 47.103 32.781 1.00 0.00 H new ATOM 0 HB3 ARG A 85 25.528 48.717 33.425 1.00 0.00 H new ATOM 0 HG2 ARG A 85 27.681 47.590 33.091 1.00 0.00 H new ATOM 0 HG3 ARG A 85 27.424 47.965 34.783 1.00 0.00 H new ATOM 0 HD2 ARG A 85 27.437 45.767 35.412 1.00 0.00 H new ATOM 0 HD3 ARG A 85 26.493 45.253 34.028 1.00 0.00 H new ATOM 0 HE ARG A 85 28.436 44.694 32.911 1.00 0.00 H new ATOM 0 HH11 ARG A 85 29.437 46.791 35.590 1.00 0.00 H new ATOM 0 HH12 ARG A 85 31.143 46.567 35.191 1.00 0.00 H new ATOM 0 HH21 ARG A 85 30.589 44.542 32.483 1.00 0.00 H new ATOM 0 HH22 ARG A 85 31.761 45.359 33.522 1.00 0.00 H new ATOM 1371 N GLU A 86 24.257 49.354 36.161 1.00 0.00 N ATOM 1372 CA GLU A 86 23.627 50.607 36.631 1.00 0.00 C ATOM 1373 C GLU A 86 24.655 51.587 37.227 1.00 0.00 C ATOM 1374 O GLU A 86 24.700 52.752 36.769 1.00 0.00 O ATOM 1375 CB GLU A 86 22.497 50.274 37.628 1.00 0.00 C ATOM 1376 CG GLU A 86 21.732 51.520 38.108 1.00 0.00 C ATOM 1377 CD GLU A 86 20.522 51.211 39.029 1.00 0.00 C ATOM 1378 OE1 GLU A 86 20.211 50.027 39.312 1.00 0.00 O ATOM 1379 OE2 GLU A 86 19.859 52.176 39.486 1.00 0.00 O ATOM 1380 OXT GLU A 86 25.429 51.181 38.125 1.00 0.00 O ATOM 0 H GLU A 86 25.111 49.132 36.672 1.00 0.00 H new ATOM 0 HA GLU A 86 23.193 51.119 35.772 1.00 0.00 H new ATOM 0 HB2 GLU A 86 21.797 49.583 37.158 1.00 0.00 H new ATOM 0 HB3 GLU A 86 22.921 49.760 38.491 1.00 0.00 H new ATOM 0 HG2 GLU A 86 22.423 52.173 38.642 1.00 0.00 H new ATOM 0 HG3 GLU A 86 21.379 52.073 37.238 1.00 0.00 H new TER 1387 GLU A 86 ATOM 1388 O5' A B 101 23.572 22.416 41.173 1.00 0.00 O ATOM 1389 C5' A B 101 23.699 23.765 40.734 1.00 0.00 C ATOM 1390 C4' A B 101 25.165 24.226 40.752 1.00 0.00 C ATOM 1391 O4' A B 101 25.211 25.542 40.211 1.00 0.00 O ATOM 1392 C3' A B 101 25.753 24.263 42.184 1.00 0.00 C ATOM 1393 O3' A B 101 27.113 23.854 42.410 1.00 0.00 O ATOM 1394 C2' A B 101 25.482 25.724 42.580 1.00 0.00 C ATOM 1395 O2' A B 101 26.370 26.268 43.556 1.00 0.00 O ATOM 1396 C1' A B 101 25.590 26.446 41.237 1.00 0.00 C ATOM 1397 N9 A B 101 24.814 27.707 41.195 1.00 0.00 N ATOM 1398 C8 A B 101 25.320 28.949 40.927 1.00 0.00 C ATOM 1399 N7 A B 101 24.449 29.917 40.996 1.00 0.00 N ATOM 1400 C5 A B 101 23.258 29.253 41.320 1.00 0.00 C ATOM 1401 C6 A B 101 21.922 29.666 41.555 1.00 0.00 C ATOM 1402 N6 A B 101 21.477 30.906 41.451 1.00 0.00 N ATOM 1403 N1 A B 101 20.979 28.789 41.910 1.00 0.00 N ATOM 1404 C2 A B 101 21.334 27.514 42.013 1.00 0.00 C ATOM 1405 N3 A B 101 22.530 26.975 41.798 1.00 0.00 N ATOM 1406 C4 A B 101 23.470 27.906 41.455 1.00 0.00 C ATOM 0 H5' A B 101 23.104 24.415 41.375 1.00 0.00 H new ATOM 0 H5'' A B 101 23.299 23.860 39.725 1.00 0.00 H new ATOM 0 H4' A B 101 25.756 23.519 40.170 1.00 0.00 H new ATOM 0 H3' A B 101 25.285 23.492 42.797 1.00 0.00 H new ATOM 0 H2' A B 101 24.520 25.831 43.081 1.00 0.00 H new ATOM 0 HO2' A B 101 27.121 25.654 43.694 1.00 0.00 H new ATOM 0 HO5' A B 101 22.628 22.153 41.152 1.00 0.00 H new ATOM 0 H1' A B 101 26.624 26.756 41.084 1.00 0.00 H new ATOM 0 H8 A B 101 26.358 29.115 40.678 1.00 0.00 H new ATOM 0 H61 A B 101 20.496 31.113 41.639 1.00 0.00 H new ATOM 0 H62 A B 101 22.114 31.656 41.182 1.00 0.00 H new ATOM 0 H2 A B 101 20.553 26.829 42.309 1.00 0.00 H new ATOM 1419 P C B 102 28.328 23.889 41.346 1.00 0.00 P ATOM 1420 OP1 C B 102 27.973 22.989 40.222 1.00 0.00 O ATOM 1421 OP2 C B 102 29.553 23.567 42.121 1.00 0.00 O ATOM 1422 O5' C B 102 28.518 25.395 40.796 1.00 0.00 O ATOM 1423 C5' C B 102 28.940 25.620 39.455 1.00 0.00 C ATOM 1424 C4' C B 102 29.595 26.989 39.209 1.00 0.00 C ATOM 1425 O4' C B 102 28.693 28.091 39.262 1.00 0.00 O ATOM 1426 C3' C B 102 30.752 27.298 40.177 1.00 0.00 C ATOM 1427 O3' C B 102 31.900 27.497 39.350 1.00 0.00 O ATOM 1428 C2' C B 102 30.200 28.561 40.876 1.00 0.00 C ATOM 1429 O2' C B 102 31.184 29.398 41.467 1.00 0.00 O ATOM 1430 C1' C B 102 29.431 29.218 39.722 1.00 0.00 C ATOM 1431 N1 C B 102 28.482 30.369 39.918 1.00 0.00 N ATOM 1432 C2 C B 102 28.379 31.133 41.102 1.00 0.00 C ATOM 1433 O2 C B 102 29.140 31.006 42.061 1.00 0.00 O ATOM 1434 N3 C B 102 27.393 32.058 41.242 1.00 0.00 N ATOM 1435 C4 C B 102 26.546 32.246 40.251 1.00 0.00 C ATOM 1436 N4 C B 102 25.555 33.063 40.495 1.00 0.00 N ATOM 1437 C5 C B 102 26.658 31.587 38.999 1.00 0.00 C ATOM 1438 C6 C B 102 27.645 30.669 38.867 1.00 0.00 C ATOM 0 H5' C B 102 28.078 25.521 38.796 1.00 0.00 H new ATOM 0 H5'' C B 102 29.647 24.839 39.175 1.00 0.00 H new ATOM 0 H4' C B 102 29.974 26.886 38.192 1.00 0.00 H new ATOM 0 H3' C B 102 31.051 26.557 40.918 1.00 0.00 H new ATOM 0 H2' C B 102 29.590 28.339 41.752 1.00 0.00 H new ATOM 0 HO2' C B 102 30.754 30.196 41.840 1.00 0.00 H new ATOM 0 H1' C B 102 30.160 29.730 39.093 1.00 0.00 H new ATOM 0 H41 C B 102 24.862 33.254 39.772 1.00 0.00 H new ATOM 0 H42 C B 102 25.475 33.509 41.409 1.00 0.00 H new ATOM 0 H5 C B 102 25.984 31.808 38.185 1.00 0.00 H new ATOM 0 H6 C B 102 27.778 30.164 37.922 1.00 0.00 H new ATOM 1450 P A B 103 33.410 27.326 39.881 1.00 0.00 P ATOM 1451 OP1 A B 103 34.205 26.883 38.709 1.00 0.00 O ATOM 1452 OP2 A B 103 33.421 26.480 41.101 1.00 0.00 O ATOM 1453 O5' A B 103 33.879 28.814 40.287 1.00 0.00 O ATOM 1454 C5' A B 103 35.245 29.212 40.385 1.00 0.00 C ATOM 1455 C4' A B 103 35.944 29.352 39.017 1.00 0.00 C ATOM 1456 O4' A B 103 35.111 29.968 38.034 1.00 0.00 O ATOM 1457 C3' A B 103 37.232 30.192 39.069 1.00 0.00 C ATOM 1458 O3' A B 103 38.129 29.813 38.023 1.00 0.00 O ATOM 1459 C2' A B 103 36.639 31.596 38.861 1.00 0.00 C ATOM 1460 O2' A B 103 37.570 32.582 38.421 1.00 0.00 O ATOM 1461 C1' A B 103 35.556 31.305 37.816 1.00 0.00 C ATOM 1462 N9 A B 103 34.427 32.274 37.831 1.00 0.00 N ATOM 1463 C8 A B 103 33.957 33.015 36.773 1.00 0.00 C ATOM 1464 N7 A B 103 32.891 33.728 37.036 1.00 0.00 N ATOM 1465 C5 A B 103 32.639 33.434 38.382 1.00 0.00 C ATOM 1466 C6 A B 103 31.650 33.824 39.321 1.00 0.00 C ATOM 1467 N6 A B 103 30.645 34.643 39.074 1.00 0.00 N ATOM 1468 N1 A B 103 31.658 33.372 40.574 1.00 0.00 N ATOM 1469 C2 A B 103 32.632 32.540 40.916 1.00 0.00 C ATOM 1470 N3 A B 103 33.638 32.106 40.163 1.00 0.00 N ATOM 1471 C4 A B 103 33.578 32.571 38.884 1.00 0.00 C ATOM 0 H5' A B 103 35.786 28.482 40.988 1.00 0.00 H new ATOM 0 H5'' A B 103 35.301 30.164 40.912 1.00 0.00 H new ATOM 0 H4' A B 103 36.176 28.322 38.747 1.00 0.00 H new ATOM 0 H3' A B 103 37.830 30.090 39.975 1.00 0.00 H new ATOM 0 H2' A B 103 36.279 32.042 39.788 1.00 0.00 H new ATOM 0 HO2' A B 103 38.327 32.143 37.980 1.00 0.00 H new ATOM 0 H1' A B 103 35.985 31.419 36.821 1.00 0.00 H new ATOM 0 H8 A B 103 34.430 33.009 35.802 1.00 0.00 H new ATOM 0 H61 A B 103 29.978 34.869 39.812 1.00 0.00 H new ATOM 0 H62 A B 103 30.535 35.050 38.145 1.00 0.00 H new ATOM 0 H2 A B 103 32.605 32.170 41.930 1.00 0.00 H new ATOM 1483 P U B 104 38.932 28.426 38.091 1.00 0.00 P ATOM 1484 OP1 U B 104 38.054 27.386 37.501 1.00 0.00 O ATOM 1485 OP2 U B 104 39.408 28.243 39.482 1.00 0.00 O ATOM 1486 O5' U B 104 40.245 28.642 37.165 1.00 0.00 O ATOM 1487 C5' U B 104 40.507 27.845 36.014 1.00 0.00 C ATOM 1488 C4' U B 104 40.168 28.518 34.677 1.00 0.00 C ATOM 1489 O4' U B 104 38.885 29.142 34.662 1.00 0.00 O ATOM 1490 C3' U B 104 41.139 29.630 34.265 1.00 0.00 C ATOM 1491 O3' U B 104 42.413 29.148 33.842 1.00 0.00 O ATOM 1492 C2' U B 104 40.315 30.272 33.137 1.00 0.00 C ATOM 1493 O2' U B 104 40.520 29.619 31.891 1.00 0.00 O ATOM 1494 C1' U B 104 38.863 30.019 33.546 1.00 0.00 C ATOM 1495 N1 U B 104 38.094 31.283 33.752 1.00 0.00 N ATOM 1496 C2 U B 104 38.535 32.241 34.682 1.00 0.00 C ATOM 1497 O2 U B 104 39.524 32.115 35.401 1.00 0.00 O ATOM 1498 N3 U B 104 37.826 33.422 34.748 1.00 0.00 N ATOM 1499 C4 U B 104 36.769 33.772 33.943 1.00 0.00 C ATOM 1500 O4 U B 104 36.251 34.878 34.055 1.00 0.00 O ATOM 1501 C5 U B 104 36.362 32.745 33.016 1.00 0.00 C ATOM 1502 C6 U B 104 37.000 31.546 32.950 1.00 0.00 C ATOM 0 H5' U B 104 39.938 26.919 36.093 1.00 0.00 H new ATOM 0 H5'' U B 104 41.562 27.572 36.010 1.00 0.00 H new ATOM 0 H4' U B 104 40.220 27.675 33.988 1.00 0.00 H new ATOM 0 H3' U B 104 41.430 30.310 35.066 1.00 0.00 H new ATOM 0 H2' U B 104 40.586 31.320 33.012 1.00 0.00 H new ATOM 0 HO2' U B 104 41.413 29.837 31.551 1.00 0.00 H new ATOM 0 H1' U B 104 38.311 29.536 32.740 1.00 0.00 H new ATOM 0 H3 U B 104 38.112 34.096 35.458 1.00 0.00 H new ATOM 0 H5 U B 104 35.528 32.933 32.356 1.00 0.00 H new ATOM 0 H6 U B 104 36.648 30.791 32.263 1.00 0.00 H new ATOM 1513 P C B 105 43.570 30.139 33.327 1.00 0.00 P ATOM 1514 OP1 C B 105 42.993 31.023 32.285 1.00 0.00 O ATOM 1515 OP2 C B 105 44.740 29.291 32.992 1.00 0.00 O ATOM 1516 O5' C B 105 43.940 30.994 34.642 1.00 0.00 O ATOM 1517 C5' C B 105 44.198 32.394 34.611 1.00 0.00 C ATOM 1518 C4' C B 105 45.552 32.772 33.977 1.00 0.00 C ATOM 1519 O4' C B 105 45.569 32.558 32.573 1.00 0.00 O ATOM 1520 C3' C B 105 45.848 34.263 34.133 1.00 0.00 C ATOM 1521 O3' C B 105 46.300 34.599 35.437 1.00 0.00 O ATOM 1522 C2' C B 105 46.901 34.489 33.030 1.00 0.00 C ATOM 1523 O2' C B 105 48.230 34.175 33.455 1.00 0.00 O ATOM 1524 C1' C B 105 46.497 33.448 31.970 1.00 0.00 C ATOM 1525 N1 C B 105 45.876 34.024 30.740 1.00 0.00 N ATOM 1526 C2 C B 105 46.357 33.615 29.484 1.00 0.00 C ATOM 1527 O2 C B 105 47.292 32.820 29.373 1.00 0.00 O ATOM 1528 N3 C B 105 45.798 34.092 28.342 1.00 0.00 N ATOM 1529 C4 C B 105 44.797 34.943 28.433 1.00 0.00 C ATOM 1530 N4 C B 105 44.305 35.367 27.302 1.00 0.00 N ATOM 1531 C5 C B 105 44.259 35.388 29.672 1.00 0.00 C ATOM 1532 C6 C B 105 44.818 34.903 30.807 1.00 0.00 C ATOM 0 H5' C B 105 44.165 32.781 35.629 1.00 0.00 H new ATOM 0 H5'' C B 105 43.399 32.887 34.057 1.00 0.00 H new ATOM 0 H4' C B 105 46.280 32.144 34.491 1.00 0.00 H new ATOM 0 H3' C B 105 44.974 34.905 34.024 1.00 0.00 H new ATOM 0 H2' C B 105 46.917 35.530 32.706 1.00 0.00 H new ATOM 0 HO2' C B 105 48.261 34.141 34.434 1.00 0.00 H new ATOM 0 H1' C B 105 47.412 32.955 31.642 1.00 0.00 H new ATOM 0 H41 C B 105 43.528 36.028 27.300 1.00 0.00 H new ATOM 0 H42 C B 105 44.697 35.038 26.420 1.00 0.00 H new ATOM 0 H5 C B 105 43.436 36.086 29.707 1.00 0.00 H new ATOM 0 H6 C B 105 44.432 35.207 31.769 1.00 0.00 H new ATOM 1544 P A B 106 45.897 35.986 36.127 1.00 0.00 P ATOM 1545 OP1 A B 106 46.636 36.067 37.409 1.00 0.00 O ATOM 1546 OP2 A B 106 44.416 36.065 36.153 1.00 0.00 O ATOM 1547 O5' A B 106 46.466 37.148 35.165 1.00 0.00 O ATOM 1548 C5' A B 106 45.647 37.790 34.197 1.00 0.00 C ATOM 1549 C4' A B 106 46.439 38.848 33.417 1.00 0.00 C ATOM 1550 O4' A B 106 47.495 38.244 32.671 1.00 0.00 O ATOM 1551 C3' A B 106 45.547 39.608 32.414 1.00 0.00 C ATOM 1552 O3' A B 106 45.755 41.011 32.546 1.00 0.00 O ATOM 1553 C2' A B 106 46.063 39.100 31.058 1.00 0.00 C ATOM 1554 O2' A B 106 45.862 40.025 29.989 1.00 0.00 O ATOM 1555 C1' A B 106 47.536 38.877 31.401 1.00 0.00 C ATOM 1556 N9 A B 106 48.290 38.055 30.422 1.00 0.00 N ATOM 1557 C8 A B 106 47.853 37.023 29.627 1.00 0.00 C ATOM 1558 N7 A B 106 48.776 36.506 28.855 1.00 0.00 N ATOM 1559 C5 A B 106 49.910 37.279 29.157 1.00 0.00 C ATOM 1560 C6 A B 106 51.257 37.310 28.708 1.00 0.00 C ATOM 1561 N6 A B 106 51.782 36.502 27.802 1.00 0.00 N ATOM 1562 N1 A B 106 52.129 38.199 29.188 1.00 0.00 N ATOM 1563 C2 A B 106 51.696 39.059 30.101 1.00 0.00 C ATOM 1564 N3 A B 106 50.474 39.159 30.619 1.00 0.00 N ATOM 1565 C4 A B 106 49.619 38.226 30.104 1.00 0.00 C ATOM 0 H5' A B 106 44.796 38.259 34.690 1.00 0.00 H new ATOM 0 H5'' A B 106 45.246 37.048 33.506 1.00 0.00 H new ATOM 0 H4' A B 106 46.835 39.541 34.160 1.00 0.00 H new ATOM 0 H3' A B 106 44.478 39.445 32.554 1.00 0.00 H new ATOM 0 H2' A B 106 45.547 38.218 30.679 1.00 0.00 H new ATOM 0 HO2' A B 106 46.338 39.712 29.191 1.00 0.00 H new ATOM 0 HO3' A B 106 45.894 41.406 31.660 1.00 0.00 H new ATOM 0 H1' A B 106 48.074 39.825 31.389 1.00 0.00 H new ATOM 0 H8 A B 106 46.833 36.668 29.638 1.00 0.00 H new ATOM 0 H61 A B 106 52.763 36.598 27.540 1.00 0.00 H new ATOM 0 H62 A B 106 51.206 35.783 27.365 1.00 0.00 H new ATOM 0 H2 A B 106 52.425 39.765 30.469 1.00 0.00 H new TER 1578 A B 106