USER MOD reduce.3.24.130724 H: found=0, std=0, add=853, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 850 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 10 SER OG : rot -153:sc= 1.08 USER MOD Set 1.2: A 16 THR OG1 : rot 180:sc= 0.987 USER MOD Set 1.3: A 59 GLN : amide:sc= -3.48! X(o=-0.14!,f=-0.31) USER MOD Set 1.4: A 84 TYR OH : rot -20:sc= 1.27 USER MOD Set 2.1: A 29 LYS NZ :NH3+ 153:sc= 0.212 (180deg=0) USER MOD Set 2.2: A 30 TYR OH : rot 30:sc= 0.202 USER MOD Single : A 1 MET CE :methyl 179:sc= 0 (180deg=-0.000514) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 HIS :FLIP no HD1:sc= -0.164 F(o=-1.1,f=-0.16) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= -0.343 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 72:sc= -4.04! USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 25:sc= 0.277 USER MOD Single : A 22 LYS NZ :NH3+ -139:sc= 0 (180deg=-1.4!) USER MOD Single : A 23 MET CE :methyl -169:sc= -9.28! (180deg=-9.64!) USER MOD Single : A 26 GLN : amide:sc= -15.3! C(o=-15!,f=-28!) USER MOD Single : A 42 THR OG1 : rot 30:sc= 0.574! USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 1.02 K(o=1,f=-0.97) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 62 TYR OH : rot 22:sc= 0.181 USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -2.98! C(o=-3!,f=-6.6!) USER MOD Single : A 73 ASN :FLIP amide:sc= -0.207 F(o=-1.6,f=-0.21) USER MOD Single : A 74 LYS NZ :NH3+ 173:sc= -0.968 (180deg=-1.02) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -0.203 X(o=-0.2,f=-0.027) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.439 16.865 8.609 1.00 0.00 N ATOM 2 CA MET A 1 8.050 16.413 9.916 1.00 0.00 C ATOM 3 C MET A 1 6.984 15.731 10.788 1.00 0.00 C ATOM 4 O MET A 1 6.142 16.338 11.389 1.00 0.00 O ATOM 5 CB MET A 1 8.635 17.649 10.632 1.00 0.00 C ATOM 6 CG MET A 1 9.957 17.297 11.365 1.00 0.00 C ATOM 7 SD MET A 1 11.152 18.677 11.408 1.00 0.00 S ATOM 8 CE MET A 1 10.242 19.807 12.490 1.00 0.00 C ATOM 0 H1 MET A 1 8.167 17.325 8.026 1.00 0.00 H new ATOM 0 H2 MET A 1 7.058 16.042 8.101 1.00 0.00 H new ATOM 0 H3 MET A 1 6.671 17.540 8.800 1.00 0.00 H new ATOM 0 HA MET A 1 8.844 15.689 9.732 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.818 18.441 9.906 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.910 18.035 11.349 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.728 16.993 12.386 1.00 0.00 H new ATOM 0 HG3 MET A 1 10.419 16.441 10.874 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.830 20.711 12.649 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.291 20.069 12.025 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.056 19.322 13.448 1.00 0.00 H new ATOM 18 N GLU A 2 7.041 14.358 10.781 1.00 0.00 N ATOM 19 CA GLU A 2 6.150 13.487 11.535 1.00 0.00 C ATOM 20 C GLU A 2 6.176 12.036 10.984 1.00 0.00 C ATOM 21 O GLU A 2 5.889 11.073 11.708 1.00 0.00 O ATOM 22 CB GLU A 2 4.707 14.000 11.562 1.00 0.00 C ATOM 23 CG GLU A 2 4.303 14.531 12.946 1.00 0.00 C ATOM 24 CD GLU A 2 2.740 14.543 13.127 1.00 0.00 C ATOM 25 OE1 GLU A 2 2.164 13.549 12.658 1.00 0.00 O ATOM 26 OE2 GLU A 2 2.252 15.534 13.730 1.00 0.00 O ATOM 0 H GLU A 2 7.730 13.843 10.232 1.00 0.00 H new ATOM 0 HA GLU A 2 6.525 13.489 12.558 1.00 0.00 H new ATOM 0 HB2 GLU A 2 4.592 14.793 10.823 1.00 0.00 H new ATOM 0 HB3 GLU A 2 4.032 13.195 11.273 1.00 0.00 H new ATOM 0 HG2 GLU A 2 4.755 13.911 13.720 1.00 0.00 H new ATOM 0 HG3 GLU A 2 4.693 15.540 13.077 1.00 0.00 H new ATOM 33 N LYS A 3 6.449 11.905 9.656 1.00 0.00 N ATOM 34 CA LYS A 3 6.446 10.631 8.937 1.00 0.00 C ATOM 35 C LYS A 3 5.124 10.357 8.206 1.00 0.00 C ATOM 36 O LYS A 3 4.034 10.355 8.826 1.00 0.00 O ATOM 37 CB LYS A 3 6.842 9.449 9.801 1.00 0.00 C ATOM 38 CG LYS A 3 8.183 9.739 10.505 1.00 0.00 C ATOM 39 CD LYS A 3 9.359 10.017 9.542 1.00 0.00 C ATOM 40 CE LYS A 3 10.553 9.133 9.968 1.00 0.00 C ATOM 41 NZ LYS A 3 11.220 9.710 11.151 1.00 0.00 N ATOM 0 H LYS A 3 6.678 12.701 9.061 1.00 0.00 H new ATOM 0 HA LYS A 3 7.221 10.744 8.179 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.067 9.253 10.542 1.00 0.00 H new ATOM 0 HB3 LYS A 3 6.930 8.552 9.188 1.00 0.00 H new ATOM 0 HG2 LYS A 3 8.056 10.599 11.163 1.00 0.00 H new ATOM 0 HG3 LYS A 3 8.439 8.889 11.137 1.00 0.00 H new ATOM 0 HD2 LYS A 3 9.069 9.795 8.515 1.00 0.00 H new ATOM 0 HD3 LYS A 3 9.636 11.071 9.575 1.00 0.00 H new ATOM 0 HE2 LYS A 3 10.206 8.125 10.193 1.00 0.00 H new ATOM 0 HE3 LYS A 3 11.264 9.049 9.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.021 9.106 11.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 11.568 10.663 10.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 10.542 9.768 11.938 1.00 0.00 H new ATOM 55 N LYS A 4 5.236 10.146 6.899 1.00 0.00 N ATOM 56 CA LYS A 4 4.081 9.737 6.021 1.00 0.00 C ATOM 57 C LYS A 4 3.931 8.196 6.082 1.00 0.00 C ATOM 58 O LYS A 4 4.808 7.504 6.618 1.00 0.00 O ATOM 59 CB LYS A 4 4.309 10.209 4.594 1.00 0.00 C ATOM 60 CG LYS A 4 3.445 11.437 4.257 1.00 0.00 C ATOM 61 CD LYS A 4 3.461 11.862 2.776 1.00 0.00 C ATOM 62 CE LYS A 4 3.250 13.388 2.706 1.00 0.00 C ATOM 63 NZ LYS A 4 4.578 14.066 2.772 1.00 0.00 N ATOM 0 H LYS A 4 6.116 10.246 6.394 1.00 0.00 H new ATOM 0 HA LYS A 4 3.161 10.200 6.377 1.00 0.00 H new ATOM 0 HB2 LYS A 4 5.362 10.455 4.456 1.00 0.00 H new ATOM 0 HB3 LYS A 4 4.078 9.400 3.901 1.00 0.00 H new ATOM 0 HG2 LYS A 4 2.415 11.228 4.548 1.00 0.00 H new ATOM 0 HG3 LYS A 4 3.783 12.277 4.864 1.00 0.00 H new ATOM 0 HD2 LYS A 4 4.409 11.588 2.313 1.00 0.00 H new ATOM 0 HD3 LYS A 4 2.676 11.345 2.224 1.00 0.00 H new ATOM 0 HE2 LYS A 4 2.737 13.655 1.782 1.00 0.00 H new ATOM 0 HE3 LYS A 4 2.617 13.719 3.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 4.444 15.096 2.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 5.050 13.818 3.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 5.166 13.757 1.972 1.00 0.00 H new ATOM 77 N HIS A 5 2.782 7.706 5.597 1.00 0.00 N ATOM 78 CA HIS A 5 2.388 6.286 5.634 1.00 0.00 C ATOM 79 C HIS A 5 1.854 5.798 4.278 1.00 0.00 C ATOM 80 O HIS A 5 0.754 6.151 3.818 1.00 0.00 O ATOM 81 CB HIS A 5 1.352 6.061 6.753 1.00 0.00 C ATOM 82 CG HIS A 5 1.637 6.891 8.020 1.00 0.00 C ATOM 83 ND1 HIS A 5 2.776 6.825 8.741 1.00 0.00 N flip ATOM 84 CD2 HIS A 5 0.846 7.810 8.559 1.00 0.00 C flip ATOM 85 CE1 HIS A 5 2.582 7.641 9.813 1.00 0.00 C flip ATOM 86 NE2 HIS A 5 1.537 8.438 9.549 1.00 0.00 N flip ATOM 0 H HIS A 5 2.080 8.300 5.156 1.00 0.00 H new ATOM 0 HA HIS A 5 3.278 5.695 5.849 1.00 0.00 H new ATOM 0 HB2 HIS A 5 0.360 6.313 6.377 1.00 0.00 H new ATOM 0 HB3 HIS A 5 1.334 5.003 7.016 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -0.171 8.023 8.263 1.00 0.00 H new ATOM 0 HE1 HIS A 5 3.169 7.646 10.720 1.00 0.00 H new ATOM 0 HE2 HIS A 5 1.308 9.326 9.995 1.00 0.00 H new ATOM 94 N ILE A 6 2.657 4.874 3.671 1.00 0.00 N ATOM 95 CA ILE A 6 2.237 3.870 2.671 1.00 0.00 C ATOM 96 C ILE A 6 1.540 2.706 3.428 1.00 0.00 C ATOM 97 O ILE A 6 2.135 1.742 3.838 1.00 0.00 O ATOM 98 CB ILE A 6 3.474 3.348 1.873 1.00 0.00 C ATOM 99 CG1 ILE A 6 4.237 4.474 1.164 1.00 0.00 C ATOM 100 CG2 ILE A 6 3.066 2.224 0.883 1.00 0.00 C ATOM 101 CD1 ILE A 6 5.350 4.057 0.189 1.00 0.00 C ATOM 0 H ILE A 6 3.653 4.814 3.881 1.00 0.00 H new ATOM 0 HA ILE A 6 1.547 4.314 1.953 1.00 0.00 H new ATOM 0 HB ILE A 6 4.164 2.922 2.602 1.00 0.00 H new ATOM 0 HG12 ILE A 6 3.515 5.079 0.615 1.00 0.00 H new ATOM 0 HG13 ILE A 6 4.678 5.117 1.926 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.947 1.879 0.341 1.00 0.00 H new ATOM 0 HG22 ILE A 6 2.632 1.392 1.437 1.00 0.00 H new ATOM 0 HG23 ILE A 6 2.333 2.611 0.175 1.00 0.00 H new ATOM 0 HD11 ILE A 6 5.808 4.947 -0.243 1.00 0.00 H new ATOM 0 HD12 ILE A 6 6.106 3.483 0.724 1.00 0.00 H new ATOM 0 HD13 ILE A 6 4.926 3.445 -0.607 1.00 0.00 H new ATOM 113 N TYR A 7 0.189 2.888 3.575 1.00 0.00 N ATOM 114 CA TYR A 7 -0.792 1.901 3.918 1.00 0.00 C ATOM 115 C TYR A 7 -1.361 1.186 2.685 1.00 0.00 C ATOM 116 O TYR A 7 -1.655 1.828 1.644 1.00 0.00 O ATOM 117 CB TYR A 7 -1.907 2.413 4.823 1.00 0.00 C ATOM 118 CG TYR A 7 -1.515 2.631 6.287 1.00 0.00 C ATOM 119 CD1 TYR A 7 -0.190 2.555 6.708 1.00 0.00 C ATOM 120 CD2 TYR A 7 -2.541 2.852 7.204 1.00 0.00 C ATOM 121 CE1 TYR A 7 0.185 3.128 7.925 1.00 0.00 C ATOM 122 CE2 TYR A 7 -2.199 3.418 8.437 1.00 0.00 C ATOM 123 CZ TYR A 7 -0.862 3.487 8.829 1.00 0.00 C ATOM 124 OH TYR A 7 -0.528 3.884 10.089 1.00 0.00 O ATOM 0 H TYR A 7 -0.234 3.806 3.439 1.00 0.00 H new ATOM 0 HA TYR A 7 -0.243 1.167 4.508 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.276 3.356 4.419 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.735 1.705 4.788 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.545 2.055 6.095 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -3.564 2.595 6.971 1.00 0.00 H new ATOM 0 HE1 TYR A 7 1.223 3.293 8.173 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -2.972 3.802 9.087 1.00 0.00 H new ATOM 0 HH TYR A 7 -1.342 4.098 10.591 1.00 0.00 H new ATOM 134 N LEU A 8 -1.501 -0.127 2.824 1.00 0.00 N ATOM 135 CA LEU A 8 -1.672 -1.105 1.702 1.00 0.00 C ATOM 136 C LEU A 8 -2.381 -2.342 2.352 1.00 0.00 C ATOM 137 O LEU A 8 -1.964 -2.877 3.329 1.00 0.00 O ATOM 138 CB LEU A 8 -0.118 -1.500 1.541 1.00 0.00 C ATOM 139 CG LEU A 8 0.183 -2.855 0.945 1.00 0.00 C ATOM 140 CD1 LEU A 8 1.523 -2.943 0.144 1.00 0.00 C ATOM 141 CD2 LEU A 8 -0.002 -3.978 1.951 1.00 0.00 C ATOM 0 H LEU A 8 -1.502 -0.577 3.740 1.00 0.00 H new ATOM 0 HA LEU A 8 -2.200 -0.783 0.805 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.363 -0.742 0.922 1.00 0.00 H new ATOM 0 HB3 LEU A 8 0.349 -1.451 2.525 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.575 -2.998 0.175 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.649 -3.954 -0.244 1.00 0.00 H new ATOM 0 HD12 LEU A 8 1.498 -2.236 -0.686 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.357 -2.700 0.802 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.226 -4.933 1.477 1.00 0.00 H new ATOM 0 HD22 LEU A 8 0.669 -3.824 2.796 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.034 -3.985 2.303 1.00 0.00 H new ATOM 153 N PHE A 9 -3.529 -2.688 1.719 1.00 0.00 N ATOM 154 CA PHE A 9 -4.709 -3.336 2.390 1.00 0.00 C ATOM 155 C PHE A 9 -5.092 -4.609 1.669 1.00 0.00 C ATOM 156 O PHE A 9 -5.503 -4.590 0.480 1.00 0.00 O ATOM 157 CB PHE A 9 -5.826 -2.270 2.436 1.00 0.00 C ATOM 158 CG PHE A 9 -5.519 -1.016 3.284 1.00 0.00 C ATOM 159 CD1 PHE A 9 -5.112 -1.216 4.608 1.00 0.00 C ATOM 160 CD2 PHE A 9 -5.659 0.289 2.761 1.00 0.00 C ATOM 161 CE1 PHE A 9 -5.217 -0.131 5.510 1.00 0.00 C ATOM 162 CE2 PHE A 9 -5.468 1.382 3.627 1.00 0.00 C ATOM 163 CZ PHE A 9 -5.256 1.169 4.998 1.00 0.00 C ATOM 0 H PHE A 9 -3.674 -2.529 0.722 1.00 0.00 H new ATOM 0 HA PHE A 9 -4.490 -3.655 3.409 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -6.042 -1.952 1.416 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.732 -2.736 2.824 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -4.728 -2.172 4.932 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.907 0.444 1.721 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -5.266 -0.304 6.575 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -5.485 2.388 3.235 1.00 0.00 H new ATOM 0 HZ PHE A 9 -5.123 2.012 5.659 1.00 0.00 H new ATOM 173 N SER A 10 -4.808 -5.800 2.260 1.00 0.00 N ATOM 174 CA SER A 10 -4.757 -7.092 1.545 1.00 0.00 C ATOM 175 C SER A 10 -5.076 -8.288 2.472 1.00 0.00 C ATOM 176 O SER A 10 -5.598 -8.170 3.554 1.00 0.00 O ATOM 177 CB SER A 10 -3.416 -7.250 0.851 1.00 0.00 C ATOM 178 OG SER A 10 -3.577 -7.935 -0.425 1.00 0.00 O ATOM 0 H SER A 10 -4.607 -5.885 3.256 1.00 0.00 H new ATOM 0 HA SER A 10 -5.538 -7.088 0.784 1.00 0.00 H new ATOM 0 HB2 SER A 10 -2.966 -6.270 0.690 1.00 0.00 H new ATOM 0 HB3 SER A 10 -2.734 -7.813 1.489 1.00 0.00 H new ATOM 0 HG SER A 10 -2.747 -8.405 -0.651 1.00 0.00 H new ATOM 184 N SER A 11 -4.644 -9.503 1.945 1.00 0.00 N ATOM 185 CA SER A 11 -5.160 -10.799 2.424 1.00 0.00 C ATOM 186 C SER A 11 -4.032 -11.861 2.507 1.00 0.00 C ATOM 187 O SER A 11 -3.604 -12.344 3.565 1.00 0.00 O ATOM 188 CB SER A 11 -6.245 -11.286 1.429 1.00 0.00 C ATOM 189 OG SER A 11 -7.510 -10.716 1.722 1.00 0.00 O ATOM 0 H SER A 11 -3.950 -9.581 1.201 1.00 0.00 H new ATOM 0 HA SER A 11 -5.573 -10.668 3.424 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.953 -11.023 0.412 1.00 0.00 H new ATOM 0 HB3 SER A 11 -6.316 -12.373 1.469 1.00 0.00 H new ATOM 0 HG SER A 11 -8.172 -11.041 1.077 1.00 0.00 H new ATOM 195 N ALA A 12 -3.463 -12.189 1.315 1.00 0.00 N ATOM 196 CA ALA A 12 -2.726 -13.345 0.963 1.00 0.00 C ATOM 197 C ALA A 12 -1.569 -13.685 1.918 1.00 0.00 C ATOM 198 O ALA A 12 -0.413 -13.318 1.712 1.00 0.00 O ATOM 199 CB ALA A 12 -2.134 -13.244 -0.467 1.00 0.00 C ATOM 0 H ALA A 12 -3.542 -11.554 0.520 1.00 0.00 H new ATOM 0 HA ALA A 12 -3.466 -14.143 1.026 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -1.577 -14.153 -0.695 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -2.943 -13.124 -1.188 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -1.466 -12.385 -0.524 1.00 0.00 H new ATOM 205 N GLY A 13 -1.934 -14.393 3.032 1.00 0.00 N ATOM 206 CA GLY A 13 -0.979 -15.120 3.896 1.00 0.00 C ATOM 207 C GLY A 13 0.392 -14.516 4.024 1.00 0.00 C ATOM 208 O GLY A 13 0.653 -13.770 4.997 1.00 0.00 O ATOM 0 H GLY A 13 -2.901 -14.468 3.346 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -1.412 -15.201 4.893 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -0.872 -16.134 3.511 1.00 0.00 H new ATOM 212 N MET A 14 1.334 -14.832 3.096 1.00 0.00 N ATOM 213 CA MET A 14 2.648 -14.174 2.932 1.00 0.00 C ATOM 214 C MET A 14 2.759 -13.571 1.508 1.00 0.00 C ATOM 215 O MET A 14 3.078 -14.251 0.551 1.00 0.00 O ATOM 216 CB MET A 14 3.791 -15.097 3.259 1.00 0.00 C ATOM 217 CG MET A 14 4.796 -15.345 2.172 1.00 0.00 C ATOM 218 SD MET A 14 6.330 -14.286 2.312 1.00 0.00 S ATOM 219 CE MET A 14 7.575 -15.530 1.988 1.00 0.00 C ATOM 0 H MET A 14 1.189 -15.581 2.419 1.00 0.00 H new ATOM 0 HA MET A 14 2.718 -13.358 3.651 1.00 0.00 H new ATOM 0 HB2 MET A 14 4.318 -14.691 4.122 1.00 0.00 H new ATOM 0 HB3 MET A 14 3.375 -16.058 3.562 1.00 0.00 H new ATOM 0 HG2 MET A 14 5.087 -16.395 2.191 1.00 0.00 H new ATOM 0 HG3 MET A 14 4.326 -15.162 1.206 1.00 0.00 H new ATOM 0 HE1 MET A 14 8.564 -15.074 2.031 1.00 0.00 H new ATOM 0 HE2 MET A 14 7.506 -16.318 2.738 1.00 0.00 H new ATOM 0 HE3 MET A 14 7.414 -15.956 0.998 1.00 0.00 H new ATOM 229 N SER A 15 2.396 -12.258 1.443 1.00 0.00 N ATOM 230 CA SER A 15 2.664 -11.410 0.243 1.00 0.00 C ATOM 231 C SER A 15 2.346 -9.958 0.461 1.00 0.00 C ATOM 232 O SER A 15 2.122 -9.170 -0.536 1.00 0.00 O ATOM 233 CB SER A 15 1.758 -12.013 -0.883 1.00 0.00 C ATOM 234 OG SER A 15 2.459 -13.124 -1.490 1.00 0.00 O ATOM 0 H SER A 15 1.921 -11.767 2.200 1.00 0.00 H new ATOM 0 HA SER A 15 3.725 -11.425 -0.008 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.808 -12.347 -0.466 1.00 0.00 H new ATOM 0 HB3 SER A 15 1.529 -11.255 -1.632 1.00 0.00 H new ATOM 0 HG SER A 15 2.478 -13.879 -0.866 1.00 0.00 H new ATOM 240 N THR A 16 2.349 -9.470 1.723 1.00 0.00 N ATOM 241 CA THR A 16 1.981 -8.188 2.261 1.00 0.00 C ATOM 242 C THR A 16 2.953 -7.610 3.290 1.00 0.00 C ATOM 243 O THR A 16 3.477 -6.484 3.157 1.00 0.00 O ATOM 244 CB THR A 16 0.541 -8.014 2.789 1.00 0.00 C ATOM 245 OG1 THR A 16 -0.226 -9.222 2.635 1.00 0.00 O ATOM 246 CG2 THR A 16 -0.142 -6.769 2.285 1.00 0.00 C ATOM 0 H THR A 16 2.661 -10.079 2.480 1.00 0.00 H new ATOM 0 HA THR A 16 2.040 -7.611 1.338 1.00 0.00 H new ATOM 0 HB THR A 16 0.614 -7.842 3.863 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.132 -9.080 2.980 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.149 -6.714 2.698 1.00 0.00 H new ATOM 0 HG22 THR A 16 0.426 -5.892 2.595 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.197 -6.799 1.197 1.00 0.00 H new ATOM 254 N SER A 17 3.166 -8.388 4.380 1.00 0.00 N ATOM 255 CA SER A 17 4.080 -7.997 5.513 1.00 0.00 C ATOM 256 C SER A 17 5.478 -7.627 4.993 1.00 0.00 C ATOM 257 O SER A 17 5.874 -6.449 4.859 1.00 0.00 O ATOM 258 CB SER A 17 4.156 -9.158 6.490 1.00 0.00 C ATOM 259 OG SER A 17 3.180 -9.066 7.548 1.00 0.00 O ATOM 0 H SER A 17 2.721 -9.296 4.510 1.00 0.00 H new ATOM 0 HA SER A 17 3.682 -7.116 6.016 1.00 0.00 H new ATOM 0 HB2 SER A 17 4.010 -10.092 5.948 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.154 -9.195 6.926 1.00 0.00 H new ATOM 0 HG SER A 17 3.272 -9.837 8.146 1.00 0.00 H new ATOM 265 N LEU A 18 6.289 -8.693 4.691 1.00 0.00 N ATOM 266 CA LEU A 18 7.727 -8.609 4.297 1.00 0.00 C ATOM 267 C LEU A 18 7.826 -8.104 2.845 1.00 0.00 C ATOM 268 O LEU A 18 8.898 -8.159 2.234 1.00 0.00 O ATOM 269 CB LEU A 18 8.319 -9.996 4.519 1.00 0.00 C ATOM 270 CG LEU A 18 8.592 -10.927 3.348 1.00 0.00 C ATOM 271 CD1 LEU A 18 7.402 -11.061 2.339 1.00 0.00 C ATOM 272 CD2 LEU A 18 9.908 -10.555 2.620 1.00 0.00 C ATOM 0 H LEU A 18 5.947 -9.654 4.717 1.00 0.00 H new ATOM 0 HA LEU A 18 8.297 -7.896 4.893 1.00 0.00 H new ATOM 0 HB2 LEU A 18 9.264 -9.860 5.045 1.00 0.00 H new ATOM 0 HB3 LEU A 18 7.649 -10.524 5.198 1.00 0.00 H new ATOM 0 HG LEU A 18 8.708 -11.916 3.792 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.681 -11.743 1.536 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.527 -11.451 2.858 1.00 0.00 H new ATOM 0 HD13 LEU A 18 7.169 -10.082 1.920 1.00 0.00 H new ATOM 0 HD21 LEU A 18 10.071 -11.241 1.789 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.838 -9.536 2.240 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.742 -10.626 3.318 1.00 0.00 H new ATOM 284 N LEU A 19 6.701 -7.594 2.261 1.00 0.00 N ATOM 285 CA LEU A 19 6.639 -6.562 1.233 1.00 0.00 C ATOM 286 C LEU A 19 6.890 -5.153 1.950 1.00 0.00 C ATOM 287 O LEU A 19 7.860 -4.496 1.715 1.00 0.00 O ATOM 288 CB LEU A 19 5.087 -6.507 0.858 1.00 0.00 C ATOM 289 CG LEU A 19 4.802 -6.739 -0.662 1.00 0.00 C ATOM 290 CD1 LEU A 19 3.403 -6.994 -1.077 1.00 0.00 C ATOM 291 CD2 LEU A 19 5.574 -5.682 -1.505 1.00 0.00 C ATOM 0 H LEU A 19 5.773 -7.924 2.524 1.00 0.00 H new ATOM 0 HA LEU A 19 7.330 -6.747 0.411 1.00 0.00 H new ATOM 0 HB2 LEU A 19 4.555 -7.261 1.438 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.685 -5.537 1.151 1.00 0.00 H new ATOM 0 HG LEU A 19 5.203 -7.727 -0.889 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.364 -7.135 -2.157 1.00 0.00 H new ATOM 0 HD12 LEU A 19 3.034 -7.891 -0.580 1.00 0.00 H new ATOM 0 HD13 LEU A 19 2.780 -6.143 -0.799 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.374 -5.845 -2.564 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.245 -4.682 -1.224 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.644 -5.778 -1.318 1.00 0.00 H new ATOM 303 N VAL A 20 5.864 -4.755 2.740 1.00 0.00 N ATOM 304 CA VAL A 20 5.823 -3.529 3.539 1.00 0.00 C ATOM 305 C VAL A 20 7.090 -3.467 4.418 1.00 0.00 C ATOM 306 O VAL A 20 7.493 -2.348 4.855 1.00 0.00 O ATOM 307 CB VAL A 20 4.502 -3.477 4.292 1.00 0.00 C ATOM 308 CG1 VAL A 20 4.556 -2.973 5.741 1.00 0.00 C ATOM 309 CG2 VAL A 20 3.335 -2.822 3.525 1.00 0.00 C ATOM 0 H VAL A 20 5.013 -5.309 2.835 1.00 0.00 H new ATOM 0 HA VAL A 20 5.846 -2.628 2.926 1.00 0.00 H new ATOM 0 HB VAL A 20 4.284 -4.543 4.364 1.00 0.00 H new ATOM 0 HG11 VAL A 20 3.553 -2.983 6.167 1.00 0.00 H new ATOM 0 HG12 VAL A 20 5.206 -3.622 6.328 1.00 0.00 H new ATOM 0 HG13 VAL A 20 4.947 -1.956 5.758 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.439 -2.834 4.146 1.00 0.00 H new ATOM 0 HG22 VAL A 20 3.593 -1.792 3.280 1.00 0.00 H new ATOM 0 HG23 VAL A 20 3.147 -3.377 2.606 1.00 0.00 H new ATOM 319 N SER A 21 7.681 -4.632 4.717 1.00 0.00 N ATOM 320 CA SER A 21 8.849 -4.805 5.581 1.00 0.00 C ATOM 321 C SER A 21 10.156 -4.986 4.807 1.00 0.00 C ATOM 322 O SER A 21 11.273 -4.620 5.243 1.00 0.00 O ATOM 323 CB SER A 21 8.666 -5.902 6.591 1.00 0.00 C ATOM 324 OG SER A 21 7.326 -6.186 6.939 1.00 0.00 O ATOM 0 H SER A 21 7.339 -5.518 4.344 1.00 0.00 H new ATOM 0 HA SER A 21 8.934 -3.865 6.127 1.00 0.00 H new ATOM 0 HB2 SER A 21 9.123 -6.812 6.202 1.00 0.00 H new ATOM 0 HB3 SER A 21 9.210 -5.634 7.497 1.00 0.00 H new ATOM 0 HG SER A 21 6.733 -5.910 6.209 1.00 0.00 H new ATOM 330 N LYS A 22 10.001 -5.514 3.549 1.00 0.00 N ATOM 331 CA LYS A 22 11.176 -5.560 2.585 1.00 0.00 C ATOM 332 C LYS A 22 11.357 -4.164 1.960 1.00 0.00 C ATOM 333 O LYS A 22 12.451 -3.699 1.689 1.00 0.00 O ATOM 334 CB LYS A 22 10.835 -6.588 1.463 1.00 0.00 C ATOM 335 CG LYS A 22 12.048 -6.697 0.519 1.00 0.00 C ATOM 336 CD LYS A 22 11.856 -7.725 -0.629 1.00 0.00 C ATOM 337 CE LYS A 22 12.049 -9.135 -0.015 1.00 0.00 C ATOM 338 NZ LYS A 22 12.125 -10.145 -1.102 1.00 0.00 N ATOM 0 H LYS A 22 9.128 -5.896 3.184 1.00 0.00 H new ATOM 0 HA LYS A 22 12.092 -5.851 3.100 1.00 0.00 H new ATOM 0 HB2 LYS A 22 10.604 -7.561 1.897 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.952 -6.267 0.910 1.00 0.00 H new ATOM 0 HG2 LYS A 22 12.250 -5.717 0.087 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.926 -6.976 1.101 1.00 0.00 H new ATOM 0 HD2 LYS A 22 10.864 -7.629 -1.070 1.00 0.00 H new ATOM 0 HD3 LYS A 22 12.577 -7.550 -1.427 1.00 0.00 H new ATOM 0 HE2 LYS A 22 12.960 -9.161 0.584 1.00 0.00 H new ATOM 0 HE3 LYS A 22 11.221 -9.368 0.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 11.589 -10.993 -0.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 11.721 -9.748 -1.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 13.119 -10.403 -1.268 1.00 0.00 H new ATOM 352 N MET A 23 10.181 -3.552 1.672 1.00 0.00 N ATOM 353 CA MET A 23 10.048 -2.110 1.318 1.00 0.00 C ATOM 354 C MET A 23 10.698 -1.209 2.359 1.00 0.00 C ATOM 355 O MET A 23 11.600 -0.386 2.058 1.00 0.00 O ATOM 356 CB MET A 23 8.511 -1.787 1.238 1.00 0.00 C ATOM 357 CG MET A 23 8.074 -1.956 -0.248 1.00 0.00 C ATOM 358 SD MET A 23 6.681 -0.890 -0.740 1.00 0.00 S ATOM 359 CE MET A 23 5.442 -1.323 0.478 1.00 0.00 C ATOM 0 H MET A 23 9.289 -4.047 1.678 1.00 0.00 H new ATOM 0 HA MET A 23 10.551 -1.925 0.369 1.00 0.00 H new ATOM 0 HB2 MET A 23 7.944 -2.458 1.883 1.00 0.00 H new ATOM 0 HB3 MET A 23 8.314 -0.772 1.583 1.00 0.00 H new ATOM 0 HG2 MET A 23 8.926 -1.742 -0.893 1.00 0.00 H new ATOM 0 HG3 MET A 23 7.799 -2.997 -0.418 1.00 0.00 H new ATOM 0 HE1 MET A 23 4.481 -0.899 0.186 1.00 0.00 H new ATOM 0 HE2 MET A 23 5.356 -2.408 0.540 1.00 0.00 H new ATOM 0 HE3 MET A 23 5.733 -0.926 1.450 1.00 0.00 H new ATOM 369 N ARG A 24 10.222 -1.322 3.628 1.00 0.00 N ATOM 370 CA ARG A 24 10.865 -0.655 4.806 1.00 0.00 C ATOM 371 C ARG A 24 12.414 -0.762 4.615 1.00 0.00 C ATOM 372 O ARG A 24 13.147 0.096 4.997 1.00 0.00 O ATOM 373 CB ARG A 24 10.471 -1.350 6.106 1.00 0.00 C ATOM 374 CG ARG A 24 9.624 -0.442 7.058 1.00 0.00 C ATOM 375 CD ARG A 24 8.168 -0.363 6.533 1.00 0.00 C ATOM 376 NE ARG A 24 7.260 -1.123 7.434 1.00 0.00 N ATOM 377 CZ ARG A 24 7.177 -1.025 8.762 1.00 0.00 C ATOM 378 NH1 ARG A 24 7.824 -0.067 9.459 1.00 0.00 N ATOM 379 NH2 ARG A 24 6.403 -1.887 9.466 1.00 0.00 N ATOM 0 H ARG A 24 9.394 -1.868 3.867 1.00 0.00 H new ATOM 0 HA ARG A 24 10.540 0.384 4.866 1.00 0.00 H new ATOM 0 HB2 ARG A 24 9.902 -2.250 5.872 1.00 0.00 H new ATOM 0 HB3 ARG A 24 11.373 -1.670 6.627 1.00 0.00 H new ATOM 0 HG2 ARG A 24 9.636 -0.846 8.070 1.00 0.00 H new ATOM 0 HG3 ARG A 24 10.059 0.556 7.109 1.00 0.00 H new ATOM 0 HD2 ARG A 24 7.849 0.678 6.476 1.00 0.00 H new ATOM 0 HD3 ARG A 24 8.114 -0.769 5.523 1.00 0.00 H new ATOM 0 HE ARG A 24 6.633 -1.792 6.988 1.00 0.00 H new ATOM 0 HH11 ARG A 24 8.403 0.616 8.970 1.00 0.00 H new ATOM 0 HH12 ARG A 24 7.734 -0.026 10.474 1.00 0.00 H new ATOM 0 HH21 ARG A 24 5.880 -2.616 8.981 1.00 0.00 H new ATOM 0 HH22 ARG A 24 6.344 -1.807 10.481 1.00 0.00 H new ATOM 393 N ALA A 25 12.810 -1.944 4.057 1.00 0.00 N ATOM 394 CA ALA A 25 14.170 -2.334 3.783 1.00 0.00 C ATOM 395 C ALA A 25 14.949 -1.524 2.791 1.00 0.00 C ATOM 396 O ALA A 25 16.170 -1.381 2.889 1.00 0.00 O ATOM 397 CB ALA A 25 14.312 -3.850 3.528 1.00 0.00 C ATOM 0 H ALA A 25 12.138 -2.661 3.785 1.00 0.00 H new ATOM 0 HA ALA A 25 14.660 -2.082 4.723 1.00 0.00 H new ATOM 0 HB1 ALA A 25 15.356 -4.089 3.327 1.00 0.00 H new ATOM 0 HB2 ALA A 25 13.977 -4.400 4.407 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.703 -4.133 2.669 1.00 0.00 H new ATOM 403 N GLN A 26 14.253 -0.983 1.751 1.00 0.00 N ATOM 404 CA GLN A 26 14.659 0.193 0.959 1.00 0.00 C ATOM 405 C GLN A 26 14.686 1.475 1.854 1.00 0.00 C ATOM 406 O GLN A 26 15.675 2.130 2.008 1.00 0.00 O ATOM 407 CB GLN A 26 13.821 0.386 -0.226 1.00 0.00 C ATOM 408 CG GLN A 26 12.477 -0.167 -0.429 1.00 0.00 C ATOM 409 CD GLN A 26 12.392 -1.637 -0.871 1.00 0.00 C ATOM 410 OE1 GLN A 26 11.275 -2.237 -0.997 1.00 0.00 O ATOM 411 NE2 GLN A 26 13.527 -2.324 -1.084 1.00 0.00 N ATOM 0 H GLN A 26 13.365 -1.374 1.438 1.00 0.00 H new ATOM 0 HA GLN A 26 15.669 0.005 0.594 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.716 1.465 -0.340 1.00 0.00 H new ATOM 0 HB3 GLN A 26 14.416 0.032 -1.068 1.00 0.00 H new ATOM 0 HG2 GLN A 26 11.921 -0.060 0.502 1.00 0.00 H new ATOM 0 HG3 GLN A 26 11.968 0.442 -1.176 1.00 0.00 H new ATOM 0 HE21 GLN A 26 14.430 -1.860 -0.988 1.00 0.00 H new ATOM 0 HE22 GLN A 26 13.486 -3.310 -1.342 1.00 0.00 H new ATOM 420 N ALA A 27 13.463 1.860 2.319 1.00 0.00 N ATOM 421 CA ALA A 27 13.090 3.195 2.743 1.00 0.00 C ATOM 422 C ALA A 27 13.656 3.571 4.140 1.00 0.00 C ATOM 423 O ALA A 27 13.390 4.600 4.694 1.00 0.00 O ATOM 424 CB ALA A 27 11.554 3.385 2.771 1.00 0.00 C ATOM 0 H ALA A 27 12.691 1.199 2.403 1.00 0.00 H new ATOM 0 HA ALA A 27 13.532 3.858 1.999 1.00 0.00 H new ATOM 0 HB1 ALA A 27 11.319 4.399 3.094 1.00 0.00 H new ATOM 0 HB2 ALA A 27 11.149 3.219 1.773 1.00 0.00 H new ATOM 0 HB3 ALA A 27 11.112 2.671 3.466 1.00 0.00 H new ATOM 430 N GLU A 28 14.423 2.583 4.706 1.00 0.00 N ATOM 431 CA GLU A 28 15.301 2.746 5.856 1.00 0.00 C ATOM 432 C GLU A 28 16.751 2.338 5.557 1.00 0.00 C ATOM 433 O GLU A 28 17.679 2.681 6.276 1.00 0.00 O ATOM 434 CB GLU A 28 14.728 2.059 7.107 1.00 0.00 C ATOM 435 CG GLU A 28 13.369 2.661 7.512 1.00 0.00 C ATOM 436 CD GLU A 28 13.206 3.013 8.975 1.00 0.00 C ATOM 437 OE1 GLU A 28 12.808 2.147 9.814 1.00 0.00 O ATOM 438 OE2 GLU A 28 13.504 4.200 9.319 1.00 0.00 O ATOM 0 H GLU A 28 14.428 1.630 4.343 1.00 0.00 H new ATOM 0 HA GLU A 28 15.342 3.813 6.077 1.00 0.00 H new ATOM 0 HB2 GLU A 28 14.612 0.992 6.916 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.432 2.160 7.933 1.00 0.00 H new ATOM 0 HG2 GLU A 28 13.203 3.562 6.922 1.00 0.00 H new ATOM 0 HG3 GLU A 28 12.586 1.954 7.240 1.00 0.00 H new ATOM 445 N LYS A 29 16.912 1.479 4.518 1.00 0.00 N ATOM 446 CA LYS A 29 18.186 1.348 3.764 1.00 0.00 C ATOM 447 C LYS A 29 18.773 2.724 3.363 1.00 0.00 C ATOM 448 O LYS A 29 19.958 2.868 3.168 1.00 0.00 O ATOM 449 CB LYS A 29 17.923 0.508 2.485 1.00 0.00 C ATOM 450 CG LYS A 29 18.937 0.763 1.399 1.00 0.00 C ATOM 451 CD LYS A 29 19.226 -0.386 0.403 1.00 0.00 C ATOM 452 CE LYS A 29 17.946 -0.615 -0.447 1.00 0.00 C ATOM 453 NZ LYS A 29 18.303 -0.795 -1.863 1.00 0.00 N ATOM 0 H LYS A 29 16.171 0.864 4.182 1.00 0.00 H new ATOM 0 HA LYS A 29 18.914 0.858 4.411 1.00 0.00 H new ATOM 0 HB2 LYS A 29 17.933 -0.551 2.743 1.00 0.00 H new ATOM 0 HB3 LYS A 29 16.927 0.735 2.106 1.00 0.00 H new ATOM 0 HG2 LYS A 29 18.605 1.629 0.826 1.00 0.00 H new ATOM 0 HG3 LYS A 29 19.878 1.039 1.876 1.00 0.00 H new ATOM 0 HD2 LYS A 29 20.070 -0.131 -0.239 1.00 0.00 H new ATOM 0 HD3 LYS A 29 19.496 -1.296 0.939 1.00 0.00 H new ATOM 0 HE2 LYS A 29 17.412 -1.493 -0.084 1.00 0.00 H new ATOM 0 HE3 LYS A 29 17.272 0.235 -0.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 17.578 -1.374 -2.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 18.359 0.134 -2.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 19.225 -1.272 -1.931 1.00 0.00 H new ATOM 467 N TYR A 30 17.829 3.714 3.229 1.00 0.00 N ATOM 468 CA TYR A 30 18.067 5.084 2.767 1.00 0.00 C ATOM 469 C TYR A 30 17.929 6.120 3.857 1.00 0.00 C ATOM 470 O TYR A 30 18.855 6.315 4.697 1.00 0.00 O ATOM 471 CB TYR A 30 17.085 5.394 1.552 1.00 0.00 C ATOM 472 CG TYR A 30 17.416 4.457 0.354 1.00 0.00 C ATOM 473 CD1 TYR A 30 18.735 4.442 -0.100 1.00 0.00 C ATOM 474 CD2 TYR A 30 16.453 3.608 -0.160 1.00 0.00 C ATOM 475 CE1 TYR A 30 19.071 3.629 -1.186 1.00 0.00 C ATOM 476 CE2 TYR A 30 16.778 2.735 -1.207 1.00 0.00 C ATOM 477 CZ TYR A 30 18.054 2.863 -1.790 1.00 0.00 C ATOM 478 OH TYR A 30 18.327 2.198 -2.929 1.00 0.00 O ATOM 0 H TYR A 30 16.848 3.549 3.455 1.00 0.00 H new ATOM 0 HA TYR A 30 19.105 5.149 2.440 1.00 0.00 H new ATOM 0 HB2 TYR A 30 16.050 5.250 1.863 1.00 0.00 H new ATOM 0 HB3 TYR A 30 17.185 6.436 1.249 1.00 0.00 H new ATOM 0 HD1 TYR A 30 19.486 5.050 0.381 1.00 0.00 H new ATOM 0 HD2 TYR A 30 15.452 3.618 0.245 1.00 0.00 H new ATOM 0 HE1 TYR A 30 20.086 3.589 -1.554 1.00 0.00 H new ATOM 0 HE2 TYR A 30 16.076 1.991 -1.554 1.00 0.00 H new ATOM 0 HH TYR A 30 19.274 1.948 -2.943 1.00 0.00 H new ATOM 488 N GLU A 31 16.807 6.822 3.880 1.00 0.00 N ATOM 489 CA GLU A 31 16.503 7.992 4.714 1.00 0.00 C ATOM 490 C GLU A 31 15.051 8.494 4.479 1.00 0.00 C ATOM 491 O GLU A 31 14.780 9.685 4.561 1.00 0.00 O ATOM 492 CB GLU A 31 17.480 9.152 4.395 1.00 0.00 C ATOM 493 CG GLU A 31 18.708 9.130 5.280 1.00 0.00 C ATOM 494 CD GLU A 31 19.572 10.403 5.229 1.00 0.00 C ATOM 495 OE1 GLU A 31 19.213 11.352 4.497 1.00 0.00 O ATOM 496 OE2 GLU A 31 20.667 10.357 5.870 1.00 0.00 O ATOM 0 H GLU A 31 16.023 6.578 3.275 1.00 0.00 H new ATOM 0 HA GLU A 31 16.612 7.683 5.754 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.786 9.089 3.351 1.00 0.00 H new ATOM 0 HB3 GLU A 31 16.963 10.104 4.519 1.00 0.00 H new ATOM 0 HG2 GLU A 31 18.392 8.965 6.310 1.00 0.00 H new ATOM 0 HG3 GLU A 31 19.326 8.278 4.996 1.00 0.00 H new ATOM 503 N VAL A 32 14.199 7.578 3.966 1.00 0.00 N ATOM 504 CA VAL A 32 12.895 7.849 3.335 1.00 0.00 C ATOM 505 C VAL A 32 11.780 7.944 4.383 1.00 0.00 C ATOM 506 O VAL A 32 11.294 6.920 4.906 1.00 0.00 O ATOM 507 CB VAL A 32 12.629 6.829 2.214 1.00 0.00 C ATOM 508 CG1 VAL A 32 11.323 7.072 1.418 1.00 0.00 C ATOM 509 CG2 VAL A 32 13.837 6.657 1.284 1.00 0.00 C ATOM 0 H VAL A 32 14.416 6.582 3.984 1.00 0.00 H new ATOM 0 HA VAL A 32 12.914 8.828 2.857 1.00 0.00 H new ATOM 0 HB VAL A 32 12.473 5.885 2.736 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.217 6.306 0.649 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.470 7.026 2.095 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.361 8.055 0.948 1.00 0.00 H new ATOM 0 HG21 VAL A 32 13.599 5.927 0.510 1.00 0.00 H new ATOM 0 HG22 VAL A 32 14.078 7.613 0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.694 6.308 1.861 1.00 0.00 H new ATOM 519 N PRO A 33 11.390 9.176 4.756 1.00 0.00 N ATOM 520 CA PRO A 33 10.547 9.519 5.899 1.00 0.00 C ATOM 521 C PRO A 33 9.050 9.156 5.888 1.00 0.00 C ATOM 522 O PRO A 33 8.232 9.763 6.619 1.00 0.00 O ATOM 523 CB PRO A 33 10.811 10.981 6.224 1.00 0.00 C ATOM 524 CG PRO A 33 11.070 11.554 4.812 1.00 0.00 C ATOM 525 CD PRO A 33 11.928 10.412 4.146 1.00 0.00 C ATOM 0 HA PRO A 33 10.853 8.840 6.695 1.00 0.00 H new ATOM 0 HB2 PRO A 33 9.960 11.455 6.712 1.00 0.00 H new ATOM 0 HB3 PRO A 33 11.669 11.108 6.885 1.00 0.00 H new ATOM 0 HG2 PRO A 33 10.142 11.736 4.269 1.00 0.00 H new ATOM 0 HG3 PRO A 33 11.609 12.501 4.849 1.00 0.00 H new ATOM 0 HD2 PRO A 33 11.816 10.406 3.062 1.00 0.00 H new ATOM 0 HD3 PRO A 33 12.991 10.534 4.356 1.00 0.00 H new ATOM 533 N VAL A 34 8.758 8.038 5.203 1.00 0.00 N ATOM 534 CA VAL A 34 7.511 7.275 5.273 1.00 0.00 C ATOM 535 C VAL A 34 7.631 6.101 6.238 1.00 0.00 C ATOM 536 O VAL A 34 8.710 5.645 6.652 1.00 0.00 O ATOM 537 CB VAL A 34 7.046 6.899 3.849 1.00 0.00 C ATOM 538 CG1 VAL A 34 6.467 5.470 3.735 1.00 0.00 C ATOM 539 CG2 VAL A 34 6.105 7.947 3.227 1.00 0.00 C ATOM 0 H VAL A 34 9.425 7.624 4.552 1.00 0.00 H new ATOM 0 HA VAL A 34 6.720 7.894 5.696 1.00 0.00 H new ATOM 0 HB VAL A 34 7.960 6.899 3.256 1.00 0.00 H new ATOM 0 HG11 VAL A 34 6.163 5.282 2.705 1.00 0.00 H new ATOM 0 HG12 VAL A 34 7.227 4.745 4.027 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.602 5.374 4.392 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.813 7.626 2.227 1.00 0.00 H new ATOM 0 HG22 VAL A 34 5.216 8.052 3.848 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.619 8.906 3.165 1.00 0.00 H new ATOM 549 N ILE A 35 6.456 5.587 6.694 1.00 0.00 N ATOM 550 CA ILE A 35 6.236 4.160 7.076 1.00 0.00 C ATOM 551 C ILE A 35 5.316 3.494 6.053 1.00 0.00 C ATOM 552 O ILE A 35 4.457 4.136 5.430 1.00 0.00 O ATOM 553 CB ILE A 35 5.716 4.102 8.550 1.00 0.00 C ATOM 554 CG1 ILE A 35 6.620 4.789 9.551 1.00 0.00 C ATOM 555 CG2 ILE A 35 5.206 2.723 8.950 1.00 0.00 C ATOM 556 CD1 ILE A 35 7.690 3.967 10.265 1.00 0.00 C ATOM 0 H ILE A 35 5.620 6.160 6.809 1.00 0.00 H new ATOM 0 HA ILE A 35 7.165 3.590 7.056 1.00 0.00 H new ATOM 0 HB ILE A 35 4.822 4.724 8.578 1.00 0.00 H new ATOM 0 HG12 ILE A 35 7.123 5.606 9.034 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.985 5.238 10.315 1.00 0.00 H new ATOM 0 HG21 ILE A 35 4.860 2.749 9.983 1.00 0.00 H new ATOM 0 HG22 ILE A 35 4.381 2.437 8.298 1.00 0.00 H new ATOM 0 HG23 ILE A 35 6.012 1.995 8.856 1.00 0.00 H new ATOM 0 HD11 ILE A 35 8.248 4.609 10.946 1.00 0.00 H new ATOM 0 HD12 ILE A 35 7.216 3.165 10.830 1.00 0.00 H new ATOM 0 HD13 ILE A 35 8.371 3.539 9.529 1.00 0.00 H new ATOM 568 N ILE A 36 5.508 2.168 5.861 1.00 0.00 N ATOM 569 CA ILE A 36 4.619 1.236 5.143 1.00 0.00 C ATOM 570 C ILE A 36 3.972 0.283 6.196 1.00 0.00 C ATOM 571 O ILE A 36 4.676 -0.358 6.970 1.00 0.00 O ATOM 572 CB ILE A 36 5.401 0.424 4.050 1.00 0.00 C ATOM 573 CG1 ILE A 36 6.778 0.988 3.764 1.00 0.00 C ATOM 574 CG2 ILE A 36 4.529 0.123 2.850 1.00 0.00 C ATOM 575 CD1 ILE A 36 6.902 2.149 2.784 1.00 0.00 C ATOM 0 H ILE A 36 6.336 1.697 6.225 1.00 0.00 H new ATOM 0 HA ILE A 36 3.845 1.795 4.618 1.00 0.00 H new ATOM 0 HB ILE A 36 5.637 -0.560 4.457 1.00 0.00 H new ATOM 0 HG12 ILE A 36 7.208 1.309 4.713 1.00 0.00 H new ATOM 0 HG13 ILE A 36 7.399 0.173 3.392 1.00 0.00 H new ATOM 0 HG21 ILE A 36 5.104 -0.440 2.115 1.00 0.00 H new ATOM 0 HG22 ILE A 36 3.667 -0.466 3.165 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.187 1.057 2.405 1.00 0.00 H new ATOM 0 HD11 ILE A 36 7.950 2.435 2.689 1.00 0.00 H new ATOM 0 HD12 ILE A 36 6.519 1.845 1.810 1.00 0.00 H new ATOM 0 HD13 ILE A 36 6.326 2.998 3.151 1.00 0.00 H new ATOM 587 N GLU A 37 2.632 0.246 6.182 1.00 0.00 N ATOM 588 CA GLU A 37 1.812 -0.735 6.903 1.00 0.00 C ATOM 589 C GLU A 37 0.622 -1.245 6.025 1.00 0.00 C ATOM 590 O GLU A 37 0.288 -0.638 5.020 1.00 0.00 O ATOM 591 CB GLU A 37 1.250 -0.105 8.203 1.00 0.00 C ATOM 592 CG GLU A 37 2.307 0.113 9.253 1.00 0.00 C ATOM 593 CD GLU A 37 2.020 -0.573 10.615 1.00 0.00 C ATOM 594 OE1 GLU A 37 0.998 -0.196 11.218 1.00 0.00 O ATOM 595 OE2 GLU A 37 2.835 -1.470 11.016 1.00 0.00 O ATOM 0 H GLU A 37 2.074 0.917 5.654 1.00 0.00 H new ATOM 0 HA GLU A 37 2.452 -1.584 7.145 1.00 0.00 H new ATOM 0 HB2 GLU A 37 0.780 0.849 7.965 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.471 -0.752 8.607 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.260 -0.253 8.871 1.00 0.00 H new ATOM 0 HG3 GLU A 37 2.420 1.184 9.418 1.00 0.00 H new ATOM 602 N ALA A 38 0.128 -2.444 6.416 1.00 0.00 N ATOM 603 CA ALA A 38 -0.541 -3.394 5.450 1.00 0.00 C ATOM 604 C ALA A 38 -1.647 -4.164 6.233 1.00 0.00 C ATOM 605 O ALA A 38 -1.327 -5.037 7.029 1.00 0.00 O ATOM 606 CB ALA A 38 0.522 -4.429 5.026 1.00 0.00 C ATOM 0 H ALA A 38 0.171 -2.787 7.376 1.00 0.00 H new ATOM 0 HA ALA A 38 -0.958 -2.864 4.593 1.00 0.00 H new ATOM 0 HB1 ALA A 38 0.081 -5.138 4.325 1.00 0.00 H new ATOM 0 HB2 ALA A 38 1.357 -3.918 4.547 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.880 -4.964 5.906 1.00 0.00 H new ATOM 612 N PHE A 39 -2.916 -3.747 6.068 1.00 0.00 N ATOM 613 CA PHE A 39 -4.082 -4.084 6.924 1.00 0.00 C ATOM 614 C PHE A 39 -4.962 -5.087 6.184 1.00 0.00 C ATOM 615 O PHE A 39 -4.543 -5.631 5.157 1.00 0.00 O ATOM 616 CB PHE A 39 -4.780 -2.828 7.370 1.00 0.00 C ATOM 617 CG PHE A 39 -3.940 -1.691 7.981 1.00 0.00 C ATOM 618 CD1 PHE A 39 -2.689 -1.379 7.425 1.00 0.00 C ATOM 619 CD2 PHE A 39 -4.432 -0.974 9.090 1.00 0.00 C ATOM 620 CE1 PHE A 39 -1.944 -0.304 7.935 1.00 0.00 C ATOM 621 CE2 PHE A 39 -3.609 0.007 9.699 1.00 0.00 C ATOM 622 CZ PHE A 39 -2.417 0.388 9.045 1.00 0.00 C ATOM 0 H PHE A 39 -3.175 -3.134 5.295 1.00 0.00 H new ATOM 0 HA PHE A 39 -3.773 -4.573 7.848 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -5.310 -2.421 6.509 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -5.535 -3.112 8.104 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -2.300 -1.966 6.606 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -5.423 -1.169 9.471 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -1.012 -0.017 7.470 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -3.888 0.453 10.642 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.860 1.236 9.415 1.00 0.00 H new ATOM 632 N PRO A 40 -6.092 -5.504 6.773 1.00 0.00 N ATOM 633 CA PRO A 40 -7.056 -6.497 6.236 1.00 0.00 C ATOM 634 C PRO A 40 -8.335 -5.964 5.525 1.00 0.00 C ATOM 635 O PRO A 40 -9.458 -6.434 5.637 1.00 0.00 O ATOM 636 CB PRO A 40 -7.350 -7.414 7.428 1.00 0.00 C ATOM 637 CG PRO A 40 -7.176 -6.547 8.644 1.00 0.00 C ATOM 638 CD PRO A 40 -6.430 -5.273 8.188 1.00 0.00 C ATOM 0 HA PRO A 40 -6.604 -7.010 5.387 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.361 -7.818 7.374 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -6.667 -8.264 7.449 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -8.143 -6.293 9.078 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -6.609 -7.071 9.413 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -7.056 -4.388 8.303 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -5.533 -5.108 8.785 1.00 0.00 H new ATOM 646 N GLU A 41 -7.990 -5.045 4.578 1.00 0.00 N ATOM 647 CA GLU A 41 -8.893 -4.138 3.896 1.00 0.00 C ATOM 648 C GLU A 41 -10.168 -3.820 4.699 1.00 0.00 C ATOM 649 O GLU A 41 -11.280 -3.818 4.125 1.00 0.00 O ATOM 650 CB GLU A 41 -9.361 -4.832 2.547 1.00 0.00 C ATOM 651 CG GLU A 41 -10.215 -6.059 2.923 1.00 0.00 C ATOM 652 CD GLU A 41 -10.685 -6.910 1.763 1.00 0.00 C ATOM 653 OE1 GLU A 41 -9.842 -7.179 0.868 1.00 0.00 O ATOM 654 OE2 GLU A 41 -11.882 -7.362 1.776 1.00 0.00 O ATOM 0 H GLU A 41 -7.024 -4.930 4.272 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.349 -3.206 3.741 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -9.939 -4.136 1.939 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -8.498 -5.134 1.953 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -9.637 -6.688 3.600 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -11.089 -5.715 3.475 1.00 0.00 H new ATOM 661 N THR A 42 -10.011 -3.664 6.028 1.00 0.00 N ATOM 662 CA THR A 42 -11.042 -3.402 7.073 1.00 0.00 C ATOM 663 C THR A 42 -10.765 -2.108 7.817 1.00 0.00 C ATOM 664 O THR A 42 -11.590 -1.659 8.656 1.00 0.00 O ATOM 665 CB THR A 42 -11.260 -4.540 8.059 1.00 0.00 C ATOM 666 OG1 THR A 42 -11.534 -4.085 9.405 1.00 0.00 O ATOM 667 CG2 THR A 42 -10.050 -5.558 8.038 1.00 0.00 C ATOM 0 H THR A 42 -9.081 -3.722 6.443 1.00 0.00 H new ATOM 0 HA THR A 42 -11.974 -3.311 6.515 1.00 0.00 H new ATOM 0 HB THR A 42 -12.156 -5.062 7.724 1.00 0.00 H new ATOM 0 HG1 THR A 42 -11.992 -3.219 9.371 1.00 0.00 H new ATOM 0 HG21 THR A 42 -10.236 -6.359 8.753 1.00 0.00 H new ATOM 0 HG22 THR A 42 -9.947 -5.980 7.038 1.00 0.00 H new ATOM 0 HG23 THR A 42 -9.131 -5.037 8.308 1.00 0.00 H new ATOM 675 N LEU A 43 -9.585 -1.494 7.544 1.00 0.00 N ATOM 676 CA LEU A 43 -9.020 -0.320 8.213 1.00 0.00 C ATOM 677 C LEU A 43 -8.577 0.720 7.185 1.00 0.00 C ATOM 678 O LEU A 43 -7.842 1.675 7.558 1.00 0.00 O ATOM 679 CB LEU A 43 -7.770 -0.846 8.989 1.00 0.00 C ATOM 680 CG LEU A 43 -7.912 -1.378 10.401 1.00 0.00 C ATOM 681 CD1 LEU A 43 -9.355 -1.476 10.943 1.00 0.00 C ATOM 682 CD2 LEU A 43 -7.067 -2.647 10.667 1.00 0.00 C ATOM 0 H LEU A 43 -8.974 -1.836 6.803 1.00 0.00 H new ATOM 0 HA LEU A 43 -9.750 0.154 8.869 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -7.329 -1.641 8.388 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.046 -0.032 9.023 1.00 0.00 H new ATOM 0 HG LEU A 43 -7.474 -0.586 11.009 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -9.336 -1.868 11.960 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -9.811 -0.486 10.945 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -9.938 -2.143 10.308 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -7.216 -2.974 11.696 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.377 -3.440 9.986 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -6.013 -2.422 10.507 1.00 0.00 H new ATOM 694 N ALA A 44 -8.915 0.570 5.896 1.00 0.00 N ATOM 695 CA ALA A 44 -8.574 1.477 4.807 1.00 0.00 C ATOM 696 C ALA A 44 -9.327 2.828 4.955 1.00 0.00 C ATOM 697 O ALA A 44 -8.816 3.872 4.640 1.00 0.00 O ATOM 698 CB ALA A 44 -8.968 0.869 3.441 1.00 0.00 C ATOM 0 H ALA A 44 -9.461 -0.230 5.576 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.497 1.638 4.852 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.704 1.564 2.644 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -8.436 -0.071 3.294 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -10.042 0.685 3.421 1.00 0.00 H new ATOM 704 N GLY A 45 -10.594 2.704 5.423 1.00 0.00 N ATOM 705 CA GLY A 45 -11.389 3.845 5.929 1.00 0.00 C ATOM 706 C GLY A 45 -10.589 4.730 6.866 1.00 0.00 C ATOM 707 O GLY A 45 -10.349 5.918 6.608 1.00 0.00 O ATOM 0 H GLY A 45 -11.089 1.813 5.459 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.746 4.439 5.087 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -12.270 3.469 6.450 1.00 0.00 H new ATOM 711 N GLU A 46 -10.187 4.140 8.021 1.00 0.00 N ATOM 712 CA GLU A 46 -9.573 4.818 9.163 1.00 0.00 C ATOM 713 C GLU A 46 -8.043 5.061 8.873 1.00 0.00 C ATOM 714 O GLU A 46 -7.540 6.153 9.072 1.00 0.00 O ATOM 715 CB GLU A 46 -9.718 3.960 10.442 1.00 0.00 C ATOM 716 CG GLU A 46 -9.202 4.696 11.679 1.00 0.00 C ATOM 717 CD GLU A 46 -9.342 6.230 11.589 1.00 0.00 C ATOM 718 OE1 GLU A 46 -10.441 6.656 11.120 1.00 0.00 O ATOM 719 OE2 GLU A 46 -8.394 6.947 11.956 1.00 0.00 O ATOM 0 H GLU A 46 -10.292 3.137 8.176 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.078 5.772 9.315 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -10.766 3.696 10.586 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -9.168 3.027 10.318 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.744 4.341 12.555 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.152 4.444 11.830 1.00 0.00 H new ATOM 726 N LYS A 47 -7.367 3.933 8.557 1.00 0.00 N ATOM 727 CA LYS A 47 -5.862 3.930 8.560 1.00 0.00 C ATOM 728 C LYS A 47 -5.355 4.486 7.199 1.00 0.00 C ATOM 729 O LYS A 47 -4.259 5.031 7.105 1.00 0.00 O ATOM 730 CB LYS A 47 -5.385 2.459 8.700 1.00 0.00 C ATOM 731 CG LYS A 47 -5.881 1.932 10.104 1.00 0.00 C ATOM 732 CD LYS A 47 -5.151 2.591 11.283 1.00 0.00 C ATOM 733 CE LYS A 47 -5.947 2.368 12.586 1.00 0.00 C ATOM 734 NZ LYS A 47 -5.327 3.104 13.707 1.00 0.00 N ATOM 0 H LYS A 47 -7.802 3.045 8.306 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.481 4.541 9.378 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.790 1.846 7.895 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -4.299 2.400 8.630 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -6.951 2.116 10.198 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -5.738 0.853 10.152 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.150 2.172 11.382 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.032 3.659 11.097 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -6.976 2.700 12.451 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -5.983 1.304 12.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -5.876 2.942 14.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -4.353 2.768 13.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -5.315 4.121 13.490 1.00 0.00 H new ATOM 748 N GLY A 48 -6.158 4.268 6.148 1.00 0.00 N ATOM 749 CA GLY A 48 -5.961 4.811 4.790 1.00 0.00 C ATOM 750 C GLY A 48 -6.315 6.295 4.669 1.00 0.00 C ATOM 751 O GLY A 48 -5.686 7.023 3.889 1.00 0.00 O ATOM 0 H GLY A 48 -6.994 3.688 6.219 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -4.921 4.669 4.498 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -6.570 4.242 4.088 1.00 0.00 H new ATOM 755 N GLN A 49 -7.330 6.734 5.460 1.00 0.00 N ATOM 756 CA GLN A 49 -7.659 8.133 5.718 1.00 0.00 C ATOM 757 C GLN A 49 -6.654 8.761 6.740 1.00 0.00 C ATOM 758 O GLN A 49 -6.644 9.946 6.994 1.00 0.00 O ATOM 759 CB GLN A 49 -9.080 8.243 6.189 1.00 0.00 C ATOM 760 CG GLN A 49 -9.291 8.393 7.701 1.00 0.00 C ATOM 761 CD GLN A 49 -10.760 8.761 8.049 1.00 0.00 C ATOM 762 OE1 GLN A 49 -11.515 9.354 7.300 1.00 0.00 O ATOM 763 NE2 GLN A 49 -11.182 8.379 9.301 1.00 0.00 N ATOM 0 H GLN A 49 -7.954 6.089 5.945 1.00 0.00 H new ATOM 0 HA GLN A 49 -7.566 8.700 4.792 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -9.538 9.099 5.694 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -9.619 7.356 5.856 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -9.023 7.461 8.199 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -8.623 9.164 8.086 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -10.545 7.882 9.924 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -12.132 8.592 9.606 1.00 0.00 H new ATOM 772 N ASN A 50 -5.824 7.849 7.345 1.00 0.00 N ATOM 773 CA ASN A 50 -4.619 8.202 8.106 1.00 0.00 C ATOM 774 C ASN A 50 -3.332 8.104 7.248 1.00 0.00 C ATOM 775 O ASN A 50 -2.292 8.654 7.610 1.00 0.00 O ATOM 776 CB ASN A 50 -4.534 7.365 9.376 1.00 0.00 C ATOM 777 CG ASN A 50 -5.376 7.898 10.535 1.00 0.00 C ATOM 778 OD1 ASN A 50 -6.181 8.830 10.436 1.00 0.00 O ATOM 779 ND2 ASN A 50 -5.241 7.282 11.753 1.00 0.00 N ATOM 0 H ASN A 50 -5.992 6.844 7.306 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.699 9.249 8.398 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -4.851 6.347 9.149 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.493 7.311 9.693 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -5.798 7.596 12.548 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -4.584 6.510 11.864 1.00 0.00 H new ATOM 786 N ALA A 51 -3.410 7.279 6.179 1.00 0.00 N ATOM 787 CA ALA A 51 -2.239 6.980 5.292 1.00 0.00 C ATOM 788 C ALA A 51 -1.872 8.262 4.495 1.00 0.00 C ATOM 789 O ALA A 51 -2.489 9.307 4.639 1.00 0.00 O ATOM 790 CB ALA A 51 -2.632 5.859 4.305 1.00 0.00 C ATOM 0 H ALA A 51 -4.268 6.803 5.901 1.00 0.00 H new ATOM 0 HA ALA A 51 -1.386 6.661 5.890 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.787 5.634 3.655 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.910 4.964 4.862 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -3.478 6.187 3.700 1.00 0.00 H new ATOM 796 N ASP A 52 -0.791 8.125 3.722 1.00 0.00 N ATOM 797 CA ASP A 52 -0.406 8.968 2.549 1.00 0.00 C ATOM 798 C ASP A 52 -0.959 8.339 1.234 1.00 0.00 C ATOM 799 O ASP A 52 -1.091 9.033 0.233 1.00 0.00 O ATOM 800 CB ASP A 52 1.143 8.998 2.489 1.00 0.00 C ATOM 801 CG ASP A 52 1.688 9.488 1.116 1.00 0.00 C ATOM 802 OD1 ASP A 52 0.992 10.332 0.533 1.00 0.00 O ATOM 803 OD2 ASP A 52 2.836 9.045 0.817 1.00 0.00 O ATOM 0 H ASP A 52 -0.111 7.384 3.895 1.00 0.00 H new ATOM 0 HA ASP A 52 -0.816 9.973 2.652 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.519 9.650 3.277 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.529 7.999 2.691 1.00 0.00 H new ATOM 808 N VAL A 53 -1.016 6.976 1.228 1.00 0.00 N ATOM 809 CA VAL A 53 -1.504 6.196 0.075 1.00 0.00 C ATOM 810 C VAL A 53 -2.141 4.875 0.609 1.00 0.00 C ATOM 811 O VAL A 53 -1.767 4.354 1.636 1.00 0.00 O ATOM 812 CB VAL A 53 -0.384 5.976 -0.946 1.00 0.00 C ATOM 813 CG1 VAL A 53 -0.804 5.180 -2.209 1.00 0.00 C ATOM 814 CG2 VAL A 53 0.248 7.327 -1.400 1.00 0.00 C ATOM 0 H VAL A 53 -0.726 6.401 2.019 1.00 0.00 H new ATOM 0 HA VAL A 53 -2.277 6.742 -0.466 1.00 0.00 H new ATOM 0 HB VAL A 53 0.345 5.369 -0.410 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.053 5.074 -2.874 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -1.160 4.193 -1.915 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.601 5.713 -2.727 1.00 0.00 H new ATOM 0 HG21 VAL A 53 1.039 7.133 -2.124 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.519 7.952 -1.858 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.666 7.842 -0.535 1.00 0.00 H new ATOM 824 N VAL A 54 -3.207 4.450 -0.119 1.00 0.00 N ATOM 825 CA VAL A 54 -4.158 3.421 0.353 1.00 0.00 C ATOM 826 C VAL A 54 -4.260 2.311 -0.722 1.00 0.00 C ATOM 827 O VAL A 54 -5.133 2.369 -1.602 1.00 0.00 O ATOM 828 CB VAL A 54 -5.507 4.078 0.688 1.00 0.00 C ATOM 829 CG1 VAL A 54 -6.666 3.074 0.977 1.00 0.00 C ATOM 830 CG2 VAL A 54 -5.384 5.064 1.906 1.00 0.00 C ATOM 0 H VAL A 54 -3.427 4.813 -1.047 1.00 0.00 H new ATOM 0 HA VAL A 54 -3.811 2.951 1.273 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.768 4.621 -0.221 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.578 3.626 1.203 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -6.830 2.446 0.101 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.401 2.447 1.828 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.357 5.509 2.113 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.041 4.517 2.784 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.669 5.851 1.666 1.00 0.00 H new ATOM 840 N LEU A 55 -3.312 1.376 -0.694 1.00 0.00 N ATOM 841 CA LEU A 55 -2.944 0.438 -1.772 1.00 0.00 C ATOM 842 C LEU A 55 -3.464 -0.975 -1.422 1.00 0.00 C ATOM 843 O LEU A 55 -3.049 -1.618 -0.496 1.00 0.00 O ATOM 844 CB LEU A 55 -1.387 0.440 -1.736 1.00 0.00 C ATOM 845 CG LEU A 55 -0.626 -0.706 -2.433 1.00 0.00 C ATOM 846 CD1 LEU A 55 -1.217 -1.122 -3.772 1.00 0.00 C ATOM 847 CD2 LEU A 55 0.874 -0.368 -2.510 1.00 0.00 C ATOM 0 H LEU A 55 -2.736 1.238 0.137 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.354 0.713 -2.744 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -1.048 1.377 -2.177 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -1.081 0.451 -0.690 1.00 0.00 H new ATOM 0 HG LEU A 55 -0.745 -1.596 -1.816 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -0.624 -1.932 -4.196 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -2.243 -1.461 -3.627 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -1.208 -0.271 -4.454 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.405 -1.182 -3.003 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.011 0.552 -3.078 1.00 0.00 H new ATOM 0 HD23 LEU A 55 1.269 -0.235 -1.503 1.00 0.00 H new ATOM 859 N LEU A 56 -4.509 -1.387 -2.211 1.00 0.00 N ATOM 860 CA LEU A 56 -5.456 -2.455 -1.933 1.00 0.00 C ATOM 861 C LEU A 56 -4.948 -3.741 -2.647 1.00 0.00 C ATOM 862 O LEU A 56 -4.519 -3.660 -3.773 1.00 0.00 O ATOM 863 CB LEU A 56 -6.791 -1.997 -2.538 1.00 0.00 C ATOM 864 CG LEU A 56 -7.845 -1.394 -1.554 1.00 0.00 C ATOM 865 CD1 LEU A 56 -8.848 -2.427 -1.043 1.00 0.00 C ATOM 866 CD2 LEU A 56 -7.180 -0.582 -0.419 1.00 0.00 C ATOM 0 H LEU A 56 -4.700 -0.937 -3.106 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.566 -2.665 -0.869 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.578 -1.252 -3.305 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -7.246 -2.851 -3.041 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.437 -0.685 -2.134 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.552 -1.946 -0.365 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -9.391 -2.855 -1.886 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.317 -3.218 -0.513 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -7.950 -0.181 0.241 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.515 -1.231 0.151 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -6.606 0.240 -0.848 1.00 0.00 H new ATOM 878 N GLY A 57 -4.934 -4.878 -1.926 1.00 0.00 N ATOM 879 CA GLY A 57 -4.826 -6.234 -2.531 1.00 0.00 C ATOM 880 C GLY A 57 -5.340 -6.226 -3.992 1.00 0.00 C ATOM 881 O GLY A 57 -6.255 -5.432 -4.311 1.00 0.00 O ATOM 0 H GLY A 57 -4.997 -4.891 -0.908 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -3.788 -6.566 -2.508 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -5.402 -6.947 -1.942 1.00 0.00 H new ATOM 885 N PRO A 58 -4.694 -7.030 -4.857 1.00 0.00 N ATOM 886 CA PRO A 58 -5.074 -7.290 -6.247 1.00 0.00 C ATOM 887 C PRO A 58 -6.046 -8.482 -6.518 1.00 0.00 C ATOM 888 O PRO A 58 -6.830 -8.429 -7.454 1.00 0.00 O ATOM 889 CB PRO A 58 -3.763 -7.390 -7.017 1.00 0.00 C ATOM 890 CG PRO A 58 -2.840 -8.062 -6.003 1.00 0.00 C ATOM 891 CD PRO A 58 -3.351 -7.648 -4.631 1.00 0.00 C ATOM 0 HA PRO A 58 -5.702 -6.467 -6.588 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -3.869 -7.983 -7.925 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -3.392 -6.410 -7.317 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -2.860 -9.146 -6.116 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -1.807 -7.746 -6.146 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -3.425 -8.509 -3.967 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -2.670 -6.939 -4.159 1.00 0.00 H new ATOM 899 N GLN A 59 -6.030 -9.413 -5.538 1.00 0.00 N ATOM 900 CA GLN A 59 -7.038 -10.435 -5.341 1.00 0.00 C ATOM 901 C GLN A 59 -8.197 -9.941 -4.454 1.00 0.00 C ATOM 902 O GLN A 59 -9.220 -10.626 -4.324 1.00 0.00 O ATOM 903 CB GLN A 59 -6.301 -11.585 -4.536 1.00 0.00 C ATOM 904 CG GLN A 59 -6.089 -11.128 -3.060 1.00 0.00 C ATOM 905 CD GLN A 59 -4.721 -11.500 -2.517 1.00 0.00 C ATOM 906 OE1 GLN A 59 -4.179 -11.002 -1.534 1.00 0.00 O ATOM 907 NE2 GLN A 59 -4.048 -12.493 -3.195 1.00 0.00 N ATOM 0 H GLN A 59 -5.281 -9.460 -4.847 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.452 -10.740 -6.302 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -6.892 -12.500 -4.564 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -5.341 -11.811 -5.000 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -6.218 -10.047 -2.998 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -6.858 -11.577 -2.432 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -4.471 -12.927 -4.015 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -3.127 -12.794 -2.876 1.00 0.00 H new ATOM 916 N ILE A 60 -8.004 -8.780 -3.809 1.00 0.00 N ATOM 917 CA ILE A 60 -9.052 -8.025 -3.035 1.00 0.00 C ATOM 918 C ILE A 60 -9.327 -6.680 -3.733 1.00 0.00 C ATOM 919 O ILE A 60 -9.987 -5.791 -3.165 1.00 0.00 O ATOM 920 CB ILE A 60 -8.603 -7.884 -1.548 1.00 0.00 C ATOM 921 CG1 ILE A 60 -7.663 -6.691 -1.331 1.00 0.00 C ATOM 922 CG2 ILE A 60 -8.115 -9.184 -0.947 1.00 0.00 C ATOM 923 CD1 ILE A 60 -8.262 -5.383 -0.864 1.00 0.00 C ATOM 0 H ILE A 60 -7.098 -8.312 -3.799 1.00 0.00 H new ATOM 0 HA ILE A 60 -9.997 -8.568 -3.019 1.00 0.00 H new ATOM 0 HB ILE A 60 -9.499 -7.646 -0.974 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.909 -6.990 -0.603 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -7.143 -6.502 -2.270 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -7.818 -9.017 0.088 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -8.915 -9.923 -0.980 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.260 -9.549 -1.516 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -7.473 -4.639 -0.757 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -8.992 -5.035 -1.595 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -8.754 -5.531 0.097 1.00 0.00 H new ATOM 935 N ALA A 61 -8.785 -6.516 -4.954 1.00 0.00 N ATOM 936 CA ALA A 61 -9.100 -5.408 -5.865 1.00 0.00 C ATOM 937 C ALA A 61 -10.497 -4.816 -5.566 1.00 0.00 C ATOM 938 O ALA A 61 -10.706 -3.644 -5.410 1.00 0.00 O ATOM 939 CB ALA A 61 -9.073 -5.879 -7.330 1.00 0.00 C ATOM 0 H ALA A 61 -8.101 -7.167 -5.340 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.341 -4.642 -5.709 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -9.309 -5.041 -7.986 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -8.081 -6.260 -7.571 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -9.810 -6.670 -7.472 1.00 0.00 H new ATOM 945 N TYR A 62 -11.492 -5.792 -5.539 1.00 0.00 N ATOM 946 CA TYR A 62 -12.941 -5.502 -5.625 1.00 0.00 C ATOM 947 C TYR A 62 -13.330 -4.360 -4.730 1.00 0.00 C ATOM 948 O TYR A 62 -14.322 -3.613 -4.909 1.00 0.00 O ATOM 949 CB TYR A 62 -13.766 -6.782 -5.399 1.00 0.00 C ATOM 950 CG TYR A 62 -13.671 -7.357 -3.964 1.00 0.00 C ATOM 951 CD1 TYR A 62 -12.558 -7.140 -3.155 1.00 0.00 C ATOM 952 CD2 TYR A 62 -14.730 -8.185 -3.546 1.00 0.00 C ATOM 953 CE1 TYR A 62 -12.477 -7.746 -1.898 1.00 0.00 C ATOM 954 CE2 TYR A 62 -14.520 -8.978 -2.409 1.00 0.00 C ATOM 955 CZ TYR A 62 -13.524 -8.602 -1.502 1.00 0.00 C ATOM 956 OH TYR A 62 -13.555 -9.090 -0.252 1.00 0.00 O ATOM 0 H TYR A 62 -11.285 -6.787 -5.457 1.00 0.00 H new ATOM 0 HA TYR A 62 -13.173 -5.165 -6.635 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -14.811 -6.571 -5.625 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -13.435 -7.543 -6.105 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -11.757 -6.503 -3.499 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -15.668 -8.208 -4.081 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -11.634 -7.563 -1.248 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -15.116 -9.862 -2.237 1.00 0.00 H new ATOM 0 HH TYR A 62 -13.020 -8.517 0.336 1.00 0.00 H new ATOM 966 N MET A 63 -12.550 -4.197 -3.609 1.00 0.00 N ATOM 967 CA MET A 63 -12.916 -3.397 -2.426 1.00 0.00 C ATOM 968 C MET A 63 -12.915 -1.882 -2.741 1.00 0.00 C ATOM 969 O MET A 63 -13.433 -1.048 -1.996 1.00 0.00 O ATOM 970 CB MET A 63 -11.983 -3.697 -1.251 1.00 0.00 C ATOM 971 CG MET A 63 -12.339 -4.958 -0.480 1.00 0.00 C ATOM 972 SD MET A 63 -12.717 -4.692 1.312 1.00 0.00 S ATOM 973 CE MET A 63 -14.443 -5.133 1.302 1.00 0.00 C ATOM 0 H MET A 63 -11.633 -4.635 -3.519 1.00 0.00 H new ATOM 0 HA MET A 63 -13.930 -3.681 -2.145 1.00 0.00 H new ATOM 0 HB2 MET A 63 -10.963 -3.789 -1.625 1.00 0.00 H new ATOM 0 HB3 MET A 63 -11.996 -2.850 -0.566 1.00 0.00 H new ATOM 0 HG2 MET A 63 -13.203 -5.425 -0.954 1.00 0.00 H new ATOM 0 HG3 MET A 63 -11.511 -5.663 -0.562 1.00 0.00 H new ATOM 0 HE1 MET A 63 -14.850 -5.033 2.308 1.00 0.00 H new ATOM 0 HE2 MET A 63 -14.984 -4.472 0.625 1.00 0.00 H new ATOM 0 HE3 MET A 63 -14.553 -6.164 0.967 1.00 0.00 H new ATOM 983 N LEU A 64 -12.248 -1.520 -3.849 1.00 0.00 N ATOM 984 CA LEU A 64 -11.654 -0.247 -4.190 1.00 0.00 C ATOM 985 C LEU A 64 -12.714 0.856 -4.341 1.00 0.00 C ATOM 986 O LEU A 64 -12.419 2.020 -3.961 1.00 0.00 O ATOM 987 CB LEU A 64 -10.960 -0.465 -5.578 1.00 0.00 C ATOM 988 CG LEU A 64 -9.758 0.417 -5.947 1.00 0.00 C ATOM 989 CD1 LEU A 64 -8.982 -0.010 -7.201 1.00 0.00 C ATOM 990 CD2 LEU A 64 -10.119 1.926 -5.945 1.00 0.00 C ATOM 0 H LEU A 64 -12.105 -2.196 -4.599 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.965 0.069 -3.407 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -10.635 -1.504 -5.625 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -11.717 -0.332 -6.351 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.044 0.249 -5.141 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.155 0.680 -7.370 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -8.591 -1.018 -7.061 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.648 0.004 -8.064 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -9.239 2.511 -6.211 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -10.911 2.112 -6.670 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -10.461 2.217 -4.952 1.00 0.00 H new ATOM 1002 N PRO A 65 -13.900 0.563 -4.890 1.00 0.00 N ATOM 1003 CA PRO A 65 -14.996 1.533 -5.181 1.00 0.00 C ATOM 1004 C PRO A 65 -15.955 1.896 -3.986 1.00 0.00 C ATOM 1005 O PRO A 65 -16.426 3.008 -3.887 1.00 0.00 O ATOM 1006 CB PRO A 65 -15.703 0.973 -6.394 1.00 0.00 C ATOM 1007 CG PRO A 65 -15.631 -0.556 -6.107 1.00 0.00 C ATOM 1008 CD PRO A 65 -14.215 -0.736 -5.520 1.00 0.00 C ATOM 0 HA PRO A 65 -14.569 2.518 -5.370 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -16.730 1.329 -6.472 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -15.201 1.241 -7.323 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -16.402 -0.871 -5.404 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -15.769 -1.143 -7.015 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -14.189 -1.546 -4.791 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -13.493 -0.984 -6.298 1.00 0.00 H new ATOM 1016 N GLU A 66 -15.985 0.950 -3.057 1.00 0.00 N ATOM 1017 CA GLU A 66 -16.354 1.172 -1.625 1.00 0.00 C ATOM 1018 C GLU A 66 -15.287 2.089 -0.966 1.00 0.00 C ATOM 1019 O GLU A 66 -15.610 3.039 -0.265 1.00 0.00 O ATOM 1020 CB GLU A 66 -16.341 -0.223 -0.929 1.00 0.00 C ATOM 1021 CG GLU A 66 -16.742 -0.153 0.532 1.00 0.00 C ATOM 1022 CD GLU A 66 -18.206 -0.558 0.825 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -19.089 -0.199 -0.007 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -18.426 -1.135 1.919 1.00 0.00 O ATOM 0 H GLU A 66 -15.752 -0.022 -3.261 1.00 0.00 H new ATOM 0 HA GLU A 66 -17.333 1.643 -1.535 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -17.020 -0.893 -1.456 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.343 -0.654 -1.007 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.079 -0.800 1.107 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -16.583 0.865 0.889 1.00 0.00 H new ATOM 1031 N ILE A 67 -14.011 1.710 -1.138 1.00 0.00 N ATOM 1032 CA ILE A 67 -12.821 2.310 -0.478 1.00 0.00 C ATOM 1033 C ILE A 67 -12.766 3.806 -0.780 1.00 0.00 C ATOM 1034 O ILE A 67 -12.289 4.637 0.013 1.00 0.00 O ATOM 1035 CB ILE A 67 -11.510 1.549 -0.835 1.00 0.00 C ATOM 1036 CG1 ILE A 67 -11.552 0.084 -0.464 1.00 0.00 C ATOM 1037 CG2 ILE A 67 -10.239 2.289 -0.331 1.00 0.00 C ATOM 1038 CD1 ILE A 67 -10.621 -0.385 0.653 1.00 0.00 C ATOM 0 H ILE A 67 -13.760 0.946 -1.765 1.00 0.00 H new ATOM 0 HA ILE A 67 -12.917 2.201 0.602 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.439 1.555 -1.923 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -12.574 -0.161 -0.176 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -11.325 -0.497 -1.358 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -9.352 1.717 -0.605 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -10.189 3.278 -0.787 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -10.284 2.392 0.753 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -10.756 -1.455 0.814 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.587 -0.188 0.371 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -10.856 0.152 1.572 1.00 0.00 H new ATOM 1050 N GLN A 68 -13.286 4.154 -1.983 1.00 0.00 N ATOM 1051 CA GLN A 68 -13.584 5.520 -2.436 1.00 0.00 C ATOM 1052 C GLN A 68 -14.757 6.120 -1.612 1.00 0.00 C ATOM 1053 O GLN A 68 -14.691 7.279 -1.195 1.00 0.00 O ATOM 1054 CB GLN A 68 -13.925 5.488 -3.916 1.00 0.00 C ATOM 1055 CG GLN A 68 -12.790 5.544 -4.911 1.00 0.00 C ATOM 1056 CD GLN A 68 -11.407 5.279 -4.280 1.00 0.00 C ATOM 1057 OE1 GLN A 68 -10.950 4.126 -4.118 1.00 0.00 O ATOM 1058 NE2 GLN A 68 -10.657 6.356 -3.925 1.00 0.00 N ATOM 0 H GLN A 68 -13.516 3.454 -2.689 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.711 6.155 -2.283 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -14.491 4.577 -4.108 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -14.591 6.326 -4.123 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -12.969 4.810 -5.697 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -12.782 6.525 -5.387 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -11.025 7.299 -4.055 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.727 6.221 -3.529 1.00 0.00 H new ATOM 1067 N ARG A 69 -15.837 5.323 -1.508 1.00 0.00 N ATOM 1068 CA ARG A 69 -17.087 5.715 -0.811 1.00 0.00 C ATOM 1069 C ARG A 69 -16.767 6.392 0.525 1.00 0.00 C ATOM 1070 O ARG A 69 -17.539 7.203 1.047 1.00 0.00 O ATOM 1071 CB ARG A 69 -18.031 4.526 -0.615 1.00 0.00 C ATOM 1072 CG ARG A 69 -19.432 4.752 -1.219 1.00 0.00 C ATOM 1073 CD ARG A 69 -19.765 3.705 -2.320 1.00 0.00 C ATOM 1074 NE ARG A 69 -19.221 4.208 -3.612 1.00 0.00 N ATOM 1075 CZ ARG A 69 -19.760 5.188 -4.366 1.00 0.00 C ATOM 1076 NH1 ARG A 69 -20.818 5.923 -3.971 1.00 0.00 N ATOM 1077 NH2 ARG A 69 -19.184 5.530 -5.545 1.00 0.00 N ATOM 0 H ARG A 69 -15.872 4.384 -1.905 1.00 0.00 H new ATOM 0 HA ARG A 69 -17.607 6.432 -1.446 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -17.587 3.640 -1.068 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -18.131 4.323 0.451 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -20.181 4.698 -0.429 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -19.487 5.755 -1.643 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -19.326 2.738 -2.072 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -20.843 3.557 -2.392 1.00 0.00 H new ATOM 0 HE ARG A 69 -18.365 3.773 -3.957 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -21.249 5.749 -3.063 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -21.188 6.653 -4.580 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -18.344 5.046 -5.861 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -19.591 6.271 -6.116 1.00 0.00 H new ATOM 1091 N LEU A 70 -15.618 6.002 1.120 1.00 0.00 N ATOM 1092 CA LEU A 70 -15.018 6.547 2.370 1.00 0.00 C ATOM 1093 C LEU A 70 -13.946 7.600 1.963 1.00 0.00 C ATOM 1094 O LEU A 70 -14.115 8.789 2.261 1.00 0.00 O ATOM 1095 CB LEU A 70 -14.289 5.318 2.994 1.00 0.00 C ATOM 1096 CG LEU A 70 -15.146 4.339 3.830 1.00 0.00 C ATOM 1097 CD1 LEU A 70 -16.681 4.729 3.819 1.00 0.00 C ATOM 1098 CD2 LEU A 70 -14.938 2.886 3.429 1.00 0.00 C ATOM 0 H LEU A 70 -15.047 5.256 0.722 1.00 0.00 H new ATOM 0 HA LEU A 70 -15.742 7.006 3.043 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -13.824 4.754 2.185 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -13.484 5.689 3.628 1.00 0.00 H new ATOM 0 HG LEU A 70 -14.794 4.435 4.857 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -17.243 4.013 4.419 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -16.805 5.728 4.236 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -17.053 4.714 2.794 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -15.564 2.244 4.049 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -15.209 2.755 2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -13.891 2.616 3.569 1.00 0.00 H new ATOM 1110 N LEU A 71 -12.811 7.133 1.365 1.00 0.00 N ATOM 1111 CA LEU A 71 -11.716 7.975 0.827 1.00 0.00 C ATOM 1112 C LEU A 71 -11.897 8.255 -0.663 1.00 0.00 C ATOM 1113 O LEU A 71 -11.315 7.529 -1.501 1.00 0.00 O ATOM 1114 CB LEU A 71 -10.433 7.112 1.021 1.00 0.00 C ATOM 1115 CG LEU A 71 -9.928 6.925 2.483 1.00 0.00 C ATOM 1116 CD1 LEU A 71 -10.842 6.049 3.368 1.00 0.00 C ATOM 1117 CD2 LEU A 71 -8.449 6.523 2.530 1.00 0.00 C ATOM 0 H LEU A 71 -12.635 6.136 1.244 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.681 8.941 1.330 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.620 6.125 0.597 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.629 7.562 0.439 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.996 7.909 2.947 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -10.415 5.972 4.368 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.831 6.502 3.430 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -10.925 5.054 2.932 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -8.137 6.403 3.568 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.311 5.582 1.998 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.846 7.298 2.057 1.00 0.00 H new ATOM 1129 N PRO A 72 -12.689 9.259 -1.041 1.00 0.00 N ATOM 1130 CA PRO A 72 -12.929 9.774 -2.405 1.00 0.00 C ATOM 1131 C PRO A 72 -12.095 11.025 -2.868 1.00 0.00 C ATOM 1132 O PRO A 72 -12.475 11.711 -3.806 1.00 0.00 O ATOM 1133 CB PRO A 72 -14.437 10.071 -2.449 1.00 0.00 C ATOM 1134 CG PRO A 72 -14.562 10.818 -1.050 1.00 0.00 C ATOM 1135 CD PRO A 72 -13.710 9.903 -0.141 1.00 0.00 C ATOM 0 HA PRO A 72 -12.589 9.019 -3.113 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -14.721 10.700 -3.293 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -15.046 9.169 -2.504 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -14.172 11.835 -1.091 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -15.596 10.886 -0.711 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -13.227 10.478 0.649 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -14.330 9.151 0.347 1.00 0.00 H new ATOM 1143 N ASN A 73 -10.910 11.108 -2.253 1.00 0.00 N ATOM 1144 CA ASN A 73 -9.799 12.001 -2.662 1.00 0.00 C ATOM 1145 C ASN A 73 -8.505 11.679 -1.943 1.00 0.00 C ATOM 1146 O ASN A 73 -7.889 12.601 -1.361 1.00 0.00 O ATOM 1147 CB ASN A 73 -10.225 13.481 -2.498 1.00 0.00 C ATOM 1148 CG ASN A 73 -10.538 13.836 -1.028 1.00 0.00 C ATOM 1149 OD1 ASN A 73 -11.514 13.201 -0.428 1.00 0.00 O flip ATOM 1150 ND2 ASN A 73 -9.837 14.669 -0.401 1.00 0.00 N flip ATOM 0 H ASN A 73 -10.682 10.544 -1.434 1.00 0.00 H new ATOM 0 HA ASN A 73 -9.589 11.827 -3.717 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -9.430 14.130 -2.866 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -11.104 13.675 -3.112 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -9.079 15.159 -0.877 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -10.026 14.856 0.584 1.00 0.00 H new ATOM 1157 N LYS A 74 -8.148 10.381 -1.887 1.00 0.00 N ATOM 1158 CA LYS A 74 -6.835 9.908 -1.414 1.00 0.00 C ATOM 1159 C LYS A 74 -6.208 8.901 -2.360 1.00 0.00 C ATOM 1160 O LYS A 74 -6.853 8.165 -3.078 1.00 0.00 O ATOM 1161 CB LYS A 74 -6.955 9.292 0.021 1.00 0.00 C ATOM 1162 CG LYS A 74 -7.325 10.409 1.024 1.00 0.00 C ATOM 1163 CD LYS A 74 -7.079 10.049 2.486 1.00 0.00 C ATOM 1164 CE LYS A 74 -5.634 10.166 2.885 1.00 0.00 C ATOM 1165 NZ LYS A 74 -4.807 10.873 1.886 1.00 0.00 N ATOM 0 H LYS A 74 -8.770 9.625 -2.172 1.00 0.00 H new ATOM 0 HA LYS A 74 -6.179 10.778 -1.381 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.715 8.511 0.032 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -6.013 8.825 0.309 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -6.751 11.303 0.781 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -8.378 10.661 0.897 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -7.679 10.701 3.121 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -7.418 9.029 2.665 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -5.569 10.692 3.838 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -5.226 9.168 3.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -3.853 11.025 2.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -4.745 10.301 1.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -5.241 11.792 1.664 1.00 0.00 H new ATOM 1179 N PRO A 75 -4.841 8.917 -2.371 1.00 0.00 N ATOM 1180 CA PRO A 75 -3.993 7.903 -3.001 1.00 0.00 C ATOM 1181 C PRO A 75 -4.278 6.392 -2.718 1.00 0.00 C ATOM 1182 O PRO A 75 -3.410 5.618 -2.371 1.00 0.00 O ATOM 1183 CB PRO A 75 -2.577 8.296 -2.790 1.00 0.00 C ATOM 1184 CG PRO A 75 -2.557 9.578 -2.042 1.00 0.00 C ATOM 1185 CD PRO A 75 -4.026 10.077 -1.955 1.00 0.00 C ATOM 0 HA PRO A 75 -4.263 7.916 -4.057 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.047 7.523 -2.233 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -2.067 8.406 -3.747 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -2.138 9.436 -1.046 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.930 10.311 -2.550 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -4.277 10.395 -0.943 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -4.193 10.933 -2.609 1.00 0.00 H new ATOM 1193 N VAL A 76 -5.485 6.022 -3.186 1.00 0.00 N ATOM 1194 CA VAL A 76 -5.974 4.640 -3.316 1.00 0.00 C ATOM 1195 C VAL A 76 -5.558 4.058 -4.690 1.00 0.00 C ATOM 1196 O VAL A 76 -6.035 4.452 -5.760 1.00 0.00 O ATOM 1197 CB VAL A 76 -7.474 4.606 -3.023 1.00 0.00 C ATOM 1198 CG1 VAL A 76 -8.127 3.201 -2.922 1.00 0.00 C ATOM 1199 CG2 VAL A 76 -7.852 5.475 -1.803 1.00 0.00 C ATOM 0 H VAL A 76 -6.173 6.708 -3.496 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.512 3.983 -2.579 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.904 5.042 -3.925 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -9.191 3.309 -2.712 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.995 2.670 -3.865 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.654 2.637 -2.119 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.928 5.418 -1.635 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -7.327 5.110 -0.920 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.568 6.510 -1.992 1.00 0.00 H new ATOM 1209 N GLU A 77 -4.528 3.188 -4.654 1.00 0.00 N ATOM 1210 CA GLU A 77 -4.025 2.379 -5.774 1.00 0.00 C ATOM 1211 C GLU A 77 -3.810 0.895 -5.350 1.00 0.00 C ATOM 1212 O GLU A 77 -3.183 0.605 -4.332 1.00 0.00 O ATOM 1213 CB GLU A 77 -2.785 2.998 -6.403 1.00 0.00 C ATOM 1214 CG GLU A 77 -3.098 3.659 -7.780 1.00 0.00 C ATOM 1215 CD GLU A 77 -4.288 4.626 -7.732 1.00 0.00 C ATOM 1216 OE1 GLU A 77 -4.200 5.646 -7.003 1.00 0.00 O ATOM 1217 OE2 GLU A 77 -5.277 4.318 -8.450 1.00 0.00 O ATOM 0 H GLU A 77 -4.000 3.025 -3.797 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.789 2.373 -6.551 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -2.371 3.746 -5.727 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -2.023 2.230 -6.534 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -2.215 4.197 -8.126 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -3.303 2.878 -8.512 1.00 0.00 H new ATOM 1224 N VAL A 78 -4.486 -0.031 -6.066 1.00 0.00 N ATOM 1225 CA VAL A 78 -4.324 -1.478 -5.913 1.00 0.00 C ATOM 1226 C VAL A 78 -2.867 -1.894 -6.101 1.00 0.00 C ATOM 1227 O VAL A 78 -2.048 -1.179 -6.703 1.00 0.00 O ATOM 1228 CB VAL A 78 -5.304 -2.224 -6.829 1.00 0.00 C ATOM 1229 CG1 VAL A 78 -6.680 -2.540 -6.222 1.00 0.00 C ATOM 1230 CG2 VAL A 78 -5.424 -1.596 -8.231 1.00 0.00 C ATOM 0 H VAL A 78 -5.171 0.221 -6.778 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.578 -1.763 -4.892 1.00 0.00 H new ATOM 0 HB VAL A 78 -4.830 -3.199 -6.945 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.289 -3.067 -6.956 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -6.553 -3.166 -5.339 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -7.175 -1.611 -5.940 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.132 -2.171 -8.828 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.776 -0.568 -8.140 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -4.449 -1.604 -8.718 1.00 0.00 H new ATOM 1240 N ILE A 79 -2.498 -3.086 -5.564 1.00 0.00 N ATOM 1241 CA ILE A 79 -1.219 -3.777 -5.765 1.00 0.00 C ATOM 1242 C ILE A 79 -1.145 -4.410 -7.145 1.00 0.00 C ATOM 1243 O ILE A 79 -2.124 -4.395 -7.909 1.00 0.00 O ATOM 1244 CB ILE A 79 -0.812 -4.648 -4.547 1.00 0.00 C ATOM 1245 CG1 ILE A 79 -1.577 -4.384 -3.285 1.00 0.00 C ATOM 1246 CG2 ILE A 79 0.720 -4.751 -4.390 1.00 0.00 C ATOM 1247 CD1 ILE A 79 -0.946 -4.559 -1.922 1.00 0.00 C ATOM 0 H ILE A 79 -3.123 -3.608 -4.950 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.411 -3.046 -5.785 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.143 -5.659 -4.786 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -1.930 -3.354 -3.340 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.458 -5.025 -3.310 1.00 0.00 H new ATOM 0 HG21 ILE A 79 0.956 -5.370 -3.525 1.00 0.00 H new ATOM 0 HG22 ILE A 79 1.148 -5.201 -5.286 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.139 -3.755 -4.249 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.675 -4.315 -1.149 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -0.622 -5.593 -1.801 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -0.086 -3.896 -1.831 1.00 0.00 H new ATOM 1259 N ASP A 80 0.036 -4.920 -7.487 1.00 0.00 N ATOM 1260 CA ASP A 80 0.323 -5.958 -8.503 1.00 0.00 C ATOM 1261 C ASP A 80 0.630 -7.307 -7.790 1.00 0.00 C ATOM 1262 O ASP A 80 1.342 -7.355 -6.791 1.00 0.00 O ATOM 1263 CB ASP A 80 1.587 -5.535 -9.306 1.00 0.00 C ATOM 1264 CG ASP A 80 1.339 -4.992 -10.697 1.00 0.00 C ATOM 1265 OD1 ASP A 80 0.270 -5.369 -11.312 1.00 0.00 O ATOM 1266 OD2 ASP A 80 2.147 -4.169 -11.208 1.00 0.00 O ATOM 0 H ASP A 80 0.891 -4.600 -7.032 1.00 0.00 H new ATOM 0 HA ASP A 80 -0.536 -6.070 -9.165 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.121 -4.778 -8.732 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.247 -6.398 -9.387 1.00 0.00 H new ATOM 1271 N SER A 81 -0.129 -8.328 -8.222 1.00 0.00 N ATOM 1272 CA SER A 81 -0.367 -9.619 -7.493 1.00 0.00 C ATOM 1273 C SER A 81 0.879 -10.513 -7.560 1.00 0.00 C ATOM 1274 O SER A 81 1.026 -11.472 -6.792 1.00 0.00 O ATOM 1275 CB SER A 81 -1.537 -10.277 -8.246 1.00 0.00 C ATOM 1276 OG SER A 81 -1.693 -11.626 -7.965 1.00 0.00 O ATOM 0 H SER A 81 -0.617 -8.292 -9.117 1.00 0.00 H new ATOM 0 HA SER A 81 -0.585 -9.463 -6.436 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.459 -9.754 -7.995 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.383 -10.154 -9.318 1.00 0.00 H new ATOM 0 HG SER A 81 -2.452 -11.980 -8.473 1.00 0.00 H new ATOM 1282 N LEU A 82 1.824 -10.093 -8.423 1.00 0.00 N ATOM 1283 CA LEU A 82 3.141 -10.778 -8.714 1.00 0.00 C ATOM 1284 C LEU A 82 4.208 -10.068 -7.854 1.00 0.00 C ATOM 1285 O LEU A 82 4.921 -10.683 -7.118 1.00 0.00 O ATOM 1286 CB LEU A 82 3.351 -10.549 -10.194 1.00 0.00 C ATOM 1287 CG LEU A 82 4.673 -10.480 -10.913 1.00 0.00 C ATOM 1288 CD1 LEU A 82 5.932 -10.260 -10.026 1.00 0.00 C ATOM 1289 CD2 LEU A 82 4.890 -11.682 -11.891 1.00 0.00 C ATOM 0 H LEU A 82 1.707 -9.238 -8.967 1.00 0.00 H new ATOM 0 HA LEU A 82 3.181 -11.843 -8.485 1.00 0.00 H new ATOM 0 HB2 LEU A 82 2.788 -11.338 -10.694 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.848 -9.608 -10.418 1.00 0.00 H new ATOM 0 HG LEU A 82 4.577 -9.561 -11.490 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.820 -10.228 -10.657 1.00 0.00 H new ATOM 0 HD12 LEU A 82 5.836 -9.318 -9.486 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.022 -11.079 -9.313 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.858 -11.581 -12.382 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.863 -12.617 -11.331 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.101 -11.687 -12.643 1.00 0.00 H new ATOM 1301 N LEU A 83 4.291 -8.698 -8.010 1.00 0.00 N ATOM 1302 CA LEU A 83 5.142 -7.793 -7.175 1.00 0.00 C ATOM 1303 C LEU A 83 4.654 -7.974 -5.715 1.00 0.00 C ATOM 1304 O LEU A 83 5.475 -7.971 -4.784 1.00 0.00 O ATOM 1305 CB LEU A 83 4.776 -6.365 -7.675 1.00 0.00 C ATOM 1306 CG LEU A 83 5.144 -5.897 -9.055 1.00 0.00 C ATOM 1307 CD1 LEU A 83 5.792 -4.496 -9.195 1.00 0.00 C ATOM 1308 CD2 LEU A 83 5.835 -6.976 -9.922 1.00 0.00 C ATOM 0 H LEU A 83 3.763 -8.198 -8.725 1.00 0.00 H new ATOM 0 HA LEU A 83 6.214 -7.981 -7.235 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.694 -6.266 -7.585 1.00 0.00 H new ATOM 0 HB3 LEU A 83 5.220 -5.660 -6.973 1.00 0.00 H new ATOM 0 HG LEU A 83 4.155 -5.730 -9.482 1.00 0.00 H new ATOM 0 HD11 LEU A 83 6.002 -4.296 -10.246 1.00 0.00 H new ATOM 0 HD12 LEU A 83 5.108 -3.739 -8.811 1.00 0.00 H new ATOM 0 HD13 LEU A 83 6.722 -4.467 -8.627 1.00 0.00 H new ATOM 0 HD21 LEU A 83 6.069 -6.560 -10.902 1.00 0.00 H new ATOM 0 HD22 LEU A 83 6.756 -7.299 -9.436 1.00 0.00 H new ATOM 0 HD23 LEU A 83 5.168 -7.830 -10.040 1.00 0.00 H new ATOM 1320 N TYR A 84 3.328 -8.062 -5.492 1.00 0.00 N ATOM 1321 CA TYR A 84 2.637 -8.400 -4.240 1.00 0.00 C ATOM 1322 C TYR A 84 3.288 -9.597 -3.539 1.00 0.00 C ATOM 1323 O TYR A 84 3.871 -9.484 -2.437 1.00 0.00 O ATOM 1324 CB TYR A 84 1.121 -8.583 -4.475 1.00 0.00 C ATOM 1325 CG TYR A 84 0.294 -8.850 -3.200 1.00 0.00 C ATOM 1326 CD1 TYR A 84 0.302 -7.908 -2.154 1.00 0.00 C ATOM 1327 CD2 TYR A 84 -0.409 -10.049 -3.118 1.00 0.00 C ATOM 1328 CE1 TYR A 84 -0.268 -8.269 -0.909 1.00 0.00 C ATOM 1329 CE2 TYR A 84 -1.036 -10.377 -1.905 1.00 0.00 C ATOM 1330 CZ TYR A 84 -0.882 -9.527 -0.816 1.00 0.00 C ATOM 1331 OH TYR A 84 -1.370 -9.926 0.398 1.00 0.00 O ATOM 0 H TYR A 84 2.663 -7.884 -6.245 1.00 0.00 H new ATOM 0 HA TYR A 84 2.745 -7.560 -3.554 1.00 0.00 H new ATOM 0 HB2 TYR A 84 0.733 -7.688 -4.962 1.00 0.00 H new ATOM 0 HB3 TYR A 84 0.973 -9.412 -5.167 1.00 0.00 H new ATOM 0 HD1 TYR A 84 0.734 -6.929 -2.298 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.471 -10.712 -3.968 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -0.231 -7.600 -0.062 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -1.629 -11.276 -1.820 1.00 0.00 H new ATOM 0 HH TYR A 84 -0.943 -9.405 1.110 1.00 0.00 H new ATOM 1341 N GLY A 85 3.055 -10.789 -4.134 1.00 0.00 N ATOM 1342 CA GLY A 85 3.489 -12.083 -3.595 1.00 0.00 C ATOM 1343 C GLY A 85 4.905 -12.488 -3.993 1.00 0.00 C ATOM 1344 O GLY A 85 5.412 -13.546 -3.572 1.00 0.00 O ATOM 0 H GLY A 85 2.551 -10.872 -5.017 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.426 -12.050 -2.507 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.796 -12.854 -3.931 1.00 0.00 H new ATOM 1348 N LYS A 86 5.543 -11.632 -4.845 1.00 0.00 N ATOM 1349 CA LYS A 86 6.993 -11.663 -5.061 1.00 0.00 C ATOM 1350 C LYS A 86 7.686 -10.397 -4.474 1.00 0.00 C ATOM 1351 O LYS A 86 8.779 -10.041 -4.846 1.00 0.00 O ATOM 1352 CB LYS A 86 7.330 -11.810 -6.538 1.00 0.00 C ATOM 1353 CG LYS A 86 6.567 -12.966 -7.181 1.00 0.00 C ATOM 1354 CD LYS A 86 7.156 -13.528 -8.484 1.00 0.00 C ATOM 1355 CE LYS A 86 6.324 -14.798 -8.860 1.00 0.00 C ATOM 1356 NZ LYS A 86 7.282 -15.819 -9.345 1.00 0.00 N ATOM 0 H LYS A 86 5.060 -10.916 -5.387 1.00 0.00 H new ATOM 0 HA LYS A 86 7.375 -12.536 -4.532 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.092 -10.883 -7.059 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.402 -11.974 -6.652 1.00 0.00 H new ATOM 0 HG2 LYS A 86 6.502 -13.778 -6.457 1.00 0.00 H new ATOM 0 HG3 LYS A 86 5.548 -12.634 -7.381 1.00 0.00 H new ATOM 0 HD2 LYS A 86 7.105 -12.786 -9.280 1.00 0.00 H new ATOM 0 HD3 LYS A 86 8.208 -13.783 -8.352 1.00 0.00 H new ATOM 0 HE2 LYS A 86 5.773 -15.167 -7.995 1.00 0.00 H new ATOM 0 HE3 LYS A 86 5.589 -14.563 -9.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 6.766 -16.683 -9.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 7.788 -15.453 -10.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 7.966 -16.039 -8.593 1.00 0.00 H new ATOM 1370 N VAL A 87 6.916 -9.726 -3.581 1.00 0.00 N ATOM 1371 CA VAL A 87 7.483 -8.932 -2.466 1.00 0.00 C ATOM 1372 C VAL A 87 8.514 -7.930 -2.994 1.00 0.00 C ATOM 1373 O VAL A 87 9.673 -7.858 -2.528 1.00 0.00 O ATOM 1374 CB VAL A 87 8.002 -9.857 -1.349 1.00 0.00 C ATOM 1375 CG1 VAL A 87 6.851 -10.542 -0.551 1.00 0.00 C ATOM 1376 CG2 VAL A 87 8.906 -10.973 -1.962 1.00 0.00 C ATOM 0 H VAL A 87 5.897 -9.720 -3.614 1.00 0.00 H new ATOM 0 HA VAL A 87 6.701 -8.331 -2.002 1.00 0.00 H new ATOM 0 HB VAL A 87 8.566 -9.228 -0.660 1.00 0.00 H new ATOM 0 HG11 VAL A 87 7.275 -11.182 0.223 1.00 0.00 H new ATOM 0 HG12 VAL A 87 6.225 -9.779 -0.088 1.00 0.00 H new ATOM 0 HG13 VAL A 87 6.247 -11.145 -1.229 1.00 0.00 H new ATOM 0 HG21 VAL A 87 9.270 -11.624 -1.167 1.00 0.00 H new ATOM 0 HG22 VAL A 87 8.327 -11.560 -2.675 1.00 0.00 H new ATOM 0 HG23 VAL A 87 9.753 -10.515 -2.473 1.00 0.00 H new ATOM 1386 N ASP A 88 8.137 -7.165 -4.030 1.00 0.00 N ATOM 1387 CA ASP A 88 8.913 -6.363 -4.967 1.00 0.00 C ATOM 1388 C ASP A 88 9.523 -5.110 -4.331 1.00 0.00 C ATOM 1389 O ASP A 88 9.712 -4.048 -4.964 1.00 0.00 O ATOM 1390 CB ASP A 88 8.045 -5.975 -6.182 1.00 0.00 C ATOM 1391 CG ASP A 88 8.547 -6.593 -7.506 1.00 0.00 C ATOM 1392 OD1 ASP A 88 9.609 -6.012 -8.004 1.00 0.00 O ATOM 1393 OD2 ASP A 88 7.961 -7.562 -7.971 1.00 0.00 O ATOM 0 H ASP A 88 7.144 -7.091 -4.252 1.00 0.00 H new ATOM 0 HA ASP A 88 9.748 -6.985 -5.291 1.00 0.00 H new ATOM 0 HB2 ASP A 88 7.018 -6.295 -6.005 1.00 0.00 H new ATOM 0 HB3 ASP A 88 8.029 -4.889 -6.278 1.00 0.00 H new ATOM 1398 N GLY A 89 9.725 -5.170 -2.996 1.00 0.00 N ATOM 1399 CA GLY A 89 10.785 -4.441 -2.278 1.00 0.00 C ATOM 1400 C GLY A 89 11.734 -3.639 -3.166 1.00 0.00 C ATOM 1401 O GLY A 89 12.899 -4.022 -3.420 1.00 0.00 O ATOM 0 H GLY A 89 9.143 -5.738 -2.380 1.00 0.00 H new ATOM 0 HA2 GLY A 89 10.318 -3.762 -1.565 1.00 0.00 H new ATOM 0 HA3 GLY A 89 11.370 -5.157 -1.701 1.00 0.00 H new ATOM 1405 N LEU A 90 11.215 -2.508 -3.702 1.00 0.00 N ATOM 1406 CA LEU A 90 11.912 -1.401 -4.352 1.00 0.00 C ATOM 1407 C LEU A 90 10.987 -0.851 -5.492 1.00 0.00 C ATOM 1408 O LEU A 90 11.100 0.302 -5.820 1.00 0.00 O ATOM 1409 CB LEU A 90 13.169 -2.003 -5.052 1.00 0.00 C ATOM 1410 CG LEU A 90 14.262 -0.996 -5.502 1.00 0.00 C ATOM 1411 CD1 LEU A 90 14.676 -1.156 -6.989 1.00 0.00 C ATOM 1412 CD2 LEU A 90 13.882 0.451 -5.149 1.00 0.00 C ATOM 0 H LEU A 90 10.208 -2.345 -3.682 1.00 0.00 H new ATOM 0 HA LEU A 90 12.169 -0.622 -3.634 1.00 0.00 H new ATOM 0 HB2 LEU A 90 13.627 -2.721 -4.372 1.00 0.00 H new ATOM 0 HB3 LEU A 90 12.837 -2.560 -5.928 1.00 0.00 H new ATOM 0 HG LEU A 90 15.156 -1.244 -4.929 1.00 0.00 H new ATOM 0 HD11 LEU A 90 15.442 -0.421 -7.234 1.00 0.00 H new ATOM 0 HD12 LEU A 90 15.070 -2.159 -7.151 1.00 0.00 H new ATOM 0 HD13 LEU A 90 13.806 -1.000 -7.628 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.672 1.126 -5.480 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.948 0.714 -5.646 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.756 0.541 -4.070 1.00 0.00 H new ATOM 1424 N GLY A 91 10.156 -1.741 -6.056 1.00 0.00 N ATOM 1425 CA GLY A 91 9.138 -1.433 -7.077 1.00 0.00 C ATOM 1426 C GLY A 91 7.759 -1.139 -6.387 1.00 0.00 C ATOM 1427 O GLY A 91 6.908 -0.529 -7.009 1.00 0.00 O ATOM 0 H GLY A 91 10.174 -2.730 -5.806 1.00 0.00 H new ATOM 0 HA2 GLY A 91 9.451 -0.571 -7.666 1.00 0.00 H new ATOM 0 HA3 GLY A 91 9.038 -2.271 -7.767 1.00 0.00 H new ATOM 1431 N VAL A 92 7.659 -1.648 -5.136 1.00 0.00 N ATOM 1432 CA VAL A 92 6.413 -1.516 -4.317 1.00 0.00 C ATOM 1433 C VAL A 92 6.422 -0.158 -3.603 1.00 0.00 C ATOM 1434 O VAL A 92 5.401 0.475 -3.340 1.00 0.00 O ATOM 1435 CB VAL A 92 6.255 -2.743 -3.396 1.00 0.00 C ATOM 1436 CG1 VAL A 92 5.038 -2.612 -2.418 1.00 0.00 C ATOM 1437 CG2 VAL A 92 6.196 -4.069 -4.163 1.00 0.00 C ATOM 0 H VAL A 92 8.414 -2.150 -4.669 1.00 0.00 H new ATOM 0 HA VAL A 92 5.520 -1.518 -4.942 1.00 0.00 H new ATOM 0 HB VAL A 92 7.163 -2.761 -2.793 1.00 0.00 H new ATOM 0 HG11 VAL A 92 4.975 -3.504 -1.794 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.173 -1.735 -1.785 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.118 -2.506 -2.994 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.084 -4.893 -3.458 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.346 -4.057 -4.845 1.00 0.00 H new ATOM 0 HG23 VAL A 92 7.116 -4.201 -4.733 1.00 0.00 H new ATOM 1447 N LEU A 93 7.659 0.256 -3.219 1.00 0.00 N ATOM 1448 CA LEU A 93 7.991 1.653 -2.787 1.00 0.00 C ATOM 1449 C LEU A 93 7.741 2.602 -3.962 1.00 0.00 C ATOM 1450 O LEU A 93 6.828 3.429 -3.855 1.00 0.00 O ATOM 1451 CB LEU A 93 9.475 1.633 -2.395 1.00 0.00 C ATOM 1452 CG LEU A 93 9.974 2.475 -1.200 1.00 0.00 C ATOM 1453 CD1 LEU A 93 9.532 1.891 0.189 1.00 0.00 C ATOM 1454 CD2 LEU A 93 11.481 2.770 -1.256 1.00 0.00 C ATOM 0 H LEU A 93 8.464 -0.370 -3.198 1.00 0.00 H new ATOM 0 HA LEU A 93 7.382 1.993 -1.949 1.00 0.00 H new ATOM 0 HB2 LEU A 93 9.742 0.596 -2.193 1.00 0.00 H new ATOM 0 HB3 LEU A 93 10.045 1.945 -3.270 1.00 0.00 H new ATOM 0 HG LEU A 93 9.474 3.439 -1.299 1.00 0.00 H new ATOM 0 HD11 LEU A 93 9.913 2.526 0.989 1.00 0.00 H new ATOM 0 HD12 LEU A 93 8.444 1.857 0.240 1.00 0.00 H new ATOM 0 HD13 LEU A 93 9.932 0.884 0.304 1.00 0.00 H new ATOM 0 HD21 LEU A 93 11.768 3.365 -0.389 1.00 0.00 H new ATOM 0 HD22 LEU A 93 12.036 1.832 -1.252 1.00 0.00 H new ATOM 0 HD23 LEU A 93 11.710 3.323 -2.167 1.00 0.00 H new ATOM 1466 N LYS A 94 8.503 2.507 -5.048 1.00 0.00 N ATOM 1467 CA LYS A 94 8.147 3.108 -6.357 1.00 0.00 C ATOM 1468 C LYS A 94 6.635 3.137 -6.623 1.00 0.00 C ATOM 1469 O LYS A 94 6.068 4.191 -6.953 1.00 0.00 O ATOM 1470 CB LYS A 94 8.878 2.410 -7.523 1.00 0.00 C ATOM 1471 CG LYS A 94 9.559 3.467 -8.426 1.00 0.00 C ATOM 1472 CD LYS A 94 11.070 3.651 -8.169 1.00 0.00 C ATOM 1473 CE LYS A 94 11.836 2.408 -8.641 1.00 0.00 C ATOM 1474 NZ LYS A 94 12.549 2.746 -9.926 1.00 0.00 N ATOM 0 H LYS A 94 9.394 2.010 -5.058 1.00 0.00 H new ATOM 0 HA LYS A 94 8.482 4.144 -6.299 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.624 1.717 -7.133 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.170 1.822 -8.107 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.412 3.184 -9.468 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.060 4.425 -8.282 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.432 4.534 -8.696 1.00 0.00 H new ATOM 0 HD3 LYS A 94 11.249 3.818 -7.107 1.00 0.00 H new ATOM 0 HE2 LYS A 94 12.552 2.093 -7.882 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.149 1.576 -8.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.074 1.913 -10.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.853 3.029 -10.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 13.212 3.530 -9.759 1.00 0.00 H new ATOM 1488 N ALA A 95 6.007 1.953 -6.510 1.00 0.00 N ATOM 1489 CA ALA A 95 4.598 1.717 -6.926 1.00 0.00 C ATOM 1490 C ALA A 95 3.635 2.679 -6.248 1.00 0.00 C ATOM 1491 O ALA A 95 2.562 3.002 -6.769 1.00 0.00 O ATOM 1492 CB ALA A 95 4.201 0.262 -6.727 1.00 0.00 C ATOM 0 H ALA A 95 6.459 1.123 -6.126 1.00 0.00 H new ATOM 0 HA ALA A 95 4.532 1.923 -7.994 1.00 0.00 H new ATOM 0 HB1 ALA A 95 3.166 0.121 -7.040 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.851 -0.377 -7.324 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.301 -0.002 -5.674 1.00 0.00 H new ATOM 1498 N ALA A 96 4.011 3.139 -5.026 1.00 0.00 N ATOM 1499 CA ALA A 96 3.450 4.339 -4.371 1.00 0.00 C ATOM 1500 C ALA A 96 3.893 5.620 -5.094 1.00 0.00 C ATOM 1501 O ALA A 96 3.092 6.404 -5.590 1.00 0.00 O ATOM 1502 CB ALA A 96 3.836 4.392 -2.910 1.00 0.00 C ATOM 0 H ALA A 96 4.724 2.675 -4.463 1.00 0.00 H new ATOM 0 HA ALA A 96 2.364 4.272 -4.433 1.00 0.00 H new ATOM 0 HB1 ALA A 96 3.410 5.285 -2.453 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.455 3.507 -2.401 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.922 4.422 -2.821 1.00 0.00 H new ATOM 1508 N VAL A 97 5.248 5.828 -5.044 1.00 0.00 N ATOM 1509 CA VAL A 97 5.918 6.984 -5.666 1.00 0.00 C ATOM 1510 C VAL A 97 5.129 7.363 -6.971 1.00 0.00 C ATOM 1511 O VAL A 97 4.680 8.465 -7.160 1.00 0.00 O ATOM 1512 CB VAL A 97 7.399 6.682 -5.886 1.00 0.00 C ATOM 1513 CG1 VAL A 97 8.085 5.795 -4.792 1.00 0.00 C ATOM 1514 CG2 VAL A 97 7.747 6.135 -7.314 1.00 0.00 C ATOM 0 H VAL A 97 5.890 5.193 -4.570 1.00 0.00 H new ATOM 0 HA VAL A 97 5.903 7.858 -5.014 1.00 0.00 H new ATOM 0 HB VAL A 97 7.830 7.679 -5.791 1.00 0.00 H new ATOM 0 HG11 VAL A 97 9.133 5.645 -5.050 1.00 0.00 H new ATOM 0 HG12 VAL A 97 8.017 6.293 -3.825 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.583 4.829 -4.739 1.00 0.00 H new ATOM 0 HG21 VAL A 97 8.819 5.948 -7.381 1.00 0.00 H new ATOM 0 HG22 VAL A 97 7.205 5.206 -7.490 1.00 0.00 H new ATOM 0 HG23 VAL A 97 7.459 6.870 -8.065 1.00 0.00 H new ATOM 1524 N ALA A 98 5.088 6.357 -7.882 1.00 0.00 N ATOM 1525 CA ALA A 98 4.452 6.443 -9.196 1.00 0.00 C ATOM 1526 C ALA A 98 2.930 6.477 -9.141 1.00 0.00 C ATOM 1527 O ALA A 98 2.228 6.915 -10.066 1.00 0.00 O ATOM 1528 CB ALA A 98 4.915 5.336 -10.136 1.00 0.00 C ATOM 0 H ALA A 98 5.511 5.446 -7.706 1.00 0.00 H new ATOM 0 HA ALA A 98 4.780 7.403 -9.596 1.00 0.00 H new ATOM 0 HB1 ALA A 98 4.415 5.443 -11.098 1.00 0.00 H new ATOM 0 HB2 ALA A 98 5.993 5.407 -10.278 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.669 4.366 -9.705 1.00 0.00 H new ATOM 1534 N ALA A 99 2.366 5.994 -8.011 1.00 0.00 N ATOM 1535 CA ALA A 99 1.021 6.247 -7.523 1.00 0.00 C ATOM 1536 C ALA A 99 0.813 7.777 -7.249 1.00 0.00 C ATOM 1537 O ALA A 99 -0.242 8.324 -7.575 1.00 0.00 O ATOM 1538 CB ALA A 99 0.668 5.443 -6.289 1.00 0.00 C ATOM 0 H ALA A 99 2.885 5.378 -7.385 1.00 0.00 H new ATOM 0 HA ALA A 99 0.345 5.920 -8.313 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.349 5.681 -5.979 1.00 0.00 H new ATOM 0 HB2 ALA A 99 0.739 4.379 -6.515 1.00 0.00 H new ATOM 0 HB3 ALA A 99 1.360 5.690 -5.484 1.00 0.00 H new ATOM 1544 N ILE A 100 1.844 8.368 -6.677 1.00 0.00 N ATOM 1545 CA ILE A 100 1.878 9.785 -6.176 1.00 0.00 C ATOM 1546 C ILE A 100 1.768 10.745 -7.381 1.00 0.00 C ATOM 1547 O ILE A 100 0.805 11.461 -7.561 1.00 0.00 O ATOM 1548 CB ILE A 100 3.135 10.024 -5.294 1.00 0.00 C ATOM 1549 CG1 ILE A 100 2.832 9.762 -3.799 1.00 0.00 C ATOM 1550 CG2 ILE A 100 3.856 11.328 -5.555 1.00 0.00 C ATOM 1551 CD1 ILE A 100 3.838 10.332 -2.792 1.00 0.00 C ATOM 0 H ILE A 100 2.728 7.882 -6.529 1.00 0.00 H new ATOM 0 HA ILE A 100 1.026 9.984 -5.526 1.00 0.00 H new ATOM 0 HB ILE A 100 3.866 9.278 -5.607 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.849 10.175 -3.572 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.768 8.685 -3.647 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.718 11.406 -4.893 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.191 11.358 -6.592 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.179 12.162 -5.368 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.519 10.085 -1.779 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.822 9.902 -2.978 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.889 11.415 -2.902 1.00 0.00 H new ATOM 1563 N LYS A 101 2.862 10.717 -8.202 1.00 0.00 N ATOM 1564 CA LYS A 101 2.860 11.311 -9.561 1.00 0.00 C ATOM 1565 C LYS A 101 1.519 11.073 -10.305 1.00 0.00 C ATOM 1566 O LYS A 101 0.921 12.001 -10.828 1.00 0.00 O ATOM 1567 CB LYS A 101 4.039 10.797 -10.408 1.00 0.00 C ATOM 1568 CG LYS A 101 4.314 11.754 -11.600 1.00 0.00 C ATOM 1569 CD LYS A 101 5.434 11.338 -12.536 1.00 0.00 C ATOM 1570 CE LYS A 101 4.878 10.974 -13.928 1.00 0.00 C ATOM 1571 NZ LYS A 101 5.910 11.151 -14.967 1.00 0.00 N ATOM 0 H LYS A 101 3.750 10.289 -7.940 1.00 0.00 H new ATOM 0 HA LYS A 101 2.978 12.386 -9.424 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.931 10.715 -9.787 1.00 0.00 H new ATOM 0 HB3 LYS A 101 3.817 9.797 -10.781 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.397 11.852 -12.182 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.546 12.742 -11.202 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.157 12.149 -12.629 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.966 10.484 -12.117 1.00 0.00 H new ATOM 0 HE2 LYS A 101 4.530 9.941 -13.927 1.00 0.00 H new ATOM 0 HE3 LYS A 101 4.016 11.601 -14.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.514 10.900 -15.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.223 12.143 -14.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 6.721 10.535 -14.759 1.00 0.00 H new ATOM 1585 N LYS A 102 1.125 9.785 -10.363 1.00 0.00 N ATOM 1586 CA LYS A 102 -0.005 9.314 -11.232 1.00 0.00 C ATOM 1587 C LYS A 102 -1.320 10.021 -10.904 1.00 0.00 C ATOM 1588 O LYS A 102 -2.251 10.074 -11.742 1.00 0.00 O ATOM 1589 CB LYS A 102 -0.135 7.802 -11.206 1.00 0.00 C ATOM 1590 CG LYS A 102 -1.265 7.289 -10.326 1.00 0.00 C ATOM 1591 CD LYS A 102 -2.554 6.868 -11.102 1.00 0.00 C ATOM 1592 CE LYS A 102 -2.401 5.409 -11.542 1.00 0.00 C ATOM 1593 NZ LYS A 102 -2.691 5.298 -13.006 1.00 0.00 N ATOM 0 H LYS A 102 1.565 9.041 -9.822 1.00 0.00 H new ATOM 0 HA LYS A 102 0.239 9.592 -12.257 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.291 7.444 -12.224 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.805 7.374 -10.858 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.904 6.433 -9.756 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.527 8.064 -9.606 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -3.433 6.982 -10.467 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.701 7.512 -11.969 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -1.390 5.059 -11.333 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -3.082 4.774 -10.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -2.587 4.308 -13.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -3.663 5.617 -13.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -2.024 5.893 -13.538 1.00 0.00 H new ATOM 1607 N ALA A 103 -1.435 10.498 -9.660 1.00 0.00 N ATOM 1608 CA ALA A 103 -2.513 11.405 -9.175 1.00 0.00 C ATOM 1609 C ALA A 103 -2.548 12.702 -10.025 1.00 0.00 C ATOM 1610 O ALA A 103 -3.551 13.421 -10.032 1.00 0.00 O ATOM 1611 CB ALA A 103 -2.341 11.744 -7.703 1.00 0.00 C ATOM 0 H ALA A 103 -0.764 10.263 -8.929 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.462 10.880 -9.285 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.146 12.407 -7.386 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.372 10.828 -7.113 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.382 12.240 -7.554 1.00 0.00 H new ATOM 1617 N ALA A 104 -1.421 12.993 -10.705 1.00 0.00 N ATOM 1618 CA ALA A 104 -1.300 14.012 -11.754 1.00 0.00 C ATOM 1619 C ALA A 104 -1.925 15.353 -11.299 1.00 0.00 C ATOM 1620 O ALA A 104 -3.097 15.610 -11.507 1.00 0.00 O ATOM 1621 CB ALA A 104 -1.983 13.561 -13.057 1.00 0.00 C ATOM 0 H ALA A 104 -0.543 12.505 -10.529 1.00 0.00 H new ATOM 0 HA ALA A 104 -0.235 14.151 -11.940 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -1.875 14.339 -13.813 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -1.517 12.642 -13.413 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.042 13.382 -12.870 1.00 0.00 H new ATOM 1627 N ALA A 105 -1.097 16.181 -10.616 1.00 0.00 N ATOM 1628 CA ALA A 105 -1.453 17.496 -10.072 1.00 0.00 C ATOM 1629 C ALA A 105 -0.305 18.522 -10.227 1.00 0.00 C ATOM 1630 O ALA A 105 0.747 18.395 -9.579 1.00 0.00 O ATOM 1631 CB ALA A 105 -1.822 17.391 -8.578 1.00 0.00 C ATOM 0 H ALA A 105 -0.126 15.932 -10.426 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.312 17.844 -10.646 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -2.082 18.379 -8.197 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -2.673 16.721 -8.460 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -0.972 16.999 -8.020 1.00 0.00 H new ATOM 1637 N ASN A 106 -0.490 19.481 -11.154 1.00 0.00 N ATOM 1638 CA ASN A 106 0.499 20.485 -11.592 1.00 0.00 C ATOM 1639 C ASN A 106 -0.176 21.848 -11.857 1.00 0.00 C ATOM 1640 O ASN A 106 -1.410 21.916 -11.982 1.00 0.00 O ATOM 1641 CB ASN A 106 1.236 19.983 -12.848 1.00 0.00 C ATOM 1642 CG ASN A 106 2.774 20.145 -12.762 1.00 0.00 C ATOM 1643 OD1 ASN A 106 3.575 19.295 -13.156 1.00 0.00 O ATOM 1644 ND2 ASN A 106 3.228 21.266 -12.158 1.00 0.00 N ATOM 0 H ASN A 106 -1.379 19.582 -11.643 1.00 0.00 H new ATOM 0 HA ASN A 106 1.227 20.628 -10.793 1.00 0.00 H new ATOM 0 HB2 ASN A 106 0.997 18.931 -13.005 1.00 0.00 H new ATOM 0 HB3 ASN A 106 0.868 20.527 -13.718 1.00 0.00 H new ATOM 0 HD21 ASN A 106 4.230 21.406 -12.030 1.00 0.00 H new ATOM 0 HD22 ASN A 106 2.568 21.972 -11.831 1.00 0.00 H new TER 1651 ASN A 106