USER MOD reduce.3.24.130724 H: found=0, std=0, add=853, rem=0, adj=20 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 47 LYS NZ :NH3+ 156:sc= 1.07 (180deg=0) USER MOD Set 1.2: A 50 ASN : amide:sc= 0.742 K(o=1.8,f=-5!) USER MOD Set 2.1: A 26 GLN : amide:sc= -11.3! C(o=-11!,f=-16!) USER MOD Set 2.2: A 29 LYS NZ :NH3+ -124:sc= -0.0168 (180deg=-0.829) USER MOD Set 2.3: A 30 TYR OH : rot 139:sc= 0.318 USER MOD Set 3.1: A 11 SER OG : rot -144:sc= -2.34! USER MOD Set 3.2: A 59 GLN : amide:sc= -0.933 K(o=-3.3,f=-2.5) USER MOD Set 4.1: A 10 SER OG : rot 24:sc= 0.513 USER MOD Set 4.2: A 84 TYR OH : rot 23:sc= -0.785! USER MOD Set 5.1: A 5 HIS : no HD1:sc= -3.18! K(o=-2.4!,f=-1) USER MOD Set 5.2: A 7 TYR OH : rot 60:sc= 0.796 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 160:sc= -0.38 (180deg=-1.55!) 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 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= -3.28! USER MOD Single : A 16 THR OG1 : rot 99:sc= -5.23! USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 MET CE :methyl 155:sc= -4.74 (180deg=-9.33!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.0412 X(o=-0.041,f=-0.48) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl -125:sc= -1.5 (180deg=-4.62!) USER MOD Single : A 68 GLN : amide:sc= -0.0965 X(o=-0.097,f=0) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 74 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.291) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ -163:sc= -0.0233 (180deg=-0.299) 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+ -164:sc= 0 (180deg=-0.0663) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.929 16.781 11.409 1.00 0.00 N ATOM 2 CA MET A 1 4.932 15.713 10.344 1.00 0.00 C ATOM 3 C MET A 1 6.330 15.175 10.154 1.00 0.00 C ATOM 4 O MET A 1 6.904 14.511 11.032 1.00 0.00 O ATOM 5 CB MET A 1 4.298 16.241 9.068 1.00 0.00 C ATOM 6 CG MET A 1 4.626 17.729 8.824 1.00 0.00 C ATOM 7 SD MET A 1 5.329 18.069 7.167 1.00 0.00 S ATOM 8 CE MET A 1 5.444 19.871 7.265 1.00 0.00 C ATOM 0 H1 MET A 1 4.079 17.371 11.306 1.00 0.00 H new ATOM 0 H2 MET A 1 4.929 16.335 12.348 1.00 0.00 H new ATOM 0 H3 MET A 1 5.777 17.375 11.308 1.00 0.00 H new ATOM 0 HA MET A 1 4.320 14.868 10.658 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.646 15.651 8.221 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.217 16.114 9.122 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.717 18.317 8.950 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.332 18.065 9.584 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.856 20.260 6.334 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.451 20.291 7.426 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.094 20.150 8.094 1.00 0.00 H new ATOM 18 N GLU A 2 6.927 15.432 8.963 1.00 0.00 N ATOM 19 CA GLU A 2 8.357 15.069 8.678 1.00 0.00 C ATOM 20 C GLU A 2 8.444 13.596 8.262 1.00 0.00 C ATOM 21 O GLU A 2 9.535 13.029 8.149 1.00 0.00 O ATOM 22 CB GLU A 2 9.234 15.368 9.880 1.00 0.00 C ATOM 23 CG GLU A 2 10.253 16.496 9.622 1.00 0.00 C ATOM 24 CD GLU A 2 10.581 17.331 10.887 1.00 0.00 C ATOM 25 OE1 GLU A 2 10.455 16.732 11.987 1.00 0.00 O ATOM 26 OE2 GLU A 2 10.958 18.535 10.737 1.00 0.00 O ATOM 0 H GLU A 2 6.452 15.886 8.183 1.00 0.00 H new ATOM 0 HA GLU A 2 8.726 15.677 7.852 1.00 0.00 H new ATOM 0 HB2 GLU A 2 8.601 15.644 10.724 1.00 0.00 H new ATOM 0 HB3 GLU A 2 9.769 14.462 10.166 1.00 0.00 H new ATOM 0 HG2 GLU A 2 11.174 16.062 9.234 1.00 0.00 H new ATOM 0 HG3 GLU A 2 9.863 17.159 8.850 1.00 0.00 H new ATOM 33 N LYS A 3 7.278 12.921 8.158 1.00 0.00 N ATOM 34 CA LYS A 3 7.159 11.553 7.584 1.00 0.00 C ATOM 35 C LYS A 3 5.705 11.132 7.394 1.00 0.00 C ATOM 36 O LYS A 3 4.780 11.561 8.088 1.00 0.00 O ATOM 37 CB LYS A 3 8.025 10.550 8.284 1.00 0.00 C ATOM 38 CG LYS A 3 7.308 9.288 8.750 1.00 0.00 C ATOM 39 CD LYS A 3 8.225 8.325 9.583 1.00 0.00 C ATOM 40 CE LYS A 3 9.071 9.196 10.525 1.00 0.00 C ATOM 41 NZ LYS A 3 9.573 8.406 11.665 1.00 0.00 N ATOM 0 H LYS A 3 6.387 13.307 8.470 1.00 0.00 H new ATOM 0 HA LYS A 3 7.568 11.589 6.574 1.00 0.00 H new ATOM 0 HB2 LYS A 3 8.835 10.262 7.614 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.482 11.030 9.149 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.446 9.570 9.354 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.926 8.753 7.880 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.622 7.618 10.152 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.865 7.739 8.924 1.00 0.00 H new ATOM 0 HE2 LYS A 3 9.910 9.623 9.976 1.00 0.00 H new ATOM 0 HE3 LYS A 3 8.472 10.030 10.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 10.141 9.016 12.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 8.769 8.019 12.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 10.163 7.625 11.313 1.00 0.00 H new ATOM 55 N LYS A 4 5.484 10.284 6.345 1.00 0.00 N ATOM 56 CA LYS A 4 4.143 9.826 5.962 1.00 0.00 C ATOM 57 C LYS A 4 4.076 8.262 5.905 1.00 0.00 C ATOM 58 O LYS A 4 5.010 7.580 6.288 1.00 0.00 O ATOM 59 CB LYS A 4 3.614 10.409 4.654 1.00 0.00 C ATOM 60 CG LYS A 4 4.315 9.711 3.428 1.00 0.00 C ATOM 61 CD LYS A 4 5.337 10.696 2.769 1.00 0.00 C ATOM 62 CE LYS A 4 4.561 11.503 1.696 1.00 0.00 C ATOM 63 NZ LYS A 4 5.304 12.769 1.403 1.00 0.00 N ATOM 0 H LYS A 4 6.230 9.912 5.758 1.00 0.00 H new ATOM 0 HA LYS A 4 3.491 10.205 6.749 1.00 0.00 H new ATOM 0 HB2 LYS A 4 2.535 10.268 4.594 1.00 0.00 H new ATOM 0 HB3 LYS A 4 3.798 11.483 4.625 1.00 0.00 H new ATOM 0 HG2 LYS A 4 4.828 8.807 3.757 1.00 0.00 H new ATOM 0 HG3 LYS A 4 3.568 9.405 2.696 1.00 0.00 H new ATOM 0 HD2 LYS A 4 5.767 11.362 3.517 1.00 0.00 H new ATOM 0 HD3 LYS A 4 6.164 10.148 2.317 1.00 0.00 H new ATOM 0 HE2 LYS A 4 4.452 10.912 0.787 1.00 0.00 H new ATOM 0 HE3 LYS A 4 3.556 11.730 2.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 4.789 13.315 0.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 5.386 13.333 2.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 6.254 12.540 1.048 1.00 0.00 H new ATOM 77 N HIS A 5 2.879 7.798 5.497 1.00 0.00 N ATOM 78 CA HIS A 5 2.362 6.457 5.807 1.00 0.00 C ATOM 79 C HIS A 5 1.868 5.768 4.492 1.00 0.00 C ATOM 80 O HIS A 5 0.747 5.966 4.064 1.00 0.00 O ATOM 81 CB HIS A 5 1.218 6.568 6.841 1.00 0.00 C ATOM 82 CG HIS A 5 1.723 6.919 8.246 1.00 0.00 C ATOM 83 ND1 HIS A 5 0.957 7.162 9.343 1.00 0.00 N ATOM 84 CD2 HIS A 5 2.998 7.136 8.593 1.00 0.00 C ATOM 85 CE1 HIS A 5 1.791 7.536 10.332 1.00 0.00 C ATOM 86 NE2 HIS A 5 3.023 7.428 9.891 1.00 0.00 N ATOM 0 H HIS A 5 2.236 8.355 4.934 1.00 0.00 H new ATOM 0 HA HIS A 5 3.155 5.845 6.238 1.00 0.00 H new ATOM 0 HB2 HIS A 5 0.510 7.329 6.513 1.00 0.00 H new ATOM 0 HB3 HIS A 5 0.676 5.623 6.880 1.00 0.00 H new ATOM 0 HD2 HIS A 5 3.854 7.083 7.936 1.00 0.00 H new ATOM 0 HE1 HIS A 5 1.497 7.867 11.317 1.00 0.00 H new ATOM 0 HE2 HIS A 5 3.865 7.549 10.454 1.00 0.00 H new ATOM 94 N ILE A 6 2.765 4.954 3.921 1.00 0.00 N ATOM 95 CA ILE A 6 2.513 3.974 2.850 1.00 0.00 C ATOM 96 C ILE A 6 1.824 2.723 3.434 1.00 0.00 C ATOM 97 O ILE A 6 2.419 1.844 3.991 1.00 0.00 O ATOM 98 CB ILE A 6 3.803 3.673 2.039 1.00 0.00 C ATOM 99 CG1 ILE A 6 4.164 4.820 1.074 1.00 0.00 C ATOM 100 CG2 ILE A 6 3.800 2.301 1.361 1.00 0.00 C ATOM 101 CD1 ILE A 6 5.581 4.829 0.500 1.00 0.00 C ATOM 0 H ILE A 6 3.744 4.960 4.209 1.00 0.00 H new ATOM 0 HA ILE A 6 1.821 4.397 2.122 1.00 0.00 H new ATOM 0 HB ILE A 6 4.607 3.618 2.773 1.00 0.00 H new ATOM 0 HG12 ILE A 6 3.462 4.794 0.241 1.00 0.00 H new ATOM 0 HG13 ILE A 6 4.005 5.764 1.596 1.00 0.00 H new ATOM 0 HG21 ILE A 6 4.733 2.163 0.814 1.00 0.00 H new ATOM 0 HG22 ILE A 6 3.704 1.522 2.117 1.00 0.00 H new ATOM 0 HG23 ILE A 6 2.961 2.239 0.668 1.00 0.00 H new ATOM 0 HD11 ILE A 6 5.700 5.687 -0.162 1.00 0.00 H new ATOM 0 HD12 ILE A 6 6.303 4.895 1.314 1.00 0.00 H new ATOM 0 HD13 ILE A 6 5.752 3.911 -0.062 1.00 0.00 H new ATOM 113 N TYR A 7 0.448 2.702 3.264 1.00 0.00 N ATOM 114 CA TYR A 7 -0.489 1.757 3.817 1.00 0.00 C ATOM 115 C TYR A 7 -0.985 0.740 2.767 1.00 0.00 C ATOM 116 O TYR A 7 -1.245 1.049 1.621 1.00 0.00 O ATOM 117 CB TYR A 7 -1.704 2.491 4.470 1.00 0.00 C ATOM 118 CG TYR A 7 -1.486 2.952 5.905 1.00 0.00 C ATOM 119 CD1 TYR A 7 -0.223 2.898 6.506 1.00 0.00 C ATOM 120 CD2 TYR A 7 -2.610 3.424 6.605 1.00 0.00 C ATOM 121 CE1 TYR A 7 -0.009 3.565 7.718 1.00 0.00 C ATOM 122 CE2 TYR A 7 -2.394 4.099 7.821 1.00 0.00 C ATOM 123 CZ TYR A 7 -1.106 4.130 8.378 1.00 0.00 C ATOM 124 OH TYR A 7 -0.931 4.771 9.559 1.00 0.00 O ATOM 0 H TYR A 7 -0.021 3.407 2.695 1.00 0.00 H new ATOM 0 HA TYR A 7 0.046 1.201 4.587 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -1.955 3.359 3.860 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.566 1.825 4.446 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.579 2.347 6.039 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -3.608 3.273 6.222 1.00 0.00 H new ATOM 0 HE1 TYR A 7 0.984 3.642 8.136 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -3.215 4.590 8.323 1.00 0.00 H new ATOM 0 HH TYR A 7 -0.318 5.526 9.434 1.00 0.00 H new ATOM 134 N LEU A 8 -1.066 -0.543 3.240 1.00 0.00 N ATOM 135 CA LEU A 8 -1.286 -1.750 2.424 1.00 0.00 C ATOM 136 C LEU A 8 -2.425 -2.574 3.015 1.00 0.00 C ATOM 137 O LEU A 8 -2.469 -2.811 4.226 1.00 0.00 O ATOM 138 CB LEU A 8 0.077 -2.539 2.509 1.00 0.00 C ATOM 139 CG LEU A 8 1.088 -2.309 1.387 1.00 0.00 C ATOM 140 CD1 LEU A 8 2.140 -1.195 1.721 1.00 0.00 C ATOM 141 CD2 LEU A 8 1.799 -3.607 0.952 1.00 0.00 C ATOM 0 H LEU A 8 -0.975 -0.756 4.233 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.562 -1.521 1.395 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.557 -2.283 3.454 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.151 -3.604 2.545 1.00 0.00 H new ATOM 0 HG LEU A 8 0.494 -1.953 0.546 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.828 -1.082 0.883 1.00 0.00 H new ATOM 0 HD12 LEU A 8 1.626 -0.250 1.899 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.698 -1.478 2.613 1.00 0.00 H new ATOM 0 HD21 LEU A 8 2.506 -3.384 0.153 1.00 0.00 H new ATOM 0 HD22 LEU A 8 2.334 -4.031 1.802 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.060 -4.324 0.594 1.00 0.00 H new ATOM 153 N PHE A 9 -3.398 -2.977 2.167 1.00 0.00 N ATOM 154 CA PHE A 9 -4.705 -3.600 2.528 1.00 0.00 C ATOM 155 C PHE A 9 -4.854 -4.911 1.816 1.00 0.00 C ATOM 156 O PHE A 9 -4.883 -4.945 0.580 1.00 0.00 O ATOM 157 CB PHE A 9 -5.802 -2.552 2.233 1.00 0.00 C ATOM 158 CG PHE A 9 -5.570 -1.225 3.008 1.00 0.00 C ATOM 159 CD1 PHE A 9 -5.556 -1.301 4.411 1.00 0.00 C ATOM 160 CD2 PHE A 9 -5.388 -0.018 2.350 1.00 0.00 C ATOM 161 CE1 PHE A 9 -5.458 -0.117 5.144 1.00 0.00 C ATOM 162 CE2 PHE A 9 -5.014 1.139 3.092 1.00 0.00 C ATOM 163 CZ PHE A 9 -5.098 1.079 4.497 1.00 0.00 C ATOM 0 H PHE A 9 -3.294 -2.874 1.158 1.00 0.00 H new ATOM 0 HA PHE A 9 -4.783 -3.857 3.584 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -5.827 -2.346 1.163 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.776 -2.962 2.502 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -5.620 -2.256 4.912 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.529 0.044 1.281 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -5.658 -0.119 6.205 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -4.676 2.035 2.593 1.00 0.00 H new ATOM 0 HZ PHE A 9 -4.884 1.960 5.083 1.00 0.00 H new ATOM 173 N SER A 10 -4.695 -6.102 2.461 1.00 0.00 N ATOM 174 CA SER A 10 -4.181 -7.344 1.998 1.00 0.00 C ATOM 175 C SER A 10 -5.093 -8.242 1.168 1.00 0.00 C ATOM 176 O SER A 10 -6.298 -8.445 1.510 1.00 0.00 O ATOM 177 CB SER A 10 -3.672 -8.142 3.244 1.00 0.00 C ATOM 178 OG SER A 10 -2.759 -9.163 2.824 1.00 0.00 O ATOM 0 H SER A 10 -4.972 -6.180 3.440 1.00 0.00 H new ATOM 0 HA SER A 10 -3.402 -7.067 1.288 1.00 0.00 H new ATOM 0 HB2 SER A 10 -3.180 -7.467 3.944 1.00 0.00 H new ATOM 0 HB3 SER A 10 -4.515 -8.589 3.771 1.00 0.00 H new ATOM 0 HG SER A 10 -2.366 -8.915 1.961 1.00 0.00 H new ATOM 184 N SER A 11 -4.589 -8.807 0.077 1.00 0.00 N ATOM 185 CA SER A 11 -5.255 -9.598 -0.942 1.00 0.00 C ATOM 186 C SER A 11 -5.545 -11.035 -0.469 1.00 0.00 C ATOM 187 O SER A 11 -6.692 -11.508 -0.464 1.00 0.00 O ATOM 188 CB SER A 11 -4.356 -9.636 -2.193 1.00 0.00 C ATOM 189 OG SER A 11 -3.678 -10.939 -2.269 1.00 0.00 O ATOM 0 H SER A 11 -3.596 -8.709 -0.134 1.00 0.00 H new ATOM 0 HA SER A 11 -6.216 -9.134 -1.164 1.00 0.00 H new ATOM 0 HB2 SER A 11 -4.954 -9.472 -3.089 1.00 0.00 H new ATOM 0 HB3 SER A 11 -3.620 -8.833 -2.150 1.00 0.00 H new ATOM 0 HG SER A 11 -2.776 -10.818 -2.632 1.00 0.00 H new ATOM 195 N ALA A 12 -4.456 -11.713 -0.030 1.00 0.00 N ATOM 196 CA ALA A 12 -4.448 -13.042 0.587 1.00 0.00 C ATOM 197 C ALA A 12 -3.898 -13.038 2.012 1.00 0.00 C ATOM 198 O ALA A 12 -4.136 -13.966 2.779 1.00 0.00 O ATOM 199 CB ALA A 12 -3.665 -14.035 -0.287 1.00 0.00 C ATOM 0 H ALA A 12 -3.518 -11.319 -0.105 1.00 0.00 H new ATOM 0 HA ALA A 12 -5.488 -13.360 0.655 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -3.669 -15.017 0.186 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.133 -14.103 -1.269 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.637 -13.690 -0.398 1.00 0.00 H new ATOM 205 N GLY A 13 -3.090 -12.005 2.367 1.00 0.00 N ATOM 206 CA GLY A 13 -2.213 -11.979 3.529 1.00 0.00 C ATOM 207 C GLY A 13 -0.753 -11.659 3.268 1.00 0.00 C ATOM 208 O GLY A 13 -0.264 -10.507 3.428 1.00 0.00 O ATOM 0 H GLY A 13 -3.042 -11.145 1.821 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -2.602 -11.245 4.234 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -2.267 -12.951 4.019 1.00 0.00 H new ATOM 212 N MET A 14 0.047 -12.690 2.907 1.00 0.00 N ATOM 213 CA MET A 14 1.516 -12.705 2.937 1.00 0.00 C ATOM 214 C MET A 14 2.100 -12.772 1.502 1.00 0.00 C ATOM 215 O MET A 14 2.942 -13.547 1.145 1.00 0.00 O ATOM 216 CB MET A 14 2.006 -13.906 3.760 1.00 0.00 C ATOM 217 CG MET A 14 1.358 -14.013 5.127 1.00 0.00 C ATOM 218 SD MET A 14 2.326 -15.048 6.335 1.00 0.00 S ATOM 219 CE MET A 14 1.714 -14.338 7.871 1.00 0.00 C ATOM 0 H MET A 14 -0.340 -13.572 2.572 1.00 0.00 H new ATOM 0 HA MET A 14 1.861 -11.781 3.402 1.00 0.00 H new ATOM 0 HB2 MET A 14 1.810 -14.822 3.202 1.00 0.00 H new ATOM 0 HB3 MET A 14 3.086 -13.833 3.884 1.00 0.00 H new ATOM 0 HG2 MET A 14 1.232 -13.012 5.539 1.00 0.00 H new ATOM 0 HG3 MET A 14 0.361 -14.439 5.014 1.00 0.00 H new ATOM 0 HE1 MET A 14 2.187 -14.837 8.717 1.00 0.00 H new ATOM 0 HE2 MET A 14 1.950 -13.274 7.900 1.00 0.00 H new ATOM 0 HE3 MET A 14 0.634 -14.472 7.929 1.00 0.00 H new ATOM 229 N SER A 15 1.541 -11.830 0.659 1.00 0.00 N ATOM 230 CA SER A 15 2.223 -11.286 -0.536 1.00 0.00 C ATOM 231 C SER A 15 2.430 -9.757 -0.422 1.00 0.00 C ATOM 232 O SER A 15 2.712 -9.060 -1.388 1.00 0.00 O ATOM 233 CB SER A 15 1.391 -11.583 -1.783 1.00 0.00 C ATOM 234 OG SER A 15 1.568 -13.002 -2.158 1.00 0.00 O ATOM 0 H SER A 15 0.609 -11.441 0.805 1.00 0.00 H new ATOM 0 HA SER A 15 3.200 -11.764 -0.609 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.339 -11.374 -1.591 1.00 0.00 H new ATOM 0 HB3 SER A 15 1.700 -10.936 -2.604 1.00 0.00 H new ATOM 0 HG SER A 15 1.035 -13.198 -2.957 1.00 0.00 H new ATOM 240 N THR A 16 2.308 -9.272 0.861 1.00 0.00 N ATOM 241 CA THR A 16 2.270 -7.876 1.317 1.00 0.00 C ATOM 242 C THR A 16 3.121 -7.636 2.563 1.00 0.00 C ATOM 243 O THR A 16 4.032 -6.811 2.578 1.00 0.00 O ATOM 244 CB THR A 16 0.909 -7.266 1.488 1.00 0.00 C ATOM 245 OG1 THR A 16 0.738 -6.014 0.762 1.00 0.00 O ATOM 246 CG2 THR A 16 0.362 -7.231 2.927 1.00 0.00 C ATOM 0 H THR A 16 2.229 -9.916 1.648 1.00 0.00 H new ATOM 0 HA THR A 16 2.712 -7.348 0.472 1.00 0.00 H new ATOM 0 HB THR A 16 0.252 -7.986 1.000 1.00 0.00 H new ATOM 0 HG1 THR A 16 0.270 -6.186 -0.082 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.626 -6.770 2.930 1.00 0.00 H new ATOM 0 HG22 THR A 16 0.289 -8.248 3.313 1.00 0.00 H new ATOM 0 HG23 THR A 16 1.035 -6.651 3.558 1.00 0.00 H new ATOM 254 N SER A 17 2.785 -8.361 3.644 1.00 0.00 N ATOM 255 CA SER A 17 3.268 -8.153 5.030 1.00 0.00 C ATOM 256 C SER A 17 4.791 -8.036 5.105 1.00 0.00 C ATOM 257 O SER A 17 5.340 -7.256 5.895 1.00 0.00 O ATOM 258 CB SER A 17 2.746 -9.266 5.919 1.00 0.00 C ATOM 259 OG SER A 17 2.974 -8.987 7.333 1.00 0.00 O ATOM 0 H SER A 17 2.138 -9.147 3.577 1.00 0.00 H new ATOM 0 HA SER A 17 2.879 -7.200 5.388 1.00 0.00 H new ATOM 0 HB2 SER A 17 1.679 -9.400 5.743 1.00 0.00 H new ATOM 0 HB3 SER A 17 3.234 -10.203 5.651 1.00 0.00 H new ATOM 0 HG SER A 17 2.623 -9.726 7.873 1.00 0.00 H new ATOM 265 N LEU A 18 5.496 -8.784 4.219 1.00 0.00 N ATOM 266 CA LEU A 18 6.965 -8.813 4.050 1.00 0.00 C ATOM 267 C LEU A 18 7.385 -7.857 2.929 1.00 0.00 C ATOM 268 O LEU A 18 8.581 -7.530 2.794 1.00 0.00 O ATOM 269 CB LEU A 18 7.317 -10.276 3.751 1.00 0.00 C ATOM 270 CG LEU A 18 8.695 -10.827 3.760 1.00 0.00 C ATOM 271 CD1 LEU A 18 8.918 -12.211 3.091 1.00 0.00 C ATOM 272 CD2 LEU A 18 9.810 -9.819 3.318 1.00 0.00 C ATOM 0 H LEU A 18 5.027 -9.416 3.570 1.00 0.00 H new ATOM 0 HA LEU A 18 7.500 -8.474 4.937 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.748 -10.875 4.462 1.00 0.00 H new ATOM 0 HB3 LEU A 18 6.914 -10.487 2.761 1.00 0.00 H new ATOM 0 HG LEU A 18 8.804 -11.011 4.829 1.00 0.00 H new ATOM 0 HD11 LEU A 18 9.969 -12.489 3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.305 -12.960 3.592 1.00 0.00 H new ATOM 0 HD13 LEU A 18 8.637 -12.156 2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 18 10.782 -10.311 3.356 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.614 -9.483 2.300 1.00 0.00 H new ATOM 0 HD23 LEU A 18 9.811 -8.961 3.990 1.00 0.00 H new ATOM 284 N LEU A 19 6.431 -7.406 2.070 1.00 0.00 N ATOM 285 CA LEU A 19 6.602 -6.454 0.944 1.00 0.00 C ATOM 286 C LEU A 19 6.573 -5.011 1.504 1.00 0.00 C ATOM 287 O LEU A 19 7.177 -4.111 0.886 1.00 0.00 O ATOM 288 CB LEU A 19 5.418 -6.689 0.019 1.00 0.00 C ATOM 289 CG LEU A 19 4.538 -5.500 -0.437 1.00 0.00 C ATOM 290 CD1 LEU A 19 5.356 -4.341 -1.056 1.00 0.00 C ATOM 291 CD2 LEU A 19 3.422 -5.977 -1.421 1.00 0.00 C ATOM 0 H LEU A 19 5.463 -7.718 2.153 1.00 0.00 H new ATOM 0 HA LEU A 19 7.545 -6.595 0.415 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.801 -7.171 -0.880 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.762 -7.407 0.510 1.00 0.00 H new ATOM 0 HG LEU A 19 4.069 -5.103 0.463 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.681 -3.539 -1.355 1.00 0.00 H new ATOM 0 HD12 LEU A 19 6.066 -3.963 -0.320 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.898 -4.704 -1.929 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.817 -5.123 -1.727 1.00 0.00 H new ATOM 0 HD22 LEU A 19 3.881 -6.430 -2.300 1.00 0.00 H new ATOM 0 HD23 LEU A 19 2.788 -6.711 -0.924 1.00 0.00 H new ATOM 303 N VAL A 20 5.818 -4.765 2.572 1.00 0.00 N ATOM 304 CA VAL A 20 5.902 -3.592 3.449 1.00 0.00 C ATOM 305 C VAL A 20 7.228 -3.597 4.237 1.00 0.00 C ATOM 306 O VAL A 20 7.916 -2.578 4.348 1.00 0.00 O ATOM 307 CB VAL A 20 4.645 -3.608 4.387 1.00 0.00 C ATOM 308 CG1 VAL A 20 3.352 -3.163 3.661 1.00 0.00 C ATOM 309 CG2 VAL A 20 4.403 -4.982 5.063 1.00 0.00 C ATOM 0 H VAL A 20 5.089 -5.414 2.868 1.00 0.00 H new ATOM 0 HA VAL A 20 5.901 -2.669 2.869 1.00 0.00 H new ATOM 0 HB VAL A 20 4.879 -2.882 5.165 1.00 0.00 H new ATOM 0 HG11 VAL A 20 2.515 -3.193 4.358 1.00 0.00 H new ATOM 0 HG12 VAL A 20 3.476 -2.147 3.287 1.00 0.00 H new ATOM 0 HG13 VAL A 20 3.154 -3.835 2.826 1.00 0.00 H new ATOM 0 HG21 VAL A 20 3.519 -4.924 5.698 1.00 0.00 H new ATOM 0 HG22 VAL A 20 4.251 -5.743 4.297 1.00 0.00 H new ATOM 0 HG23 VAL A 20 5.269 -5.246 5.670 1.00 0.00 H new ATOM 319 N SER A 21 7.525 -4.759 4.863 1.00 0.00 N ATOM 320 CA SER A 21 8.737 -4.999 5.672 1.00 0.00 C ATOM 321 C SER A 21 10.003 -5.103 4.859 1.00 0.00 C ATOM 322 O SER A 21 11.155 -5.118 5.392 1.00 0.00 O ATOM 323 CB SER A 21 8.482 -6.185 6.583 1.00 0.00 C ATOM 324 OG SER A 21 7.826 -5.748 7.819 1.00 0.00 O ATOM 0 H SER A 21 6.913 -5.573 4.817 1.00 0.00 H new ATOM 0 HA SER A 21 8.927 -4.123 6.291 1.00 0.00 H new ATOM 0 HB2 SER A 21 7.857 -6.917 6.071 1.00 0.00 H new ATOM 0 HB3 SER A 21 9.424 -6.680 6.819 1.00 0.00 H new ATOM 0 HG SER A 21 7.666 -6.524 8.396 1.00 0.00 H new ATOM 330 N LYS A 22 9.834 -5.081 3.497 1.00 0.00 N ATOM 331 CA LYS A 22 11.029 -4.879 2.598 1.00 0.00 C ATOM 332 C LYS A 22 11.011 -3.408 2.092 1.00 0.00 C ATOM 333 O LYS A 22 11.994 -2.692 2.112 1.00 0.00 O ATOM 334 CB LYS A 22 10.922 -5.855 1.394 1.00 0.00 C ATOM 335 CG LYS A 22 11.667 -5.294 0.185 1.00 0.00 C ATOM 336 CD LYS A 22 12.508 -6.185 -0.659 1.00 0.00 C ATOM 337 CE LYS A 22 11.670 -6.938 -1.695 1.00 0.00 C ATOM 338 NZ LYS A 22 12.472 -8.100 -2.213 1.00 0.00 N ATOM 0 H LYS A 22 8.941 -5.193 3.017 1.00 0.00 H new ATOM 0 HA LYS A 22 11.957 -5.074 3.135 1.00 0.00 H new ATOM 0 HB2 LYS A 22 11.337 -6.825 1.667 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.874 -6.016 1.141 1.00 0.00 H new ATOM 0 HG2 LYS A 22 10.924 -4.838 -0.469 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.310 -4.491 0.546 1.00 0.00 H new ATOM 0 HD2 LYS A 22 13.269 -5.593 -1.167 1.00 0.00 H new ATOM 0 HD3 LYS A 22 13.031 -6.900 -0.024 1.00 0.00 H new ATOM 0 HE2 LYS A 22 10.741 -7.290 -1.246 1.00 0.00 H new ATOM 0 HE3 LYS A 22 11.396 -6.273 -2.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 11.913 -8.621 -2.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.346 -7.749 -2.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 12.712 -8.735 -1.425 1.00 0.00 H new ATOM 352 N MET A 23 9.819 -3.065 1.560 1.00 0.00 N ATOM 353 CA MET A 23 9.467 -1.625 1.241 1.00 0.00 C ATOM 354 C MET A 23 9.994 -0.715 2.367 1.00 0.00 C ATOM 355 O MET A 23 10.342 0.423 2.190 1.00 0.00 O ATOM 356 CB MET A 23 7.961 -1.481 1.116 1.00 0.00 C ATOM 357 CG MET A 23 7.458 -1.585 -0.326 1.00 0.00 C ATOM 358 SD MET A 23 6.079 -0.445 -0.694 1.00 0.00 S ATOM 359 CE MET A 23 6.841 1.129 -0.316 1.00 0.00 C ATOM 0 H MET A 23 9.083 -3.735 1.338 1.00 0.00 H new ATOM 0 HA MET A 23 9.927 -1.334 0.296 1.00 0.00 H new ATOM 0 HB2 MET A 23 7.479 -2.251 1.718 1.00 0.00 H new ATOM 0 HB3 MET A 23 7.660 -0.518 1.529 1.00 0.00 H new ATOM 0 HG2 MET A 23 8.283 -1.378 -1.007 1.00 0.00 H new ATOM 0 HG3 MET A 23 7.135 -2.608 -0.518 1.00 0.00 H new ATOM 0 HE1 MET A 23 6.343 1.919 -0.878 1.00 0.00 H new ATOM 0 HE2 MET A 23 6.750 1.330 0.751 1.00 0.00 H new ATOM 0 HE3 MET A 23 7.895 1.098 -0.591 1.00 0.00 H new ATOM 369 N ARG A 24 9.933 -1.322 3.601 1.00 0.00 N ATOM 370 CA ARG A 24 10.586 -0.798 4.814 1.00 0.00 C ATOM 371 C ARG A 24 12.113 -0.824 4.722 1.00 0.00 C ATOM 372 O ARG A 24 12.784 0.180 4.972 1.00 0.00 O ATOM 373 CB ARG A 24 10.098 -1.567 6.053 1.00 0.00 C ATOM 374 CG ARG A 24 8.820 -0.947 6.647 1.00 0.00 C ATOM 375 CD ARG A 24 8.117 -1.858 7.621 1.00 0.00 C ATOM 376 NE ARG A 24 7.157 -1.084 8.446 1.00 0.00 N ATOM 377 CZ ARG A 24 6.606 -1.480 9.590 1.00 0.00 C ATOM 378 NH1 ARG A 24 6.985 -2.608 10.241 1.00 0.00 N ATOM 379 NH2 ARG A 24 5.641 -0.739 10.196 1.00 0.00 N ATOM 0 H ARG A 24 9.423 -2.190 3.762 1.00 0.00 H new ATOM 0 HA ARG A 24 10.301 0.250 4.907 1.00 0.00 H new ATOM 0 HB2 ARG A 24 9.906 -2.606 5.783 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.883 -1.574 6.809 1.00 0.00 H new ATOM 0 HG2 ARG A 24 9.076 -0.015 7.151 1.00 0.00 H new ATOM 0 HG3 ARG A 24 8.136 -0.694 5.837 1.00 0.00 H new ATOM 0 HD2 ARG A 24 7.591 -2.644 7.080 1.00 0.00 H new ATOM 0 HD3 ARG A 24 8.848 -2.348 8.264 1.00 0.00 H new ATOM 0 HE ARG A 24 6.894 -0.160 8.103 1.00 0.00 H new ATOM 0 HH11 ARG A 24 7.724 -3.196 9.855 1.00 0.00 H new ATOM 0 HH12 ARG A 24 6.531 -2.869 11.116 1.00 0.00 H new ATOM 0 HH21 ARG A 24 5.329 0.135 9.774 1.00 0.00 H new ATOM 0 HH22 ARG A 24 5.229 -1.057 11.073 1.00 0.00 H new ATOM 393 N ALA A 25 12.672 -2.032 4.450 1.00 0.00 N ATOM 394 CA ALA A 25 14.066 -2.212 3.999 1.00 0.00 C ATOM 395 C ALA A 25 14.543 -0.985 3.164 1.00 0.00 C ATOM 396 O ALA A 25 15.342 -0.190 3.600 1.00 0.00 O ATOM 397 CB ALA A 25 14.253 -3.496 3.221 1.00 0.00 C ATOM 0 H ALA A 25 12.160 -2.910 4.540 1.00 0.00 H new ATOM 0 HA ALA A 25 14.685 -2.284 4.894 1.00 0.00 H new ATOM 0 HB1 ALA A 25 15.294 -3.585 2.910 1.00 0.00 H new ATOM 0 HB2 ALA A 25 13.989 -4.345 3.851 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.611 -3.484 2.340 1.00 0.00 H new ATOM 403 N GLN A 26 14.012 -0.913 1.928 1.00 0.00 N ATOM 404 CA GLN A 26 13.983 0.346 1.069 1.00 0.00 C ATOM 405 C GLN A 26 14.212 1.558 2.021 1.00 0.00 C ATOM 406 O GLN A 26 15.293 2.144 2.061 1.00 0.00 O ATOM 407 CB GLN A 26 12.541 0.401 0.534 1.00 0.00 C ATOM 408 CG GLN A 26 12.319 0.096 -0.922 1.00 0.00 C ATOM 409 CD GLN A 26 13.386 -0.794 -1.544 1.00 0.00 C ATOM 410 OE1 GLN A 26 14.111 -0.453 -2.524 1.00 0.00 O ATOM 411 NE2 GLN A 26 13.598 -2.021 -1.002 1.00 0.00 N ATOM 0 H GLN A 26 13.582 -1.717 1.471 1.00 0.00 H new ATOM 0 HA GLN A 26 14.726 0.358 0.272 1.00 0.00 H new ATOM 0 HB2 GLN A 26 11.941 -0.297 1.117 1.00 0.00 H new ATOM 0 HB3 GLN A 26 12.149 1.399 0.730 1.00 0.00 H new ATOM 0 HG2 GLN A 26 11.348 -0.386 -1.037 1.00 0.00 H new ATOM 0 HG3 GLN A 26 12.277 1.034 -1.476 1.00 0.00 H new ATOM 0 HE21 GLN A 26 13.035 -2.333 -0.211 1.00 0.00 H new ATOM 0 HE22 GLN A 26 14.320 -2.630 -1.386 1.00 0.00 H new ATOM 420 N ALA A 27 13.138 1.980 2.700 1.00 0.00 N ATOM 421 CA ALA A 27 12.950 3.291 3.338 1.00 0.00 C ATOM 422 C ALA A 27 14.132 3.696 4.247 1.00 0.00 C ATOM 423 O ALA A 27 14.442 4.871 4.393 1.00 0.00 O ATOM 424 CB ALA A 27 11.632 3.366 4.087 1.00 0.00 C ATOM 0 H ALA A 27 12.325 1.377 2.827 1.00 0.00 H new ATOM 0 HA ALA A 27 12.919 4.018 2.526 1.00 0.00 H new ATOM 0 HB1 ALA A 27 11.529 4.350 4.545 1.00 0.00 H new ATOM 0 HB2 ALA A 27 10.809 3.201 3.392 1.00 0.00 H new ATOM 0 HB3 ALA A 27 11.610 2.601 4.863 1.00 0.00 H new ATOM 430 N GLU A 28 14.765 2.674 4.849 1.00 0.00 N ATOM 431 CA GLU A 28 15.829 2.820 5.865 1.00 0.00 C ATOM 432 C GLU A 28 17.136 2.223 5.413 1.00 0.00 C ATOM 433 O GLU A 28 18.247 2.491 5.951 1.00 0.00 O ATOM 434 CB GLU A 28 15.292 2.173 7.197 1.00 0.00 C ATOM 435 CG GLU A 28 13.866 2.721 7.485 1.00 0.00 C ATOM 436 CD GLU A 28 13.631 3.245 8.869 1.00 0.00 C ATOM 437 OE1 GLU A 28 14.581 3.849 9.477 1.00 0.00 O ATOM 438 OE2 GLU A 28 12.517 3.016 9.410 1.00 0.00 O ATOM 0 H GLU A 28 14.548 1.700 4.640 1.00 0.00 H new ATOM 0 HA GLU A 28 16.053 3.874 6.030 1.00 0.00 H new ATOM 0 HB2 GLU A 28 15.267 1.087 7.105 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.960 2.407 8.026 1.00 0.00 H new ATOM 0 HG2 GLU A 28 13.655 3.520 6.775 1.00 0.00 H new ATOM 0 HG3 GLU A 28 13.147 1.925 7.292 1.00 0.00 H new ATOM 445 N LYS A 29 17.126 1.342 4.387 1.00 0.00 N ATOM 446 CA LYS A 29 18.220 1.138 3.380 1.00 0.00 C ATOM 447 C LYS A 29 18.469 2.425 2.529 1.00 0.00 C ATOM 448 O LYS A 29 19.409 2.587 1.802 1.00 0.00 O ATOM 449 CB LYS A 29 17.714 0.011 2.402 1.00 0.00 C ATOM 450 CG LYS A 29 18.567 0.025 1.104 1.00 0.00 C ATOM 451 CD LYS A 29 18.362 -1.220 0.222 1.00 0.00 C ATOM 452 CE LYS A 29 17.086 -0.999 -0.647 1.00 0.00 C ATOM 453 NZ LYS A 29 17.259 -1.615 -1.986 1.00 0.00 N ATOM 0 H LYS A 29 16.331 0.725 4.222 1.00 0.00 H new ATOM 0 HA LYS A 29 19.147 0.884 3.894 1.00 0.00 H new ATOM 0 HB2 LYS A 29 17.786 -0.963 2.886 1.00 0.00 H new ATOM 0 HB3 LYS A 29 16.663 0.170 2.160 1.00 0.00 H new ATOM 0 HG2 LYS A 29 18.320 0.915 0.526 1.00 0.00 H new ATOM 0 HG3 LYS A 29 19.621 0.101 1.372 1.00 0.00 H new ATOM 0 HD2 LYS A 29 19.232 -1.382 -0.415 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.250 -2.110 0.841 1.00 0.00 H new ATOM 0 HE2 LYS A 29 16.219 -1.434 -0.149 1.00 0.00 H new ATOM 0 HE3 LYS A 29 16.891 0.068 -0.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 17.109 -0.895 -2.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 18.222 -1.999 -2.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 16.568 -2.383 -2.107 1.00 0.00 H new ATOM 467 N TYR A 30 17.467 3.353 2.694 1.00 0.00 N ATOM 468 CA TYR A 30 17.594 4.828 2.360 1.00 0.00 C ATOM 469 C TYR A 30 17.269 5.633 3.617 1.00 0.00 C ATOM 470 O TYR A 30 17.726 5.311 4.740 1.00 0.00 O ATOM 471 CB TYR A 30 16.374 5.039 1.316 1.00 0.00 C ATOM 472 CG TYR A 30 16.425 3.926 0.236 1.00 0.00 C ATOM 473 CD1 TYR A 30 17.666 3.373 -0.125 1.00 0.00 C ATOM 474 CD2 TYR A 30 15.228 3.530 -0.352 1.00 0.00 C ATOM 475 CE1 TYR A 30 17.712 2.527 -1.255 1.00 0.00 C ATOM 476 CE2 TYR A 30 15.255 2.510 -1.323 1.00 0.00 C ATOM 477 CZ TYR A 30 16.511 2.136 -1.856 1.00 0.00 C ATOM 478 OH TYR A 30 16.520 1.355 -2.963 1.00 0.00 O ATOM 0 H TYR A 30 16.548 3.106 3.061 1.00 0.00 H new ATOM 0 HA TYR A 30 18.575 5.122 1.988 1.00 0.00 H new ATOM 0 HB2 TYR A 30 15.420 5.007 1.842 1.00 0.00 H new ATOM 0 HB3 TYR A 30 16.447 6.020 0.847 1.00 0.00 H new ATOM 0 HD1 TYR A 30 18.558 3.589 0.445 1.00 0.00 H new ATOM 0 HD2 TYR A 30 14.296 3.996 -0.069 1.00 0.00 H new ATOM 0 HE1 TYR A 30 18.659 2.188 -1.649 1.00 0.00 H new ATOM 0 HE2 TYR A 30 14.345 2.029 -1.650 1.00 0.00 H new ATOM 0 HH TYR A 30 15.812 0.681 -2.894 1.00 0.00 H new ATOM 488 N GLU A 31 16.497 6.718 3.433 1.00 0.00 N ATOM 489 CA GLU A 31 15.941 7.555 4.518 1.00 0.00 C ATOM 490 C GLU A 31 14.492 7.967 4.231 1.00 0.00 C ATOM 491 O GLU A 31 13.907 8.732 5.033 1.00 0.00 O ATOM 492 CB GLU A 31 16.810 8.860 4.643 1.00 0.00 C ATOM 493 CG GLU A 31 17.164 9.414 3.281 1.00 0.00 C ATOM 494 CD GLU A 31 17.152 10.951 3.155 1.00 0.00 C ATOM 495 OE1 GLU A 31 17.326 11.607 4.221 1.00 0.00 O ATOM 496 OE2 GLU A 31 16.944 11.445 2.018 1.00 0.00 O ATOM 0 H GLU A 31 16.234 7.048 2.504 1.00 0.00 H new ATOM 0 HA GLU A 31 15.959 6.972 5.439 1.00 0.00 H new ATOM 0 HB2 GLU A 31 16.263 9.611 5.213 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.722 8.641 5.198 1.00 0.00 H new ATOM 0 HG2 GLU A 31 18.157 9.054 3.011 1.00 0.00 H new ATOM 0 HG3 GLU A 31 16.467 9.003 2.551 1.00 0.00 H new ATOM 503 N VAL A 32 13.935 7.509 3.102 1.00 0.00 N ATOM 504 CA VAL A 32 12.570 7.860 2.599 1.00 0.00 C ATOM 505 C VAL A 32 11.641 8.044 3.814 1.00 0.00 C ATOM 506 O VAL A 32 11.444 7.142 4.649 1.00 0.00 O ATOM 507 CB VAL A 32 12.169 6.716 1.637 1.00 0.00 C ATOM 508 CG1 VAL A 32 10.778 6.749 1.075 1.00 0.00 C ATOM 509 CG2 VAL A 32 13.271 6.461 0.555 1.00 0.00 C ATOM 0 H VAL A 32 14.425 6.863 2.483 1.00 0.00 H new ATOM 0 HA VAL A 32 12.515 8.798 2.047 1.00 0.00 H new ATOM 0 HB VAL A 32 12.116 5.842 2.286 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.630 5.892 0.418 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.055 6.710 1.890 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.636 7.669 0.508 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.955 5.651 -0.102 1.00 0.00 H new ATOM 0 HG22 VAL A 32 13.421 7.367 -0.032 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.205 6.187 1.045 1.00 0.00 H new ATOM 519 N PRO A 33 11.098 9.269 4.002 1.00 0.00 N ATOM 520 CA PRO A 33 10.279 9.672 5.177 1.00 0.00 C ATOM 521 C PRO A 33 8.794 9.242 5.197 1.00 0.00 C ATOM 522 O PRO A 33 7.860 10.030 5.148 1.00 0.00 O ATOM 523 CB PRO A 33 10.515 11.151 5.333 1.00 0.00 C ATOM 524 CG PRO A 33 10.706 11.641 3.891 1.00 0.00 C ATOM 525 CD PRO A 33 11.441 10.465 3.213 1.00 0.00 C ATOM 0 HA PRO A 33 10.608 9.110 6.051 1.00 0.00 H new ATOM 0 HB2 PRO A 33 9.670 11.643 5.815 1.00 0.00 H new ATOM 0 HB3 PRO A 33 11.394 11.354 5.945 1.00 0.00 H new ATOM 0 HG2 PRO A 33 9.752 11.852 3.408 1.00 0.00 H new ATOM 0 HG3 PRO A 33 11.293 12.559 3.852 1.00 0.00 H new ATOM 0 HD2 PRO A 33 11.126 10.353 2.176 1.00 0.00 H new ATOM 0 HD3 PRO A 33 12.518 10.631 3.203 1.00 0.00 H new ATOM 533 N VAL A 34 8.664 7.903 5.485 1.00 0.00 N ATOM 534 CA VAL A 34 7.400 7.174 5.370 1.00 0.00 C ATOM 535 C VAL A 34 7.485 5.852 6.151 1.00 0.00 C ATOM 536 O VAL A 34 8.401 5.033 6.000 1.00 0.00 O ATOM 537 CB VAL A 34 6.980 7.014 3.906 1.00 0.00 C ATOM 538 CG1 VAL A 34 8.061 6.378 2.999 1.00 0.00 C ATOM 539 CG2 VAL A 34 5.647 6.238 3.745 1.00 0.00 C ATOM 0 H VAL A 34 9.442 7.324 5.800 1.00 0.00 H new ATOM 0 HA VAL A 34 6.599 7.753 5.829 1.00 0.00 H new ATOM 0 HB VAL A 34 6.836 8.040 3.568 1.00 0.00 H new ATOM 0 HG11 VAL A 34 7.682 6.301 1.980 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.956 7.001 3.007 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.308 5.383 3.370 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.400 6.155 2.687 1.00 0.00 H new ATOM 0 HG22 VAL A 34 5.753 5.241 4.172 1.00 0.00 H new ATOM 0 HG23 VAL A 34 4.850 6.772 4.263 1.00 0.00 H new ATOM 549 N ILE A 35 6.516 5.672 7.066 1.00 0.00 N ATOM 550 CA ILE A 35 6.018 4.359 7.566 1.00 0.00 C ATOM 551 C ILE A 35 5.185 3.648 6.483 1.00 0.00 C ATOM 552 O ILE A 35 4.234 4.224 5.925 1.00 0.00 O ATOM 553 CB ILE A 35 5.311 4.517 8.927 1.00 0.00 C ATOM 554 CG1 ILE A 35 6.257 4.810 10.095 1.00 0.00 C ATOM 555 CG2 ILE A 35 4.259 3.447 9.198 1.00 0.00 C ATOM 556 CD1 ILE A 35 7.629 4.128 10.089 1.00 0.00 C ATOM 0 H ILE A 35 6.035 6.460 7.499 1.00 0.00 H new ATOM 0 HA ILE A 35 6.862 3.698 7.764 1.00 0.00 H new ATOM 0 HB ILE A 35 4.732 5.436 8.840 1.00 0.00 H new ATOM 0 HG12 ILE A 35 6.418 5.887 10.134 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.748 4.531 11.017 1.00 0.00 H new ATOM 0 HG21 ILE A 35 3.804 3.623 10.173 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.490 3.489 8.426 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.729 2.464 9.189 1.00 0.00 H new ATOM 0 HD11 ILE A 35 8.189 4.428 10.975 1.00 0.00 H new ATOM 0 HD12 ILE A 35 7.497 3.046 10.092 1.00 0.00 H new ATOM 0 HD13 ILE A 35 8.178 4.424 9.195 1.00 0.00 H new ATOM 568 N ILE A 36 5.544 2.410 6.183 1.00 0.00 N ATOM 569 CA ILE A 36 4.749 1.360 5.491 1.00 0.00 C ATOM 570 C ILE A 36 4.091 0.416 6.522 1.00 0.00 C ATOM 571 O ILE A 36 4.765 -0.385 7.175 1.00 0.00 O ATOM 572 CB ILE A 36 5.690 0.557 4.500 1.00 0.00 C ATOM 573 CG1 ILE A 36 6.701 1.443 3.828 1.00 0.00 C ATOM 574 CG2 ILE A 36 4.820 -0.287 3.547 1.00 0.00 C ATOM 575 CD1 ILE A 36 8.185 1.082 3.974 1.00 0.00 C ATOM 0 H ILE A 36 6.472 2.067 6.430 1.00 0.00 H new ATOM 0 HA ILE A 36 3.951 1.828 4.915 1.00 0.00 H new ATOM 0 HB ILE A 36 6.309 -0.143 5.061 1.00 0.00 H new ATOM 0 HG12 ILE A 36 6.467 1.469 2.764 1.00 0.00 H new ATOM 0 HG13 ILE A 36 6.564 2.455 4.210 1.00 0.00 H new ATOM 0 HG21 ILE A 36 5.462 -0.842 2.863 1.00 0.00 H new ATOM 0 HG22 ILE A 36 4.218 -0.987 4.127 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.163 0.370 2.976 1.00 0.00 H new ATOM 0 HD11 ILE A 36 8.791 1.811 3.436 1.00 0.00 H new ATOM 0 HD12 ILE A 36 8.459 1.089 5.029 1.00 0.00 H new ATOM 0 HD13 ILE A 36 8.360 0.089 3.561 1.00 0.00 H new ATOM 587 N GLU A 37 2.750 0.514 6.659 1.00 0.00 N ATOM 588 CA GLU A 37 1.873 -0.476 7.311 1.00 0.00 C ATOM 589 C GLU A 37 0.951 -1.188 6.294 1.00 0.00 C ATOM 590 O GLU A 37 0.620 -0.610 5.243 1.00 0.00 O ATOM 591 CB GLU A 37 0.989 0.219 8.372 1.00 0.00 C ATOM 592 CG GLU A 37 1.774 0.893 9.482 1.00 0.00 C ATOM 593 CD GLU A 37 1.064 0.846 10.883 1.00 0.00 C ATOM 594 OE1 GLU A 37 -0.146 0.530 10.916 1.00 0.00 O ATOM 595 OE2 GLU A 37 1.801 1.158 11.849 1.00 0.00 O ATOM 0 H GLU A 37 2.232 1.317 6.304 1.00 0.00 H new ATOM 0 HA GLU A 37 2.519 -1.220 7.777 1.00 0.00 H new ATOM 0 HB2 GLU A 37 0.364 0.964 7.879 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.318 -0.519 8.812 1.00 0.00 H new ATOM 0 HG2 GLU A 37 2.751 0.416 9.564 1.00 0.00 H new ATOM 0 HG3 GLU A 37 1.950 1.934 9.209 1.00 0.00 H new ATOM 602 N ALA A 38 0.636 -2.467 6.548 1.00 0.00 N ATOM 603 CA ALA A 38 -0.345 -3.284 5.776 1.00 0.00 C ATOM 604 C ALA A 38 -1.310 -4.004 6.759 1.00 0.00 C ATOM 605 O ALA A 38 -0.875 -4.584 7.753 1.00 0.00 O ATOM 606 CB ALA A 38 0.413 -4.383 4.982 1.00 0.00 C ATOM 0 H ALA A 38 1.062 -2.987 7.315 1.00 0.00 H new ATOM 0 HA ALA A 38 -0.897 -2.628 5.103 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -0.301 -4.982 4.417 1.00 0.00 H new ATOM 0 HB2 ALA A 38 1.118 -3.915 4.295 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.955 -5.025 5.676 1.00 0.00 H new ATOM 612 N PHE A 39 -2.624 -3.913 6.452 1.00 0.00 N ATOM 613 CA PHE A 39 -3.740 -4.398 7.285 1.00 0.00 C ATOM 614 C PHE A 39 -4.545 -5.441 6.593 1.00 0.00 C ATOM 615 O PHE A 39 -4.140 -5.919 5.504 1.00 0.00 O ATOM 616 CB PHE A 39 -4.577 -3.140 7.744 1.00 0.00 C ATOM 617 CG PHE A 39 -3.754 -1.876 7.995 1.00 0.00 C ATOM 618 CD1 PHE A 39 -3.472 -0.967 6.937 1.00 0.00 C ATOM 619 CD2 PHE A 39 -3.255 -1.633 9.290 1.00 0.00 C ATOM 620 CE1 PHE A 39 -2.946 0.302 7.257 1.00 0.00 C ATOM 621 CE2 PHE A 39 -2.412 -0.526 9.512 1.00 0.00 C ATOM 622 CZ PHE A 39 -2.389 0.500 8.528 1.00 0.00 C ATOM 0 H PHE A 39 -2.945 -3.483 5.584 1.00 0.00 H new ATOM 0 HA PHE A 39 -3.363 -4.907 8.172 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -5.326 -2.923 6.983 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -5.115 -3.393 8.658 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -3.657 -1.243 5.909 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -3.517 -2.290 10.106 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -2.972 1.106 6.536 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.803 -0.459 10.401 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.934 1.450 8.764 1.00 0.00 H new ATOM 632 N PRO A 40 -5.632 -5.977 7.198 1.00 0.00 N ATOM 633 CA PRO A 40 -6.634 -6.859 6.607 1.00 0.00 C ATOM 634 C PRO A 40 -7.882 -6.332 5.909 1.00 0.00 C ATOM 635 O PRO A 40 -9.037 -6.767 6.053 1.00 0.00 O ATOM 636 CB PRO A 40 -6.897 -7.902 7.699 1.00 0.00 C ATOM 637 CG PRO A 40 -6.771 -7.091 8.982 1.00 0.00 C ATOM 638 CD PRO A 40 -5.866 -5.905 8.678 1.00 0.00 C ATOM 0 HA PRO A 40 -6.206 -7.238 5.679 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -7.886 -8.350 7.600 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -6.173 -8.716 7.663 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -7.750 -6.751 9.320 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -6.351 -7.700 9.782 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.338 -4.964 8.959 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -4.929 -5.969 9.231 1.00 0.00 H new ATOM 646 N GLU A 41 -7.575 -5.420 4.945 1.00 0.00 N ATOM 647 CA GLU A 41 -8.453 -4.461 4.345 1.00 0.00 C ATOM 648 C GLU A 41 -9.637 -3.992 5.213 1.00 0.00 C ATOM 649 O GLU A 41 -10.643 -3.561 4.655 1.00 0.00 O ATOM 650 CB GLU A 41 -9.022 -5.028 2.981 1.00 0.00 C ATOM 651 CG GLU A 41 -10.213 -5.941 3.236 1.00 0.00 C ATOM 652 CD GLU A 41 -10.909 -6.499 2.012 1.00 0.00 C ATOM 653 OE1 GLU A 41 -10.511 -7.569 1.479 1.00 0.00 O ATOM 654 OE2 GLU A 41 -11.874 -5.806 1.563 1.00 0.00 O ATOM 0 H GLU A 41 -6.632 -5.358 4.562 1.00 0.00 H new ATOM 0 HA GLU A 41 -7.827 -3.581 4.198 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -9.321 -4.203 2.334 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -8.241 -5.578 2.455 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -9.877 -6.777 3.849 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -10.946 -5.389 3.824 1.00 0.00 H new ATOM 661 N THR A 42 -9.532 -4.178 6.556 1.00 0.00 N ATOM 662 CA THR A 42 -10.568 -3.922 7.585 1.00 0.00 C ATOM 663 C THR A 42 -10.456 -2.482 8.154 1.00 0.00 C ATOM 664 O THR A 42 -11.387 -1.919 8.682 1.00 0.00 O ATOM 665 CB THR A 42 -10.611 -4.889 8.747 1.00 0.00 C ATOM 666 OG1 THR A 42 -10.296 -4.278 10.013 1.00 0.00 O ATOM 667 CG2 THR A 42 -9.838 -6.204 8.492 1.00 0.00 C ATOM 0 H THR A 42 -8.670 -4.532 6.971 1.00 0.00 H new ATOM 0 HA THR A 42 -11.497 -4.067 7.034 1.00 0.00 H new ATOM 0 HB THR A 42 -11.657 -5.188 8.823 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.342 -4.953 10.722 1.00 0.00 H new ATOM 0 HG21 THR A 42 -9.914 -6.847 9.369 1.00 0.00 H new ATOM 0 HG22 THR A 42 -10.265 -6.715 7.629 1.00 0.00 H new ATOM 0 HG23 THR A 42 -8.790 -5.978 8.298 1.00 0.00 H new ATOM 675 N LEU A 43 -9.230 -1.917 8.049 1.00 0.00 N ATOM 676 CA LEU A 43 -8.723 -0.705 8.720 1.00 0.00 C ATOM 677 C LEU A 43 -8.809 0.463 7.707 1.00 0.00 C ATOM 678 O LEU A 43 -8.887 1.634 8.082 1.00 0.00 O ATOM 679 CB LEU A 43 -7.216 -1.017 8.978 1.00 0.00 C ATOM 680 CG LEU A 43 -6.651 -0.936 10.399 1.00 0.00 C ATOM 681 CD1 LEU A 43 -7.529 -0.132 11.399 1.00 0.00 C ATOM 682 CD2 LEU A 43 -6.209 -2.295 10.943 1.00 0.00 C ATOM 0 H LEU A 43 -8.519 -2.331 7.446 1.00 0.00 H new ATOM 0 HA LEU A 43 -9.268 -0.448 9.628 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -7.026 -2.025 8.610 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.633 -0.336 8.358 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.745 -0.339 10.299 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.052 -0.127 12.379 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.639 0.893 11.044 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.512 -0.597 11.476 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -5.818 -2.173 11.953 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.062 -2.973 10.964 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -5.432 -2.709 10.301 1.00 0.00 H new ATOM 694 N ALA A 44 -8.704 0.116 6.393 1.00 0.00 N ATOM 695 CA ALA A 44 -8.274 1.016 5.313 1.00 0.00 C ATOM 696 C ALA A 44 -9.152 2.285 5.278 1.00 0.00 C ATOM 697 O ALA A 44 -8.736 3.366 4.928 1.00 0.00 O ATOM 698 CB ALA A 44 -8.326 0.317 3.957 1.00 0.00 C ATOM 0 H ALA A 44 -8.924 -0.823 6.060 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.242 1.302 5.516 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.002 1.008 3.179 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -7.666 -0.550 3.969 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -9.347 -0.007 3.753 1.00 0.00 H new ATOM 704 N GLY A 45 -10.469 2.067 5.614 1.00 0.00 N ATOM 705 CA GLY A 45 -11.388 3.167 5.950 1.00 0.00 C ATOM 706 C GLY A 45 -10.725 4.188 6.901 1.00 0.00 C ATOM 707 O GLY A 45 -10.565 5.356 6.512 1.00 0.00 O ATOM 0 H GLY A 45 -10.896 1.141 5.654 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.704 3.671 5.036 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -12.286 2.763 6.417 1.00 0.00 H new ATOM 711 N GLU A 46 -10.319 3.725 8.093 1.00 0.00 N ATOM 712 CA GLU A 46 -9.741 4.502 9.160 1.00 0.00 C ATOM 713 C GLU A 46 -8.202 4.738 8.936 1.00 0.00 C ATOM 714 O GLU A 46 -7.732 5.843 9.114 1.00 0.00 O ATOM 715 CB GLU A 46 -9.938 3.774 10.495 1.00 0.00 C ATOM 716 CG GLU A 46 -10.650 4.644 11.528 1.00 0.00 C ATOM 717 CD GLU A 46 -11.399 3.863 12.620 1.00 0.00 C ATOM 718 OE1 GLU A 46 -11.148 2.670 12.825 1.00 0.00 O ATOM 719 OE2 GLU A 46 -12.306 4.552 13.234 1.00 0.00 O ATOM 0 H GLU A 46 -10.397 2.737 8.336 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.243 5.469 9.174 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -10.515 2.864 10.329 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.968 3.469 10.887 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.915 5.293 12.004 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -11.360 5.290 11.011 1.00 0.00 H new ATOM 726 N LYS A 47 -7.511 3.629 8.637 1.00 0.00 N ATOM 727 CA LYS A 47 -6.020 3.658 8.426 1.00 0.00 C ATOM 728 C LYS A 47 -5.688 4.388 7.099 1.00 0.00 C ATOM 729 O LYS A 47 -4.844 5.261 7.046 1.00 0.00 O ATOM 730 CB LYS A 47 -5.446 2.252 8.441 1.00 0.00 C ATOM 731 CG LYS A 47 -4.513 2.079 9.685 1.00 0.00 C ATOM 732 CD LYS A 47 -5.100 2.612 10.982 1.00 0.00 C ATOM 733 CE LYS A 47 -4.053 3.555 11.662 1.00 0.00 C ATOM 734 NZ LYS A 47 -4.636 4.201 12.838 1.00 0.00 N ATOM 0 H LYS A 47 -7.933 2.706 8.533 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.558 4.209 9.246 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -6.252 1.519 8.474 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -4.885 2.068 7.525 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.285 1.020 9.810 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.569 2.587 9.491 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -6.023 3.156 10.782 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.353 1.787 11.648 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -3.173 2.982 11.953 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -3.720 4.311 10.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -3.878 4.481 13.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -5.167 5.045 12.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -5.278 3.537 13.316 1.00 0.00 H new ATOM 748 N GLY A 48 -6.403 3.963 6.041 1.00 0.00 N ATOM 749 CA GLY A 48 -6.503 4.711 4.733 1.00 0.00 C ATOM 750 C GLY A 48 -6.412 6.214 4.981 1.00 0.00 C ATOM 751 O GLY A 48 -5.461 6.873 4.508 1.00 0.00 O ATOM 0 H GLY A 48 -6.935 3.093 6.049 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -5.703 4.396 4.063 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -7.445 4.472 4.240 1.00 0.00 H new ATOM 755 N GLN A 49 -7.418 6.787 5.723 1.00 0.00 N ATOM 756 CA GLN A 49 -7.325 8.120 6.333 1.00 0.00 C ATOM 757 C GLN A 49 -5.903 8.459 6.796 1.00 0.00 C ATOM 758 O GLN A 49 -5.289 9.416 6.294 1.00 0.00 O ATOM 759 CB GLN A 49 -8.343 8.221 7.476 1.00 0.00 C ATOM 760 CG GLN A 49 -9.755 7.723 7.127 1.00 0.00 C ATOM 761 CD GLN A 49 -10.852 8.716 7.463 1.00 0.00 C ATOM 762 OE1 GLN A 49 -10.770 9.929 7.459 1.00 0.00 O ATOM 763 NE2 GLN A 49 -12.099 8.155 7.722 1.00 0.00 N ATOM 0 H GLN A 49 -8.307 6.321 5.903 1.00 0.00 H new ATOM 0 HA GLN A 49 -7.566 8.865 5.575 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -7.971 7.650 8.327 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.408 9.261 7.795 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -9.797 7.495 6.062 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.944 6.791 7.660 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -12.209 7.141 7.734 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -12.902 8.758 7.900 1.00 0.00 H new ATOM 772 N ASN A 50 -5.412 7.700 7.809 1.00 0.00 N ATOM 773 CA ASN A 50 -4.220 8.049 8.603 1.00 0.00 C ATOM 774 C ASN A 50 -2.961 7.910 7.719 1.00 0.00 C ATOM 775 O ASN A 50 -1.862 8.389 8.083 1.00 0.00 O ATOM 776 CB ASN A 50 -4.124 7.162 9.856 1.00 0.00 C ATOM 777 CG ASN A 50 -5.355 7.212 10.765 1.00 0.00 C ATOM 778 OD1 ASN A 50 -5.846 6.237 11.337 1.00 0.00 O ATOM 779 ND2 ASN A 50 -5.946 8.403 10.948 1.00 0.00 N ATOM 0 H ASN A 50 -5.842 6.820 8.095 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.299 9.082 8.942 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -3.960 6.131 9.544 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.250 7.463 10.433 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -6.771 8.477 11.543 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -5.570 9.234 10.492 1.00 0.00 H new ATOM 786 N ALA A 51 -3.120 7.205 6.591 1.00 0.00 N ATOM 787 CA ALA A 51 -2.126 7.132 5.490 1.00 0.00 C ATOM 788 C ALA A 51 -2.112 8.430 4.677 1.00 0.00 C ATOM 789 O ALA A 51 -3.011 9.303 4.811 1.00 0.00 O ATOM 790 CB ALA A 51 -2.493 5.934 4.552 1.00 0.00 C ATOM 0 H ALA A 51 -3.958 6.654 6.406 1.00 0.00 H new ATOM 0 HA ALA A 51 -1.135 6.987 5.921 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.768 5.872 3.740 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.477 5.006 5.124 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -3.489 6.088 4.138 1.00 0.00 H new ATOM 796 N ASP A 52 -1.028 8.647 3.906 1.00 0.00 N ATOM 797 CA ASP A 52 -0.809 9.669 2.891 1.00 0.00 C ATOM 798 C ASP A 52 -0.829 9.104 1.460 1.00 0.00 C ATOM 799 O ASP A 52 -1.078 9.821 0.485 1.00 0.00 O ATOM 800 CB ASP A 52 0.514 10.437 3.148 1.00 0.00 C ATOM 801 CG ASP A 52 0.469 11.908 2.657 1.00 0.00 C ATOM 802 OD1 ASP A 52 -0.359 12.134 1.734 1.00 0.00 O ATOM 803 OD2 ASP A 52 1.194 12.748 3.262 1.00 0.00 O ATOM 0 H ASP A 52 -0.209 8.045 3.996 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.645 10.364 2.973 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.734 10.423 4.216 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.332 9.918 2.648 1.00 0.00 H new ATOM 808 N VAL A 53 -0.409 7.823 1.329 1.00 0.00 N ATOM 809 CA VAL A 53 -0.703 6.949 0.164 1.00 0.00 C ATOM 810 C VAL A 53 -1.087 5.540 0.605 1.00 0.00 C ATOM 811 O VAL A 53 -0.602 4.986 1.597 1.00 0.00 O ATOM 812 CB VAL A 53 0.568 6.978 -0.743 1.00 0.00 C ATOM 813 CG1 VAL A 53 0.668 5.842 -1.736 1.00 0.00 C ATOM 814 CG2 VAL A 53 0.812 8.357 -1.362 1.00 0.00 C ATOM 0 H VAL A 53 0.154 7.358 2.042 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.566 7.309 -0.395 1.00 0.00 H new ATOM 0 HB VAL A 53 1.400 6.793 -0.064 1.00 0.00 H new ATOM 0 HG11 VAL A 53 1.583 5.948 -2.320 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.687 4.892 -1.202 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.193 5.866 -2.404 1.00 0.00 H new ATOM 0 HG21 VAL A 53 1.707 8.324 -1.983 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.045 8.638 -1.975 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.948 9.093 -0.569 1.00 0.00 H new ATOM 824 N VAL A 54 -2.067 4.919 -0.151 1.00 0.00 N ATOM 825 CA VAL A 54 -2.741 3.675 0.169 1.00 0.00 C ATOM 826 C VAL A 54 -2.480 2.603 -0.890 1.00 0.00 C ATOM 827 O VAL A 54 -2.159 2.866 -2.041 1.00 0.00 O ATOM 828 CB VAL A 54 -4.264 3.938 0.460 1.00 0.00 C ATOM 829 CG1 VAL A 54 -5.158 2.722 0.107 1.00 0.00 C ATOM 830 CG2 VAL A 54 -4.487 4.428 1.897 1.00 0.00 C ATOM 0 H VAL A 54 -2.395 5.319 -1.030 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.321 3.266 1.088 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.577 4.742 -0.206 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.199 2.959 0.328 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.056 2.491 -0.953 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.849 1.860 0.698 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.551 4.599 2.062 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.128 3.675 2.598 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.941 5.359 2.053 1.00 0.00 H new ATOM 840 N LEU A 55 -2.526 1.291 -0.472 1.00 0.00 N ATOM 841 CA LEU A 55 -2.552 0.095 -1.239 1.00 0.00 C ATOM 842 C LEU A 55 -3.507 -0.994 -0.722 1.00 0.00 C ATOM 843 O LEU A 55 -3.821 -1.073 0.456 1.00 0.00 O ATOM 844 CB LEU A 55 -1.114 -0.514 -1.279 1.00 0.00 C ATOM 845 CG LEU A 55 -0.003 0.418 -1.815 1.00 0.00 C ATOM 846 CD1 LEU A 55 1.032 0.819 -0.739 1.00 0.00 C ATOM 847 CD2 LEU A 55 0.604 -0.062 -3.120 1.00 0.00 C ATOM 0 H LEU A 55 -2.546 1.078 0.525 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.919 0.391 -2.222 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.844 -0.827 -0.270 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -1.137 -1.412 -1.896 1.00 0.00 H new ATOM 0 HG LEU A 55 -0.500 1.353 -2.074 1.00 0.00 H new ATOM 0 HD11 LEU A 55 1.783 1.473 -1.182 1.00 0.00 H new ATOM 0 HD12 LEU A 55 0.528 1.343 0.073 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.516 -0.076 -0.348 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.377 0.637 -3.441 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.045 -1.048 -2.975 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -0.172 -0.120 -3.883 1.00 0.00 H new ATOM 859 N LEU A 56 -4.005 -1.847 -1.667 1.00 0.00 N ATOM 860 CA LEU A 56 -4.960 -2.929 -1.450 1.00 0.00 C ATOM 861 C LEU A 56 -4.562 -4.125 -2.367 1.00 0.00 C ATOM 862 O LEU A 56 -4.023 -3.914 -3.457 1.00 0.00 O ATOM 863 CB LEU A 56 -6.339 -2.391 -1.934 1.00 0.00 C ATOM 864 CG LEU A 56 -7.585 -3.265 -1.769 1.00 0.00 C ATOM 865 CD1 LEU A 56 -7.381 -4.661 -2.499 1.00 0.00 C ATOM 866 CD2 LEU A 56 -7.977 -3.469 -0.299 1.00 0.00 C ATOM 0 H LEU A 56 -3.723 -1.777 -2.645 1.00 0.00 H new ATOM 0 HA LEU A 56 -4.984 -3.247 -0.408 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.526 -1.453 -1.412 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.244 -2.153 -2.993 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.413 -2.734 -2.239 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.275 -5.272 -2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -7.203 -4.494 -3.561 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.525 -5.177 -2.064 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -8.867 -4.096 -0.243 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.158 -3.953 0.232 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -8.185 -2.502 0.160 1.00 0.00 H new ATOM 878 N GLY A 57 -4.788 -5.361 -1.887 1.00 0.00 N ATOM 879 CA GLY A 57 -4.575 -6.629 -2.572 1.00 0.00 C ATOM 880 C GLY A 57 -5.174 -6.692 -3.990 1.00 0.00 C ATOM 881 O GLY A 57 -6.329 -6.311 -4.199 1.00 0.00 O ATOM 0 H GLY A 57 -5.150 -5.499 -0.943 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -3.504 -6.820 -2.634 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -5.007 -7.430 -1.972 1.00 0.00 H new ATOM 885 N PRO A 58 -4.336 -7.084 -4.951 1.00 0.00 N ATOM 886 CA PRO A 58 -4.716 -7.477 -6.318 1.00 0.00 C ATOM 887 C PRO A 58 -6.055 -8.258 -6.516 1.00 0.00 C ATOM 888 O PRO A 58 -6.902 -7.971 -7.332 1.00 0.00 O ATOM 889 CB PRO A 58 -3.514 -8.334 -6.766 1.00 0.00 C ATOM 890 CG PRO A 58 -2.329 -7.522 -6.226 1.00 0.00 C ATOM 891 CD PRO A 58 -2.850 -7.006 -4.855 1.00 0.00 C ATOM 0 HA PRO A 58 -4.922 -6.579 -6.901 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -3.548 -9.338 -6.343 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -3.473 -8.446 -7.849 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -1.437 -8.138 -6.112 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -2.066 -6.700 -6.892 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.475 -7.618 -4.035 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -2.520 -5.984 -4.667 1.00 0.00 H new ATOM 899 N GLN A 59 -6.232 -9.184 -5.516 1.00 0.00 N ATOM 900 CA GLN A 59 -7.226 -10.254 -5.498 1.00 0.00 C ATOM 901 C GLN A 59 -8.508 -9.894 -4.723 1.00 0.00 C ATOM 902 O GLN A 59 -9.566 -10.506 -4.913 1.00 0.00 O ATOM 903 CB GLN A 59 -6.591 -11.518 -4.958 1.00 0.00 C ATOM 904 CG GLN A 59 -5.082 -11.653 -5.148 1.00 0.00 C ATOM 905 CD GLN A 59 -4.489 -12.862 -4.370 1.00 0.00 C ATOM 906 OE1 GLN A 59 -5.177 -13.818 -3.980 1.00 0.00 O ATOM 907 NE2 GLN A 59 -3.171 -12.810 -4.110 1.00 0.00 N ATOM 0 H GLN A 59 -5.650 -9.184 -4.678 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.551 -10.413 -6.526 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -6.808 -11.581 -3.892 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -7.073 -12.373 -5.433 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -4.861 -11.765 -6.210 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -4.594 -10.737 -4.816 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -2.618 -12.018 -4.437 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -2.724 -13.563 -3.586 1.00 0.00 H new ATOM 916 N ILE A 60 -8.393 -8.898 -3.807 1.00 0.00 N ATOM 917 CA ILE A 60 -9.544 -8.217 -3.115 1.00 0.00 C ATOM 918 C ILE A 60 -9.770 -6.848 -3.785 1.00 0.00 C ATOM 919 O ILE A 60 -10.501 -6.015 -3.276 1.00 0.00 O ATOM 920 CB ILE A 60 -9.352 -8.169 -1.591 1.00 0.00 C ATOM 921 CG1 ILE A 60 -8.521 -6.968 -1.135 1.00 0.00 C ATOM 922 CG2 ILE A 60 -8.818 -9.510 -1.009 1.00 0.00 C ATOM 923 CD1 ILE A 60 -8.214 -6.858 0.382 1.00 0.00 C ATOM 0 H ILE A 60 -7.487 -8.532 -3.516 1.00 0.00 H new ATOM 0 HA ILE A 60 -10.461 -8.794 -3.235 1.00 0.00 H new ATOM 0 HB ILE A 60 -10.349 -8.028 -1.173 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.573 -6.989 -1.672 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -9.041 -6.060 -1.442 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -8.702 -9.417 0.071 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -9.525 -10.310 -1.231 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.853 -9.743 -1.459 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -7.619 -5.964 0.569 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -9.149 -6.795 0.939 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.658 -7.738 0.705 1.00 0.00 H new ATOM 935 N ALA A 61 -9.067 -6.640 -4.916 1.00 0.00 N ATOM 936 CA ALA A 61 -9.285 -5.516 -5.850 1.00 0.00 C ATOM 937 C ALA A 61 -10.680 -4.919 -5.745 1.00 0.00 C ATOM 938 O ALA A 61 -10.827 -3.673 -5.763 1.00 0.00 O ATOM 939 CB ALA A 61 -9.029 -6.062 -7.298 1.00 0.00 C ATOM 0 H ALA A 61 -8.315 -7.262 -5.213 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.600 -4.706 -5.599 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -9.180 -5.260 -8.021 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -8.006 -6.430 -7.372 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -9.723 -6.876 -7.508 1.00 0.00 H new ATOM 945 N TYR A 62 -11.712 -5.782 -5.672 1.00 0.00 N ATOM 946 CA TYR A 62 -13.157 -5.432 -5.749 1.00 0.00 C ATOM 947 C TYR A 62 -13.501 -4.275 -4.845 1.00 0.00 C ATOM 948 O TYR A 62 -14.482 -3.497 -5.074 1.00 0.00 O ATOM 949 CB TYR A 62 -14.037 -6.671 -5.608 1.00 0.00 C ATOM 950 CG TYR A 62 -13.994 -7.358 -4.229 1.00 0.00 C ATOM 951 CD1 TYR A 62 -12.957 -7.067 -3.337 1.00 0.00 C ATOM 952 CD2 TYR A 62 -14.968 -8.303 -3.936 1.00 0.00 C ATOM 953 CE1 TYR A 62 -12.933 -7.646 -2.068 1.00 0.00 C ATOM 954 CE2 TYR A 62 -14.951 -8.904 -2.665 1.00 0.00 C ATOM 955 CZ TYR A 62 -13.905 -8.631 -1.779 1.00 0.00 C ATOM 956 OH TYR A 62 -13.805 -9.313 -0.612 1.00 0.00 O ATOM 0 H TYR A 62 -11.563 -6.784 -5.553 1.00 0.00 H new ATOM 0 HA TYR A 62 -13.380 -5.056 -6.748 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.068 -6.390 -5.823 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -13.739 -7.396 -6.366 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -12.170 -6.390 -3.633 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -15.719 -8.569 -4.665 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -12.198 -7.352 -1.333 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -15.745 -9.576 -2.374 1.00 0.00 H new ATOM 0 HH TYR A 62 -14.541 -9.957 -0.545 1.00 0.00 H new ATOM 966 N MET A 63 -12.738 -4.100 -3.748 1.00 0.00 N ATOM 967 CA MET A 63 -13.067 -3.248 -2.589 1.00 0.00 C ATOM 968 C MET A 63 -12.749 -1.764 -2.893 1.00 0.00 C ATOM 969 O MET A 63 -13.139 -0.895 -2.123 1.00 0.00 O ATOM 970 CB MET A 63 -12.268 -3.684 -1.336 1.00 0.00 C ATOM 971 CG MET A 63 -13.020 -4.784 -0.554 1.00 0.00 C ATOM 972 SD MET A 63 -14.219 -4.157 0.681 1.00 0.00 S ATOM 973 CE MET A 63 -13.109 -3.337 1.797 1.00 0.00 C ATOM 0 H MET A 63 -11.838 -4.568 -3.641 1.00 0.00 H new ATOM 0 HA MET A 63 -14.133 -3.361 -2.394 1.00 0.00 H new ATOM 0 HB2 MET A 63 -11.287 -4.052 -1.636 1.00 0.00 H new ATOM 0 HB3 MET A 63 -12.101 -2.823 -0.689 1.00 0.00 H new ATOM 0 HG2 MET A 63 -13.549 -5.419 -1.264 1.00 0.00 H new ATOM 0 HG3 MET A 63 -12.290 -5.413 -0.045 1.00 0.00 H new ATOM 0 HE1 MET A 63 -13.255 -3.724 2.805 1.00 0.00 H new ATOM 0 HE2 MET A 63 -12.080 -3.517 1.485 1.00 0.00 H new ATOM 0 HE3 MET A 63 -13.309 -2.265 1.787 1.00 0.00 H new ATOM 983 N LEU A 64 -12.001 -1.538 -3.978 1.00 0.00 N ATOM 984 CA LEU A 64 -11.353 -0.245 -4.344 1.00 0.00 C ATOM 985 C LEU A 64 -12.421 0.805 -4.646 1.00 0.00 C ATOM 986 O LEU A 64 -12.230 1.976 -4.310 1.00 0.00 O ATOM 987 CB LEU A 64 -10.453 -0.522 -5.557 1.00 0.00 C ATOM 988 CG LEU A 64 -10.241 0.560 -6.629 1.00 0.00 C ATOM 989 CD1 LEU A 64 -10.336 2.008 -6.190 1.00 0.00 C ATOM 990 CD2 LEU A 64 -8.930 0.250 -7.440 1.00 0.00 C ATOM 0 H LEU A 64 -11.814 -2.271 -4.662 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.750 0.151 -3.527 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -9.469 -0.794 -5.174 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -10.853 -1.402 -6.061 1.00 0.00 H new ATOM 0 HG LEU A 64 -11.114 0.485 -7.278 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.166 2.660 -7.047 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.328 2.200 -5.780 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.583 2.207 -5.427 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.782 1.018 -8.199 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.077 0.240 -6.762 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.022 -0.723 -7.922 1.00 0.00 H new ATOM 1002 N PRO A 65 -13.537 0.404 -5.277 1.00 0.00 N ATOM 1003 CA PRO A 65 -14.735 1.236 -5.518 1.00 0.00 C ATOM 1004 C PRO A 65 -15.454 1.743 -4.203 1.00 0.00 C ATOM 1005 O PRO A 65 -15.686 2.923 -4.029 1.00 0.00 O ATOM 1006 CB PRO A 65 -15.606 0.500 -6.470 1.00 0.00 C ATOM 1007 CG PRO A 65 -14.636 -0.497 -7.187 1.00 0.00 C ATOM 1008 CD PRO A 65 -13.664 -0.874 -6.014 1.00 0.00 C ATOM 0 HA PRO A 65 -14.439 2.182 -5.971 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -16.407 -0.027 -5.951 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -16.079 1.177 -7.182 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -15.159 -1.367 -7.583 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -14.112 -0.032 -8.022 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -14.074 -1.665 -5.386 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -12.701 -1.227 -6.383 1.00 0.00 H new ATOM 1016 N GLU A 66 -15.528 0.783 -3.284 1.00 0.00 N ATOM 1017 CA GLU A 66 -15.755 0.988 -1.850 1.00 0.00 C ATOM 1018 C GLU A 66 -14.665 1.938 -1.246 1.00 0.00 C ATOM 1019 O GLU A 66 -14.986 3.024 -0.796 1.00 0.00 O ATOM 1020 CB GLU A 66 -15.699 -0.358 -1.097 1.00 0.00 C ATOM 1021 CG GLU A 66 -16.898 -0.619 -0.220 1.00 0.00 C ATOM 1022 CD GLU A 66 -17.210 -2.107 0.047 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -17.614 -2.825 -0.892 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -17.061 -2.489 1.238 1.00 0.00 O ATOM 0 H GLU A 66 -15.427 -0.203 -3.526 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.741 1.439 -1.734 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.610 -1.166 -1.823 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -14.799 -0.382 -0.482 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.743 -0.120 0.737 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -17.772 -0.159 -0.681 1.00 0.00 H new ATOM 1031 N ILE A 67 -13.435 1.405 -1.191 1.00 0.00 N ATOM 1032 CA ILE A 67 -12.217 2.060 -0.578 1.00 0.00 C ATOM 1033 C ILE A 67 -12.233 3.566 -0.986 1.00 0.00 C ATOM 1034 O ILE A 67 -11.756 4.437 -0.270 1.00 0.00 O ATOM 1035 CB ILE A 67 -10.929 1.331 -1.018 1.00 0.00 C ATOM 1036 CG1 ILE A 67 -10.984 -0.168 -0.643 1.00 0.00 C ATOM 1037 CG2 ILE A 67 -9.633 2.006 -0.576 1.00 0.00 C ATOM 1038 CD1 ILE A 67 -10.501 -0.565 0.750 1.00 0.00 C ATOM 0 H ILE A 67 -13.230 0.483 -1.575 1.00 0.00 H new ATOM 0 HA ILE A 67 -12.238 1.991 0.510 1.00 0.00 H new ATOM 0 HB ILE A 67 -10.901 1.404 -2.105 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -12.016 -0.504 -0.749 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -10.392 -0.719 -1.374 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -8.781 1.425 -0.929 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -9.585 3.011 -0.995 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -9.606 2.065 0.512 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -10.597 -1.644 0.875 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.456 -0.277 0.869 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -11.105 -0.058 1.503 1.00 0.00 H new ATOM 1050 N GLN A 68 -12.740 3.812 -2.224 1.00 0.00 N ATOM 1051 CA GLN A 68 -12.708 5.102 -2.917 1.00 0.00 C ATOM 1052 C GLN A 68 -13.886 6.018 -2.545 1.00 0.00 C ATOM 1053 O GLN A 68 -13.870 7.220 -2.859 1.00 0.00 O ATOM 1054 CB GLN A 68 -12.668 4.872 -4.429 1.00 0.00 C ATOM 1055 CG GLN A 68 -11.283 4.932 -5.082 1.00 0.00 C ATOM 1056 CD GLN A 68 -10.709 6.321 -5.265 1.00 0.00 C ATOM 1057 OE1 GLN A 68 -10.791 6.971 -6.344 1.00 0.00 O ATOM 1058 NE2 GLN A 68 -10.078 6.928 -4.221 1.00 0.00 N ATOM 0 H GLN A 68 -13.195 3.084 -2.775 1.00 0.00 H new ATOM 0 HA GLN A 68 -11.805 5.618 -2.593 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.105 3.896 -4.640 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -13.305 5.616 -4.907 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -10.590 4.348 -4.477 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -11.339 4.449 -6.058 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.987 6.443 -3.328 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.697 7.868 -4.332 1.00 0.00 H new ATOM 1067 N ARG A 69 -14.952 5.433 -1.969 1.00 0.00 N ATOM 1068 CA ARG A 69 -16.005 6.187 -1.234 1.00 0.00 C ATOM 1069 C ARG A 69 -15.448 6.687 0.113 1.00 0.00 C ATOM 1070 O ARG A 69 -15.276 7.865 0.339 1.00 0.00 O ATOM 1071 CB ARG A 69 -17.213 5.273 -0.990 1.00 0.00 C ATOM 1072 CG ARG A 69 -18.031 4.991 -2.283 1.00 0.00 C ATOM 1073 CD ARG A 69 -17.985 3.492 -2.650 1.00 0.00 C ATOM 1074 NE ARG A 69 -19.168 3.132 -3.444 1.00 0.00 N ATOM 1075 CZ ARG A 69 -19.521 3.701 -4.626 1.00 0.00 C ATOM 1076 NH1 ARG A 69 -18.684 4.546 -5.290 1.00 0.00 N ATOM 1077 NH2 ARG A 69 -20.728 3.477 -5.177 1.00 0.00 N ATOM 0 H ARG A 69 -15.115 4.426 -1.995 1.00 0.00 H new ATOM 0 HA ARG A 69 -16.316 7.045 -1.830 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -16.868 4.328 -0.571 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -17.865 5.732 -0.247 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -19.066 5.302 -2.138 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -17.632 5.583 -3.107 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -17.078 3.275 -3.215 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -17.948 2.888 -1.743 1.00 0.00 H new ATOM 0 HE ARG A 69 -19.772 2.396 -3.078 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -17.767 4.765 -4.901 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -18.974 4.959 -6.176 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -21.399 2.870 -4.706 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -20.972 3.915 -6.065 1.00 0.00 H new ATOM 1091 N LEU A 70 -15.228 5.677 1.028 1.00 0.00 N ATOM 1092 CA LEU A 70 -14.478 5.820 2.293 1.00 0.00 C ATOM 1093 C LEU A 70 -13.439 6.933 2.158 1.00 0.00 C ATOM 1094 O LEU A 70 -13.264 7.737 3.083 1.00 0.00 O ATOM 1095 CB LEU A 70 -13.801 4.445 2.521 1.00 0.00 C ATOM 1096 CG LEU A 70 -14.396 3.447 3.507 1.00 0.00 C ATOM 1097 CD1 LEU A 70 -15.943 3.429 3.581 1.00 0.00 C ATOM 1098 CD2 LEU A 70 -13.816 2.009 3.329 1.00 0.00 C ATOM 0 H LEU A 70 -15.582 4.731 0.886 1.00 0.00 H new ATOM 0 HA LEU A 70 -15.119 6.090 3.132 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -13.747 3.948 1.552 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -12.776 4.639 2.838 1.00 0.00 H new ATOM 0 HG LEU A 70 -14.074 3.825 4.477 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -16.264 2.686 4.311 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -16.304 4.412 3.882 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -16.351 3.176 2.602 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -14.274 1.339 4.057 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -14.031 1.652 2.322 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -12.737 2.030 3.484 1.00 0.00 H new ATOM 1110 N LEU A 71 -12.674 6.956 1.032 1.00 0.00 N ATOM 1111 CA LEU A 71 -11.719 7.996 0.613 1.00 0.00 C ATOM 1112 C LEU A 71 -11.851 8.202 -0.911 1.00 0.00 C ATOM 1113 O LEU A 71 -11.332 7.425 -1.702 1.00 0.00 O ATOM 1114 CB LEU A 71 -10.324 7.477 0.986 1.00 0.00 C ATOM 1115 CG LEU A 71 -10.163 6.657 2.290 1.00 0.00 C ATOM 1116 CD1 LEU A 71 -9.281 5.413 2.118 1.00 0.00 C ATOM 1117 CD2 LEU A 71 -9.777 7.549 3.488 1.00 0.00 C ATOM 0 H LEU A 71 -12.718 6.194 0.355 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.903 8.955 1.097 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.969 6.860 0.161 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.657 8.337 1.051 1.00 0.00 H new ATOM 0 HG LEU A 71 -11.146 6.252 2.532 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -9.209 4.884 3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -9.722 4.755 1.369 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.285 5.715 1.795 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -9.674 6.934 4.382 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.830 8.048 3.280 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -10.553 8.297 3.650 1.00 0.00 H new ATOM 1129 N PRO A 72 -12.644 9.233 -1.324 1.00 0.00 N ATOM 1130 CA PRO A 72 -12.772 9.725 -2.705 1.00 0.00 C ATOM 1131 C PRO A 72 -11.873 10.882 -3.215 1.00 0.00 C ATOM 1132 O PRO A 72 -12.288 11.764 -3.942 1.00 0.00 O ATOM 1133 CB PRO A 72 -14.267 10.088 -2.825 1.00 0.00 C ATOM 1134 CG PRO A 72 -14.569 10.683 -1.442 1.00 0.00 C ATOM 1135 CD PRO A 72 -13.681 9.871 -0.471 1.00 0.00 C ATOM 0 HA PRO A 72 -12.402 8.933 -3.356 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -14.449 10.805 -3.625 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -14.883 9.213 -3.035 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -14.329 11.746 -1.406 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -15.625 10.586 -1.190 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -13.228 10.517 0.281 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -14.266 9.122 0.063 1.00 0.00 H new ATOM 1143 N ASN A 73 -10.559 10.692 -2.886 1.00 0.00 N ATOM 1144 CA ASN A 73 -9.501 11.713 -3.109 1.00 0.00 C ATOM 1145 C ASN A 73 -8.116 11.044 -3.080 1.00 0.00 C ATOM 1146 O ASN A 73 -7.318 11.183 -4.008 1.00 0.00 O ATOM 1147 CB ASN A 73 -9.618 12.839 -2.037 1.00 0.00 C ATOM 1148 CG ASN A 73 -8.272 13.590 -1.848 1.00 0.00 C ATOM 1149 OD1 ASN A 73 -7.598 14.074 -2.745 1.00 0.00 O ATOM 1150 ND2 ASN A 73 -7.847 13.693 -0.563 1.00 0.00 N ATOM 0 H ASN A 73 -10.212 9.832 -2.462 1.00 0.00 H new ATOM 0 HA ASN A 73 -9.631 12.170 -4.090 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -10.392 13.547 -2.335 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -9.931 12.406 -1.087 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -6.971 14.172 -0.352 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -8.403 13.292 0.192 1.00 0.00 H new ATOM 1157 N LYS A 74 -7.824 10.361 -1.951 1.00 0.00 N ATOM 1158 CA LYS A 74 -6.488 9.802 -1.653 1.00 0.00 C ATOM 1159 C LYS A 74 -5.831 9.122 -2.859 1.00 0.00 C ATOM 1160 O LYS A 74 -6.460 8.729 -3.852 1.00 0.00 O ATOM 1161 CB LYS A 74 -6.587 8.821 -0.466 1.00 0.00 C ATOM 1162 CG LYS A 74 -6.383 9.562 0.874 1.00 0.00 C ATOM 1163 CD LYS A 74 -4.913 9.693 1.302 1.00 0.00 C ATOM 1164 CE LYS A 74 -4.812 9.689 2.843 1.00 0.00 C ATOM 1165 NZ LYS A 74 -5.716 10.721 3.401 1.00 0.00 N ATOM 0 H LYS A 74 -8.511 10.182 -1.219 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.843 10.641 -1.391 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.561 8.332 -0.472 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -5.837 8.038 -0.572 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -6.817 10.559 0.795 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -6.932 9.036 1.655 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -4.330 8.870 0.889 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -4.490 10.615 0.903 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -5.080 8.707 3.233 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -3.785 9.885 3.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -5.427 10.946 4.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -5.664 11.580 2.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -6.692 10.363 3.404 1.00 0.00 H new ATOM 1179 N PRO A 75 -4.486 9.017 -2.778 1.00 0.00 N ATOM 1180 CA PRO A 75 -3.644 8.163 -3.666 1.00 0.00 C ATOM 1181 C PRO A 75 -3.507 6.665 -3.352 1.00 0.00 C ATOM 1182 O PRO A 75 -2.428 6.046 -3.465 1.00 0.00 O ATOM 1183 CB PRO A 75 -2.327 8.899 -3.782 1.00 0.00 C ATOM 1184 CG PRO A 75 -2.175 9.536 -2.412 1.00 0.00 C ATOM 1185 CD PRO A 75 -3.610 9.888 -1.986 1.00 0.00 C ATOM 0 HA PRO A 75 -4.164 8.053 -4.617 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.503 8.221 -4.006 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -2.350 9.646 -4.575 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.709 8.849 -1.705 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.545 10.425 -2.456 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.753 9.721 -0.919 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.828 10.939 -2.176 1.00 0.00 H new ATOM 1193 N VAL A 76 -4.696 6.059 -3.143 1.00 0.00 N ATOM 1194 CA VAL A 76 -4.942 4.621 -3.091 1.00 0.00 C ATOM 1195 C VAL A 76 -4.491 3.954 -4.401 1.00 0.00 C ATOM 1196 O VAL A 76 -4.486 4.532 -5.482 1.00 0.00 O ATOM 1197 CB VAL A 76 -6.473 4.396 -2.809 1.00 0.00 C ATOM 1198 CG1 VAL A 76 -6.909 2.936 -2.861 1.00 0.00 C ATOM 1199 CG2 VAL A 76 -6.961 5.120 -1.555 1.00 0.00 C ATOM 0 H VAL A 76 -5.549 6.599 -2.999 1.00 0.00 H new ATOM 0 HA VAL A 76 -4.364 4.160 -2.290 1.00 0.00 H new ATOM 0 HB VAL A 76 -6.982 4.868 -3.649 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.977 2.868 -2.656 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.703 2.530 -3.851 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -6.359 2.365 -2.113 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.024 4.926 -1.414 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -6.408 4.759 -0.688 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -6.799 6.192 -1.668 1.00 0.00 H new ATOM 1209 N GLU A 77 -4.006 2.692 -4.252 1.00 0.00 N ATOM 1210 CA GLU A 77 -3.650 1.822 -5.385 1.00 0.00 C ATOM 1211 C GLU A 77 -3.517 0.341 -4.928 1.00 0.00 C ATOM 1212 O GLU A 77 -2.703 0.041 -4.077 1.00 0.00 O ATOM 1213 CB GLU A 77 -2.368 2.276 -6.087 1.00 0.00 C ATOM 1214 CG GLU A 77 -2.698 3.035 -7.382 1.00 0.00 C ATOM 1215 CD GLU A 77 -1.905 2.540 -8.617 1.00 0.00 C ATOM 1216 OE1 GLU A 77 -2.137 1.375 -8.989 1.00 0.00 O ATOM 1217 OE2 GLU A 77 -1.088 3.345 -9.145 1.00 0.00 O ATOM 0 H GLU A 77 -3.854 2.258 -3.341 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.463 1.899 -6.107 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -1.790 2.917 -5.421 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -1.746 1.410 -6.315 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.765 2.941 -7.585 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -2.494 4.095 -7.232 1.00 0.00 H new ATOM 1224 N VAL A 78 -4.429 -0.533 -5.436 1.00 0.00 N ATOM 1225 CA VAL A 78 -4.289 -1.991 -5.405 1.00 0.00 C ATOM 1226 C VAL A 78 -2.999 -2.387 -6.188 1.00 0.00 C ATOM 1227 O VAL A 78 -2.599 -1.729 -7.142 1.00 0.00 O ATOM 1228 CB VAL A 78 -5.578 -2.629 -5.947 1.00 0.00 C ATOM 1229 CG1 VAL A 78 -5.977 -2.167 -7.378 1.00 0.00 C ATOM 1230 CG2 VAL A 78 -5.648 -4.149 -5.821 1.00 0.00 C ATOM 0 H VAL A 78 -5.292 -0.225 -5.883 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.165 -2.369 -4.390 1.00 0.00 H new ATOM 0 HB VAL A 78 -6.331 -2.231 -5.267 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.897 -2.668 -7.679 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -6.133 -1.088 -7.382 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -5.181 -2.421 -8.078 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.593 -4.505 -6.230 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -4.822 -4.598 -6.372 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.579 -4.431 -4.770 1.00 0.00 H new ATOM 1240 N ILE A 79 -2.339 -3.445 -5.685 1.00 0.00 N ATOM 1241 CA ILE A 79 -0.971 -3.905 -6.039 1.00 0.00 C ATOM 1242 C ILE A 79 -1.004 -4.562 -7.428 1.00 0.00 C ATOM 1243 O ILE A 79 -2.025 -4.509 -8.121 1.00 0.00 O ATOM 1244 CB ILE A 79 -0.407 -4.844 -4.909 1.00 0.00 C ATOM 1245 CG1 ILE A 79 -0.936 -4.462 -3.535 1.00 0.00 C ATOM 1246 CG2 ILE A 79 1.125 -5.023 -4.981 1.00 0.00 C ATOM 1247 CD1 ILE A 79 0.086 -3.953 -2.498 1.00 0.00 C ATOM 0 H ILE A 79 -2.766 -4.042 -4.977 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.283 -3.062 -6.101 1.00 0.00 H new ATOM 0 HB ILE A 79 -0.798 -5.844 -5.098 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -1.694 -3.690 -3.668 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.439 -5.332 -3.113 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.453 -5.681 -4.176 1.00 0.00 H new ATOM 0 HG22 ILE A 79 1.395 -5.462 -5.941 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.610 -4.052 -4.877 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -0.428 -3.718 -1.566 1.00 0.00 H new ATOM 0 HD12 ILE A 79 0.834 -4.724 -2.315 1.00 0.00 H new ATOM 0 HD13 ILE A 79 0.575 -3.056 -2.879 1.00 0.00 H new ATOM 1259 N ASP A 80 0.096 -5.164 -7.808 1.00 0.00 N ATOM 1260 CA ASP A 80 0.258 -6.328 -8.726 1.00 0.00 C ATOM 1261 C ASP A 80 0.523 -7.598 -7.808 1.00 0.00 C ATOM 1262 O ASP A 80 0.781 -7.447 -6.650 1.00 0.00 O ATOM 1263 CB ASP A 80 1.492 -6.097 -9.576 1.00 0.00 C ATOM 1264 CG ASP A 80 1.254 -5.799 -11.070 1.00 0.00 C ATOM 1265 OD1 ASP A 80 1.108 -6.784 -11.843 1.00 0.00 O ATOM 1266 OD2 ASP A 80 1.314 -4.575 -11.409 1.00 0.00 O ATOM 0 H ASP A 80 1.001 -4.842 -7.465 1.00 0.00 H new ATOM 0 HA ASP A 80 -0.618 -6.462 -9.361 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.050 -5.265 -9.147 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.127 -6.979 -9.501 1.00 0.00 H new ATOM 1271 N SER A 81 0.221 -8.748 -8.433 1.00 0.00 N ATOM 1272 CA SER A 81 -0.123 -10.015 -7.695 1.00 0.00 C ATOM 1273 C SER A 81 1.102 -10.945 -7.661 1.00 0.00 C ATOM 1274 O SER A 81 1.194 -11.896 -6.871 1.00 0.00 O ATOM 1275 CB SER A 81 -1.274 -10.679 -8.460 1.00 0.00 C ATOM 1276 OG SER A 81 -1.430 -12.051 -8.167 1.00 0.00 O ATOM 0 H SER A 81 0.203 -8.845 -9.448 1.00 0.00 H new ATOM 0 HA SER A 81 -0.415 -9.806 -6.666 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.203 -10.158 -8.226 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.103 -10.562 -9.530 1.00 0.00 H new ATOM 0 HG SER A 81 -2.179 -12.413 -8.685 1.00 0.00 H new ATOM 1282 N LEU A 82 2.076 -10.625 -8.563 1.00 0.00 N ATOM 1283 CA LEU A 82 3.425 -11.264 -8.667 1.00 0.00 C ATOM 1284 C LEU A 82 4.528 -10.424 -8.104 1.00 0.00 C ATOM 1285 O LEU A 82 5.518 -10.979 -7.504 1.00 0.00 O ATOM 1286 CB LEU A 82 3.607 -11.490 -10.215 1.00 0.00 C ATOM 1287 CG LEU A 82 3.216 -12.851 -10.782 1.00 0.00 C ATOM 1288 CD1 LEU A 82 1.923 -12.899 -11.591 1.00 0.00 C ATOM 1289 CD2 LEU A 82 4.388 -13.664 -11.321 1.00 0.00 C ATOM 0 H LEU A 82 1.940 -9.892 -9.260 1.00 0.00 H new ATOM 0 HA LEU A 82 3.478 -12.183 -8.083 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.025 -10.730 -10.736 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.654 -11.313 -10.459 1.00 0.00 H new ATOM 0 HG LEU A 82 2.910 -13.415 -9.901 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.750 -13.917 -11.941 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.089 -12.585 -10.963 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.005 -12.230 -12.447 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.024 -14.617 -11.705 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.875 -13.111 -12.124 1.00 0.00 H new ATOM 0 HD23 LEU A 82 5.104 -13.846 -10.519 1.00 0.00 H new ATOM 1301 N LEU A 83 4.457 -9.067 -8.211 1.00 0.00 N ATOM 1302 CA LEU A 83 5.239 -8.103 -7.405 1.00 0.00 C ATOM 1303 C LEU A 83 4.819 -8.313 -5.909 1.00 0.00 C ATOM 1304 O LEU A 83 5.645 -8.318 -5.041 1.00 0.00 O ATOM 1305 CB LEU A 83 4.775 -6.727 -7.891 1.00 0.00 C ATOM 1306 CG LEU A 83 5.367 -6.048 -9.111 1.00 0.00 C ATOM 1307 CD1 LEU A 83 5.102 -4.543 -9.294 1.00 0.00 C ATOM 1308 CD2 LEU A 83 6.854 -6.401 -9.340 1.00 0.00 C ATOM 0 H LEU A 83 3.837 -8.609 -8.879 1.00 0.00 H new ATOM 0 HA LEU A 83 6.320 -8.214 -7.496 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.702 -6.805 -8.068 1.00 0.00 H new ATOM 0 HB3 LEU A 83 4.911 -6.040 -7.056 1.00 0.00 H new ATOM 0 HG LEU A 83 4.774 -6.496 -9.908 1.00 0.00 H new ATOM 0 HD11 LEU A 83 5.586 -4.197 -10.207 1.00 0.00 H new ATOM 0 HD12 LEU A 83 4.028 -4.368 -9.364 1.00 0.00 H new ATOM 0 HD13 LEU A 83 5.504 -3.996 -8.441 1.00 0.00 H new ATOM 0 HD21 LEU A 83 7.218 -5.884 -10.228 1.00 0.00 H new ATOM 0 HD22 LEU A 83 7.439 -6.091 -8.474 1.00 0.00 H new ATOM 0 HD23 LEU A 83 6.955 -7.477 -9.480 1.00 0.00 H new ATOM 1320 N TYR A 84 3.458 -8.445 -5.733 1.00 0.00 N ATOM 1321 CA TYR A 84 2.827 -8.878 -4.451 1.00 0.00 C ATOM 1322 C TYR A 84 3.500 -10.101 -3.884 1.00 0.00 C ATOM 1323 O TYR A 84 4.367 -10.012 -2.976 1.00 0.00 O ATOM 1324 CB TYR A 84 1.310 -8.966 -4.602 1.00 0.00 C ATOM 1325 CG TYR A 84 0.479 -8.777 -3.328 1.00 0.00 C ATOM 1326 CD1 TYR A 84 0.751 -7.697 -2.465 1.00 0.00 C ATOM 1327 CD2 TYR A 84 -0.495 -9.737 -3.049 1.00 0.00 C ATOM 1328 CE1 TYR A 84 -0.016 -7.558 -1.283 1.00 0.00 C ATOM 1329 CE2 TYR A 84 -1.187 -9.650 -1.824 1.00 0.00 C ATOM 1330 CZ TYR A 84 -0.921 -8.575 -0.965 1.00 0.00 C ATOM 1331 OH TYR A 84 -1.572 -8.524 0.238 1.00 0.00 O ATOM 0 H TYR A 84 2.783 -8.254 -6.473 1.00 0.00 H new ATOM 0 HA TYR A 84 2.990 -8.117 -3.688 1.00 0.00 H new ATOM 0 HB2 TYR A 84 0.996 -8.215 -5.327 1.00 0.00 H new ATOM 0 HB3 TYR A 84 1.066 -9.940 -5.026 1.00 0.00 H new ATOM 0 HD1 TYR A 84 1.531 -6.988 -2.701 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.713 -10.526 -3.753 1.00 0.00 H new ATOM 0 HE1 TYR A 84 0.095 -6.693 -0.646 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -1.913 -10.402 -1.551 1.00 0.00 H new ATOM 0 HH TYR A 84 -1.587 -7.599 0.563 1.00 0.00 H new ATOM 1341 N GLY A 85 3.124 -11.298 -4.350 1.00 0.00 N ATOM 1342 CA GLY A 85 3.548 -12.611 -3.839 1.00 0.00 C ATOM 1343 C GLY A 85 4.976 -12.977 -4.304 1.00 0.00 C ATOM 1344 O GLY A 85 5.401 -14.156 -4.219 1.00 0.00 O ATOM 0 H GLY A 85 2.481 -11.383 -5.137 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.511 -12.606 -2.750 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.849 -13.375 -4.178 1.00 0.00 H new ATOM 1348 N LYS A 86 5.692 -11.950 -4.768 1.00 0.00 N ATOM 1349 CA LYS A 86 7.179 -11.948 -4.790 1.00 0.00 C ATOM 1350 C LYS A 86 7.761 -10.853 -3.918 1.00 0.00 C ATOM 1351 O LYS A 86 8.993 -10.594 -3.915 1.00 0.00 O ATOM 1352 CB LYS A 86 7.648 -11.819 -6.253 1.00 0.00 C ATOM 1353 CG LYS A 86 7.215 -13.052 -7.062 1.00 0.00 C ATOM 1354 CD LYS A 86 8.275 -14.182 -7.120 1.00 0.00 C ATOM 1355 CE LYS A 86 9.533 -13.614 -7.830 1.00 0.00 C ATOM 1356 NZ LYS A 86 9.233 -13.481 -9.282 1.00 0.00 N ATOM 0 H LYS A 86 5.273 -11.097 -5.139 1.00 0.00 H new ATOM 0 HA LYS A 86 7.543 -12.886 -4.371 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.228 -10.917 -6.699 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.733 -11.716 -6.287 1.00 0.00 H new ATOM 0 HG2 LYS A 86 6.298 -13.452 -6.629 1.00 0.00 H new ATOM 0 HG3 LYS A 86 6.978 -12.740 -8.079 1.00 0.00 H new ATOM 0 HD2 LYS A 86 8.525 -14.524 -6.116 1.00 0.00 H new ATOM 0 HD3 LYS A 86 7.886 -15.044 -7.663 1.00 0.00 H new ATOM 0 HE2 LYS A 86 9.802 -12.646 -7.408 1.00 0.00 H new ATOM 0 HE3 LYS A 86 10.386 -14.276 -7.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 10.122 -13.383 -9.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 8.725 -14.327 -9.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 8.642 -12.640 -9.439 1.00 0.00 H new ATOM 1370 N VAL A 87 6.866 -10.123 -3.198 1.00 0.00 N ATOM 1371 CA VAL A 87 7.215 -9.308 -2.025 1.00 0.00 C ATOM 1372 C VAL A 87 8.400 -8.367 -2.351 1.00 0.00 C ATOM 1373 O VAL A 87 9.482 -8.453 -1.762 1.00 0.00 O ATOM 1374 CB VAL A 87 7.449 -10.218 -0.806 1.00 0.00 C ATOM 1375 CG1 VAL A 87 7.445 -9.420 0.539 1.00 0.00 C ATOM 1376 CG2 VAL A 87 6.327 -11.317 -0.692 1.00 0.00 C ATOM 0 H VAL A 87 5.873 -10.091 -3.427 1.00 0.00 H new ATOM 0 HA VAL A 87 6.385 -8.652 -1.761 1.00 0.00 H new ATOM 0 HB VAL A 87 8.427 -10.673 -0.964 1.00 0.00 H new ATOM 0 HG11 VAL A 87 7.614 -10.106 1.369 1.00 0.00 H new ATOM 0 HG12 VAL A 87 8.237 -8.671 0.520 1.00 0.00 H new ATOM 0 HG13 VAL A 87 6.482 -8.926 0.666 1.00 0.00 H new ATOM 0 HG21 VAL A 87 6.519 -11.944 0.178 1.00 0.00 H new ATOM 0 HG22 VAL A 87 5.355 -10.835 -0.584 1.00 0.00 H new ATOM 0 HG23 VAL A 87 6.329 -11.933 -1.591 1.00 0.00 H new ATOM 1386 N ASP A 88 8.210 -7.524 -3.357 1.00 0.00 N ATOM 1387 CA ASP A 88 9.179 -6.618 -4.026 1.00 0.00 C ATOM 1388 C ASP A 88 9.016 -5.168 -3.556 1.00 0.00 C ATOM 1389 O ASP A 88 8.507 -4.310 -4.288 1.00 0.00 O ATOM 1390 CB ASP A 88 8.862 -6.629 -5.542 1.00 0.00 C ATOM 1391 CG ASP A 88 10.095 -6.512 -6.451 1.00 0.00 C ATOM 1392 OD1 ASP A 88 11.122 -7.163 -6.203 1.00 0.00 O ATOM 1393 OD2 ASP A 88 9.956 -5.703 -7.449 1.00 0.00 O ATOM 0 H ASP A 88 7.286 -7.437 -3.779 1.00 0.00 H new ATOM 0 HA ASP A 88 10.187 -6.962 -3.794 1.00 0.00 H new ATOM 0 HB2 ASP A 88 8.334 -7.552 -5.783 1.00 0.00 H new ATOM 0 HB3 ASP A 88 8.183 -5.806 -5.764 1.00 0.00 H new ATOM 1398 N GLY A 89 9.316 -4.960 -2.235 1.00 0.00 N ATOM 1399 CA GLY A 89 9.217 -3.634 -1.568 1.00 0.00 C ATOM 1400 C GLY A 89 10.384 -2.714 -1.910 1.00 0.00 C ATOM 1401 O GLY A 89 11.072 -2.173 -1.046 1.00 0.00 O ATOM 0 H GLY A 89 9.630 -5.705 -1.613 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.283 -3.154 -1.861 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.177 -3.777 -0.488 1.00 0.00 H new ATOM 1405 N LEU A 90 10.631 -2.586 -3.258 1.00 0.00 N ATOM 1406 CA LEU A 90 11.571 -1.717 -3.909 1.00 0.00 C ATOM 1407 C LEU A 90 11.003 -1.221 -5.246 1.00 0.00 C ATOM 1408 O LEU A 90 11.250 -0.116 -5.678 1.00 0.00 O ATOM 1409 CB LEU A 90 12.857 -2.613 -4.202 1.00 0.00 C ATOM 1410 CG LEU A 90 13.794 -2.122 -5.306 1.00 0.00 C ATOM 1411 CD1 LEU A 90 15.023 -1.319 -4.800 1.00 0.00 C ATOM 1412 CD2 LEU A 90 14.150 -3.221 -6.297 1.00 0.00 C ATOM 0 H LEU A 90 10.117 -3.149 -3.935 1.00 0.00 H new ATOM 0 HA LEU A 90 11.795 -0.848 -3.290 1.00 0.00 H new ATOM 0 HB2 LEU A 90 13.431 -2.697 -3.279 1.00 0.00 H new ATOM 0 HB3 LEU A 90 12.521 -3.617 -4.461 1.00 0.00 H new ATOM 0 HG LEU A 90 13.216 -1.384 -5.862 1.00 0.00 H new ATOM 0 HD11 LEU A 90 15.632 -1.011 -5.650 1.00 0.00 H new ATOM 0 HD12 LEU A 90 14.683 -0.436 -4.258 1.00 0.00 H new ATOM 0 HD13 LEU A 90 15.618 -1.945 -4.136 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.817 -2.820 -7.060 1.00 0.00 H new ATOM 0 HD22 LEU A 90 14.647 -4.037 -5.772 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.241 -3.594 -6.769 1.00 0.00 H new ATOM 1424 N GLY A 91 10.241 -2.118 -5.958 1.00 0.00 N ATOM 1425 CA GLY A 91 9.186 -1.699 -6.917 1.00 0.00 C ATOM 1426 C GLY A 91 7.962 -1.086 -6.246 1.00 0.00 C ATOM 1427 O GLY A 91 7.172 -0.359 -6.897 1.00 0.00 O ATOM 0 H GLY A 91 10.346 -3.129 -5.878 1.00 0.00 H new ATOM 0 HA2 GLY A 91 9.608 -0.976 -7.616 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.874 -2.564 -7.503 1.00 0.00 H new ATOM 1431 N VAL A 92 7.722 -1.408 -4.948 1.00 0.00 N ATOM 1432 CA VAL A 92 6.593 -0.991 -4.139 1.00 0.00 C ATOM 1433 C VAL A 92 6.793 0.332 -3.422 1.00 0.00 C ATOM 1434 O VAL A 92 5.863 1.030 -2.998 1.00 0.00 O ATOM 1435 CB VAL A 92 6.033 -2.164 -3.301 1.00 0.00 C ATOM 1436 CG1 VAL A 92 4.597 -1.843 -2.743 1.00 0.00 C ATOM 1437 CG2 VAL A 92 6.060 -3.523 -3.997 1.00 0.00 C ATOM 0 H VAL A 92 8.364 -2.004 -4.425 1.00 0.00 H new ATOM 0 HA VAL A 92 5.779 -0.732 -4.816 1.00 0.00 H new ATOM 0 HB VAL A 92 6.726 -2.258 -2.465 1.00 0.00 H new ATOM 0 HG11 VAL A 92 4.236 -2.690 -2.159 1.00 0.00 H new ATOM 0 HG12 VAL A 92 4.643 -0.958 -2.108 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.916 -1.659 -3.574 1.00 0.00 H new ATOM 0 HG21 VAL A 92 5.648 -4.281 -3.331 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.463 -3.477 -4.908 1.00 0.00 H new ATOM 0 HG23 VAL A 92 7.088 -3.782 -4.249 1.00 0.00 H new ATOM 1447 N LEU A 93 8.086 0.727 -3.219 1.00 0.00 N ATOM 1448 CA LEU A 93 8.533 2.079 -2.949 1.00 0.00 C ATOM 1449 C LEU A 93 8.381 2.964 -4.183 1.00 0.00 C ATOM 1450 O LEU A 93 7.762 4.034 -4.094 1.00 0.00 O ATOM 1451 CB LEU A 93 10.035 1.951 -2.536 1.00 0.00 C ATOM 1452 CG LEU A 93 10.592 3.133 -1.635 1.00 0.00 C ATOM 1453 CD1 LEU A 93 10.003 4.488 -2.101 1.00 0.00 C ATOM 1454 CD2 LEU A 93 10.296 2.847 -0.153 1.00 0.00 C ATOM 0 H LEU A 93 8.859 0.062 -3.246 1.00 0.00 H new ATOM 0 HA LEU A 93 7.939 2.546 -2.164 1.00 0.00 H new ATOM 0 HB2 LEU A 93 10.169 1.012 -1.999 1.00 0.00 H new ATOM 0 HB3 LEU A 93 10.640 1.889 -3.441 1.00 0.00 H new ATOM 0 HG LEU A 93 11.674 3.199 -1.746 1.00 0.00 H new ATOM 0 HD11 LEU A 93 10.394 5.289 -1.474 1.00 0.00 H new ATOM 0 HD12 LEU A 93 10.284 4.669 -3.139 1.00 0.00 H new ATOM 0 HD13 LEU A 93 8.916 4.460 -2.019 1.00 0.00 H new ATOM 0 HD21 LEU A 93 10.681 3.663 0.459 1.00 0.00 H new ATOM 0 HD22 LEU A 93 9.219 2.761 -0.007 1.00 0.00 H new ATOM 0 HD23 LEU A 93 10.777 1.914 0.141 1.00 0.00 H new ATOM 1466 N LYS A 94 8.981 2.572 -5.327 1.00 0.00 N ATOM 1467 CA LYS A 94 8.772 3.289 -6.620 1.00 0.00 C ATOM 1468 C LYS A 94 7.247 3.419 -6.908 1.00 0.00 C ATOM 1469 O LYS A 94 6.774 4.511 -7.233 1.00 0.00 O ATOM 1470 CB LYS A 94 9.499 2.568 -7.759 1.00 0.00 C ATOM 1471 CG LYS A 94 9.576 3.463 -9.001 1.00 0.00 C ATOM 1472 CD LYS A 94 9.255 2.741 -10.329 1.00 0.00 C ATOM 1473 CE LYS A 94 7.712 2.673 -10.477 1.00 0.00 C ATOM 1474 NZ LYS A 94 7.325 2.659 -11.904 1.00 0.00 N ATOM 0 H LYS A 94 9.610 1.771 -5.390 1.00 0.00 H new ATOM 0 HA LYS A 94 9.193 4.292 -6.548 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.504 2.293 -7.440 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.977 1.643 -8.003 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.883 4.295 -8.877 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.577 3.889 -9.066 1.00 0.00 H new ATOM 0 HD2 LYS A 94 9.695 3.277 -11.170 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.683 1.738 -10.331 1.00 0.00 H new ATOM 0 HE2 LYS A 94 7.333 1.778 -9.983 1.00 0.00 H new ATOM 0 HE3 LYS A 94 7.256 3.529 -9.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 6.289 2.613 -11.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 7.669 3.525 -12.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 7.744 1.829 -12.369 1.00 0.00 H new ATOM 1488 N ALA A 95 6.547 2.279 -6.857 1.00 0.00 N ATOM 1489 CA ALA A 95 5.188 2.080 -7.375 1.00 0.00 C ATOM 1490 C ALA A 95 4.156 2.849 -6.534 1.00 0.00 C ATOM 1491 O ALA A 95 3.101 3.263 -7.040 1.00 0.00 O ATOM 1492 CB ALA A 95 4.831 0.596 -7.485 1.00 0.00 C ATOM 0 H ALA A 95 6.929 1.433 -6.435 1.00 0.00 H new ATOM 0 HA ALA A 95 5.162 2.488 -8.386 1.00 0.00 H new ATOM 0 HB1 ALA A 95 3.817 0.493 -7.872 1.00 0.00 H new ATOM 0 HB2 ALA A 95 5.529 0.103 -8.161 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.892 0.133 -6.500 1.00 0.00 H new ATOM 1498 N ALA A 96 4.435 2.980 -5.217 1.00 0.00 N ATOM 1499 CA ALA A 96 3.804 3.981 -4.341 1.00 0.00 C ATOM 1500 C ALA A 96 3.887 5.396 -4.976 1.00 0.00 C ATOM 1501 O ALA A 96 2.869 5.976 -5.312 1.00 0.00 O ATOM 1502 CB ALA A 96 4.436 3.995 -2.951 1.00 0.00 C ATOM 0 H ALA A 96 5.110 2.387 -4.733 1.00 0.00 H new ATOM 0 HA ALA A 96 2.757 3.700 -4.232 1.00 0.00 H new ATOM 0 HB1 ALA A 96 3.943 4.747 -2.335 1.00 0.00 H new ATOM 0 HB2 ALA A 96 4.321 3.014 -2.489 1.00 0.00 H new ATOM 0 HB3 ALA A 96 5.496 4.234 -3.036 1.00 0.00 H new ATOM 1508 N VAL A 97 5.122 5.940 -5.023 1.00 0.00 N ATOM 1509 CA VAL A 97 5.437 7.223 -5.644 1.00 0.00 C ATOM 1510 C VAL A 97 4.518 7.448 -6.872 1.00 0.00 C ATOM 1511 O VAL A 97 3.914 8.489 -7.066 1.00 0.00 O ATOM 1512 CB VAL A 97 6.941 7.312 -5.988 1.00 0.00 C ATOM 1513 CG1 VAL A 97 7.393 8.648 -6.598 1.00 0.00 C ATOM 1514 CG2 VAL A 97 7.874 6.906 -4.827 1.00 0.00 C ATOM 0 H VAL A 97 5.938 5.481 -4.618 1.00 0.00 H new ATOM 0 HA VAL A 97 5.240 8.031 -4.940 1.00 0.00 H new ATOM 0 HB VAL A 97 7.043 6.565 -6.775 1.00 0.00 H new ATOM 0 HG11 VAL A 97 8.463 8.611 -6.804 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.851 8.826 -7.527 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.186 9.457 -5.897 1.00 0.00 H new ATOM 0 HG21 VAL A 97 8.912 6.995 -5.147 1.00 0.00 H new ATOM 0 HG22 VAL A 97 7.699 7.561 -3.974 1.00 0.00 H new ATOM 0 HG23 VAL A 97 7.670 5.875 -4.540 1.00 0.00 H new ATOM 1524 N ALA A 98 4.532 6.421 -7.771 1.00 0.00 N ATOM 1525 CA ALA A 98 3.766 6.458 -9.055 1.00 0.00 C ATOM 1526 C ALA A 98 2.289 6.793 -8.785 1.00 0.00 C ATOM 1527 O ALA A 98 1.618 7.477 -9.560 1.00 0.00 O ATOM 1528 CB ALA A 98 3.907 5.140 -9.798 1.00 0.00 C ATOM 0 H ALA A 98 5.062 5.561 -7.632 1.00 0.00 H new ATOM 0 HA ALA A 98 4.179 7.242 -9.689 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.343 5.185 -10.730 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.959 4.958 -10.019 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.521 4.330 -9.179 1.00 0.00 H new ATOM 1534 N ALA A 99 1.761 6.214 -7.688 1.00 0.00 N ATOM 1535 CA ALA A 99 0.406 6.430 -7.187 1.00 0.00 C ATOM 1536 C ALA A 99 0.104 7.915 -6.926 1.00 0.00 C ATOM 1537 O ALA A 99 -0.870 8.470 -7.402 1.00 0.00 O ATOM 1538 CB ALA A 99 0.095 5.586 -5.962 1.00 0.00 C ATOM 0 H ALA A 99 2.293 5.561 -7.112 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.258 6.099 -7.985 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.924 5.786 -5.632 1.00 0.00 H new ATOM 0 HB2 ALA A 99 0.195 4.530 -6.213 1.00 0.00 H new ATOM 0 HB3 ALA A 99 0.791 5.836 -5.162 1.00 0.00 H new ATOM 1544 N ILE A 100 0.991 8.541 -6.127 1.00 0.00 N ATOM 1545 CA ILE A 100 0.852 9.904 -5.531 1.00 0.00 C ATOM 1546 C ILE A 100 1.071 10.955 -6.630 1.00 0.00 C ATOM 1547 O ILE A 100 0.881 12.164 -6.402 1.00 0.00 O ATOM 1548 CB ILE A 100 1.683 10.082 -4.254 1.00 0.00 C ATOM 1549 CG1 ILE A 100 2.358 11.496 -4.186 1.00 0.00 C ATOM 1550 CG2 ILE A 100 2.756 8.979 -4.030 1.00 0.00 C ATOM 1551 CD1 ILE A 100 2.995 11.930 -2.900 1.00 0.00 C ATOM 0 H ILE A 100 1.870 8.097 -5.861 1.00 0.00 H new ATOM 0 HA ILE A 100 -0.163 10.050 -5.163 1.00 0.00 H new ATOM 0 HB ILE A 100 0.958 9.986 -3.446 1.00 0.00 H new ATOM 0 HG12 ILE A 100 3.122 11.535 -4.963 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.601 12.236 -4.446 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.298 9.181 -3.106 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.269 8.006 -3.960 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.455 8.976 -4.867 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.415 12.929 -3.021 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.245 11.945 -2.109 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.789 11.233 -2.634 1.00 0.00 H new ATOM 1563 N LYS A 101 1.495 10.509 -7.819 1.00 0.00 N ATOM 1564 CA LYS A 101 1.580 11.318 -9.052 1.00 0.00 C ATOM 1565 C LYS A 101 0.399 11.054 -10.019 1.00 0.00 C ATOM 1566 O LYS A 101 0.073 11.915 -10.826 1.00 0.00 O ATOM 1567 CB LYS A 101 2.920 11.167 -9.759 1.00 0.00 C ATOM 1568 CG LYS A 101 2.947 11.900 -11.110 1.00 0.00 C ATOM 1569 CD LYS A 101 3.191 13.419 -11.033 1.00 0.00 C ATOM 1570 CE LYS A 101 2.902 14.044 -12.425 1.00 0.00 C ATOM 1571 NZ LYS A 101 4.114 14.130 -13.214 1.00 0.00 N ATOM 0 H LYS A 101 1.799 9.545 -7.959 1.00 0.00 H new ATOM 0 HA LYS A 101 1.504 12.356 -8.729 1.00 0.00 H new ATOM 0 HB2 LYS A 101 3.712 11.556 -9.120 1.00 0.00 H new ATOM 0 HB3 LYS A 101 3.129 10.109 -9.917 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.725 11.455 -11.730 1.00 0.00 H new ATOM 0 HG3 LYS A 101 1.998 11.727 -11.617 1.00 0.00 H new ATOM 0 HD2 LYS A 101 2.546 13.867 -10.277 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.220 13.621 -10.735 1.00 0.00 H new ATOM 0 HE2 LYS A 101 2.162 13.442 -12.952 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.473 15.038 -12.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 3.896 14.551 -14.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 4.809 14.724 -12.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.508 13.177 -13.351 1.00 0.00 H new ATOM 1585 N LYS A 102 -0.140 9.827 -9.939 1.00 0.00 N ATOM 1586 CA LYS A 102 -1.447 9.483 -10.539 1.00 0.00 C ATOM 1587 C LYS A 102 -2.653 9.998 -9.698 1.00 0.00 C ATOM 1588 O LYS A 102 -3.798 9.752 -10.015 1.00 0.00 O ATOM 1589 CB LYS A 102 -1.556 7.970 -10.791 1.00 0.00 C ATOM 1590 CG LYS A 102 -1.148 7.609 -12.228 1.00 0.00 C ATOM 1591 CD LYS A 102 -2.264 7.789 -13.282 1.00 0.00 C ATOM 1592 CE LYS A 102 -3.366 6.734 -12.992 1.00 0.00 C ATOM 1593 NZ LYS A 102 -4.582 7.398 -12.504 1.00 0.00 N ATOM 0 H LYS A 102 0.311 9.047 -9.461 1.00 0.00 H new ATOM 0 HA LYS A 102 -1.495 9.999 -11.498 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.920 7.436 -10.086 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.579 7.642 -10.609 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.295 8.224 -12.514 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.814 6.572 -12.246 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.677 8.796 -13.232 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -1.864 7.657 -14.288 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -3.588 6.170 -13.898 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -3.010 6.019 -12.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -5.208 6.695 -12.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -4.325 8.122 -11.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -5.076 7.848 -13.301 1.00 0.00 H new ATOM 1607 N ALA A 103 -2.300 10.713 -8.608 1.00 0.00 N ATOM 1608 CA ALA A 103 -3.215 11.569 -7.836 1.00 0.00 C ATOM 1609 C ALA A 103 -3.811 12.693 -8.711 1.00 0.00 C ATOM 1610 O ALA A 103 -5.029 12.719 -8.946 1.00 0.00 O ATOM 1611 CB ALA A 103 -2.502 12.188 -6.624 1.00 0.00 C ATOM 0 H ALA A 103 -1.350 10.708 -8.236 1.00 0.00 H new ATOM 0 HA ALA A 103 -4.027 10.932 -7.485 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.202 12.816 -6.072 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.135 11.394 -5.973 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.663 12.794 -6.966 1.00 0.00 H new ATOM 1617 N ALA A 104 -2.962 13.643 -9.131 1.00 0.00 N ATOM 1618 CA ALA A 104 -3.334 14.907 -9.787 1.00 0.00 C ATOM 1619 C ALA A 104 -4.039 14.662 -11.143 1.00 0.00 C ATOM 1620 O ALA A 104 -3.898 13.608 -11.742 1.00 0.00 O ATOM 1621 CB ALA A 104 -2.068 15.740 -10.058 1.00 0.00 C ATOM 0 H ALA A 104 -1.953 13.548 -9.018 1.00 0.00 H new ATOM 0 HA ALA A 104 -4.017 15.432 -9.119 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -2.345 16.676 -10.544 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -1.566 15.956 -9.115 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -1.396 15.179 -10.707 1.00 0.00 H new ATOM 1627 N ALA A 105 -4.852 15.665 -11.549 1.00 0.00 N ATOM 1628 CA ALA A 105 -5.684 15.659 -12.763 1.00 0.00 C ATOM 1629 C ALA A 105 -6.906 16.594 -12.580 1.00 0.00 C ATOM 1630 O ALA A 105 -8.026 16.134 -12.379 1.00 0.00 O ATOM 1631 CB ALA A 105 -6.172 14.253 -13.075 1.00 0.00 C ATOM 0 H ALA A 105 -4.946 16.530 -11.017 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.072 16.015 -13.592 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -6.785 14.272 -13.976 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -5.316 13.597 -13.233 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.766 13.880 -12.240 1.00 0.00 H new ATOM 1637 N ASN A 106 -6.616 17.907 -12.584 1.00 0.00 N ATOM 1638 CA ASN A 106 -7.630 18.999 -12.701 1.00 0.00 C ATOM 1639 C ASN A 106 -8.515 18.985 -11.430 1.00 0.00 C ATOM 1640 O ASN A 106 -8.522 17.951 -10.699 1.00 0.00 O ATOM 1641 CB ASN A 106 -8.472 18.759 -13.974 1.00 0.00 C ATOM 1642 CG ASN A 106 -7.714 18.971 -15.287 1.00 0.00 C ATOM 1643 OD1 ASN A 106 -7.469 18.073 -16.105 1.00 0.00 O ATOM 1644 ND2 ASN A 106 -7.279 20.233 -15.536 1.00 0.00 N ATOM 0 H ASN A 106 -5.661 18.256 -12.506 1.00 0.00 H new ATOM 0 HA ASN A 106 -7.152 19.975 -12.783 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -8.857 17.740 -13.952 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -9.334 19.426 -13.955 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -6.757 20.433 -16.389 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -7.475 20.981 -14.870 1.00 0.00 H new TER 1651 ASN A 106