USER MOD reduce.3.24.130724 H: found=0, std=0, add=753, rem=0, adj=26 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+ -152:sc= 1.4 (180deg=1.19) USER MOD Set 1.2: B 104 U O2' : rot -5:sc= 1.06 USER MOD Single : A 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 MET CE :methyl 174:sc= 0 (180deg=-0.0329) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0.00256 USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 GLY N :NH3+ -126:sc= 0.0616 (180deg=0) USER MOD Single : A 11 TYR OH : rot 150:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -0.0259 K(o=-0.026,f=-1.1) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HD1:sc=-0.000487 X(o=-0.00049,f=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0.291 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+ -179:sc= 1.23 (180deg=1.23) USER MOD Single : A 31 TYR OH : rot 150:sc= -0.284 USER MOD Single : A 33 ASN : amide:sc= 1.17 K(o=1.2,f=-0.12) USER MOD Single : A 37 CYS SG : rot 180:sc=-0.00185 USER MOD Single : A 40 LYS NZ :NH3+ 162:sc= 1.26 (180deg=1.13) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.194 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ -111:sc= 0.234 (180deg=-0.000192) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot 180:sc= 0.0712 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= 0.594 K(o=0.59,f=-0.058) USER MOD Single : B 101 A O2' : rot 20:sc= 0.0351 USER MOD Single : B 101 A O5' : rot 180:sc= 0 USER MOD Single : B 102 C O2' : rot 25:sc= 0.289 USER MOD Single : B 103 A O2' : rot -5:sc= 0.652 USER MOD Single : B 105 C O2' : rot -151:sc= 1.21 USER MOD Single : B 106 A O2' : rot 171:sc= 0 USER MOD Single : B 106 A O3' : rot 139:sc= 0.074 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 44.994 36.576 50.138 1.00 0.00 N ATOM 2 CA GLY A -2 44.075 37.717 50.348 1.00 0.00 C ATOM 3 C GLY A -2 43.354 38.112 49.065 1.00 0.00 C ATOM 4 O GLY A -2 43.262 37.314 48.128 1.00 0.00 O ATOM 0 H1 GLY A -2 44.773 35.822 50.819 1.00 0.00 H new ATOM 0 H2 GLY A -2 44.881 36.213 49.170 1.00 0.00 H new ATOM 0 H3 GLY A -2 45.975 36.891 50.277 1.00 0.00 H new ATOM 0 HA2 GLY A -2 43.341 37.456 51.111 1.00 0.00 H new ATOM 0 HA3 GLY A -2 44.637 38.571 50.726 1.00 0.00 H new ATOM 10 N SER A -1 42.830 39.341 49.017 1.00 0.00 N ATOM 11 CA SER A -1 42.141 39.944 47.850 1.00 0.00 C ATOM 12 C SER A -1 40.912 39.163 47.336 1.00 0.00 C ATOM 13 O SER A -1 40.569 39.228 46.154 1.00 0.00 O ATOM 14 CB SER A -1 43.138 40.261 46.720 1.00 0.00 C ATOM 15 OG SER A -1 44.219 41.049 47.204 1.00 0.00 O ATOM 0 H SER A -1 42.871 39.975 49.815 1.00 0.00 H new ATOM 0 HA SER A -1 41.722 40.880 48.221 1.00 0.00 H new ATOM 0 HB2 SER A -1 43.521 39.333 46.296 1.00 0.00 H new ATOM 0 HB3 SER A -1 42.627 40.792 45.917 1.00 0.00 H new ATOM 0 HG SER A -1 44.841 41.237 46.470 1.00 0.00 H new ATOM 21 N HIS A 0 40.243 38.406 48.215 1.00 0.00 N ATOM 22 CA HIS A 0 39.070 37.587 47.878 1.00 0.00 C ATOM 23 C HIS A 0 37.809 38.445 47.673 1.00 0.00 C ATOM 24 O HIS A 0 37.574 39.387 48.433 1.00 0.00 O ATOM 25 CB HIS A 0 38.850 36.518 48.967 1.00 0.00 C ATOM 26 CG HIS A 0 38.705 35.122 48.416 1.00 0.00 C ATOM 27 ND1 HIS A 0 39.727 34.389 47.807 1.00 0.00 N ATOM 28 CD2 HIS A 0 37.580 34.348 48.465 1.00 0.00 C ATOM 29 CE1 HIS A 0 39.198 33.192 47.501 1.00 0.00 C ATOM 30 NE2 HIS A 0 37.910 33.144 47.884 1.00 0.00 N ATOM 0 H HIS A 0 40.506 38.344 49.199 1.00 0.00 H new ATOM 0 HA HIS A 0 39.264 37.088 46.928 1.00 0.00 H new ATOM 0 HB2 HIS A 0 39.689 36.541 49.662 1.00 0.00 H new ATOM 0 HB3 HIS A 0 37.956 36.770 49.538 1.00 0.00 H new ATOM 0 HD2 HIS A 0 36.621 34.626 48.878 1.00 0.00 H new ATOM 0 HE1 HIS A 0 39.730 32.386 47.018 1.00 0.00 H new ATOM 0 HE2 HIS A 0 37.282 32.349 47.764 1.00 0.00 H new ATOM 38 N MET A 1 36.981 38.094 46.679 1.00 0.00 N ATOM 39 CA MET A 1 35.659 38.697 46.409 1.00 0.00 C ATOM 40 C MET A 1 35.676 40.242 46.353 1.00 0.00 C ATOM 41 O MET A 1 35.009 40.921 47.140 1.00 0.00 O ATOM 42 CB MET A 1 34.600 38.138 47.381 1.00 0.00 C ATOM 43 CG MET A 1 34.472 36.610 47.297 1.00 0.00 C ATOM 44 SD MET A 1 33.202 35.879 48.369 1.00 0.00 S ATOM 45 CE MET A 1 31.691 36.412 47.511 1.00 0.00 C ATOM 0 H MET A 1 37.218 37.357 46.015 1.00 0.00 H new ATOM 0 HA MET A 1 35.375 38.400 45.400 1.00 0.00 H new ATOM 0 HB2 MET A 1 34.862 38.422 48.400 1.00 0.00 H new ATOM 0 HB3 MET A 1 33.634 38.593 47.161 1.00 0.00 H new ATOM 0 HG2 MET A 1 34.254 36.336 46.265 1.00 0.00 H new ATOM 0 HG3 MET A 1 35.436 36.167 47.548 1.00 0.00 H new ATOM 0 HE1 MET A 1 30.823 35.954 47.985 1.00 0.00 H new ATOM 0 HE2 MET A 1 31.605 37.497 47.567 1.00 0.00 H new ATOM 0 HE3 MET A 1 31.738 36.105 46.466 1.00 0.00 H new ATOM 55 N VAL A 2 36.466 40.800 45.429 1.00 0.00 N ATOM 56 CA VAL A 2 36.636 42.258 45.237 1.00 0.00 C ATOM 57 C VAL A 2 35.314 42.991 44.950 1.00 0.00 C ATOM 58 O VAL A 2 34.414 42.449 44.308 1.00 0.00 O ATOM 59 CB VAL A 2 37.671 42.582 44.134 1.00 0.00 C ATOM 60 CG1 VAL A 2 39.062 42.057 44.508 1.00 0.00 C ATOM 61 CG2 VAL A 2 37.294 42.041 42.748 1.00 0.00 C ATOM 0 H VAL A 2 37.020 40.245 44.776 1.00 0.00 H new ATOM 0 HA VAL A 2 37.014 42.628 46.190 1.00 0.00 H new ATOM 0 HB VAL A 2 37.680 43.670 44.069 1.00 0.00 H new ATOM 0 HG11 VAL A 2 39.768 42.300 43.714 1.00 0.00 H new ATOM 0 HG12 VAL A 2 39.388 42.522 45.438 1.00 0.00 H new ATOM 0 HG13 VAL A 2 39.020 40.976 44.638 1.00 0.00 H new ATOM 0 HG21 VAL A 2 38.069 42.309 42.030 1.00 0.00 H new ATOM 0 HG22 VAL A 2 37.201 40.956 42.794 1.00 0.00 H new ATOM 0 HG23 VAL A 2 36.344 42.473 42.435 1.00 0.00 H new ATOM 71 N ILE A 3 35.217 44.246 45.416 1.00 0.00 N ATOM 72 CA ILE A 3 34.005 45.096 45.324 1.00 0.00 C ATOM 73 C ILE A 3 34.163 46.347 44.433 1.00 0.00 C ATOM 74 O ILE A 3 33.190 47.073 44.221 1.00 0.00 O ATOM 75 CB ILE A 3 33.495 45.465 46.738 1.00 0.00 C ATOM 76 CG1 ILE A 3 34.476 46.393 47.495 1.00 0.00 C ATOM 77 CG2 ILE A 3 33.161 44.193 47.542 1.00 0.00 C ATOM 78 CD1 ILE A 3 33.917 46.935 48.818 1.00 0.00 C ATOM 0 H ILE A 3 35.995 44.715 45.880 1.00 0.00 H new ATOM 0 HA ILE A 3 33.254 44.491 44.817 1.00 0.00 H new ATOM 0 HB ILE A 3 32.575 46.037 46.618 1.00 0.00 H new ATOM 0 HG12 ILE A 3 35.397 45.846 47.697 1.00 0.00 H new ATOM 0 HG13 ILE A 3 34.739 47.232 46.851 1.00 0.00 H new ATOM 0 HG21 ILE A 3 32.804 44.472 48.533 1.00 0.00 H new ATOM 0 HG22 ILE A 3 32.387 43.628 47.023 1.00 0.00 H new ATOM 0 HG23 ILE A 3 34.056 43.578 47.639 1.00 0.00 H new ATOM 0 HD11 ILE A 3 34.660 47.577 49.291 1.00 0.00 H new ATOM 0 HD12 ILE A 3 33.012 47.511 48.622 1.00 0.00 H new ATOM 0 HD13 ILE A 3 33.681 46.103 49.481 1.00 0.00 H new ATOM 90 N ARG A 4 35.373 46.605 43.906 1.00 0.00 N ATOM 91 CA ARG A 4 35.711 47.768 43.051 1.00 0.00 C ATOM 92 C ARG A 4 36.475 47.414 41.761 1.00 0.00 C ATOM 93 O ARG A 4 36.944 48.299 41.049 1.00 0.00 O ATOM 94 CB ARG A 4 36.400 48.878 43.881 1.00 0.00 C ATOM 95 CG ARG A 4 37.789 48.522 44.446 1.00 0.00 C ATOM 96 CD ARG A 4 37.729 47.931 45.860 1.00 0.00 C ATOM 97 NE ARG A 4 39.076 47.571 46.348 1.00 0.00 N ATOM 98 CZ ARG A 4 39.420 47.278 47.589 1.00 0.00 C ATOM 99 NH1 ARG A 4 38.560 47.283 48.570 1.00 0.00 N ATOM 100 NH2 ARG A 4 40.651 46.967 47.876 1.00 0.00 N ATOM 0 H ARG A 4 36.173 45.992 44.066 1.00 0.00 H new ATOM 0 HA ARG A 4 34.763 48.163 42.685 1.00 0.00 H new ATOM 0 HB2 ARG A 4 36.498 49.766 43.256 1.00 0.00 H new ATOM 0 HB3 ARG A 4 35.747 49.144 44.712 1.00 0.00 H new ATOM 0 HG2 ARG A 4 38.273 47.808 43.780 1.00 0.00 H new ATOM 0 HG3 ARG A 4 38.410 49.418 44.459 1.00 0.00 H new ATOM 0 HD2 ARG A 4 37.274 48.652 46.539 1.00 0.00 H new ATOM 0 HD3 ARG A 4 37.091 47.047 45.860 1.00 0.00 H new ATOM 0 HE ARG A 4 39.821 47.546 45.651 1.00 0.00 H new ATOM 0 HH11 ARG A 4 37.584 47.519 48.391 1.00 0.00 H new ATOM 0 HH12 ARG A 4 38.864 47.051 49.516 1.00 0.00 H new ATOM 0 HH21 ARG A 4 41.357 46.948 47.140 1.00 0.00 H new ATOM 0 HH22 ARG A 4 40.909 46.742 48.837 1.00 0.00 H new ATOM 114 N GLU A 5 36.591 46.122 41.460 1.00 0.00 N ATOM 115 CA GLU A 5 37.254 45.572 40.263 1.00 0.00 C ATOM 116 C GLU A 5 36.507 44.324 39.737 1.00 0.00 C ATOM 117 O GLU A 5 37.096 43.374 39.217 1.00 0.00 O ATOM 118 CB GLU A 5 38.753 45.354 40.570 1.00 0.00 C ATOM 119 CG GLU A 5 39.628 45.185 39.316 1.00 0.00 C ATOM 120 CD GLU A 5 41.130 45.378 39.610 1.00 0.00 C ATOM 121 OE1 GLU A 5 41.621 44.938 40.680 1.00 0.00 O ATOM 122 OE2 GLU A 5 41.842 45.958 38.755 1.00 0.00 O ATOM 0 H GLU A 5 36.212 45.393 42.064 1.00 0.00 H new ATOM 0 HA GLU A 5 37.208 46.281 39.436 1.00 0.00 H new ATOM 0 HB2 GLU A 5 39.123 46.201 41.147 1.00 0.00 H new ATOM 0 HB3 GLU A 5 38.860 44.469 41.198 1.00 0.00 H new ATOM 0 HG2 GLU A 5 39.468 44.191 38.897 1.00 0.00 H new ATOM 0 HG3 GLU A 5 39.314 45.904 38.559 1.00 0.00 H new ATOM 129 N SER A 6 35.184 44.300 39.929 1.00 0.00 N ATOM 130 CA SER A 6 34.295 43.172 39.613 1.00 0.00 C ATOM 131 C SER A 6 34.253 42.861 38.111 1.00 0.00 C ATOM 132 O SER A 6 34.128 43.768 37.284 1.00 0.00 O ATOM 133 CB SER A 6 32.870 43.474 40.101 1.00 0.00 C ATOM 134 OG SER A 6 32.874 43.875 41.465 1.00 0.00 O ATOM 0 H SER A 6 34.682 45.095 40.324 1.00 0.00 H new ATOM 0 HA SER A 6 34.697 42.298 40.125 1.00 0.00 H new ATOM 0 HB2 SER A 6 32.431 44.261 39.488 1.00 0.00 H new ATOM 0 HB3 SER A 6 32.245 42.589 39.980 1.00 0.00 H new ATOM 0 HG SER A 6 31.957 44.064 41.753 1.00 0.00 H new ATOM 140 N VAL A 7 34.313 41.571 37.760 1.00 0.00 N ATOM 141 CA VAL A 7 34.219 41.077 36.372 1.00 0.00 C ATOM 142 C VAL A 7 32.858 40.420 36.141 1.00 0.00 C ATOM 143 O VAL A 7 32.535 39.403 36.759 1.00 0.00 O ATOM 144 CB VAL A 7 35.386 40.120 36.044 1.00 0.00 C ATOM 145 CG1 VAL A 7 35.257 39.483 34.655 1.00 0.00 C ATOM 146 CG2 VAL A 7 36.729 40.856 36.102 1.00 0.00 C ATOM 0 H VAL A 7 34.431 40.823 38.443 1.00 0.00 H new ATOM 0 HA VAL A 7 34.303 41.923 35.690 1.00 0.00 H new ATOM 0 HB VAL A 7 35.344 39.333 36.797 1.00 0.00 H new ATOM 0 HG11 VAL A 7 36.104 38.820 34.478 1.00 0.00 H new ATOM 0 HG12 VAL A 7 34.331 38.910 34.602 1.00 0.00 H new ATOM 0 HG13 VAL A 7 35.244 40.265 33.896 1.00 0.00 H new ATOM 0 HG21 VAL A 7 37.535 40.161 35.867 1.00 0.00 H new ATOM 0 HG22 VAL A 7 36.729 41.670 35.377 1.00 0.00 H new ATOM 0 HG23 VAL A 7 36.879 41.261 37.103 1.00 0.00 H new ATOM 156 N SER A 8 32.064 40.988 35.231 1.00 0.00 N ATOM 157 CA SER A 8 30.834 40.381 34.711 1.00 0.00 C ATOM 158 C SER A 8 31.159 39.306 33.663 1.00 0.00 C ATOM 159 O SER A 8 31.951 39.527 32.742 1.00 0.00 O ATOM 160 CB SER A 8 29.914 41.469 34.134 1.00 0.00 C ATOM 161 OG SER A 8 30.595 42.300 33.207 1.00 0.00 O ATOM 0 H SER A 8 32.261 41.903 34.825 1.00 0.00 H new ATOM 0 HA SER A 8 30.308 39.890 35.530 1.00 0.00 H new ATOM 0 HB2 SER A 8 29.061 41.000 33.643 1.00 0.00 H new ATOM 0 HB3 SER A 8 29.519 42.079 34.946 1.00 0.00 H new ATOM 0 HG SER A 8 29.978 42.978 32.861 1.00 0.00 H new ATOM 167 N ARG A 9 30.547 38.120 33.803 1.00 0.00 N ATOM 168 CA ARG A 9 30.686 36.997 32.864 1.00 0.00 C ATOM 169 C ARG A 9 29.433 36.126 32.806 1.00 0.00 C ATOM 170 O ARG A 9 28.708 36.021 33.795 1.00 0.00 O ATOM 171 CB ARG A 9 31.956 36.162 33.149 1.00 0.00 C ATOM 172 CG ARG A 9 31.985 35.386 34.483 1.00 0.00 C ATOM 173 CD ARG A 9 32.506 36.213 35.668 1.00 0.00 C ATOM 174 NE ARG A 9 33.942 35.984 35.930 1.00 0.00 N ATOM 175 CZ ARG A 9 34.602 36.382 37.006 1.00 0.00 C ATOM 176 NH1 ARG A 9 34.072 37.198 37.871 1.00 0.00 N ATOM 177 NH2 ARG A 9 35.819 35.974 37.243 1.00 0.00 N ATOM 0 H ARG A 9 29.930 37.911 34.588 1.00 0.00 H new ATOM 0 HA ARG A 9 30.804 37.435 31.873 1.00 0.00 H new ATOM 0 HB2 ARG A 9 32.084 35.448 32.336 1.00 0.00 H new ATOM 0 HB3 ARG A 9 32.817 36.831 33.124 1.00 0.00 H new ATOM 0 HG2 ARG A 9 30.978 35.035 34.711 1.00 0.00 H new ATOM 0 HG3 ARG A 9 32.612 34.502 34.365 1.00 0.00 H new ATOM 0 HD2 ARG A 9 32.341 37.272 35.469 1.00 0.00 H new ATOM 0 HD3 ARG A 9 31.933 35.964 36.561 1.00 0.00 H new ATOM 0 HE ARG A 9 34.470 35.476 35.221 1.00 0.00 H new ATOM 0 HH11 ARG A 9 33.124 37.547 37.728 1.00 0.00 H new ATOM 0 HH12 ARG A 9 34.604 37.488 38.691 1.00 0.00 H new ATOM 0 HH21 ARG A 9 36.279 35.336 36.593 1.00 0.00 H new ATOM 0 HH22 ARG A 9 36.310 36.293 38.078 1.00 0.00 H new ATOM 191 N ILE A 10 29.177 35.505 31.659 1.00 0.00 N ATOM 192 CA ILE A 10 28.103 34.512 31.480 1.00 0.00 C ATOM 193 C ILE A 10 28.441 33.224 32.244 1.00 0.00 C ATOM 194 O ILE A 10 29.615 32.878 32.388 1.00 0.00 O ATOM 195 CB ILE A 10 27.853 34.249 29.969 1.00 0.00 C ATOM 196 CG1 ILE A 10 27.093 35.427 29.323 1.00 0.00 C ATOM 197 CG2 ILE A 10 27.051 32.965 29.681 1.00 0.00 C ATOM 198 CD1 ILE A 10 28.001 36.549 28.821 1.00 0.00 C ATOM 0 H ILE A 10 29.714 35.675 30.809 1.00 0.00 H new ATOM 0 HA ILE A 10 27.175 34.906 31.896 1.00 0.00 H new ATOM 0 HB ILE A 10 28.848 34.133 29.540 1.00 0.00 H new ATOM 0 HG12 ILE A 10 26.501 35.051 28.488 1.00 0.00 H new ATOM 0 HG13 ILE A 10 26.393 35.838 30.051 1.00 0.00 H new ATOM 0 HG21 ILE A 10 26.919 32.852 28.605 1.00 0.00 H new ATOM 0 HG22 ILE A 10 27.591 32.103 30.072 1.00 0.00 H new ATOM 0 HG23 ILE A 10 26.075 33.030 30.162 1.00 0.00 H new ATOM 0 HD11 ILE A 10 27.393 37.339 28.381 1.00 0.00 H new ATOM 0 HD12 ILE A 10 28.574 36.954 29.655 1.00 0.00 H new ATOM 0 HD13 ILE A 10 28.684 36.155 28.069 1.00 0.00 H new ATOM 210 N TYR A 11 27.412 32.487 32.673 1.00 0.00 N ATOM 211 CA TYR A 11 27.499 31.069 33.023 1.00 0.00 C ATOM 212 C TYR A 11 26.431 30.254 32.262 1.00 0.00 C ATOM 213 O TYR A 11 25.230 30.534 32.339 1.00 0.00 O ATOM 214 CB TYR A 11 27.406 30.900 34.546 1.00 0.00 C ATOM 215 CG TYR A 11 26.959 29.515 34.977 1.00 0.00 C ATOM 216 CD1 TYR A 11 27.839 28.421 34.889 1.00 0.00 C ATOM 217 CD2 TYR A 11 25.635 29.317 35.414 1.00 0.00 C ATOM 218 CE1 TYR A 11 27.394 27.138 35.257 1.00 0.00 C ATOM 219 CE2 TYR A 11 25.191 28.037 35.789 1.00 0.00 C ATOM 220 CZ TYR A 11 26.076 26.939 35.707 1.00 0.00 C ATOM 221 OH TYR A 11 25.680 25.693 36.076 1.00 0.00 O ATOM 0 H TYR A 11 26.474 32.870 32.789 1.00 0.00 H new ATOM 0 HA TYR A 11 28.467 30.674 32.713 1.00 0.00 H new ATOM 0 HB2 TYR A 11 28.380 31.112 34.987 1.00 0.00 H new ATOM 0 HB3 TYR A 11 26.709 31.638 34.943 1.00 0.00 H new ATOM 0 HD1 TYR A 11 28.851 28.565 34.541 1.00 0.00 H new ATOM 0 HD2 TYR A 11 24.955 30.155 35.461 1.00 0.00 H new ATOM 0 HE1 TYR A 11 28.070 26.298 35.193 1.00 0.00 H new ATOM 0 HE2 TYR A 11 24.179 27.894 36.138 1.00 0.00 H new ATOM 0 HH TYR A 11 24.992 25.761 36.771 1.00 0.00 H new ATOM 231 N VAL A 12 26.883 29.219 31.553 1.00 0.00 N ATOM 232 CA VAL A 12 26.045 28.158 30.960 1.00 0.00 C ATOM 233 C VAL A 12 26.689 26.804 31.251 1.00 0.00 C ATOM 234 O VAL A 12 27.910 26.675 31.149 1.00 0.00 O ATOM 235 CB VAL A 12 25.803 28.359 29.447 1.00 0.00 C ATOM 236 CG1 VAL A 12 25.052 29.663 29.154 1.00 0.00 C ATOM 237 CG2 VAL A 12 27.077 28.355 28.590 1.00 0.00 C ATOM 0 H VAL A 12 27.877 29.085 31.365 1.00 0.00 H new ATOM 0 HA VAL A 12 25.057 28.203 31.419 1.00 0.00 H new ATOM 0 HB VAL A 12 25.203 27.492 29.170 1.00 0.00 H new ATOM 0 HG11 VAL A 12 24.904 29.764 28.079 1.00 0.00 H new ATOM 0 HG12 VAL A 12 24.084 29.645 29.654 1.00 0.00 H new ATOM 0 HG13 VAL A 12 25.634 30.508 29.521 1.00 0.00 H new ATOM 0 HG21 VAL A 12 26.812 28.502 27.543 1.00 0.00 H new ATOM 0 HG22 VAL A 12 27.736 29.160 28.914 1.00 0.00 H new ATOM 0 HG23 VAL A 12 27.589 27.399 28.704 1.00 0.00 H new ATOM 247 N GLY A 13 25.901 25.799 31.637 1.00 0.00 N ATOM 248 CA GLY A 13 26.411 24.560 32.230 1.00 0.00 C ATOM 249 C GLY A 13 25.531 23.321 32.049 1.00 0.00 C ATOM 250 O GLY A 13 24.357 23.406 31.685 1.00 0.00 O ATOM 0 H GLY A 13 24.885 25.821 31.547 1.00 0.00 H new ATOM 0 HA2 GLY A 13 27.391 24.351 31.801 1.00 0.00 H new ATOM 0 HA3 GLY A 13 26.558 24.725 33.297 1.00 0.00 H new ATOM 254 N ASN A 14 26.139 22.156 32.298 1.00 0.00 N ATOM 255 CA ASN A 14 25.544 20.823 32.148 1.00 0.00 C ATOM 256 C ASN A 14 24.960 20.575 30.735 1.00 0.00 C ATOM 257 O ASN A 14 23.918 19.937 30.575 1.00 0.00 O ATOM 258 CB ASN A 14 24.567 20.566 33.317 1.00 0.00 C ATOM 259 CG ASN A 14 24.221 19.098 33.513 1.00 0.00 C ATOM 260 OD1 ASN A 14 24.936 18.190 33.117 1.00 0.00 O ATOM 261 ND2 ASN A 14 23.118 18.815 34.170 1.00 0.00 N ATOM 0 H ASN A 14 27.104 22.115 32.625 1.00 0.00 H new ATOM 0 HA ASN A 14 26.327 20.068 32.217 1.00 0.00 H new ATOM 0 HB2 ASN A 14 25.005 20.953 34.237 1.00 0.00 H new ATOM 0 HB3 ASN A 14 23.649 21.126 33.141 1.00 0.00 H new ATOM 0 HD21 ASN A 14 22.864 17.843 34.346 1.00 0.00 H new ATOM 0 HD22 ASN A 14 22.516 19.568 34.504 1.00 0.00 H new ATOM 268 N LEU A 15 25.613 21.140 29.710 1.00 0.00 N ATOM 269 CA LEU A 15 25.149 21.154 28.319 1.00 0.00 C ATOM 270 C LEU A 15 25.259 19.765 27.649 1.00 0.00 C ATOM 271 O LEU A 15 26.215 19.034 27.933 1.00 0.00 O ATOM 272 CB LEU A 15 25.958 22.183 27.496 1.00 0.00 C ATOM 273 CG LEU A 15 26.044 23.607 28.087 1.00 0.00 C ATOM 274 CD1 LEU A 15 27.395 23.844 28.772 1.00 0.00 C ATOM 275 CD2 LEU A 15 25.910 24.661 26.985 1.00 0.00 C ATOM 0 H LEU A 15 26.507 21.615 29.832 1.00 0.00 H new ATOM 0 HA LEU A 15 24.096 21.434 28.339 1.00 0.00 H new ATOM 0 HB2 LEU A 15 26.971 21.802 27.370 1.00 0.00 H new ATOM 0 HB3 LEU A 15 25.517 22.250 26.501 1.00 0.00 H new ATOM 0 HG LEU A 15 25.232 23.694 28.809 1.00 0.00 H new ATOM 0 HD11 LEU A 15 27.425 24.855 29.178 1.00 0.00 H new ATOM 0 HD12 LEU A 15 27.524 23.124 29.581 1.00 0.00 H new ATOM 0 HD13 LEU A 15 28.198 23.721 28.045 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.973 25.657 27.424 1.00 0.00 H new ATOM 0 HD22 LEU A 15 26.713 24.533 26.259 1.00 0.00 H new ATOM 0 HD23 LEU A 15 24.948 24.545 26.486 1.00 0.00 H new ATOM 287 N PRO A 16 24.365 19.413 26.701 1.00 0.00 N ATOM 288 CA PRO A 16 24.557 18.251 25.831 1.00 0.00 C ATOM 289 C PRO A 16 25.768 18.462 24.906 1.00 0.00 C ATOM 290 O PRO A 16 25.936 19.539 24.333 1.00 0.00 O ATOM 291 CB PRO A 16 23.248 18.112 25.047 1.00 0.00 C ATOM 292 CG PRO A 16 22.725 19.547 24.970 1.00 0.00 C ATOM 293 CD PRO A 16 23.174 20.151 26.302 1.00 0.00 C ATOM 0 HA PRO A 16 24.772 17.342 26.393 1.00 0.00 H new ATOM 0 HB2 PRO A 16 23.417 17.692 24.055 1.00 0.00 H new ATOM 0 HB3 PRO A 16 22.543 17.454 25.556 1.00 0.00 H new ATOM 0 HG2 PRO A 16 23.147 20.085 24.121 1.00 0.00 H new ATOM 0 HG3 PRO A 16 21.641 19.576 24.859 1.00 0.00 H new ATOM 0 HD2 PRO A 16 23.392 21.213 26.194 1.00 0.00 H new ATOM 0 HD3 PRO A 16 22.390 20.061 27.054 1.00 0.00 H new ATOM 301 N SER A 17 26.620 17.437 24.762 1.00 0.00 N ATOM 302 CA SER A 17 27.896 17.416 24.007 1.00 0.00 C ATOM 303 C SER A 17 29.012 18.373 24.498 1.00 0.00 C ATOM 304 O SER A 17 30.190 18.014 24.439 1.00 0.00 O ATOM 305 CB SER A 17 27.611 17.595 22.506 1.00 0.00 C ATOM 306 OG SER A 17 28.756 17.311 21.719 1.00 0.00 O ATOM 0 H SER A 17 26.429 16.535 25.198 1.00 0.00 H new ATOM 0 HA SER A 17 28.324 16.433 24.204 1.00 0.00 H new ATOM 0 HB2 SER A 17 26.793 16.938 22.210 1.00 0.00 H new ATOM 0 HB3 SER A 17 27.283 18.617 22.317 1.00 0.00 H new ATOM 0 HG SER A 17 28.540 17.433 20.771 1.00 0.00 H new ATOM 312 N HIS A 18 28.646 19.540 25.048 1.00 0.00 N ATOM 313 CA HIS A 18 29.495 20.671 25.462 1.00 0.00 C ATOM 314 C HIS A 18 30.219 21.400 24.308 1.00 0.00 C ATOM 315 O HIS A 18 30.544 20.823 23.270 1.00 0.00 O ATOM 316 CB HIS A 18 30.380 20.321 26.684 1.00 0.00 C ATOM 317 CG HIS A 18 31.871 20.474 26.481 1.00 0.00 C ATOM 318 ND1 HIS A 18 32.731 19.522 25.923 1.00 0.00 N ATOM 319 CD2 HIS A 18 32.593 21.593 26.771 1.00 0.00 C ATOM 320 CE1 HIS A 18 33.947 20.095 25.883 1.00 0.00 C ATOM 321 NE2 HIS A 18 33.889 21.340 26.384 1.00 0.00 N ATOM 0 H HIS A 18 27.662 19.735 25.231 1.00 0.00 H new ATOM 0 HA HIS A 18 28.810 21.442 25.815 1.00 0.00 H new ATOM 0 HB2 HIS A 18 30.079 20.953 27.520 1.00 0.00 H new ATOM 0 HB3 HIS A 18 30.176 19.290 26.974 1.00 0.00 H new ATOM 0 HD2 HIS A 18 32.220 22.503 27.218 1.00 0.00 H new ATOM 0 HE1 HIS A 18 34.841 19.623 25.503 1.00 0.00 H new ATOM 0 HE2 HIS A 18 34.673 21.988 26.464 1.00 0.00 H new ATOM 329 N VAL A 19 30.428 22.711 24.486 1.00 0.00 N ATOM 330 CA VAL A 19 31.034 23.619 23.494 1.00 0.00 C ATOM 331 C VAL A 19 32.545 23.794 23.707 1.00 0.00 C ATOM 332 O VAL A 19 33.005 24.068 24.815 1.00 0.00 O ATOM 333 CB VAL A 19 30.317 24.988 23.466 1.00 0.00 C ATOM 334 CG1 VAL A 19 28.984 24.874 22.719 1.00 0.00 C ATOM 335 CG2 VAL A 19 30.031 25.586 24.853 1.00 0.00 C ATOM 0 H VAL A 19 30.173 23.188 25.351 1.00 0.00 H new ATOM 0 HA VAL A 19 30.900 23.148 22.520 1.00 0.00 H new ATOM 0 HB VAL A 19 31.011 25.658 22.958 1.00 0.00 H new ATOM 0 HG11 VAL A 19 28.490 25.845 22.707 1.00 0.00 H new ATOM 0 HG12 VAL A 19 29.167 24.547 21.695 1.00 0.00 H new ATOM 0 HG13 VAL A 19 28.346 24.148 23.223 1.00 0.00 H new ATOM 0 HG21 VAL A 19 29.527 26.546 24.739 1.00 0.00 H new ATOM 0 HG22 VAL A 19 29.393 24.906 25.418 1.00 0.00 H new ATOM 0 HG23 VAL A 19 30.970 25.731 25.387 1.00 0.00 H new ATOM 345 N SER A 20 33.319 23.672 22.625 1.00 0.00 N ATOM 346 CA SER A 20 34.754 24.002 22.583 1.00 0.00 C ATOM 347 C SER A 20 34.995 25.515 22.700 1.00 0.00 C ATOM 348 O SER A 20 34.070 26.311 22.550 1.00 0.00 O ATOM 349 CB SER A 20 35.358 23.482 21.272 1.00 0.00 C ATOM 350 OG SER A 20 34.844 24.195 20.158 1.00 0.00 O ATOM 0 H SER A 20 32.961 23.334 21.732 1.00 0.00 H new ATOM 0 HA SER A 20 35.236 23.523 23.435 1.00 0.00 H new ATOM 0 HB2 SER A 20 36.443 23.581 21.303 1.00 0.00 H new ATOM 0 HB3 SER A 20 35.138 22.420 21.162 1.00 0.00 H new ATOM 0 HG SER A 20 35.245 23.847 19.334 1.00 0.00 H new ATOM 356 N SER A 21 36.245 25.947 22.907 1.00 0.00 N ATOM 357 CA SER A 21 36.609 27.377 22.905 1.00 0.00 C ATOM 358 C SER A 21 36.252 28.077 21.581 1.00 0.00 C ATOM 359 O SER A 21 35.782 29.218 21.592 1.00 0.00 O ATOM 360 CB SER A 21 38.107 27.531 23.198 1.00 0.00 C ATOM 361 OG SER A 21 38.886 26.815 22.250 1.00 0.00 O ATOM 0 H SER A 21 37.032 25.322 23.080 1.00 0.00 H new ATOM 0 HA SER A 21 36.025 27.862 23.687 1.00 0.00 H new ATOM 0 HB2 SER A 21 38.379 28.586 23.175 1.00 0.00 H new ATOM 0 HB3 SER A 21 38.324 27.167 24.202 1.00 0.00 H new ATOM 0 HG SER A 21 39.837 26.929 22.455 1.00 0.00 H new ATOM 367 N ARG A 22 36.386 27.376 20.442 1.00 0.00 N ATOM 368 CA ARG A 22 35.949 27.846 19.118 1.00 0.00 C ATOM 369 C ARG A 22 34.430 27.980 19.029 1.00 0.00 C ATOM 370 O ARG A 22 33.939 29.008 18.567 1.00 0.00 O ATOM 371 CB ARG A 22 36.535 26.924 18.028 1.00 0.00 C ATOM 372 CG ARG A 22 36.151 27.350 16.598 1.00 0.00 C ATOM 373 CD ARG A 22 34.966 26.552 16.025 1.00 0.00 C ATOM 374 NE ARG A 22 35.418 25.332 15.326 1.00 0.00 N ATOM 375 CZ ARG A 22 34.665 24.328 14.908 1.00 0.00 C ATOM 376 NH1 ARG A 22 33.426 24.171 15.273 1.00 0.00 N ATOM 377 NH2 ARG A 22 35.156 23.441 14.091 1.00 0.00 N ATOM 0 H ARG A 22 36.810 26.448 20.417 1.00 0.00 H new ATOM 0 HA ARG A 22 36.335 28.852 18.954 1.00 0.00 H new ATOM 0 HB2 ARG A 22 37.621 26.913 18.117 1.00 0.00 H new ATOM 0 HB3 ARG A 22 36.191 25.904 18.201 1.00 0.00 H new ATOM 0 HG2 ARG A 22 35.901 28.411 16.597 1.00 0.00 H new ATOM 0 HG3 ARG A 22 37.014 27.225 15.945 1.00 0.00 H new ATOM 0 HD2 ARG A 22 34.287 26.279 16.832 1.00 0.00 H new ATOM 0 HD3 ARG A 22 34.404 27.180 15.334 1.00 0.00 H new ATOM 0 HE ARG A 22 36.419 25.255 15.146 1.00 0.00 H new ATOM 0 HH11 ARG A 22 32.993 24.840 15.910 1.00 0.00 H new ATOM 0 HH12 ARG A 22 32.887 23.379 14.922 1.00 0.00 H new ATOM 0 HH21 ARG A 22 36.122 23.520 13.773 1.00 0.00 H new ATOM 0 HH22 ARG A 22 34.575 22.667 13.769 1.00 0.00 H new ATOM 391 N ASP A 23 33.677 26.985 19.500 1.00 0.00 N ATOM 392 CA ASP A 23 32.209 27.038 19.513 1.00 0.00 C ATOM 393 C ASP A 23 31.659 28.104 20.473 1.00 0.00 C ATOM 394 O ASP A 23 30.688 28.780 20.133 1.00 0.00 O ATOM 395 CB ASP A 23 31.622 25.659 19.844 1.00 0.00 C ATOM 396 CG ASP A 23 31.847 24.604 18.748 1.00 0.00 C ATOM 397 OD1 ASP A 23 32.193 24.964 17.597 1.00 0.00 O ATOM 398 OD2 ASP A 23 31.616 23.402 19.032 1.00 0.00 O ATOM 0 H ASP A 23 34.063 26.122 19.882 1.00 0.00 H new ATOM 0 HA ASP A 23 31.897 27.328 18.510 1.00 0.00 H new ATOM 0 HB2 ASP A 23 32.063 25.301 20.774 1.00 0.00 H new ATOM 0 HB3 ASP A 23 30.551 25.764 20.019 1.00 0.00 H new ATOM 403 N VAL A 24 32.300 28.316 21.630 1.00 0.00 N ATOM 404 CA VAL A 24 31.980 29.418 22.550 1.00 0.00 C ATOM 405 C VAL A 24 32.163 30.768 21.854 1.00 0.00 C ATOM 406 O VAL A 24 31.223 31.555 21.826 1.00 0.00 O ATOM 407 CB VAL A 24 32.805 29.331 23.854 1.00 0.00 C ATOM 408 CG1 VAL A 24 32.655 30.578 24.732 1.00 0.00 C ATOM 409 CG2 VAL A 24 32.351 28.152 24.720 1.00 0.00 C ATOM 0 H VAL A 24 33.062 27.723 21.958 1.00 0.00 H new ATOM 0 HA VAL A 24 30.932 29.325 22.835 1.00 0.00 H new ATOM 0 HB VAL A 24 33.838 29.219 23.526 1.00 0.00 H new ATOM 0 HG11 VAL A 24 33.256 30.462 25.634 1.00 0.00 H new ATOM 0 HG12 VAL A 24 32.994 31.455 24.180 1.00 0.00 H new ATOM 0 HG13 VAL A 24 31.608 30.705 25.007 1.00 0.00 H new ATOM 0 HG21 VAL A 24 32.950 28.117 25.630 1.00 0.00 H new ATOM 0 HG22 VAL A 24 31.300 28.276 24.982 1.00 0.00 H new ATOM 0 HG23 VAL A 24 32.479 27.222 24.165 1.00 0.00 H new ATOM 419 N GLU A 25 33.317 31.035 21.232 1.00 0.00 N ATOM 420 CA GLU A 25 33.538 32.292 20.501 1.00 0.00 C ATOM 421 C GLU A 25 32.516 32.480 19.362 1.00 0.00 C ATOM 422 O GLU A 25 31.905 33.542 19.247 1.00 0.00 O ATOM 423 CB GLU A 25 34.986 32.363 19.974 1.00 0.00 C ATOM 424 CG GLU A 25 35.276 33.703 19.271 1.00 0.00 C ATOM 425 CD GLU A 25 36.669 33.803 18.619 1.00 0.00 C ATOM 426 OE1 GLU A 25 37.608 33.057 18.991 1.00 0.00 O ATOM 427 OE2 GLU A 25 36.829 34.662 17.715 1.00 0.00 O ATOM 0 H GLU A 25 34.114 30.398 21.219 1.00 0.00 H new ATOM 0 HA GLU A 25 33.388 33.115 21.200 1.00 0.00 H new ATOM 0 HB2 GLU A 25 35.681 32.230 20.803 1.00 0.00 H new ATOM 0 HB3 GLU A 25 35.160 31.543 19.278 1.00 0.00 H new ATOM 0 HG2 GLU A 25 34.519 33.866 18.504 1.00 0.00 H new ATOM 0 HG3 GLU A 25 35.172 34.508 19.998 1.00 0.00 H new ATOM 434 N ASN A 26 32.298 31.449 18.538 1.00 0.00 N ATOM 435 CA ASN A 26 31.405 31.516 17.381 1.00 0.00 C ATOM 436 C ASN A 26 29.927 31.737 17.774 1.00 0.00 C ATOM 437 O ASN A 26 29.229 32.509 17.114 1.00 0.00 O ATOM 438 CB ASN A 26 31.597 30.235 16.556 1.00 0.00 C ATOM 439 CG ASN A 26 30.824 30.283 15.249 1.00 0.00 C ATOM 440 OD1 ASN A 26 29.736 29.741 15.119 1.00 0.00 O ATOM 441 ND2 ASN A 26 31.356 30.937 14.241 1.00 0.00 N ATOM 0 H ASN A 26 32.741 30.538 18.658 1.00 0.00 H new ATOM 0 HA ASN A 26 31.666 32.387 16.780 1.00 0.00 H new ATOM 0 HB2 ASN A 26 32.657 30.094 16.346 1.00 0.00 H new ATOM 0 HB3 ASN A 26 31.270 29.375 17.140 1.00 0.00 H new ATOM 0 HD21 ASN A 26 30.861 30.992 13.351 1.00 0.00 H new ATOM 0 HD22 ASN A 26 32.264 31.389 14.349 1.00 0.00 H new ATOM 448 N GLU A 27 29.450 31.099 18.847 1.00 0.00 N ATOM 449 CA GLU A 27 28.080 31.267 19.349 1.00 0.00 C ATOM 450 C GLU A 27 27.884 32.616 20.057 1.00 0.00 C ATOM 451 O GLU A 27 26.957 33.365 19.733 1.00 0.00 O ATOM 452 CB GLU A 27 27.733 30.092 20.282 1.00 0.00 C ATOM 453 CG GLU A 27 26.280 30.091 20.786 1.00 0.00 C ATOM 454 CD GLU A 27 25.228 29.986 19.659 1.00 0.00 C ATOM 455 OE1 GLU A 27 25.487 29.331 18.619 1.00 0.00 O ATOM 456 OE2 GLU A 27 24.112 30.534 19.818 1.00 0.00 O ATOM 0 H GLU A 27 30.007 30.446 19.397 1.00 0.00 H new ATOM 0 HA GLU A 27 27.399 31.266 18.498 1.00 0.00 H new ATOM 0 HB2 GLU A 27 27.923 29.157 19.755 1.00 0.00 H new ATOM 0 HB3 GLU A 27 28.403 30.116 21.141 1.00 0.00 H new ATOM 0 HG2 GLU A 27 26.145 29.257 21.475 1.00 0.00 H new ATOM 0 HG3 GLU A 27 26.101 31.005 21.353 1.00 0.00 H new ATOM 463 N PHE A 28 28.766 32.960 21.006 1.00 0.00 N ATOM 464 CA PHE A 28 28.617 34.155 21.839 1.00 0.00 C ATOM 465 C PHE A 28 28.947 35.474 21.115 1.00 0.00 C ATOM 466 O PHE A 28 28.527 36.533 21.581 1.00 0.00 O ATOM 467 CB PHE A 28 29.351 33.972 23.175 1.00 0.00 C ATOM 468 CG PHE A 28 28.554 33.114 24.146 1.00 0.00 C ATOM 469 CD1 PHE A 28 27.562 33.715 24.947 1.00 0.00 C ATOM 470 CD2 PHE A 28 28.741 31.719 24.204 1.00 0.00 C ATOM 471 CE1 PHE A 28 26.761 32.928 25.794 1.00 0.00 C ATOM 472 CE2 PHE A 28 27.946 30.932 25.056 1.00 0.00 C ATOM 473 CZ PHE A 28 26.955 31.536 25.851 1.00 0.00 C ATOM 0 H PHE A 28 29.602 32.415 21.215 1.00 0.00 H new ATOM 0 HA PHE A 28 27.556 34.261 22.064 1.00 0.00 H new ATOM 0 HB2 PHE A 28 30.322 33.511 22.996 1.00 0.00 H new ATOM 0 HB3 PHE A 28 29.539 34.948 23.623 1.00 0.00 H new ATOM 0 HD1 PHE A 28 27.416 34.784 24.910 1.00 0.00 H new ATOM 0 HD2 PHE A 28 29.498 31.252 23.592 1.00 0.00 H new ATOM 0 HE1 PHE A 28 25.997 33.392 26.400 1.00 0.00 H new ATOM 0 HE2 PHE A 28 28.096 29.863 25.100 1.00 0.00 H new ATOM 0 HZ PHE A 28 26.344 30.931 26.505 1.00 0.00 H new ATOM 483 N ARG A 29 29.574 35.438 19.929 1.00 0.00 N ATOM 484 CA ARG A 29 29.765 36.622 19.068 1.00 0.00 C ATOM 485 C ARG A 29 28.472 37.378 18.716 1.00 0.00 C ATOM 486 O ARG A 29 28.536 38.590 18.503 1.00 0.00 O ATOM 487 CB ARG A 29 30.518 36.217 17.783 1.00 0.00 C ATOM 488 CG ARG A 29 32.007 36.569 17.872 1.00 0.00 C ATOM 489 CD ARG A 29 32.744 36.111 16.607 1.00 0.00 C ATOM 490 NE ARG A 29 34.113 36.661 16.538 1.00 0.00 N ATOM 491 CZ ARG A 29 34.470 37.849 16.079 1.00 0.00 C ATOM 492 NH1 ARG A 29 33.604 38.717 15.626 1.00 0.00 N ATOM 493 NH2 ARG A 29 35.723 38.198 16.065 1.00 0.00 N ATOM 0 H ARG A 29 29.966 34.583 19.535 1.00 0.00 H new ATOM 0 HA ARG A 29 30.356 37.325 19.655 1.00 0.00 H new ATOM 0 HB2 ARG A 29 30.405 35.146 17.616 1.00 0.00 H new ATOM 0 HB3 ARG A 29 30.074 36.722 16.925 1.00 0.00 H new ATOM 0 HG2 ARG A 29 32.125 37.645 17.999 1.00 0.00 H new ATOM 0 HG3 ARG A 29 32.447 36.094 18.749 1.00 0.00 H new ATOM 0 HD2 ARG A 29 32.789 35.022 16.587 1.00 0.00 H new ATOM 0 HD3 ARG A 29 32.182 36.423 15.726 1.00 0.00 H new ATOM 0 HE ARG A 29 34.863 36.061 16.881 1.00 0.00 H new ATOM 0 HH11 ARG A 29 32.610 38.489 15.618 1.00 0.00 H new ATOM 0 HH12 ARG A 29 33.922 39.623 15.281 1.00 0.00 H new ATOM 0 HH21 ARG A 29 36.436 37.554 16.409 1.00 0.00 H new ATOM 0 HH22 ARG A 29 35.993 39.115 15.710 1.00 0.00 H new ATOM 507 N LYS A 30 27.305 36.712 18.679 1.00 0.00 N ATOM 508 CA LYS A 30 26.001 37.386 18.467 1.00 0.00 C ATOM 509 C LYS A 30 25.442 38.054 19.737 1.00 0.00 C ATOM 510 O LYS A 30 24.662 38.999 19.636 1.00 0.00 O ATOM 511 CB LYS A 30 25.009 36.442 17.742 1.00 0.00 C ATOM 512 CG LYS A 30 24.092 35.559 18.611 1.00 0.00 C ATOM 513 CD LYS A 30 22.726 36.215 18.883 1.00 0.00 C ATOM 514 CE LYS A 30 21.849 35.371 19.821 1.00 0.00 C ATOM 515 NZ LYS A 30 20.506 35.989 19.987 1.00 0.00 N ATOM 0 H LYS A 30 27.233 35.701 18.793 1.00 0.00 H new ATOM 0 HA LYS A 30 26.167 38.230 17.797 1.00 0.00 H new ATOM 0 HB2 LYS A 30 24.375 37.052 17.099 1.00 0.00 H new ATOM 0 HB3 LYS A 30 25.586 35.786 17.090 1.00 0.00 H new ATOM 0 HG2 LYS A 30 23.939 34.601 18.114 1.00 0.00 H new ATOM 0 HG3 LYS A 30 24.587 35.351 19.560 1.00 0.00 H new ATOM 0 HD2 LYS A 30 22.880 37.200 19.323 1.00 0.00 H new ATOM 0 HD3 LYS A 30 22.203 36.365 17.938 1.00 0.00 H new ATOM 0 HE2 LYS A 30 21.743 34.363 19.419 1.00 0.00 H new ATOM 0 HE3 LYS A 30 22.334 35.277 20.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 19.936 35.412 20.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 20.611 36.948 20.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 20.031 36.040 19.063 1.00 0.00 H new ATOM 529 N TYR A 31 25.856 37.594 20.922 1.00 0.00 N ATOM 530 CA TYR A 31 25.466 38.151 22.226 1.00 0.00 C ATOM 531 C TYR A 31 26.256 39.438 22.535 1.00 0.00 C ATOM 532 O TYR A 31 25.697 40.379 23.100 1.00 0.00 O ATOM 533 CB TYR A 31 25.708 37.134 23.361 1.00 0.00 C ATOM 534 CG TYR A 31 24.948 35.811 23.365 1.00 0.00 C ATOM 535 CD1 TYR A 31 25.064 34.900 22.295 1.00 0.00 C ATOM 536 CD2 TYR A 31 24.237 35.423 24.519 1.00 0.00 C ATOM 537 CE1 TYR A 31 24.476 33.625 22.364 1.00 0.00 C ATOM 538 CE2 TYR A 31 23.667 34.137 24.605 1.00 0.00 C ATOM 539 CZ TYR A 31 23.790 33.231 23.532 1.00 0.00 C ATOM 540 OH TYR A 31 23.282 31.974 23.628 1.00 0.00 O ATOM 0 H TYR A 31 26.491 36.800 21.005 1.00 0.00 H new ATOM 0 HA TYR A 31 24.402 38.382 22.170 1.00 0.00 H new ATOM 0 HB2 TYR A 31 26.772 36.898 23.366 1.00 0.00 H new ATOM 0 HB3 TYR A 31 25.489 37.638 24.302 1.00 0.00 H new ATOM 0 HD1 TYR A 31 25.613 35.186 21.410 1.00 0.00 H new ATOM 0 HD2 TYR A 31 24.129 36.115 25.341 1.00 0.00 H new ATOM 0 HE1 TYR A 31 24.549 32.949 21.525 1.00 0.00 H new ATOM 0 HE2 TYR A 31 23.133 33.844 25.497 1.00 0.00 H new ATOM 0 HH TYR A 31 23.281 31.692 24.567 1.00 0.00 H new ATOM 550 N GLY A 32 27.537 39.493 22.151 1.00 0.00 N ATOM 551 CA GLY A 32 28.405 40.660 22.335 1.00 0.00 C ATOM 552 C GLY A 32 29.832 40.461 21.802 1.00 0.00 C ATOM 553 O GLY A 32 30.188 39.392 21.302 1.00 0.00 O ATOM 0 H GLY A 32 28.008 38.711 21.695 1.00 0.00 H new ATOM 0 HA2 GLY A 32 27.956 41.518 21.834 1.00 0.00 H new ATOM 0 HA3 GLY A 32 28.454 40.901 23.397 1.00 0.00 H new ATOM 557 N ASN A 33 30.664 41.498 21.922 1.00 0.00 N ATOM 558 CA ASN A 33 32.091 41.442 21.579 1.00 0.00 C ATOM 559 C ASN A 33 32.884 40.720 22.684 1.00 0.00 C ATOM 560 O ASN A 33 33.298 41.339 23.667 1.00 0.00 O ATOM 561 CB ASN A 33 32.618 42.868 21.327 1.00 0.00 C ATOM 562 CG ASN A 33 31.956 43.568 20.152 1.00 0.00 C ATOM 563 OD1 ASN A 33 31.717 42.993 19.098 1.00 0.00 O ATOM 564 ND2 ASN A 33 31.640 44.836 20.287 1.00 0.00 N ATOM 0 H ASN A 33 30.365 42.411 22.264 1.00 0.00 H new ATOM 0 HA ASN A 33 32.224 40.867 20.663 1.00 0.00 H new ATOM 0 HB2 ASN A 33 32.466 43.465 22.226 1.00 0.00 H new ATOM 0 HB3 ASN A 33 33.693 42.822 21.152 1.00 0.00 H new ATOM 0 HD21 ASN A 33 31.198 45.336 19.516 1.00 0.00 H new ATOM 0 HD22 ASN A 33 31.837 45.320 21.163 1.00 0.00 H new ATOM 571 N ILE A 34 33.072 39.403 22.538 1.00 0.00 N ATOM 572 CA ILE A 34 33.830 38.566 23.483 1.00 0.00 C ATOM 573 C ILE A 34 35.279 39.057 23.604 1.00 0.00 C ATOM 574 O ILE A 34 35.992 39.166 22.602 1.00 0.00 O ATOM 575 CB ILE A 34 33.700 37.057 23.133 1.00 0.00 C ATOM 576 CG1 ILE A 34 34.551 36.128 24.035 1.00 0.00 C ATOM 577 CG2 ILE A 34 33.892 36.726 21.642 1.00 0.00 C ATOM 578 CD1 ILE A 34 36.009 35.863 23.623 1.00 0.00 C ATOM 0 H ILE A 34 32.697 38.878 21.748 1.00 0.00 H new ATOM 0 HA ILE A 34 33.394 38.670 24.477 1.00 0.00 H new ATOM 0 HB ILE A 34 32.655 36.842 23.356 1.00 0.00 H new ATOM 0 HG12 ILE A 34 34.559 36.552 25.039 1.00 0.00 H new ATOM 0 HG13 ILE A 34 34.042 35.166 24.100 1.00 0.00 H new ATOM 0 HG21 ILE A 34 33.784 35.652 21.491 1.00 0.00 H new ATOM 0 HG22 ILE A 34 33.141 37.252 21.053 1.00 0.00 H new ATOM 0 HG23 ILE A 34 34.887 37.039 21.325 1.00 0.00 H new ATOM 0 HD11 ILE A 34 36.477 35.197 24.348 1.00 0.00 H new ATOM 0 HD12 ILE A 34 36.030 35.398 22.637 1.00 0.00 H new ATOM 0 HD13 ILE A 34 36.555 36.806 23.591 1.00 0.00 H new ATOM 590 N LEU A 35 35.710 39.355 24.834 1.00 0.00 N ATOM 591 CA LEU A 35 37.091 39.763 25.140 1.00 0.00 C ATOM 592 C LEU A 35 37.939 38.601 25.687 1.00 0.00 C ATOM 593 O LEU A 35 39.136 38.524 25.395 1.00 0.00 O ATOM 594 CB LEU A 35 37.083 40.961 26.108 1.00 0.00 C ATOM 595 CG LEU A 35 36.302 42.205 25.637 1.00 0.00 C ATOM 596 CD1 LEU A 35 36.557 43.363 26.604 1.00 0.00 C ATOM 597 CD2 LEU A 35 36.717 42.684 24.241 1.00 0.00 C ATOM 0 H LEU A 35 35.106 39.320 25.655 1.00 0.00 H new ATOM 0 HA LEU A 35 37.563 40.069 24.206 1.00 0.00 H new ATOM 0 HB2 LEU A 35 36.664 40.632 27.059 1.00 0.00 H new ATOM 0 HB3 LEU A 35 38.115 41.255 26.299 1.00 0.00 H new ATOM 0 HG LEU A 35 35.252 41.913 25.607 1.00 0.00 H new ATOM 0 HD11 LEU A 35 36.005 44.243 26.272 1.00 0.00 H new ATOM 0 HD12 LEU A 35 36.225 43.082 27.603 1.00 0.00 H new ATOM 0 HD13 LEU A 35 37.623 43.590 26.627 1.00 0.00 H new ATOM 0 HD21 LEU A 35 36.131 43.562 23.968 1.00 0.00 H new ATOM 0 HD22 LEU A 35 37.776 42.942 24.245 1.00 0.00 H new ATOM 0 HD23 LEU A 35 36.539 41.890 23.516 1.00 0.00 H new ATOM 609 N LYS A 36 37.319 37.682 26.443 1.00 0.00 N ATOM 610 CA LYS A 36 37.922 36.450 26.980 1.00 0.00 C ATOM 611 C LYS A 36 36.835 35.397 27.230 1.00 0.00 C ATOM 612 O LYS A 36 35.731 35.746 27.643 1.00 0.00 O ATOM 613 CB LYS A 36 38.717 36.809 28.258 1.00 0.00 C ATOM 614 CG LYS A 36 39.564 35.660 28.837 1.00 0.00 C ATOM 615 CD LYS A 36 38.840 34.851 29.928 1.00 0.00 C ATOM 616 CE LYS A 36 39.118 33.348 29.816 1.00 0.00 C ATOM 617 NZ LYS A 36 40.538 32.997 30.048 1.00 0.00 N ATOM 0 H LYS A 36 36.339 37.781 26.709 1.00 0.00 H new ATOM 0 HA LYS A 36 38.616 36.011 26.263 1.00 0.00 H new ATOM 0 HB2 LYS A 36 39.374 37.650 28.036 1.00 0.00 H new ATOM 0 HB3 LYS A 36 38.016 37.146 29.022 1.00 0.00 H new ATOM 0 HG2 LYS A 36 39.851 34.988 28.028 1.00 0.00 H new ATOM 0 HG3 LYS A 36 40.484 36.071 29.252 1.00 0.00 H new ATOM 0 HD2 LYS A 36 39.155 35.205 30.910 1.00 0.00 H new ATOM 0 HD3 LYS A 36 37.767 35.026 29.856 1.00 0.00 H new ATOM 0 HE2 LYS A 36 38.497 32.816 30.536 1.00 0.00 H new ATOM 0 HE3 LYS A 36 38.823 33.004 28.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 40.771 32.128 29.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 41.146 33.773 29.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 40.696 32.843 31.064 1.00 0.00 H new ATOM 631 N CYS A 37 37.134 34.116 27.006 1.00 0.00 N ATOM 632 CA CYS A 37 36.227 33.003 27.319 1.00 0.00 C ATOM 633 C CYS A 37 36.984 31.705 27.656 1.00 0.00 C ATOM 634 O CYS A 37 38.122 31.505 27.225 1.00 0.00 O ATOM 635 CB CYS A 37 35.228 32.807 26.168 1.00 0.00 C ATOM 636 SG CYS A 37 36.059 32.277 24.639 1.00 0.00 S ATOM 0 H CYS A 37 38.020 33.816 26.599 1.00 0.00 H new ATOM 0 HA CYS A 37 35.671 33.261 28.220 1.00 0.00 H new ATOM 0 HB2 CYS A 37 34.484 32.064 26.454 1.00 0.00 H new ATOM 0 HB3 CYS A 37 34.693 33.740 25.987 1.00 0.00 H new ATOM 0 HG CYS A 37 35.177 32.122 23.697 1.00 0.00 H new ATOM 642 N ASP A 38 36.372 30.833 28.463 1.00 0.00 N ATOM 643 CA ASP A 38 36.961 29.557 28.910 1.00 0.00 C ATOM 644 C ASP A 38 35.896 28.535 29.353 1.00 0.00 C ATOM 645 O ASP A 38 34.709 28.856 29.463 1.00 0.00 O ATOM 646 CB ASP A 38 37.980 29.811 30.042 1.00 0.00 C ATOM 647 CG ASP A 38 39.404 29.402 29.626 1.00 0.00 C ATOM 648 OD1 ASP A 38 39.587 28.236 29.208 1.00 0.00 O ATOM 649 OD2 ASP A 38 40.337 30.234 29.750 1.00 0.00 O ATOM 0 H ASP A 38 35.435 30.993 28.834 1.00 0.00 H new ATOM 0 HA ASP A 38 37.475 29.120 28.054 1.00 0.00 H new ATOM 0 HB2 ASP A 38 37.969 30.867 30.312 1.00 0.00 H new ATOM 0 HB3 ASP A 38 37.685 29.252 30.930 1.00 0.00 H new ATOM 654 N VAL A 39 36.333 27.301 29.621 1.00 0.00 N ATOM 655 CA VAL A 39 35.491 26.169 30.053 1.00 0.00 C ATOM 656 C VAL A 39 36.073 25.475 31.293 1.00 0.00 C ATOM 657 O VAL A 39 37.291 25.318 31.418 1.00 0.00 O ATOM 658 CB VAL A 39 35.236 25.206 28.871 1.00 0.00 C ATOM 659 CG1 VAL A 39 36.513 24.543 28.332 1.00 0.00 C ATOM 660 CG2 VAL A 39 34.242 24.094 29.216 1.00 0.00 C ATOM 0 H VAL A 39 37.318 27.048 29.542 1.00 0.00 H new ATOM 0 HA VAL A 39 34.518 26.551 30.363 1.00 0.00 H new ATOM 0 HB VAL A 39 34.817 25.852 28.099 1.00 0.00 H new ATOM 0 HG11 VAL A 39 36.258 23.881 27.504 1.00 0.00 H new ATOM 0 HG12 VAL A 39 37.202 25.312 27.983 1.00 0.00 H new ATOM 0 HG13 VAL A 39 36.986 23.965 29.126 1.00 0.00 H new ATOM 0 HG21 VAL A 39 34.102 23.449 28.349 1.00 0.00 H new ATOM 0 HG22 VAL A 39 34.629 23.505 30.048 1.00 0.00 H new ATOM 0 HG23 VAL A 39 33.286 24.535 29.498 1.00 0.00 H new ATOM 670 N LYS A 40 35.197 25.070 32.220 1.00 0.00 N ATOM 671 CA LYS A 40 35.511 24.415 33.509 1.00 0.00 C ATOM 672 C LYS A 40 34.584 23.205 33.735 1.00 0.00 C ATOM 673 O LYS A 40 33.623 23.019 32.988 1.00 0.00 O ATOM 674 CB LYS A 40 35.403 25.434 34.669 1.00 0.00 C ATOM 675 CG LYS A 40 36.183 26.750 34.482 1.00 0.00 C ATOM 676 CD LYS A 40 37.705 26.558 34.536 1.00 0.00 C ATOM 677 CE LYS A 40 38.416 27.782 33.949 1.00 0.00 C ATOM 678 NZ LYS A 40 39.882 27.708 34.176 1.00 0.00 N ATOM 0 H LYS A 40 34.193 25.194 32.090 1.00 0.00 H new ATOM 0 HA LYS A 40 36.537 24.048 33.480 1.00 0.00 H new ATOM 0 HB2 LYS A 40 34.351 25.676 34.818 1.00 0.00 H new ATOM 0 HB3 LYS A 40 35.752 24.954 35.583 1.00 0.00 H new ATOM 0 HG2 LYS A 40 35.912 27.193 33.524 1.00 0.00 H new ATOM 0 HG3 LYS A 40 35.884 27.456 35.256 1.00 0.00 H new ATOM 0 HD2 LYS A 40 38.023 26.404 35.567 1.00 0.00 H new ATOM 0 HD3 LYS A 40 37.986 25.664 33.979 1.00 0.00 H new ATOM 0 HE2 LYS A 40 38.213 27.846 32.880 1.00 0.00 H new ATOM 0 HE3 LYS A 40 38.020 28.690 34.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 40.367 28.361 33.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 40.095 27.974 35.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 40.212 26.737 34.001 1.00 0.00 H new ATOM 692 N LYS A 41 34.870 22.374 34.744 1.00 0.00 N ATOM 693 CA LYS A 41 34.076 21.177 35.091 1.00 0.00 C ATOM 694 C LYS A 41 34.124 20.821 36.581 1.00 0.00 C ATOM 695 O LYS A 41 35.112 21.107 37.259 1.00 0.00 O ATOM 696 CB LYS A 41 34.462 19.978 34.192 1.00 0.00 C ATOM 697 CG LYS A 41 35.773 19.235 34.528 1.00 0.00 C ATOM 698 CD LYS A 41 37.084 20.023 34.377 1.00 0.00 C ATOM 699 CE LYS A 41 37.307 20.519 32.939 1.00 0.00 C ATOM 700 NZ LYS A 41 38.650 21.140 32.778 1.00 0.00 N ATOM 0 H LYS A 41 35.673 22.512 35.357 1.00 0.00 H new ATOM 0 HA LYS A 41 33.034 21.428 34.892 1.00 0.00 H new ATOM 0 HB2 LYS A 41 33.647 19.255 34.225 1.00 0.00 H new ATOM 0 HB3 LYS A 41 34.530 20.335 33.164 1.00 0.00 H new ATOM 0 HG2 LYS A 41 35.707 18.882 35.557 1.00 0.00 H new ATOM 0 HG3 LYS A 41 35.834 18.352 33.892 1.00 0.00 H new ATOM 0 HD2 LYS A 41 37.072 20.876 35.055 1.00 0.00 H new ATOM 0 HD3 LYS A 41 37.921 19.391 34.674 1.00 0.00 H new ATOM 0 HE2 LYS A 41 37.205 19.684 32.245 1.00 0.00 H new ATOM 0 HE3 LYS A 41 36.536 21.245 32.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 38.767 21.464 31.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 38.737 21.951 33.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 39.385 20.440 33.002 1.00 0.00 H new ATOM 714 N THR A 42 33.067 20.175 37.076 1.00 0.00 N ATOM 715 CA THR A 42 32.986 19.593 38.432 1.00 0.00 C ATOM 716 C THR A 42 33.353 18.102 38.436 1.00 0.00 C ATOM 717 O THR A 42 33.175 17.401 37.437 1.00 0.00 O ATOM 718 CB THR A 42 31.598 19.828 39.068 1.00 0.00 C ATOM 719 OG1 THR A 42 31.482 19.138 40.296 1.00 0.00 O ATOM 720 CG2 THR A 42 30.424 19.358 38.214 1.00 0.00 C ATOM 0 H THR A 42 32.214 20.034 36.534 1.00 0.00 H new ATOM 0 HA THR A 42 33.723 20.111 39.045 1.00 0.00 H new ATOM 0 HB THR A 42 31.544 20.910 39.185 1.00 0.00 H new ATOM 0 HG1 THR A 42 30.596 19.303 40.681 1.00 0.00 H new ATOM 0 HG21 THR A 42 29.489 19.562 38.737 1.00 0.00 H new ATOM 0 HG22 THR A 42 30.431 19.889 37.262 1.00 0.00 H new ATOM 0 HG23 THR A 42 30.512 18.287 38.032 1.00 0.00 H new ATOM 728 N VAL A 43 33.798 17.588 39.589 1.00 0.00 N ATOM 729 CA VAL A 43 33.972 16.146 39.857 1.00 0.00 C ATOM 730 C VAL A 43 32.658 15.350 39.764 1.00 0.00 C ATOM 731 O VAL A 43 32.692 14.134 39.577 1.00 0.00 O ATOM 732 CB VAL A 43 34.634 15.909 41.232 1.00 0.00 C ATOM 733 CG1 VAL A 43 36.038 16.526 41.284 1.00 0.00 C ATOM 734 CG2 VAL A 43 33.808 16.450 42.408 1.00 0.00 C ATOM 0 H VAL A 43 34.055 18.173 40.384 1.00 0.00 H new ATOM 0 HA VAL A 43 34.630 15.775 39.071 1.00 0.00 H new ATOM 0 HB VAL A 43 34.696 14.826 41.340 1.00 0.00 H new ATOM 0 HG11 VAL A 43 36.480 16.343 42.264 1.00 0.00 H new ATOM 0 HG12 VAL A 43 36.663 16.073 40.514 1.00 0.00 H new ATOM 0 HG13 VAL A 43 35.970 17.600 41.111 1.00 0.00 H new ATOM 0 HG21 VAL A 43 34.331 16.250 43.343 1.00 0.00 H new ATOM 0 HG22 VAL A 43 33.671 17.525 42.292 1.00 0.00 H new ATOM 0 HG23 VAL A 43 32.835 15.960 42.425 1.00 0.00 H new ATOM 744 N SER A 44 31.499 16.021 39.830 1.00 0.00 N ATOM 745 CA SER A 44 30.177 15.432 39.554 1.00 0.00 C ATOM 746 C SER A 44 29.956 15.092 38.058 1.00 0.00 C ATOM 747 O SER A 44 29.042 14.340 37.707 1.00 0.00 O ATOM 748 CB SER A 44 29.091 16.379 40.092 1.00 0.00 C ATOM 749 OG SER A 44 27.806 15.779 40.073 1.00 0.00 O ATOM 0 H SER A 44 31.452 17.008 40.082 1.00 0.00 H new ATOM 0 HA SER A 44 30.118 14.473 40.069 1.00 0.00 H new ATOM 0 HB2 SER A 44 29.339 16.673 41.112 1.00 0.00 H new ATOM 0 HB3 SER A 44 29.075 17.290 39.493 1.00 0.00 H new ATOM 0 HG SER A 44 27.144 16.411 40.424 1.00 0.00 H new ATOM 755 N GLY A 45 30.823 15.595 37.164 1.00 0.00 N ATOM 756 CA GLY A 45 30.886 15.252 35.734 1.00 0.00 C ATOM 757 C GLY A 45 30.300 16.295 34.772 1.00 0.00 C ATOM 758 O GLY A 45 30.548 16.208 33.566 1.00 0.00 O ATOM 0 H GLY A 45 31.529 16.281 37.430 1.00 0.00 H new ATOM 0 HA2 GLY A 45 31.929 15.083 35.466 1.00 0.00 H new ATOM 0 HA3 GLY A 45 30.361 14.309 35.582 1.00 0.00 H new ATOM 762 N ALA A 46 29.563 17.294 35.267 1.00 0.00 N ATOM 763 CA ALA A 46 29.071 18.413 34.460 1.00 0.00 C ATOM 764 C ALA A 46 30.200 19.391 34.068 1.00 0.00 C ATOM 765 O ALA A 46 31.122 19.641 34.851 1.00 0.00 O ATOM 766 CB ALA A 46 27.938 19.124 35.212 1.00 0.00 C ATOM 0 H ALA A 46 29.289 17.348 36.248 1.00 0.00 H new ATOM 0 HA ALA A 46 28.680 18.017 33.523 1.00 0.00 H new ATOM 0 HB1 ALA A 46 27.570 19.957 34.613 1.00 0.00 H new ATOM 0 HB2 ALA A 46 27.125 18.421 35.394 1.00 0.00 H new ATOM 0 HB3 ALA A 46 28.313 19.499 36.164 1.00 0.00 H new ATOM 772 N ALA A 47 30.097 19.973 32.869 1.00 0.00 N ATOM 773 CA ALA A 47 30.985 21.017 32.350 1.00 0.00 C ATOM 774 C ALA A 47 30.219 22.325 32.085 1.00 0.00 C ATOM 775 O ALA A 47 29.000 22.312 31.886 1.00 0.00 O ATOM 776 CB ALA A 47 31.693 20.494 31.095 1.00 0.00 C ATOM 0 H ALA A 47 29.363 19.719 32.207 1.00 0.00 H new ATOM 0 HA ALA A 47 31.740 21.256 33.099 1.00 0.00 H new ATOM 0 HB1 ALA A 47 32.356 21.266 30.703 1.00 0.00 H new ATOM 0 HB2 ALA A 47 32.277 19.609 31.349 1.00 0.00 H new ATOM 0 HB3 ALA A 47 30.951 20.235 30.340 1.00 0.00 H new ATOM 782 N PHE A 48 30.931 23.458 32.083 1.00 0.00 N ATOM 783 CA PHE A 48 30.343 24.799 31.991 1.00 0.00 C ATOM 784 C PHE A 48 31.279 25.816 31.323 1.00 0.00 C ATOM 785 O PHE A 48 32.484 25.820 31.585 1.00 0.00 O ATOM 786 CB PHE A 48 29.897 25.317 33.374 1.00 0.00 C ATOM 787 CG PHE A 48 30.131 24.409 34.570 1.00 0.00 C ATOM 788 CD1 PHE A 48 31.399 24.373 35.178 1.00 0.00 C ATOM 789 CD2 PHE A 48 29.088 23.614 35.085 1.00 0.00 C ATOM 790 CE1 PHE A 48 31.625 23.567 36.305 1.00 0.00 C ATOM 791 CE2 PHE A 48 29.310 22.807 36.211 1.00 0.00 C ATOM 792 CZ PHE A 48 30.575 22.795 36.828 1.00 0.00 C ATOM 0 H PHE A 48 31.949 23.469 32.146 1.00 0.00 H new ATOM 0 HA PHE A 48 29.465 24.696 31.353 1.00 0.00 H new ATOM 0 HB2 PHE A 48 30.410 26.260 33.562 1.00 0.00 H new ATOM 0 HB3 PHE A 48 28.831 25.539 33.323 1.00 0.00 H new ATOM 0 HD1 PHE A 48 32.204 24.969 34.775 1.00 0.00 H new ATOM 0 HD2 PHE A 48 28.117 23.626 34.613 1.00 0.00 H new ATOM 0 HE1 PHE A 48 32.601 23.541 36.767 1.00 0.00 H new ATOM 0 HE2 PHE A 48 28.511 22.196 36.604 1.00 0.00 H new ATOM 0 HZ PHE A 48 30.739 22.190 37.707 1.00 0.00 H new ATOM 802 N ALA A 49 30.717 26.694 30.492 1.00 0.00 N ATOM 803 CA ALA A 49 31.428 27.756 29.781 1.00 0.00 C ATOM 804 C ALA A 49 31.167 29.148 30.394 1.00 0.00 C ATOM 805 O ALA A 49 30.070 29.436 30.888 1.00 0.00 O ATOM 806 CB ALA A 49 31.059 27.707 28.296 1.00 0.00 C ATOM 0 H ALA A 49 29.718 26.685 30.288 1.00 0.00 H new ATOM 0 HA ALA A 49 32.499 27.584 29.885 1.00 0.00 H new ATOM 0 HB1 ALA A 49 31.588 28.498 27.763 1.00 0.00 H new ATOM 0 HB2 ALA A 49 31.342 26.739 27.883 1.00 0.00 H new ATOM 0 HB3 ALA A 49 29.984 27.849 28.183 1.00 0.00 H new ATOM 812 N PHE A 50 32.181 30.014 30.312 1.00 0.00 N ATOM 813 CA PHE A 50 32.194 31.372 30.865 1.00 0.00 C ATOM 814 C PHE A 50 32.757 32.371 29.844 1.00 0.00 C ATOM 815 O PHE A 50 33.752 32.076 29.177 1.00 0.00 O ATOM 816 CB PHE A 50 33.006 31.402 32.170 1.00 0.00 C ATOM 817 CG PHE A 50 32.531 30.457 33.258 1.00 0.00 C ATOM 818 CD1 PHE A 50 32.975 29.120 33.269 1.00 0.00 C ATOM 819 CD2 PHE A 50 31.656 30.909 34.266 1.00 0.00 C ATOM 820 CE1 PHE A 50 32.537 28.242 34.273 1.00 0.00 C ATOM 821 CE2 PHE A 50 31.238 30.032 35.284 1.00 0.00 C ATOM 822 CZ PHE A 50 31.678 28.698 35.285 1.00 0.00 C ATOM 0 H PHE A 50 33.053 29.778 29.838 1.00 0.00 H new ATOM 0 HA PHE A 50 31.169 31.668 31.089 1.00 0.00 H new ATOM 0 HB2 PHE A 50 34.044 31.167 31.937 1.00 0.00 H new ATOM 0 HB3 PHE A 50 32.990 32.418 32.564 1.00 0.00 H new ATOM 0 HD1 PHE A 50 33.653 28.770 32.504 1.00 0.00 H new ATOM 0 HD2 PHE A 50 31.306 31.931 34.257 1.00 0.00 H new ATOM 0 HE1 PHE A 50 32.862 27.212 34.267 1.00 0.00 H new ATOM 0 HE2 PHE A 50 30.579 30.384 36.064 1.00 0.00 H new ATOM 0 HZ PHE A 50 31.355 28.023 36.064 1.00 0.00 H new ATOM 832 N ILE A 51 32.131 33.549 29.722 1.00 0.00 N ATOM 833 CA ILE A 51 32.385 34.526 28.646 1.00 0.00 C ATOM 834 C ILE A 51 32.350 35.962 29.191 1.00 0.00 C ATOM 835 O ILE A 51 31.363 36.355 29.812 1.00 0.00 O ATOM 836 CB ILE A 51 31.359 34.365 27.491 1.00 0.00 C ATOM 837 CG1 ILE A 51 31.295 32.937 26.901 1.00 0.00 C ATOM 838 CG2 ILE A 51 31.679 35.354 26.356 1.00 0.00 C ATOM 839 CD1 ILE A 51 30.200 32.058 27.527 1.00 0.00 C ATOM 0 H ILE A 51 31.417 33.860 30.381 1.00 0.00 H new ATOM 0 HA ILE A 51 33.381 34.329 28.250 1.00 0.00 H new ATOM 0 HB ILE A 51 30.385 34.574 27.933 1.00 0.00 H new ATOM 0 HG12 ILE A 51 31.124 33.005 25.827 1.00 0.00 H new ATOM 0 HG13 ILE A 51 32.261 32.452 27.040 1.00 0.00 H new ATOM 0 HG21 ILE A 51 30.953 35.232 25.552 1.00 0.00 H new ATOM 0 HG22 ILE A 51 31.630 36.374 26.737 1.00 0.00 H new ATOM 0 HG23 ILE A 51 32.681 35.157 25.974 1.00 0.00 H new ATOM 0 HD11 ILE A 51 30.216 31.072 27.063 1.00 0.00 H new ATOM 0 HD12 ILE A 51 30.381 31.959 28.597 1.00 0.00 H new ATOM 0 HD13 ILE A 51 29.226 32.520 27.365 1.00 0.00 H new ATOM 851 N GLU A 52 33.401 36.740 28.933 1.00 0.00 N ATOM 852 CA GLU A 52 33.561 38.148 29.327 1.00 0.00 C ATOM 853 C GLU A 52 33.140 39.106 28.193 1.00 0.00 C ATOM 854 O GLU A 52 33.578 38.944 27.044 1.00 0.00 O ATOM 855 CB GLU A 52 35.032 38.383 29.746 1.00 0.00 C ATOM 856 CG GLU A 52 35.239 39.435 30.851 1.00 0.00 C ATOM 857 CD GLU A 52 35.480 40.877 30.363 1.00 0.00 C ATOM 858 OE1 GLU A 52 35.144 41.217 29.209 1.00 0.00 O ATOM 859 OE2 GLU A 52 36.032 41.690 31.147 1.00 0.00 O ATOM 0 H GLU A 52 34.208 36.391 28.417 1.00 0.00 H new ATOM 0 HA GLU A 52 32.905 38.361 30.171 1.00 0.00 H new ATOM 0 HB2 GLU A 52 35.452 37.436 30.085 1.00 0.00 H new ATOM 0 HB3 GLU A 52 35.599 38.687 28.866 1.00 0.00 H new ATOM 0 HG2 GLU A 52 34.363 39.432 31.499 1.00 0.00 H new ATOM 0 HG3 GLU A 52 36.089 39.131 31.462 1.00 0.00 H new ATOM 866 N PHE A 53 32.319 40.114 28.514 1.00 0.00 N ATOM 867 CA PHE A 53 31.867 41.167 27.590 1.00 0.00 C ATOM 868 C PHE A 53 32.084 42.590 28.134 1.00 0.00 C ATOM 869 O PHE A 53 32.034 42.837 29.340 1.00 0.00 O ATOM 870 CB PHE A 53 30.375 40.989 27.258 1.00 0.00 C ATOM 871 CG PHE A 53 29.992 39.782 26.421 1.00 0.00 C ATOM 872 CD1 PHE A 53 30.720 39.452 25.265 1.00 0.00 C ATOM 873 CD2 PHE A 53 28.832 39.057 26.738 1.00 0.00 C ATOM 874 CE1 PHE A 53 30.300 38.395 24.441 1.00 0.00 C ATOM 875 CE2 PHE A 53 28.393 38.017 25.894 1.00 0.00 C ATOM 876 CZ PHE A 53 29.135 37.686 24.754 1.00 0.00 C ATOM 0 H PHE A 53 31.938 40.224 29.454 1.00 0.00 H new ATOM 0 HA PHE A 53 32.478 41.057 26.694 1.00 0.00 H new ATOM 0 HB2 PHE A 53 29.823 40.938 28.197 1.00 0.00 H new ATOM 0 HB3 PHE A 53 30.035 41.884 26.736 1.00 0.00 H new ATOM 0 HD1 PHE A 53 31.606 40.014 25.009 1.00 0.00 H new ATOM 0 HD2 PHE A 53 28.274 39.297 27.631 1.00 0.00 H new ATOM 0 HE1 PHE A 53 30.876 38.130 23.567 1.00 0.00 H new ATOM 0 HE2 PHE A 53 27.487 37.477 26.126 1.00 0.00 H new ATOM 0 HZ PHE A 53 28.807 36.880 24.114 1.00 0.00 H new ATOM 886 N GLU A 54 32.241 43.550 27.216 1.00 0.00 N ATOM 887 CA GLU A 54 32.400 44.980 27.525 1.00 0.00 C ATOM 888 C GLU A 54 31.110 45.681 28.012 1.00 0.00 C ATOM 889 O GLU A 54 31.197 46.708 28.686 1.00 0.00 O ATOM 890 CB GLU A 54 32.988 45.707 26.301 1.00 0.00 C ATOM 891 CG GLU A 54 32.057 45.745 25.075 1.00 0.00 C ATOM 892 CD GLU A 54 32.686 46.448 23.853 1.00 0.00 C ATOM 893 OE1 GLU A 54 33.568 47.329 24.011 1.00 0.00 O ATOM 894 OE2 GLU A 54 32.283 46.125 22.709 1.00 0.00 O ATOM 0 H GLU A 54 32.262 43.353 26.215 1.00 0.00 H new ATOM 0 HA GLU A 54 33.086 45.037 28.370 1.00 0.00 H new ATOM 0 HB2 GLU A 54 33.236 46.730 26.586 1.00 0.00 H new ATOM 0 HB3 GLU A 54 33.921 45.220 26.018 1.00 0.00 H new ATOM 0 HG2 GLU A 54 31.788 44.725 24.800 1.00 0.00 H new ATOM 0 HG3 GLU A 54 31.133 46.257 25.345 1.00 0.00 H new ATOM 901 N ASP A 55 29.920 45.139 27.704 1.00 0.00 N ATOM 902 CA ASP A 55 28.606 45.706 28.055 1.00 0.00 C ATOM 903 C ASP A 55 27.625 44.626 28.548 1.00 0.00 C ATOM 904 O ASP A 55 27.161 43.782 27.777 1.00 0.00 O ATOM 905 CB ASP A 55 28.004 46.460 26.853 1.00 0.00 C ATOM 906 CG ASP A 55 28.635 47.840 26.595 1.00 0.00 C ATOM 907 OD1 ASP A 55 28.747 48.647 27.549 1.00 0.00 O ATOM 908 OD2 ASP A 55 28.938 48.156 25.420 1.00 0.00 O ATOM 0 H ASP A 55 29.843 44.264 27.186 1.00 0.00 H new ATOM 0 HA ASP A 55 28.765 46.407 28.874 1.00 0.00 H new ATOM 0 HB2 ASP A 55 28.119 45.847 25.959 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.934 46.587 27.017 1.00 0.00 H new ATOM 913 N ALA A 56 27.263 44.693 29.833 1.00 0.00 N ATOM 914 CA ALA A 56 26.326 43.768 30.478 1.00 0.00 C ATOM 915 C ALA A 56 24.907 43.853 29.880 1.00 0.00 C ATOM 916 O ALA A 56 24.336 42.842 29.467 1.00 0.00 O ATOM 917 CB ALA A 56 26.327 44.082 31.983 1.00 0.00 C ATOM 0 H ALA A 56 27.621 45.407 30.467 1.00 0.00 H new ATOM 0 HA ALA A 56 26.649 42.742 30.304 1.00 0.00 H new ATOM 0 HB1 ALA A 56 25.638 43.410 32.495 1.00 0.00 H new ATOM 0 HB2 ALA A 56 27.332 43.945 32.383 1.00 0.00 H new ATOM 0 HB3 ALA A 56 26.011 45.113 32.140 1.00 0.00 H new ATOM 923 N ARG A 57 24.347 45.071 29.784 1.00 0.00 N ATOM 924 CA ARG A 57 22.972 45.313 29.293 1.00 0.00 C ATOM 925 C ARG A 57 22.739 44.965 27.816 1.00 0.00 C ATOM 926 O ARG A 57 21.599 44.744 27.418 1.00 0.00 O ATOM 927 CB ARG A 57 22.513 46.746 29.641 1.00 0.00 C ATOM 928 CG ARG A 57 23.035 47.899 28.762 1.00 0.00 C ATOM 929 CD ARG A 57 24.557 48.095 28.812 1.00 0.00 C ATOM 930 NE ARG A 57 24.977 49.352 28.160 1.00 0.00 N ATOM 931 CZ ARG A 57 25.164 49.578 26.869 1.00 0.00 C ATOM 932 NH1 ARG A 57 24.926 48.679 25.957 1.00 0.00 N ATOM 933 NH2 ARG A 57 25.592 50.739 26.463 1.00 0.00 N ATOM 0 H ARG A 57 24.838 45.926 30.047 1.00 0.00 H new ATOM 0 HA ARG A 57 22.339 44.604 29.827 1.00 0.00 H new ATOM 0 HB2 ARG A 57 21.424 46.766 29.609 1.00 0.00 H new ATOM 0 HB3 ARG A 57 22.805 46.951 30.671 1.00 0.00 H new ATOM 0 HG2 ARG A 57 22.738 47.716 27.729 1.00 0.00 H new ATOM 0 HG3 ARG A 57 22.551 48.825 29.073 1.00 0.00 H new ATOM 0 HD2 ARG A 57 24.888 48.098 29.851 1.00 0.00 H new ATOM 0 HD3 ARG A 57 25.047 47.253 28.324 1.00 0.00 H new ATOM 0 HE ARG A 57 25.144 50.144 28.781 1.00 0.00 H new ATOM 0 HH11 ARG A 57 24.581 47.758 26.227 1.00 0.00 H new ATOM 0 HH12 ARG A 57 25.084 48.896 24.973 1.00 0.00 H new ATOM 0 HH21 ARG A 57 25.784 51.477 27.140 1.00 0.00 H new ATOM 0 HH22 ARG A 57 25.735 50.910 25.468 1.00 0.00 H new ATOM 947 N ASP A 58 23.806 44.894 27.012 1.00 0.00 N ATOM 948 CA ASP A 58 23.738 44.423 25.621 1.00 0.00 C ATOM 949 C ASP A 58 23.566 42.893 25.564 1.00 0.00 C ATOM 950 O ASP A 58 22.633 42.377 24.945 1.00 0.00 O ATOM 951 CB ASP A 58 25.013 44.870 24.882 1.00 0.00 C ATOM 952 CG ASP A 58 24.983 44.612 23.362 1.00 0.00 C ATOM 953 OD1 ASP A 58 23.887 44.513 22.764 1.00 0.00 O ATOM 954 OD2 ASP A 58 26.077 44.569 22.748 1.00 0.00 O ATOM 0 H ASP A 58 24.745 45.162 27.307 1.00 0.00 H new ATOM 0 HA ASP A 58 22.868 44.859 25.131 1.00 0.00 H new ATOM 0 HB2 ASP A 58 25.166 45.935 25.056 1.00 0.00 H new ATOM 0 HB3 ASP A 58 25.870 44.350 25.311 1.00 0.00 H new ATOM 959 N ALA A 59 24.428 42.164 26.283 1.00 0.00 N ATOM 960 CA ALA A 59 24.407 40.703 26.347 1.00 0.00 C ATOM 961 C ALA A 59 23.197 40.130 27.106 1.00 0.00 C ATOM 962 O ALA A 59 22.750 39.028 26.793 1.00 0.00 O ATOM 963 CB ALA A 59 25.720 40.253 26.985 1.00 0.00 C ATOM 0 H ALA A 59 25.170 42.582 26.844 1.00 0.00 H new ATOM 0 HA ALA A 59 24.305 40.315 25.334 1.00 0.00 H new ATOM 0 HB1 ALA A 59 25.739 39.165 27.049 1.00 0.00 H new ATOM 0 HB2 ALA A 59 26.557 40.596 26.376 1.00 0.00 H new ATOM 0 HB3 ALA A 59 25.802 40.677 27.986 1.00 0.00 H new ATOM 969 N ALA A 60 22.645 40.869 28.075 1.00 0.00 N ATOM 970 CA ALA A 60 21.520 40.423 28.901 1.00 0.00 C ATOM 971 C ALA A 60 20.283 40.016 28.076 1.00 0.00 C ATOM 972 O ALA A 60 19.644 39.007 28.378 1.00 0.00 O ATOM 973 CB ALA A 60 21.184 41.542 29.896 1.00 0.00 C ATOM 0 H ALA A 60 22.972 41.806 28.310 1.00 0.00 H new ATOM 0 HA ALA A 60 21.818 39.518 29.431 1.00 0.00 H new ATOM 0 HB1 ALA A 60 20.348 41.232 30.523 1.00 0.00 H new ATOM 0 HB2 ALA A 60 22.052 41.744 30.523 1.00 0.00 H new ATOM 0 HB3 ALA A 60 20.913 42.445 29.350 1.00 0.00 H new ATOM 979 N ASP A 61 19.968 40.742 26.995 1.00 0.00 N ATOM 980 CA ASP A 61 18.831 40.426 26.118 1.00 0.00 C ATOM 981 C ASP A 61 19.038 39.133 25.296 1.00 0.00 C ATOM 982 O ASP A 61 18.079 38.418 25.001 1.00 0.00 O ATOM 983 CB ASP A 61 18.576 41.620 25.188 1.00 0.00 C ATOM 984 CG ASP A 61 17.221 41.537 24.468 1.00 0.00 C ATOM 985 OD1 ASP A 61 16.195 41.245 25.133 1.00 0.00 O ATOM 986 OD2 ASP A 61 17.168 41.813 23.246 1.00 0.00 O ATOM 0 H ASP A 61 20.494 41.566 26.703 1.00 0.00 H new ATOM 0 HA ASP A 61 17.963 40.243 26.752 1.00 0.00 H new ATOM 0 HB2 ASP A 61 18.618 42.542 25.768 1.00 0.00 H new ATOM 0 HB3 ASP A 61 19.373 41.674 24.447 1.00 0.00 H new ATOM 991 N ALA A 62 20.292 38.811 24.956 1.00 0.00 N ATOM 992 CA ALA A 62 20.671 37.582 24.253 1.00 0.00 C ATOM 993 C ALA A 62 20.829 36.368 25.190 1.00 0.00 C ATOM 994 O ALA A 62 20.608 35.231 24.771 1.00 0.00 O ATOM 995 CB ALA A 62 21.963 37.863 23.478 1.00 0.00 C ATOM 0 H ALA A 62 21.088 39.412 25.167 1.00 0.00 H new ATOM 0 HA ALA A 62 19.866 37.307 23.571 1.00 0.00 H new ATOM 0 HB1 ALA A 62 22.270 36.964 22.944 1.00 0.00 H new ATOM 0 HB2 ALA A 62 21.791 38.668 22.764 1.00 0.00 H new ATOM 0 HB3 ALA A 62 22.748 38.157 24.174 1.00 0.00 H new ATOM 1001 N ILE A 63 21.191 36.582 26.461 1.00 0.00 N ATOM 1002 CA ILE A 63 21.320 35.511 27.465 1.00 0.00 C ATOM 1003 C ILE A 63 19.952 35.117 28.056 1.00 0.00 C ATOM 1004 O ILE A 63 19.692 33.932 28.257 1.00 0.00 O ATOM 1005 CB ILE A 63 22.397 35.899 28.511 1.00 0.00 C ATOM 1006 CG1 ILE A 63 23.372 34.749 28.842 1.00 0.00 C ATOM 1007 CG2 ILE A 63 21.834 36.524 29.795 1.00 0.00 C ATOM 1008 CD1 ILE A 63 22.765 33.490 29.474 1.00 0.00 C ATOM 0 H ILE A 63 21.405 37.510 26.827 1.00 0.00 H new ATOM 0 HA ILE A 63 21.675 34.598 26.988 1.00 0.00 H new ATOM 0 HB ILE A 63 22.968 36.681 28.011 1.00 0.00 H new ATOM 0 HG12 ILE A 63 23.878 34.457 27.922 1.00 0.00 H new ATOM 0 HG13 ILE A 63 24.135 35.134 29.518 1.00 0.00 H new ATOM 0 HG21 ILE A 63 22.654 36.765 30.472 1.00 0.00 H new ATOM 0 HG22 ILE A 63 21.288 37.434 29.547 1.00 0.00 H new ATOM 0 HG23 ILE A 63 21.160 35.817 30.279 1.00 0.00 H new ATOM 0 HD11 ILE A 63 23.553 32.759 29.657 1.00 0.00 H new ATOM 0 HD12 ILE A 63 22.286 33.751 30.417 1.00 0.00 H new ATOM 0 HD13 ILE A 63 22.025 33.064 28.797 1.00 0.00 H new ATOM 1020 N LYS A 64 19.029 36.072 28.276 1.00 0.00 N ATOM 1021 CA LYS A 64 17.726 35.791 28.916 1.00 0.00 C ATOM 1022 C LYS A 64 16.791 34.911 28.081 1.00 0.00 C ATOM 1023 O LYS A 64 15.975 34.193 28.647 1.00 0.00 O ATOM 1024 CB LYS A 64 17.062 37.093 29.408 1.00 0.00 C ATOM 1025 CG LYS A 64 16.556 38.060 28.323 1.00 0.00 C ATOM 1026 CD LYS A 64 15.121 37.776 27.844 1.00 0.00 C ATOM 1027 CE LYS A 64 14.668 38.780 26.777 1.00 0.00 C ATOM 1028 NZ LYS A 64 14.397 40.127 27.342 1.00 0.00 N ATOM 0 H LYS A 64 19.161 37.050 28.019 1.00 0.00 H new ATOM 0 HA LYS A 64 17.939 35.179 29.793 1.00 0.00 H new ATOM 0 HB2 LYS A 64 16.220 36.826 30.046 1.00 0.00 H new ATOM 0 HB3 LYS A 64 17.779 37.626 30.033 1.00 0.00 H new ATOM 0 HG2 LYS A 64 16.603 39.078 28.709 1.00 0.00 H new ATOM 0 HG3 LYS A 64 17.229 38.012 27.467 1.00 0.00 H new ATOM 0 HD2 LYS A 64 15.066 36.766 27.439 1.00 0.00 H new ATOM 0 HD3 LYS A 64 14.439 37.816 28.694 1.00 0.00 H new ATOM 0 HE2 LYS A 64 15.437 38.860 26.008 1.00 0.00 H new ATOM 0 HE3 LYS A 64 13.768 38.406 26.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 13.376 40.322 27.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 14.716 40.159 28.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 14.909 40.844 26.790 1.00 0.00 H new ATOM 1042 N GLU A 65 16.933 34.881 26.751 1.00 0.00 N ATOM 1043 CA GLU A 65 16.183 33.952 25.882 1.00 0.00 C ATOM 1044 C GLU A 65 16.595 32.472 26.069 1.00 0.00 C ATOM 1045 O GLU A 65 15.899 31.573 25.589 1.00 0.00 O ATOM 1046 CB GLU A 65 16.284 34.382 24.405 1.00 0.00 C ATOM 1047 CG GLU A 65 17.728 34.463 23.885 1.00 0.00 C ATOM 1048 CD GLU A 65 17.869 34.218 22.368 1.00 0.00 C ATOM 1049 OE1 GLU A 65 17.361 33.191 21.857 1.00 0.00 O ATOM 1050 OE2 GLU A 65 18.552 35.018 21.685 1.00 0.00 O ATOM 0 H GLU A 65 17.568 35.496 26.243 1.00 0.00 H new ATOM 0 HA GLU A 65 15.139 34.012 26.191 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.725 33.676 23.791 1.00 0.00 H new ATOM 0 HB3 GLU A 65 15.808 35.355 24.285 1.00 0.00 H new ATOM 0 HG2 GLU A 65 18.133 35.447 24.122 1.00 0.00 H new ATOM 0 HG3 GLU A 65 18.336 33.732 24.418 1.00 0.00 H new ATOM 1057 N LYS A 66 17.699 32.208 26.787 1.00 0.00 N ATOM 1058 CA LYS A 66 18.194 30.872 27.162 1.00 0.00 C ATOM 1059 C LYS A 66 17.819 30.462 28.600 1.00 0.00 C ATOM 1060 O LYS A 66 18.289 29.429 29.080 1.00 0.00 O ATOM 1061 CB LYS A 66 19.724 30.798 26.937 1.00 0.00 C ATOM 1062 CG LYS A 66 20.229 31.307 25.576 1.00 0.00 C ATOM 1063 CD LYS A 66 19.684 30.499 24.386 1.00 0.00 C ATOM 1064 CE LYS A 66 19.969 31.241 23.074 1.00 0.00 C ATOM 1065 NZ LYS A 66 19.516 30.473 21.884 1.00 0.00 N ATOM 0 H LYS A 66 18.299 32.954 27.138 1.00 0.00 H new ATOM 0 HA LYS A 66 17.697 30.151 26.514 1.00 0.00 H new ATOM 0 HB2 LYS A 66 20.215 31.372 27.723 1.00 0.00 H new ATOM 0 HB3 LYS A 66 20.039 29.761 27.055 1.00 0.00 H new ATOM 0 HG2 LYS A 66 19.944 32.352 25.458 1.00 0.00 H new ATOM 0 HG3 LYS A 66 21.318 31.270 25.563 1.00 0.00 H new ATOM 0 HD2 LYS A 66 20.147 29.512 24.363 1.00 0.00 H new ATOM 0 HD3 LYS A 66 18.611 30.345 24.501 1.00 0.00 H new ATOM 0 HE2 LYS A 66 19.470 32.210 23.091 1.00 0.00 H new ATOM 0 HE3 LYS A 66 21.039 31.435 22.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 19.729 31.013 21.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 20.011 29.559 21.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 18.491 30.310 21.946 1.00 0.00 H new ATOM 1079 N ASP A 67 17.014 31.261 29.310 1.00 0.00 N ATOM 1080 CA ASP A 67 16.629 31.022 30.713 1.00 0.00 C ATOM 1081 C ASP A 67 15.696 29.800 30.921 1.00 0.00 C ATOM 1082 O ASP A 67 15.254 29.148 29.970 1.00 0.00 O ATOM 1083 CB ASP A 67 16.051 32.305 31.349 1.00 0.00 C ATOM 1084 CG ASP A 67 14.608 32.699 30.962 1.00 0.00 C ATOM 1085 OD1 ASP A 67 13.960 32.050 30.106 1.00 0.00 O ATOM 1086 OD2 ASP A 67 14.087 33.663 31.576 1.00 0.00 O ATOM 0 H ASP A 67 16.602 32.109 28.921 1.00 0.00 H new ATOM 0 HA ASP A 67 17.549 30.758 31.235 1.00 0.00 H new ATOM 0 HB2 ASP A 67 16.091 32.192 32.432 1.00 0.00 H new ATOM 0 HB3 ASP A 67 16.708 33.135 31.091 1.00 0.00 H new ATOM 1091 N GLY A 68 15.412 29.480 32.191 1.00 0.00 N ATOM 1092 CA GLY A 68 14.619 28.316 32.604 1.00 0.00 C ATOM 1093 C GLY A 68 15.438 27.025 32.551 1.00 0.00 C ATOM 1094 O GLY A 68 15.427 26.312 31.544 1.00 0.00 O ATOM 0 H GLY A 68 15.737 30.039 32.980 1.00 0.00 H new ATOM 0 HA2 GLY A 68 14.248 28.470 33.617 1.00 0.00 H new ATOM 0 HA3 GLY A 68 13.748 28.221 31.956 1.00 0.00 H new ATOM 1098 N CYS A 69 16.173 26.731 33.628 1.00 0.00 N ATOM 1099 CA CYS A 69 17.059 25.572 33.705 1.00 0.00 C ATOM 1100 C CYS A 69 16.288 24.233 33.666 1.00 0.00 C ATOM 1101 O CYS A 69 15.291 24.033 34.366 1.00 0.00 O ATOM 1102 CB CYS A 69 17.977 25.704 34.934 1.00 0.00 C ATOM 1103 SG CYS A 69 17.034 25.907 36.477 1.00 0.00 S ATOM 0 H CYS A 69 16.168 27.297 34.476 1.00 0.00 H new ATOM 0 HA CYS A 69 17.688 25.556 32.815 1.00 0.00 H new ATOM 0 HB2 CYS A 69 18.609 24.819 35.010 1.00 0.00 H new ATOM 0 HB3 CYS A 69 18.640 26.559 34.800 1.00 0.00 H new ATOM 0 HG CYS A 69 17.857 26.011 37.478 1.00 0.00 H new ATOM 1109 N ASP A 70 16.772 23.304 32.839 1.00 0.00 N ATOM 1110 CA ASP A 70 16.252 21.945 32.677 1.00 0.00 C ATOM 1111 C ASP A 70 17.038 20.923 33.513 1.00 0.00 C ATOM 1112 O ASP A 70 18.274 20.941 33.549 1.00 0.00 O ATOM 1113 CB ASP A 70 16.263 21.542 31.197 1.00 0.00 C ATOM 1114 CG ASP A 70 15.225 22.274 30.324 1.00 0.00 C ATOM 1115 OD1 ASP A 70 14.150 22.672 30.834 1.00 0.00 O ATOM 1116 OD2 ASP A 70 15.457 22.389 29.100 1.00 0.00 O ATOM 0 H ASP A 70 17.574 23.487 32.236 1.00 0.00 H new ATOM 0 HA ASP A 70 15.225 21.945 33.042 1.00 0.00 H new ATOM 0 HB2 ASP A 70 17.257 21.729 30.791 1.00 0.00 H new ATOM 0 HB3 ASP A 70 16.086 20.469 31.125 1.00 0.00 H new ATOM 1121 N PHE A 71 16.303 20.009 34.147 1.00 0.00 N ATOM 1122 CA PHE A 71 16.796 18.906 34.977 1.00 0.00 C ATOM 1123 C PHE A 71 15.812 17.718 34.927 1.00 0.00 C ATOM 1124 O PHE A 71 14.698 17.850 34.413 1.00 0.00 O ATOM 1125 CB PHE A 71 17.022 19.412 36.416 1.00 0.00 C ATOM 1126 CG PHE A 71 15.764 19.800 37.174 1.00 0.00 C ATOM 1127 CD1 PHE A 71 15.194 21.077 37.002 1.00 0.00 C ATOM 1128 CD2 PHE A 71 15.160 18.885 38.058 1.00 0.00 C ATOM 1129 CE1 PHE A 71 14.023 21.431 37.699 1.00 0.00 C ATOM 1130 CE2 PHE A 71 13.989 19.237 38.753 1.00 0.00 C ATOM 1131 CZ PHE A 71 13.418 20.510 38.572 1.00 0.00 C ATOM 0 H PHE A 71 15.285 20.018 34.092 1.00 0.00 H new ATOM 0 HA PHE A 71 17.750 18.547 34.591 1.00 0.00 H new ATOM 0 HB2 PHE A 71 17.540 18.636 36.979 1.00 0.00 H new ATOM 0 HB3 PHE A 71 17.685 20.276 36.379 1.00 0.00 H new ATOM 0 HD1 PHE A 71 15.657 21.787 36.333 1.00 0.00 H new ATOM 0 HD2 PHE A 71 15.598 17.909 38.203 1.00 0.00 H new ATOM 0 HE1 PHE A 71 13.589 22.411 37.563 1.00 0.00 H new ATOM 0 HE2 PHE A 71 13.528 18.530 39.426 1.00 0.00 H new ATOM 0 HZ PHE A 71 12.517 20.779 39.103 1.00 0.00 H new ATOM 1141 N GLU A 72 16.211 16.563 35.475 1.00 0.00 N ATOM 1142 CA GLU A 72 15.427 15.310 35.510 1.00 0.00 C ATOM 1143 C GLU A 72 15.003 14.820 34.104 1.00 0.00 C ATOM 1144 O GLU A 72 13.856 14.966 33.672 1.00 0.00 O ATOM 1145 CB GLU A 72 14.273 15.425 36.530 1.00 0.00 C ATOM 1146 CG GLU A 72 13.616 14.073 36.844 1.00 0.00 C ATOM 1147 CD GLU A 72 12.430 14.194 37.825 1.00 0.00 C ATOM 1148 OE1 GLU A 72 12.485 15.004 38.783 1.00 0.00 O ATOM 1149 OE2 GLU A 72 11.432 13.450 37.659 1.00 0.00 O ATOM 0 H GLU A 72 17.122 16.466 35.924 1.00 0.00 H new ATOM 0 HA GLU A 72 16.075 14.510 35.868 1.00 0.00 H new ATOM 0 HB2 GLU A 72 14.653 15.862 37.453 1.00 0.00 H new ATOM 0 HB3 GLU A 72 13.518 16.109 36.141 1.00 0.00 H new ATOM 0 HG2 GLU A 72 13.268 13.620 35.916 1.00 0.00 H new ATOM 0 HG3 GLU A 72 14.363 13.401 37.266 1.00 0.00 H new ATOM 1156 N GLY A 73 15.967 14.252 33.368 1.00 0.00 N ATOM 1157 CA GLY A 73 15.821 13.784 31.982 1.00 0.00 C ATOM 1158 C GLY A 73 16.455 14.753 30.984 1.00 0.00 C ATOM 1159 O GLY A 73 17.510 14.458 30.418 1.00 0.00 O ATOM 0 H GLY A 73 16.906 14.100 33.735 1.00 0.00 H new ATOM 0 HA2 GLY A 73 16.284 12.803 31.879 1.00 0.00 H new ATOM 0 HA3 GLY A 73 14.763 13.663 31.749 1.00 0.00 H new ATOM 1163 N ASN A 74 15.857 15.935 30.809 1.00 0.00 N ATOM 1164 CA ASN A 74 16.488 17.061 30.104 1.00 0.00 C ATOM 1165 C ASN A 74 17.611 17.689 30.956 1.00 0.00 C ATOM 1166 O ASN A 74 17.585 17.598 32.188 1.00 0.00 O ATOM 1167 CB ASN A 74 15.409 18.090 29.712 1.00 0.00 C ATOM 1168 CG ASN A 74 14.379 17.543 28.737 1.00 0.00 C ATOM 1169 OD1 ASN A 74 14.695 16.868 27.765 1.00 0.00 O ATOM 1170 ND2 ASN A 74 13.112 17.817 28.954 1.00 0.00 N ATOM 0 H ASN A 74 14.919 16.141 31.152 1.00 0.00 H new ATOM 0 HA ASN A 74 16.959 16.698 29.191 1.00 0.00 H new ATOM 0 HB2 ASN A 74 14.900 18.432 30.613 1.00 0.00 H new ATOM 0 HB3 ASN A 74 15.892 18.961 29.268 1.00 0.00 H new ATOM 0 HD21 ASN A 74 12.398 17.468 28.315 1.00 0.00 H new ATOM 0 HD22 ASN A 74 12.843 18.379 29.762 1.00 0.00 H new ATOM 1177 N LYS A 75 18.600 18.328 30.314 1.00 0.00 N ATOM 1178 CA LYS A 75 19.790 18.899 30.980 1.00 0.00 C ATOM 1179 C LYS A 75 20.380 20.100 30.225 1.00 0.00 C ATOM 1180 O LYS A 75 21.103 19.938 29.245 1.00 0.00 O ATOM 1181 CB LYS A 75 20.820 17.780 31.252 1.00 0.00 C ATOM 1182 CG LYS A 75 21.361 17.041 30.008 1.00 0.00 C ATOM 1183 CD LYS A 75 21.821 15.609 30.319 1.00 0.00 C ATOM 1184 CE LYS A 75 20.615 14.689 30.556 1.00 0.00 C ATOM 1185 NZ LYS A 75 21.027 13.283 30.796 1.00 0.00 N ATOM 0 H LYS A 75 18.600 18.467 29.304 1.00 0.00 H new ATOM 0 HA LYS A 75 19.482 19.311 31.941 1.00 0.00 H new ATOM 0 HB2 LYS A 75 21.664 18.213 31.789 1.00 0.00 H new ATOM 0 HB3 LYS A 75 20.363 17.046 31.916 1.00 0.00 H new ATOM 0 HG2 LYS A 75 20.585 17.010 29.243 1.00 0.00 H new ATOM 0 HG3 LYS A 75 22.197 17.604 29.592 1.00 0.00 H new ATOM 0 HD2 LYS A 75 22.419 15.227 29.492 1.00 0.00 H new ATOM 0 HD3 LYS A 75 22.461 15.611 31.201 1.00 0.00 H new ATOM 0 HE2 LYS A 75 20.045 15.051 31.412 1.00 0.00 H new ATOM 0 HE3 LYS A 75 19.952 14.730 29.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 20.183 12.696 30.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 21.548 12.928 29.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 21.639 13.239 31.636 1.00 0.00 H new ATOM 1199 N LEU A 76 20.041 21.304 30.685 1.00 0.00 N ATOM 1200 CA LEU A 76 20.600 22.600 30.268 1.00 0.00 C ATOM 1201 C LEU A 76 20.430 23.589 31.433 1.00 0.00 C ATOM 1202 O LEU A 76 19.297 23.947 31.756 1.00 0.00 O ATOM 1203 CB LEU A 76 19.877 23.177 29.021 1.00 0.00 C ATOM 1204 CG LEU A 76 20.118 22.477 27.666 1.00 0.00 C ATOM 1205 CD1 LEU A 76 18.982 21.515 27.300 1.00 0.00 C ATOM 1206 CD2 LEU A 76 20.198 23.504 26.532 1.00 0.00 C ATOM 0 H LEU A 76 19.325 21.413 31.403 1.00 0.00 H new ATOM 0 HA LEU A 76 21.648 22.453 30.007 1.00 0.00 H new ATOM 0 HB2 LEU A 76 18.805 23.165 29.219 1.00 0.00 H new ATOM 0 HB3 LEU A 76 20.170 24.222 28.916 1.00 0.00 H new ATOM 0 HG LEU A 76 21.053 21.928 27.778 1.00 0.00 H new ATOM 0 HD11 LEU A 76 19.197 21.047 26.339 1.00 0.00 H new ATOM 0 HD12 LEU A 76 18.895 20.746 28.067 1.00 0.00 H new ATOM 0 HD13 LEU A 76 18.045 22.067 27.233 1.00 0.00 H new ATOM 0 HD21 LEU A 76 20.368 22.989 25.586 1.00 0.00 H new ATOM 0 HD22 LEU A 76 19.263 24.061 26.479 1.00 0.00 H new ATOM 0 HD23 LEU A 76 21.020 24.194 26.723 1.00 0.00 H new ATOM 1218 N ARG A 77 21.517 24.052 32.062 1.00 0.00 N ATOM 1219 CA ARG A 77 21.470 25.055 33.142 1.00 0.00 C ATOM 1220 C ARG A 77 22.101 26.377 32.694 1.00 0.00 C ATOM 1221 O ARG A 77 23.165 26.397 32.081 1.00 0.00 O ATOM 1222 CB ARG A 77 22.076 24.468 34.433 1.00 0.00 C ATOM 1223 CG ARG A 77 22.067 25.477 35.593 1.00 0.00 C ATOM 1224 CD ARG A 77 22.362 24.823 36.952 1.00 0.00 C ATOM 1225 NE ARG A 77 21.126 24.335 37.599 1.00 0.00 N ATOM 1226 CZ ARG A 77 20.458 24.914 38.586 1.00 0.00 C ATOM 1227 NH1 ARG A 77 20.846 26.030 39.137 1.00 0.00 N ATOM 1228 NH2 ARG A 77 19.365 24.382 39.046 1.00 0.00 N ATOM 0 H ARG A 77 22.462 23.741 31.837 1.00 0.00 H new ATOM 0 HA ARG A 77 20.434 25.300 33.375 1.00 0.00 H new ATOM 0 HB2 ARG A 77 21.516 23.579 34.723 1.00 0.00 H new ATOM 0 HB3 ARG A 77 23.100 24.150 34.239 1.00 0.00 H new ATOM 0 HG2 ARG A 77 22.808 26.253 35.400 1.00 0.00 H new ATOM 0 HG3 ARG A 77 21.095 25.968 35.634 1.00 0.00 H new ATOM 0 HD2 ARG A 77 23.054 23.992 36.814 1.00 0.00 H new ATOM 0 HD3 ARG A 77 22.855 25.544 37.604 1.00 0.00 H new ATOM 0 HE ARG A 77 20.746 23.456 37.247 1.00 0.00 H new ATOM 0 HH11 ARG A 77 21.695 26.492 38.810 1.00 0.00 H new ATOM 0 HH12 ARG A 77 20.301 26.441 39.895 1.00 0.00 H new ATOM 0 HH21 ARG A 77 19.014 23.511 38.647 1.00 0.00 H new ATOM 0 HH22 ARG A 77 18.858 24.835 39.806 1.00 0.00 H new ATOM 1242 N VAL A 78 21.423 27.484 33.000 1.00 0.00 N ATOM 1243 CA VAL A 78 21.776 28.849 32.579 1.00 0.00 C ATOM 1244 C VAL A 78 21.427 29.828 33.699 1.00 0.00 C ATOM 1245 O VAL A 78 20.312 29.802 34.221 1.00 0.00 O ATOM 1246 CB VAL A 78 21.036 29.234 31.277 1.00 0.00 C ATOM 1247 CG1 VAL A 78 21.334 30.679 30.856 1.00 0.00 C ATOM 1248 CG2 VAL A 78 21.394 28.302 30.109 1.00 0.00 C ATOM 0 H VAL A 78 20.578 27.458 33.571 1.00 0.00 H new ATOM 0 HA VAL A 78 22.847 28.892 32.379 1.00 0.00 H new ATOM 0 HB VAL A 78 19.974 29.133 31.503 1.00 0.00 H new ATOM 0 HG11 VAL A 78 20.795 30.909 29.937 1.00 0.00 H new ATOM 0 HG12 VAL A 78 21.015 31.361 31.644 1.00 0.00 H new ATOM 0 HG13 VAL A 78 22.405 30.795 30.687 1.00 0.00 H new ATOM 0 HG21 VAL A 78 20.850 28.612 29.217 1.00 0.00 H new ATOM 0 HG22 VAL A 78 22.466 28.354 29.917 1.00 0.00 H new ATOM 0 HG23 VAL A 78 21.120 27.278 30.364 1.00 0.00 H new ATOM 1258 N GLU A 79 22.363 30.708 34.052 1.00 0.00 N ATOM 1259 CA GLU A 79 22.150 31.821 34.984 1.00 0.00 C ATOM 1260 C GLU A 79 23.153 32.947 34.688 1.00 0.00 C ATOM 1261 O GLU A 79 24.316 32.685 34.378 1.00 0.00 O ATOM 1262 CB GLU A 79 22.255 31.335 36.444 1.00 0.00 C ATOM 1263 CG GLU A 79 21.910 32.427 37.467 1.00 0.00 C ATOM 1264 CD GLU A 79 21.944 31.885 38.908 1.00 0.00 C ATOM 1265 OE1 GLU A 79 23.020 31.427 39.356 1.00 0.00 O ATOM 1266 OE2 GLU A 79 20.902 31.936 39.606 1.00 0.00 O ATOM 0 H GLU A 79 23.316 30.668 33.690 1.00 0.00 H new ATOM 0 HA GLU A 79 21.144 32.217 34.846 1.00 0.00 H new ATOM 0 HB2 GLU A 79 21.586 30.486 36.587 1.00 0.00 H new ATOM 0 HB3 GLU A 79 23.268 30.978 36.630 1.00 0.00 H new ATOM 0 HG2 GLU A 79 22.616 33.252 37.371 1.00 0.00 H new ATOM 0 HG3 GLU A 79 20.920 32.828 37.252 1.00 0.00 H new ATOM 1273 N VAL A 80 22.713 34.203 34.788 1.00 0.00 N ATOM 1274 CA VAL A 80 23.551 35.387 34.547 1.00 0.00 C ATOM 1275 C VAL A 80 23.746 36.189 35.849 1.00 0.00 C ATOM 1276 O VAL A 80 22.763 36.661 36.428 1.00 0.00 O ATOM 1277 CB VAL A 80 23.005 36.212 33.361 1.00 0.00 C ATOM 1278 CG1 VAL A 80 21.553 36.690 33.501 1.00 0.00 C ATOM 1279 CG2 VAL A 80 23.881 37.439 33.117 1.00 0.00 C ATOM 0 H VAL A 80 21.752 34.433 35.042 1.00 0.00 H new ATOM 0 HA VAL A 80 24.551 35.074 34.245 1.00 0.00 H new ATOM 0 HB VAL A 80 23.028 35.516 32.523 1.00 0.00 H new ATOM 0 HG11 VAL A 80 21.270 37.259 32.615 1.00 0.00 H new ATOM 0 HG12 VAL A 80 20.894 35.828 33.604 1.00 0.00 H new ATOM 0 HG13 VAL A 80 21.462 37.324 34.383 1.00 0.00 H new ATOM 0 HG21 VAL A 80 23.483 38.009 32.278 1.00 0.00 H new ATOM 0 HG22 VAL A 80 23.889 38.064 34.010 1.00 0.00 H new ATOM 0 HG23 VAL A 80 24.898 37.120 32.889 1.00 0.00 H new ATOM 1289 N PRO A 81 24.992 36.376 36.339 1.00 0.00 N ATOM 1290 CA PRO A 81 25.255 37.162 37.550 1.00 0.00 C ATOM 1291 C PRO A 81 25.089 38.677 37.329 1.00 0.00 C ATOM 1292 O PRO A 81 24.757 39.401 38.268 1.00 0.00 O ATOM 1293 CB PRO A 81 26.683 36.793 37.964 1.00 0.00 C ATOM 1294 CG PRO A 81 27.360 36.433 36.643 1.00 0.00 C ATOM 1295 CD PRO A 81 26.230 35.783 35.844 1.00 0.00 C ATOM 0 HA PRO A 81 24.532 36.930 38.332 1.00 0.00 H new ATOM 0 HB2 PRO A 81 27.185 37.625 38.458 1.00 0.00 H new ATOM 0 HB3 PRO A 81 26.694 35.955 38.661 1.00 0.00 H new ATOM 0 HG2 PRO A 81 27.756 37.315 36.139 1.00 0.00 H new ATOM 0 HG3 PRO A 81 28.195 35.749 36.791 1.00 0.00 H new ATOM 0 HD2 PRO A 81 26.351 35.968 34.777 1.00 0.00 H new ATOM 0 HD3 PRO A 81 26.227 34.702 35.982 1.00 0.00 H new ATOM 1303 N PHE A 82 25.253 39.159 36.090 1.00 0.00 N ATOM 1304 CA PHE A 82 24.997 40.550 35.683 1.00 0.00 C ATOM 1305 C PHE A 82 23.523 40.823 35.307 1.00 0.00 C ATOM 1306 O PHE A 82 23.233 41.721 34.516 1.00 0.00 O ATOM 1307 CB PHE A 82 26.025 40.984 34.617 1.00 0.00 C ATOM 1308 CG PHE A 82 26.001 40.253 33.281 1.00 0.00 C ATOM 1309 CD1 PHE A 82 25.132 40.667 32.251 1.00 0.00 C ATOM 1310 CD2 PHE A 82 26.896 39.192 33.041 1.00 0.00 C ATOM 1311 CE1 PHE A 82 25.143 40.022 31.004 1.00 0.00 C ATOM 1312 CE2 PHE A 82 26.913 38.557 31.787 1.00 0.00 C ATOM 1313 CZ PHE A 82 26.035 38.967 30.771 1.00 0.00 C ATOM 0 H PHE A 82 25.577 38.575 35.319 1.00 0.00 H new ATOM 0 HA PHE A 82 25.147 41.193 36.550 1.00 0.00 H new ATOM 0 HB2 PHE A 82 25.880 42.047 34.422 1.00 0.00 H new ATOM 0 HB3 PHE A 82 27.021 40.872 35.045 1.00 0.00 H new ATOM 0 HD1 PHE A 82 24.452 41.488 32.423 1.00 0.00 H new ATOM 0 HD2 PHE A 82 27.569 38.866 33.820 1.00 0.00 H new ATOM 0 HE1 PHE A 82 24.465 40.339 30.225 1.00 0.00 H new ATOM 0 HE2 PHE A 82 27.606 37.749 31.604 1.00 0.00 H new ATOM 0 HZ PHE A 82 26.047 38.470 29.812 1.00 0.00 H new ATOM 1323 N ASN A 83 22.568 40.075 35.883 1.00 0.00 N ATOM 1324 CA ASN A 83 21.115 40.239 35.660 1.00 0.00 C ATOM 1325 C ASN A 83 20.598 41.679 35.894 1.00 0.00 C ATOM 1326 O ASN A 83 19.579 42.069 35.315 1.00 0.00 O ATOM 1327 CB ASN A 83 20.334 39.234 36.527 1.00 0.00 C ATOM 1328 CG ASN A 83 20.696 39.272 38.002 1.00 0.00 C ATOM 1329 OD1 ASN A 83 20.313 40.169 38.740 1.00 0.00 O ATOM 1330 ND2 ASN A 83 21.440 38.296 38.467 1.00 0.00 N ATOM 0 H ASN A 83 22.786 39.320 36.533 1.00 0.00 H new ATOM 0 HA ASN A 83 20.943 40.035 34.603 1.00 0.00 H new ATOM 0 HB2 ASN A 83 19.267 39.432 36.421 1.00 0.00 H new ATOM 0 HB3 ASN A 83 20.511 38.228 36.147 1.00 0.00 H new ATOM 0 HD21 ASN A 83 21.704 38.281 39.452 1.00 0.00 H new ATOM 0 HD22 ASN A 83 21.754 37.553 37.843 1.00 0.00 H new ATOM 1337 N ALA A 84 21.325 42.487 36.672 1.00 0.00 N ATOM 1338 CA ALA A 84 21.316 43.946 36.614 1.00 0.00 C ATOM 1339 C ALA A 84 22.764 44.485 36.614 1.00 0.00 C ATOM 1340 O ALA A 84 23.673 43.837 37.145 1.00 0.00 O ATOM 1341 CB ALA A 84 20.476 44.497 37.773 1.00 0.00 C ATOM 0 H ALA A 84 21.959 42.126 37.385 1.00 0.00 H new ATOM 0 HA ALA A 84 20.855 44.285 35.687 1.00 0.00 H new ATOM 0 HB1 ALA A 84 20.468 45.586 37.731 1.00 0.00 H new ATOM 0 HB2 ALA A 84 19.455 44.124 37.692 1.00 0.00 H new ATOM 0 HB3 ALA A 84 20.907 44.173 38.721 1.00 0.00 H new ATOM 1347 N ARG A 85 22.985 45.671 36.024 1.00 0.00 N ATOM 1348 CA ARG A 85 24.313 46.309 35.913 1.00 0.00 C ATOM 1349 C ARG A 85 24.900 46.707 37.279 1.00 0.00 C ATOM 1350 O ARG A 85 26.117 46.669 37.469 1.00 0.00 O ATOM 1351 CB ARG A 85 24.195 47.547 35.000 1.00 0.00 C ATOM 1352 CG ARG A 85 25.555 48.054 34.483 1.00 0.00 C ATOM 1353 CD ARG A 85 25.464 49.497 33.968 1.00 0.00 C ATOM 1354 NE ARG A 85 25.328 50.455 35.086 1.00 0.00 N ATOM 1355 CZ ARG A 85 24.971 51.726 35.013 1.00 0.00 C ATOM 1356 NH1 ARG A 85 24.690 52.307 33.882 1.00 0.00 N ATOM 1357 NH2 ARG A 85 24.893 52.447 36.094 1.00 0.00 N ATOM 0 H ARG A 85 22.238 46.224 35.604 1.00 0.00 H new ATOM 0 HA ARG A 85 25.001 45.580 35.484 1.00 0.00 H new ATOM 0 HB2 ARG A 85 23.559 47.303 34.149 1.00 0.00 H new ATOM 0 HB3 ARG A 85 23.701 48.349 35.549 1.00 0.00 H new ATOM 0 HG2 ARG A 85 26.292 47.999 35.284 1.00 0.00 H new ATOM 0 HG3 ARG A 85 25.906 47.403 33.682 1.00 0.00 H new ATOM 0 HD2 ARG A 85 26.355 49.736 33.387 1.00 0.00 H new ATOM 0 HD3 ARG A 85 24.611 49.593 33.297 1.00 0.00 H new ATOM 0 HE ARG A 85 25.533 50.095 36.018 1.00 0.00 H new ATOM 0 HH11 ARG A 85 24.742 51.779 33.011 1.00 0.00 H new ATOM 0 HH12 ARG A 85 24.418 53.290 33.867 1.00 0.00 H new ATOM 0 HH21 ARG A 85 25.108 52.032 37.001 1.00 0.00 H new ATOM 0 HH22 ARG A 85 24.617 53.427 36.034 1.00 0.00 H new ATOM 1371 N GLU A 86 24.034 47.092 38.221 1.00 0.00 N ATOM 1372 CA GLU A 86 24.361 47.605 39.565 1.00 0.00 C ATOM 1373 C GLU A 86 23.310 47.195 40.613 1.00 0.00 C ATOM 1374 O GLU A 86 23.716 46.769 41.720 1.00 0.00 O ATOM 1375 CB GLU A 86 24.550 49.134 39.481 1.00 0.00 C ATOM 1376 CG GLU A 86 25.016 49.803 40.789 1.00 0.00 C ATOM 1377 CD GLU A 86 23.873 50.153 41.771 1.00 0.00 C ATOM 1378 OE1 GLU A 86 22.948 50.922 41.402 1.00 0.00 O ATOM 1379 OE2 GLU A 86 23.910 49.695 42.941 1.00 0.00 O ATOM 1380 OXT GLU A 86 22.096 47.296 40.329 1.00 0.00 O ATOM 0 H GLU A 86 23.027 47.054 38.062 1.00 0.00 H new ATOM 0 HA GLU A 86 25.294 47.155 39.905 1.00 0.00 H new ATOM 0 HB2 GLU A 86 25.277 49.353 38.699 1.00 0.00 H new ATOM 0 HB3 GLU A 86 23.606 49.586 39.175 1.00 0.00 H new ATOM 0 HG2 GLU A 86 25.720 49.139 41.291 1.00 0.00 H new ATOM 0 HG3 GLU A 86 25.559 50.715 40.543 1.00 0.00 H new TER 1387 GLU A 86 ATOM 1388 O5' A B 101 23.127 24.576 43.254 1.00 0.00 O ATOM 1389 C5' A B 101 23.316 24.502 41.842 1.00 0.00 C ATOM 1390 C4' A B 101 24.489 25.364 41.341 1.00 0.00 C ATOM 1391 O4' A B 101 24.204 26.762 41.448 1.00 0.00 O ATOM 1392 C3' A B 101 25.803 25.087 42.109 1.00 0.00 C ATOM 1393 O3' A B 101 26.909 25.022 41.218 1.00 0.00 O ATOM 1394 C2' A B 101 25.889 26.340 42.997 1.00 0.00 C ATOM 1395 O2' A B 101 27.196 26.649 43.484 1.00 0.00 O ATOM 1396 C1' A B 101 25.348 27.377 42.017 1.00 0.00 C ATOM 1397 N9 A B 101 25.059 28.703 42.627 1.00 0.00 N ATOM 1398 C8 A B 101 25.613 29.911 42.281 1.00 0.00 C ATOM 1399 N7 A B 101 25.180 30.932 42.973 1.00 0.00 N ATOM 1400 C5 A B 101 24.244 30.346 43.841 1.00 0.00 C ATOM 1401 C6 A B 101 23.384 30.837 44.858 1.00 0.00 C ATOM 1402 N6 A B 101 23.281 32.100 45.231 1.00 0.00 N ATOM 1403 N1 A B 101 22.581 30.022 45.545 1.00 0.00 N ATOM 1404 C2 A B 101 22.617 28.729 45.245 1.00 0.00 C ATOM 1405 N3 A B 101 23.363 28.123 44.326 1.00 0.00 N ATOM 1406 C4 A B 101 24.165 28.991 43.642 1.00 0.00 C ATOM 0 H5' A B 101 22.401 24.820 41.342 1.00 0.00 H new ATOM 0 H5'' A B 101 23.490 23.464 41.559 1.00 0.00 H new ATOM 0 H4' A B 101 24.619 25.086 40.295 1.00 0.00 H new ATOM 0 H3' A B 101 25.819 24.142 42.653 1.00 0.00 H new ATOM 0 H2' A B 101 25.348 26.253 43.939 1.00 0.00 H new ATOM 0 HO2' A B 101 27.867 26.202 42.926 1.00 0.00 H new ATOM 0 HO5' A B 101 22.369 24.011 43.513 1.00 0.00 H new ATOM 0 H1' A B 101 26.095 27.633 41.265 1.00 0.00 H new ATOM 0 H8 A B 101 26.350 30.010 41.497 1.00 0.00 H new ATOM 0 H61 A B 101 22.633 32.361 45.974 1.00 0.00 H new ATOM 0 H62 A B 101 23.849 32.814 44.776 1.00 0.00 H new ATOM 0 H2 A B 101 21.960 28.091 45.818 1.00 0.00 H new ATOM 1419 P C B 102 27.257 23.691 40.393 1.00 0.00 P ATOM 1420 OP1 C B 102 26.116 23.352 39.513 1.00 0.00 O ATOM 1421 OP2 C B 102 27.775 22.677 41.340 1.00 0.00 O ATOM 1422 O5' C B 102 28.478 24.218 39.487 1.00 0.00 O ATOM 1423 C5' C B 102 28.279 25.290 38.580 1.00 0.00 C ATOM 1424 C4' C B 102 29.594 25.979 38.173 1.00 0.00 C ATOM 1425 O4' C B 102 29.287 27.237 37.575 1.00 0.00 O ATOM 1426 C3' C B 102 30.532 26.287 39.348 1.00 0.00 C ATOM 1427 O3' C B 102 31.855 26.351 38.810 1.00 0.00 O ATOM 1428 C2' C B 102 29.909 27.617 39.820 1.00 0.00 C ATOM 1429 O2' C B 102 30.733 28.402 40.675 1.00 0.00 O ATOM 1430 C1' C B 102 29.603 28.292 38.477 1.00 0.00 C ATOM 1431 N1 C B 102 28.500 29.295 38.570 1.00 0.00 N ATOM 1432 C2 C B 102 28.826 30.658 38.678 1.00 0.00 C ATOM 1433 O2 C B 102 29.992 31.044 38.651 1.00 0.00 O ATOM 1434 N3 C B 102 27.851 31.591 38.830 1.00 0.00 N ATOM 1435 C4 C B 102 26.596 31.195 38.853 1.00 0.00 C ATOM 1436 N4 C B 102 25.706 32.127 39.040 1.00 0.00 N ATOM 1437 C5 C B 102 26.200 29.838 38.730 1.00 0.00 C ATOM 1438 C6 C B 102 27.181 28.915 38.571 1.00 0.00 C ATOM 0 H5' C B 102 27.614 26.025 39.034 1.00 0.00 H new ATOM 0 H5'' C B 102 27.778 24.916 37.687 1.00 0.00 H new ATOM 0 H4' C B 102 30.097 25.282 37.503 1.00 0.00 H new ATOM 0 H3' C B 102 30.621 25.586 40.178 1.00 0.00 H new ATOM 0 H2' C B 102 29.041 27.474 40.464 1.00 0.00 H new ATOM 0 HO2' C B 102 31.674 28.177 40.520 1.00 0.00 H new ATOM 0 H1' C B 102 30.462 28.868 38.133 1.00 0.00 H new ATOM 0 H41 C B 102 24.715 31.887 39.068 1.00 0.00 H new ATOM 0 H42 C B 102 26.000 33.097 39.158 1.00 0.00 H new ATOM 0 H5 C B 102 25.159 29.552 38.762 1.00 0.00 H new ATOM 0 H6 C B 102 26.923 27.874 38.444 1.00 0.00 H new ATOM 1450 P A B 103 33.163 26.025 39.693 1.00 0.00 P ATOM 1451 OP1 A B 103 34.204 25.520 38.763 1.00 0.00 O ATOM 1452 OP2 A B 103 32.784 25.165 40.844 1.00 0.00 O ATOM 1453 O5' A B 103 33.631 27.454 40.283 1.00 0.00 O ATOM 1454 C5' A B 103 34.959 27.953 40.181 1.00 0.00 C ATOM 1455 C4' A B 103 35.399 28.393 38.769 1.00 0.00 C ATOM 1456 O4' A B 103 34.396 29.182 38.128 1.00 0.00 O ATOM 1457 C3' A B 103 36.680 29.247 38.880 1.00 0.00 C ATOM 1458 O3' A B 103 37.572 28.941 37.806 1.00 0.00 O ATOM 1459 C2' A B 103 36.068 30.657 38.854 1.00 0.00 C ATOM 1460 O2' A B 103 36.933 31.727 38.491 1.00 0.00 O ATOM 1461 C1' A B 103 34.940 30.458 37.846 1.00 0.00 C ATOM 1462 N9 A B 103 33.908 31.527 37.895 1.00 0.00 N ATOM 1463 C8 A B 103 33.450 32.277 36.837 1.00 0.00 C ATOM 1464 N7 A B 103 32.572 33.192 37.155 1.00 0.00 N ATOM 1465 C5 A B 103 32.419 33.011 38.540 1.00 0.00 C ATOM 1466 C6 A B 103 31.639 33.634 39.550 1.00 0.00 C ATOM 1467 N6 A B 103 30.805 34.640 39.365 1.00 0.00 N ATOM 1468 N1 A B 103 31.720 33.260 40.829 1.00 0.00 N ATOM 1469 C2 A B 103 32.541 32.258 41.122 1.00 0.00 C ATOM 1470 N3 A B 103 33.330 31.579 40.297 1.00 0.00 N ATOM 1471 C4 A B 103 33.224 31.998 38.999 1.00 0.00 C ATOM 0 H5' A B 103 35.645 27.183 40.532 1.00 0.00 H new ATOM 0 H5'' A B 103 35.061 28.803 40.855 1.00 0.00 H new ATOM 0 H4' A B 103 35.572 27.493 38.179 1.00 0.00 H new ATOM 0 H3' A B 103 37.310 29.091 39.756 1.00 0.00 H new ATOM 0 H2' A B 103 35.772 30.985 39.851 1.00 0.00 H new ATOM 0 HO2' A B 103 37.846 31.388 38.385 1.00 0.00 H new ATOM 0 H1' A B 103 35.327 30.517 36.829 1.00 0.00 H new ATOM 0 H8 A B 103 33.789 32.122 35.823 1.00 0.00 H new ATOM 0 H61 A B 103 30.285 35.024 40.155 1.00 0.00 H new ATOM 0 H62 A B 103 30.680 35.034 38.432 1.00 0.00 H new ATOM 0 H2 A B 103 32.571 31.958 42.159 1.00 0.00 H new ATOM 1483 P U B 104 39.160 28.913 38.060 1.00 0.00 P ATOM 1484 OP1 U B 104 39.809 28.364 36.845 1.00 0.00 O ATOM 1485 OP2 U B 104 39.412 28.231 39.354 1.00 0.00 O ATOM 1486 O5' U B 104 39.565 30.464 38.234 1.00 0.00 O ATOM 1487 C5' U B 104 40.328 31.201 37.288 1.00 0.00 C ATOM 1488 C4' U B 104 39.767 31.281 35.856 1.00 0.00 C ATOM 1489 O4' U B 104 38.481 31.873 35.684 1.00 0.00 O ATOM 1490 C3' U B 104 40.710 32.125 34.995 1.00 0.00 C ATOM 1491 O3' U B 104 41.797 31.351 34.502 1.00 0.00 O ATOM 1492 C2' U B 104 39.804 32.608 33.859 1.00 0.00 C ATOM 1493 O2' U B 104 40.092 31.968 32.627 1.00 0.00 O ATOM 1494 C1' U B 104 38.411 32.147 34.292 1.00 0.00 C ATOM 1495 N1 U B 104 37.343 33.056 33.784 1.00 0.00 N ATOM 1496 C2 U B 104 37.207 34.358 34.291 1.00 0.00 C ATOM 1497 O2 U B 104 37.749 34.770 35.316 1.00 0.00 O ATOM 1498 N3 U B 104 36.386 35.218 33.591 1.00 0.00 N ATOM 1499 C4 U B 104 35.637 34.890 32.488 1.00 0.00 C ATOM 1500 O4 U B 104 34.929 35.733 31.959 1.00 0.00 O ATOM 1501 C5 U B 104 35.762 33.518 32.064 1.00 0.00 C ATOM 1502 C6 U B 104 36.577 32.645 32.712 1.00 0.00 C ATOM 0 H5' U B 104 41.324 30.762 37.239 1.00 0.00 H new ATOM 0 H5'' U B 104 40.446 32.217 37.664 1.00 0.00 H new ATOM 0 H4' U B 104 39.677 30.232 35.573 1.00 0.00 H new ATOM 0 H3' U B 104 41.175 32.942 35.546 1.00 0.00 H new ATOM 0 H2' U B 104 39.920 33.680 33.702 1.00 0.00 H new ATOM 0 HO2' U B 104 40.882 31.398 32.731 1.00 0.00 H new ATOM 0 H1' U B 104 38.094 31.213 33.828 1.00 0.00 H new ATOM 0 H3 U B 104 36.331 36.181 33.922 1.00 0.00 H new ATOM 0 H5 U B 104 35.195 33.176 31.211 1.00 0.00 H new ATOM 0 H6 U B 104 36.626 31.617 32.384 1.00 0.00 H new ATOM 1513 P C B 105 43.270 31.971 34.434 1.00 0.00 P ATOM 1514 OP1 C B 105 43.150 33.428 34.193 1.00 0.00 O ATOM 1515 OP2 C B 105 44.071 31.128 33.514 1.00 0.00 O ATOM 1516 O5' C B 105 43.758 31.700 35.944 1.00 0.00 O ATOM 1517 C5' C B 105 44.660 32.551 36.642 1.00 0.00 C ATOM 1518 C4' C B 105 46.106 32.496 36.110 1.00 0.00 C ATOM 1519 O4' C B 105 46.236 33.237 34.896 1.00 0.00 O ATOM 1520 C3' C B 105 47.074 33.100 37.138 1.00 0.00 C ATOM 1521 O3' C B 105 48.237 32.290 37.255 1.00 0.00 O ATOM 1522 C2' C B 105 47.377 34.493 36.567 1.00 0.00 C ATOM 1523 O2' C B 105 48.705 34.959 36.780 1.00 0.00 O ATOM 1524 C1' C B 105 47.136 34.323 35.068 1.00 0.00 C ATOM 1525 N1 C B 105 46.611 35.579 34.457 1.00 0.00 N ATOM 1526 C2 C B 105 47.413 36.298 33.557 1.00 0.00 C ATOM 1527 O2 C B 105 48.496 35.862 33.156 1.00 0.00 O ATOM 1528 N3 C B 105 47.003 37.503 33.081 1.00 0.00 N ATOM 1529 C4 C B 105 45.839 37.976 33.479 1.00 0.00 C ATOM 1530 N4 C B 105 45.502 39.146 33.007 1.00 0.00 N ATOM 1531 C5 C B 105 44.963 37.276 34.352 1.00 0.00 C ATOM 1532 C6 C B 105 45.379 36.070 34.814 1.00 0.00 C ATOM 0 H5' C B 105 44.660 32.277 37.697 1.00 0.00 H new ATOM 0 H5'' C B 105 44.299 33.577 36.579 1.00 0.00 H new ATOM 0 H4' C B 105 46.345 31.448 35.928 1.00 0.00 H new ATOM 0 H3' C B 105 46.669 33.159 38.148 1.00 0.00 H new ATOM 0 H2' C B 105 46.754 35.238 37.062 1.00 0.00 H new ATOM 0 HO2' C B 105 48.704 35.938 36.831 1.00 0.00 H new ATOM 0 H1' C B 105 48.075 34.109 34.557 1.00 0.00 H new ATOM 0 H41 C B 105 44.613 39.568 33.276 1.00 0.00 H new ATOM 0 H42 C B 105 46.128 39.638 32.369 1.00 0.00 H new ATOM 0 H5 C B 105 44.006 37.687 34.636 1.00 0.00 H new ATOM 0 H6 C B 105 44.739 35.494 35.465 1.00 0.00 H new ATOM 1544 P A B 106 48.822 31.888 38.695 1.00 0.00 P ATOM 1545 OP1 A B 106 49.990 31.005 38.465 1.00 0.00 O ATOM 1546 OP2 A B 106 47.703 31.386 39.527 1.00 0.00 O ATOM 1547 O5' A B 106 49.371 33.266 39.330 1.00 0.00 O ATOM 1548 C5' A B 106 48.530 34.162 40.048 1.00 0.00 C ATOM 1549 C4' A B 106 49.299 35.413 40.502 1.00 0.00 C ATOM 1550 O4' A B 106 49.984 36.010 39.399 1.00 0.00 O ATOM 1551 C3' A B 106 48.344 36.475 41.073 1.00 0.00 C ATOM 1552 O3' A B 106 48.943 37.126 42.193 1.00 0.00 O ATOM 1553 C2' A B 106 48.190 37.433 39.883 1.00 0.00 C ATOM 1554 O2' A B 106 47.784 38.748 40.269 1.00 0.00 O ATOM 1555 C1' A B 106 49.604 37.377 39.306 1.00 0.00 C ATOM 1556 N9 A B 106 49.742 37.867 37.910 1.00 0.00 N ATOM 1557 C8 A B 106 48.776 38.115 36.958 1.00 0.00 C ATOM 1558 N7 A B 106 49.239 38.566 35.818 1.00 0.00 N ATOM 1559 C5 A B 106 50.625 38.615 36.039 1.00 0.00 C ATOM 1560 C6 A B 106 51.756 38.991 35.264 1.00 0.00 C ATOM 1561 N6 A B 106 51.721 39.407 34.008 1.00 0.00 N ATOM 1562 N1 A B 106 52.990 38.951 35.765 1.00 0.00 N ATOM 1563 C2 A B 106 53.132 38.547 37.023 1.00 0.00 C ATOM 1564 N3 A B 106 52.180 38.159 37.871 1.00 0.00 N ATOM 1565 C4 A B 106 50.938 38.208 37.310 1.00 0.00 C ATOM 0 H5' A B 106 48.113 33.654 40.918 1.00 0.00 H new ATOM 0 H5'' A B 106 47.690 34.458 39.419 1.00 0.00 H new ATOM 0 H4' A B 106 50.005 35.089 41.267 1.00 0.00 H new ATOM 0 H3' A B 106 47.395 36.082 41.438 1.00 0.00 H new ATOM 0 H2' A B 106 47.406 37.159 39.177 1.00 0.00 H new ATOM 0 HO2' A B 106 47.842 39.348 39.497 1.00 0.00 H new ATOM 0 HO3' A B 106 48.749 38.086 42.156 1.00 0.00 H new ATOM 0 H1' A B 106 50.246 38.053 39.870 1.00 0.00 H new ATOM 0 H8 A B 106 47.724 37.951 37.137 1.00 0.00 H new ATOM 0 H61 A B 106 52.586 39.657 33.529 1.00 0.00 H new ATOM 0 H62 A B 106 50.829 39.478 33.519 1.00 0.00 H new ATOM 0 H2 A B 106 54.142 38.531 37.405 1.00 0.00 H new TER 1578 A B 106