USER MOD reduce.3.24.130724 H: found=0, std=0, add=554, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 555 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 91 GLN :FLIP amide:sc= -2.61 F(o=-6.1!,f=-4.1) USER MOD Set 1.2: A 139 TYR OH : rot 180:sc= -1.47 USER MOD Single : A 80 LYS NZ :NH3+ 153:sc= -0.0075 (180deg=-0.198) USER MOD Single : A 82 LYS NZ :NH3+ -122:sc= 0 (180deg=-0.0761) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0585 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc=-0.000849 USER MOD Single : A 100 LYS NZ :NH3+ -141:sc= 0 (180deg=-0.0729) USER MOD Single : A 102 SER OG : rot 180:sc= 0.0561 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 156:sc= -0.512 (180deg=-1.73!) USER MOD Single : A 111 THR OG1 : rot 42:sc= 0.88 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.00907 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0.0713 USER MOD Single : A 134 ASN : amide:sc= -0.101 X(o=-0.1,f=-0.17) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ -157:sc= -0.0408 (180deg=-0.706) USER MOD Single : A 149 GLN : amide:sc= -0.024 K(o=-0.024,f=-0.9) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 80 177.798 14.559 -8.728 1.00 0.00 N ATOM 2 CA LYS A 80 176.899 15.731 -8.521 1.00 0.00 C ATOM 3 C LYS A 80 175.691 15.335 -7.663 1.00 0.00 C ATOM 4 O LYS A 80 174.620 15.901 -7.771 1.00 0.00 O ATOM 5 CB LYS A 80 176.449 16.133 -9.926 1.00 0.00 C ATOM 6 CG LYS A 80 177.648 16.663 -10.714 1.00 0.00 C ATOM 7 CD LYS A 80 177.198 17.064 -12.120 1.00 0.00 C ATOM 8 CE LYS A 80 178.398 17.595 -12.908 1.00 0.00 C ATOM 9 NZ LYS A 80 179.141 16.378 -13.342 1.00 0.00 N ATOM 0 HA LYS A 80 177.400 16.547 -8.000 1.00 0.00 H new ATOM 0 HB2 LYS A 80 176.014 15.276 -10.439 1.00 0.00 H new ATOM 0 HB3 LYS A 80 175.673 16.896 -9.866 1.00 0.00 H new ATOM 0 HG2 LYS A 80 178.083 17.521 -10.201 1.00 0.00 H new ATOM 0 HG3 LYS A 80 178.424 15.900 -10.773 1.00 0.00 H new ATOM 0 HD2 LYS A 80 176.764 16.206 -12.633 1.00 0.00 H new ATOM 0 HD3 LYS A 80 176.422 17.827 -12.061 1.00 0.00 H new ATOM 0 HE2 LYS A 80 178.077 18.188 -13.764 1.00 0.00 H new ATOM 0 HE3 LYS A 80 179.023 18.240 -12.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 179.667 16.585 -14.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 179.807 16.094 -12.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 178.468 15.605 -13.518 1.00 0.00 H new ATOM 23 N ALA A 81 175.872 14.358 -6.812 1.00 0.00 N ATOM 24 CA ALA A 81 174.766 13.887 -5.928 1.00 0.00 C ATOM 25 C ALA A 81 175.122 14.141 -4.461 1.00 0.00 C ATOM 26 O ALA A 81 176.278 14.315 -4.124 1.00 0.00 O ATOM 27 CB ALA A 81 174.685 12.383 -6.191 1.00 0.00 C ATOM 0 H ALA A 81 176.754 13.860 -6.691 1.00 0.00 H new ATOM 0 HA ALA A 81 173.825 14.400 -6.126 1.00 0.00 H new ATOM 0 HB1 ALA A 81 173.894 11.949 -5.580 1.00 0.00 H new ATOM 0 HB2 ALA A 81 174.467 12.209 -7.245 1.00 0.00 H new ATOM 0 HB3 ALA A 81 175.637 11.917 -5.936 1.00 0.00 H new ATOM 33 N LYS A 82 174.145 14.173 -3.588 1.00 0.00 N ATOM 34 CA LYS A 82 174.439 14.427 -2.149 1.00 0.00 C ATOM 35 C LYS A 82 174.274 13.150 -1.327 1.00 0.00 C ATOM 36 O LYS A 82 173.602 12.217 -1.722 1.00 0.00 O ATOM 37 CB LYS A 82 173.417 15.478 -1.715 1.00 0.00 C ATOM 38 CG LYS A 82 173.633 16.764 -2.518 1.00 0.00 C ATOM 39 CD LYS A 82 174.977 17.385 -2.135 1.00 0.00 C ATOM 40 CE LYS A 82 175.095 18.775 -2.765 1.00 0.00 C ATOM 41 NZ LYS A 82 175.441 18.523 -4.192 1.00 0.00 N ATOM 0 H LYS A 82 173.160 14.034 -3.812 1.00 0.00 H new ATOM 0 HA LYS A 82 175.465 14.763 -1.998 1.00 0.00 H new ATOM 0 HB2 LYS A 82 172.406 15.104 -1.873 1.00 0.00 H new ATOM 0 HB3 LYS A 82 173.519 15.681 -0.649 1.00 0.00 H new ATOM 0 HG2 LYS A 82 173.612 16.546 -3.586 1.00 0.00 H new ATOM 0 HG3 LYS A 82 172.825 17.469 -2.320 1.00 0.00 H new ATOM 0 HD2 LYS A 82 175.060 17.457 -1.051 1.00 0.00 H new ATOM 0 HD3 LYS A 82 175.794 16.749 -2.476 1.00 0.00 H new ATOM 0 HE2 LYS A 82 174.160 19.329 -2.677 1.00 0.00 H new ATOM 0 HE3 LYS A 82 175.865 19.368 -2.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 176.339 18.995 -4.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 175.537 17.500 -4.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 174.688 18.898 -4.803 1.00 0.00 H new ATOM 55 N THR A 83 174.896 13.120 -0.173 1.00 0.00 N ATOM 56 CA THR A 83 174.799 11.918 0.718 1.00 0.00 C ATOM 57 C THR A 83 173.320 11.548 0.914 1.00 0.00 C ATOM 58 O THR A 83 172.966 10.401 1.093 1.00 0.00 O ATOM 59 CB THR A 83 175.437 12.345 2.043 1.00 0.00 C ATOM 60 OG1 THR A 83 176.604 13.109 1.778 1.00 0.00 O ATOM 61 CG2 THR A 83 175.812 11.106 2.860 1.00 0.00 C ATOM 0 H THR A 83 175.470 13.880 0.193 1.00 0.00 H new ATOM 0 HA THR A 83 175.300 11.043 0.303 1.00 0.00 H new ATOM 0 HB THR A 83 174.726 12.946 2.610 1.00 0.00 H new ATOM 0 HG1 THR A 83 177.013 13.385 2.624 1.00 0.00 H new ATOM 0 HG21 THR A 83 176.266 11.415 3.802 1.00 0.00 H new ATOM 0 HG22 THR A 83 174.916 10.520 3.064 1.00 0.00 H new ATOM 0 HG23 THR A 83 176.522 10.500 2.297 1.00 0.00 H new ATOM 69 N GLU A 84 172.465 12.536 0.869 1.00 0.00 N ATOM 70 CA GLU A 84 170.996 12.301 1.036 1.00 0.00 C ATOM 71 C GLU A 84 170.489 11.232 0.061 1.00 0.00 C ATOM 72 O GLU A 84 169.653 10.416 0.404 1.00 0.00 O ATOM 73 CB GLU A 84 170.354 13.649 0.698 1.00 0.00 C ATOM 74 CG GLU A 84 170.676 14.662 1.802 1.00 0.00 C ATOM 75 CD GLU A 84 170.040 16.019 1.476 1.00 0.00 C ATOM 76 OE1 GLU A 84 169.730 16.252 0.317 1.00 0.00 O ATOM 77 OE2 GLU A 84 169.879 16.807 2.393 1.00 0.00 O ATOM 0 H GLU A 84 172.725 13.511 0.721 1.00 0.00 H new ATOM 0 HA GLU A 84 170.756 11.948 2.039 1.00 0.00 H new ATOM 0 HB2 GLU A 84 170.726 14.010 -0.261 1.00 0.00 H new ATOM 0 HB3 GLU A 84 169.275 13.535 0.599 1.00 0.00 H new ATOM 0 HG2 GLU A 84 170.304 14.298 2.760 1.00 0.00 H new ATOM 0 HG3 GLU A 84 171.756 14.772 1.901 1.00 0.00 H new ATOM 84 N ASP A 85 170.983 11.238 -1.150 1.00 0.00 N ATOM 85 CA ASP A 85 170.527 10.227 -2.152 1.00 0.00 C ATOM 86 C ASP A 85 170.873 8.817 -1.665 1.00 0.00 C ATOM 87 O ASP A 85 170.040 7.931 -1.649 1.00 0.00 O ATOM 88 CB ASP A 85 171.292 10.558 -3.436 1.00 0.00 C ATOM 89 CG ASP A 85 170.468 10.132 -4.656 1.00 0.00 C ATOM 90 OD1 ASP A 85 169.716 9.179 -4.538 1.00 0.00 O ATOM 91 OD2 ASP A 85 170.607 10.768 -5.688 1.00 0.00 O ATOM 0 H ASP A 85 171.682 11.899 -1.489 1.00 0.00 H new ATOM 0 HA ASP A 85 169.449 10.256 -2.309 1.00 0.00 H new ATOM 0 HB2 ASP A 85 171.499 11.627 -3.481 1.00 0.00 H new ATOM 0 HB3 ASP A 85 172.254 10.046 -3.439 1.00 0.00 H new ATOM 96 N PHE A 86 172.101 8.613 -1.269 1.00 0.00 N ATOM 97 CA PHE A 86 172.530 7.269 -0.776 1.00 0.00 C ATOM 98 C PHE A 86 171.948 6.976 0.613 1.00 0.00 C ATOM 99 O PHE A 86 171.618 5.845 0.920 1.00 0.00 O ATOM 100 CB PHE A 86 174.061 7.337 -0.699 1.00 0.00 C ATOM 101 CG PHE A 86 174.666 6.713 -1.938 1.00 0.00 C ATOM 102 CD1 PHE A 86 174.307 5.413 -2.314 1.00 0.00 C ATOM 103 CD2 PHE A 86 175.583 7.436 -2.713 1.00 0.00 C ATOM 104 CE1 PHE A 86 174.863 4.835 -3.461 1.00 0.00 C ATOM 105 CE2 PHE A 86 176.138 6.856 -3.862 1.00 0.00 C ATOM 106 CZ PHE A 86 175.778 5.555 -4.235 1.00 0.00 C ATOM 0 H PHE A 86 172.832 9.325 -1.265 1.00 0.00 H new ATOM 0 HA PHE A 86 172.180 6.475 -1.436 1.00 0.00 H new ATOM 0 HB2 PHE A 86 174.384 8.374 -0.609 1.00 0.00 H new ATOM 0 HB3 PHE A 86 174.413 6.815 0.191 1.00 0.00 H new ATOM 0 HD1 PHE A 86 173.600 4.855 -1.718 1.00 0.00 H new ATOM 0 HD2 PHE A 86 175.862 8.439 -2.425 1.00 0.00 H new ATOM 0 HE1 PHE A 86 174.585 3.832 -3.748 1.00 0.00 H new ATOM 0 HE2 PHE A 86 176.844 7.413 -4.460 1.00 0.00 H new ATOM 0 HZ PHE A 86 176.207 5.108 -5.120 1.00 0.00 H new ATOM 116 N VAL A 87 171.845 7.969 1.466 1.00 0.00 N ATOM 117 CA VAL A 87 171.315 7.715 2.844 1.00 0.00 C ATOM 118 C VAL A 87 169.830 7.328 2.794 1.00 0.00 C ATOM 119 O VAL A 87 169.401 6.397 3.447 1.00 0.00 O ATOM 120 CB VAL A 87 171.503 9.041 3.596 1.00 0.00 C ATOM 121 CG1 VAL A 87 170.973 8.909 5.028 1.00 0.00 C ATOM 122 CG2 VAL A 87 172.993 9.395 3.643 1.00 0.00 C ATOM 0 H VAL A 87 172.103 8.936 1.270 1.00 0.00 H new ATOM 0 HA VAL A 87 171.834 6.890 3.333 1.00 0.00 H new ATOM 0 HB VAL A 87 170.952 9.825 3.077 1.00 0.00 H new ATOM 0 HG11 VAL A 87 171.110 9.853 5.555 1.00 0.00 H new ATOM 0 HG12 VAL A 87 169.913 8.658 5.002 1.00 0.00 H new ATOM 0 HG13 VAL A 87 171.519 8.121 5.547 1.00 0.00 H new ATOM 0 HG21 VAL A 87 173.127 10.336 4.177 1.00 0.00 H new ATOM 0 HG22 VAL A 87 173.539 8.605 4.159 1.00 0.00 H new ATOM 0 HG23 VAL A 87 173.375 9.496 2.627 1.00 0.00 H new ATOM 132 N LYS A 88 169.046 8.054 2.039 1.00 0.00 N ATOM 133 CA LYS A 88 167.579 7.761 1.954 1.00 0.00 C ATOM 134 C LYS A 88 167.318 6.342 1.446 1.00 0.00 C ATOM 135 O LYS A 88 166.386 5.685 1.864 1.00 0.00 O ATOM 136 CB LYS A 88 167.024 8.782 0.960 1.00 0.00 C ATOM 137 CG LYS A 88 167.005 10.169 1.605 1.00 0.00 C ATOM 138 CD LYS A 88 165.909 10.223 2.672 1.00 0.00 C ATOM 139 CE LYS A 88 165.785 11.653 3.205 1.00 0.00 C ATOM 140 NZ LYS A 88 164.690 11.594 4.213 1.00 0.00 N ATOM 0 H LYS A 88 169.359 8.843 1.473 1.00 0.00 H new ATOM 0 HA LYS A 88 167.107 7.829 2.934 1.00 0.00 H new ATOM 0 HB2 LYS A 88 167.637 8.797 0.059 1.00 0.00 H new ATOM 0 HB3 LYS A 88 166.017 8.498 0.656 1.00 0.00 H new ATOM 0 HG2 LYS A 88 167.974 10.386 2.053 1.00 0.00 H new ATOM 0 HG3 LYS A 88 166.827 10.932 0.847 1.00 0.00 H new ATOM 0 HD2 LYS A 88 164.959 9.898 2.249 1.00 0.00 H new ATOM 0 HD3 LYS A 88 166.146 9.539 3.487 1.00 0.00 H new ATOM 0 HE2 LYS A 88 166.719 11.989 3.656 1.00 0.00 H new ATOM 0 HE3 LYS A 88 165.547 12.354 2.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 164.545 12.538 4.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 163.812 11.278 3.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 164.947 10.925 4.966 1.00 0.00 H new ATOM 154 N ALA A 89 168.124 5.876 0.535 1.00 0.00 N ATOM 155 CA ALA A 89 167.918 4.504 -0.028 1.00 0.00 C ATOM 156 C ALA A 89 167.990 3.430 1.063 1.00 0.00 C ATOM 157 O ALA A 89 167.064 2.660 1.238 1.00 0.00 O ATOM 158 CB ALA A 89 169.052 4.310 -1.036 1.00 0.00 C ATOM 0 H ALA A 89 168.921 6.384 0.152 1.00 0.00 H new ATOM 0 HA ALA A 89 166.933 4.410 -0.484 1.00 0.00 H new ATOM 0 HB1 ALA A 89 168.968 3.324 -1.492 1.00 0.00 H new ATOM 0 HB2 ALA A 89 168.986 5.075 -1.810 1.00 0.00 H new ATOM 0 HB3 ALA A 89 170.011 4.393 -0.525 1.00 0.00 H new ATOM 164 N PHE A 90 169.081 3.354 1.780 1.00 0.00 N ATOM 165 CA PHE A 90 169.212 2.304 2.840 1.00 0.00 C ATOM 166 C PHE A 90 168.432 2.669 4.112 1.00 0.00 C ATOM 167 O PHE A 90 167.664 1.877 4.623 1.00 0.00 O ATOM 168 CB PHE A 90 170.712 2.222 3.124 1.00 0.00 C ATOM 169 CG PHE A 90 171.414 1.666 1.906 1.00 0.00 C ATOM 170 CD1 PHE A 90 171.147 0.358 1.485 1.00 0.00 C ATOM 171 CD2 PHE A 90 172.327 2.457 1.193 1.00 0.00 C ATOM 172 CE1 PHE A 90 171.789 -0.160 0.355 1.00 0.00 C ATOM 173 CE2 PHE A 90 172.969 1.938 0.063 1.00 0.00 C ATOM 174 CZ PHE A 90 172.701 0.629 -0.356 1.00 0.00 C ATOM 0 H PHE A 90 169.887 3.971 1.680 1.00 0.00 H new ATOM 0 HA PHE A 90 168.797 1.352 2.511 1.00 0.00 H new ATOM 0 HB2 PHE A 90 171.104 3.210 3.366 1.00 0.00 H new ATOM 0 HB3 PHE A 90 170.897 1.585 3.989 1.00 0.00 H new ATOM 0 HD1 PHE A 90 170.444 -0.252 2.033 1.00 0.00 H new ATOM 0 HD2 PHE A 90 172.534 3.466 1.516 1.00 0.00 H new ATOM 0 HE1 PHE A 90 171.581 -1.169 0.031 1.00 0.00 H new ATOM 0 HE2 PHE A 90 173.671 2.547 -0.486 1.00 0.00 H new ATOM 0 HZ PHE A 90 173.198 0.228 -1.227 1.00 0.00 H new ATOM 184 N GLN A 91 168.669 3.834 4.661 1.00 0.00 N ATOM 185 CA GLN A 91 167.996 4.226 5.947 1.00 0.00 C ATOM 186 C GLN A 91 166.480 3.978 5.935 1.00 0.00 C ATOM 187 O GLN A 91 165.925 3.568 6.939 1.00 0.00 O ATOM 188 CB GLN A 91 168.285 5.718 6.111 1.00 0.00 C ATOM 189 CG GLN A 91 169.767 5.919 6.426 1.00 0.00 C ATOM 190 CD GLN A 91 170.059 5.404 7.836 1.00 0.00 C ATOM 191 OE1 GLN A 91 170.534 4.198 7.992 1.00 0.00 O flip ATOM 192 NE2 GLN A 91 169.849 6.104 8.806 1.00 0.00 N flip ATOM 0 H GLN A 91 169.301 4.536 4.276 1.00 0.00 H new ATOM 0 HA GLN A 91 168.378 3.622 6.771 1.00 0.00 H new ATOM 0 HB2 GLN A 91 168.020 6.253 5.199 1.00 0.00 H new ATOM 0 HB3 GLN A 91 167.673 6.132 6.912 1.00 0.00 H new ATOM 0 HG2 GLN A 91 170.380 5.388 5.698 1.00 0.00 H new ATOM 0 HG3 GLN A 91 170.026 6.975 6.351 1.00 0.00 H new ATOM 0 HE21 GLN A 91 169.478 7.046 8.684 1.00 0.00 H new ATOM 0 HE22 GLN A 91 170.044 5.750 9.742 1.00 0.00 H new ATOM 201 N VAL A 92 165.795 4.219 4.839 1.00 0.00 N ATOM 202 CA VAL A 92 164.310 3.983 4.837 1.00 0.00 C ATOM 203 C VAL A 92 164.007 2.515 5.169 1.00 0.00 C ATOM 204 O VAL A 92 163.033 2.212 5.833 1.00 0.00 O ATOM 205 CB VAL A 92 163.810 4.345 3.434 1.00 0.00 C ATOM 206 CG1 VAL A 92 164.017 5.841 3.192 1.00 0.00 C ATOM 207 CG2 VAL A 92 164.569 3.540 2.371 1.00 0.00 C ATOM 0 H VAL A 92 166.188 4.562 3.962 1.00 0.00 H new ATOM 0 HA VAL A 92 163.809 4.591 5.590 1.00 0.00 H new ATOM 0 HB VAL A 92 162.749 4.104 3.363 1.00 0.00 H new ATOM 0 HG11 VAL A 92 163.662 6.101 2.195 1.00 0.00 H new ATOM 0 HG12 VAL A 92 163.459 6.410 3.935 1.00 0.00 H new ATOM 0 HG13 VAL A 92 165.078 6.079 3.273 1.00 0.00 H new ATOM 0 HG21 VAL A 92 164.202 3.809 1.380 1.00 0.00 H new ATOM 0 HG22 VAL A 92 165.634 3.764 2.437 1.00 0.00 H new ATOM 0 HG23 VAL A 92 164.411 2.475 2.540 1.00 0.00 H new ATOM 217 N PHE A 93 164.849 1.608 4.737 1.00 0.00 N ATOM 218 CA PHE A 93 164.625 0.164 5.058 1.00 0.00 C ATOM 219 C PHE A 93 164.835 -0.045 6.560 1.00 0.00 C ATOM 220 O PHE A 93 164.077 -0.751 7.196 1.00 0.00 O ATOM 221 CB PHE A 93 165.673 -0.603 4.248 1.00 0.00 C ATOM 222 CG PHE A 93 165.088 -0.991 2.911 1.00 0.00 C ATOM 223 CD1 PHE A 93 165.162 -0.105 1.831 1.00 0.00 C ATOM 224 CD2 PHE A 93 164.471 -2.238 2.754 1.00 0.00 C ATOM 225 CE1 PHE A 93 164.618 -0.465 0.592 1.00 0.00 C ATOM 226 CE2 PHE A 93 163.927 -2.598 1.515 1.00 0.00 C ATOM 227 CZ PHE A 93 164.002 -1.712 0.434 1.00 0.00 C ATOM 0 H PHE A 93 165.679 1.804 4.178 1.00 0.00 H new ATOM 0 HA PHE A 93 163.619 -0.175 4.812 1.00 0.00 H new ATOM 0 HB2 PHE A 93 166.560 0.014 4.104 1.00 0.00 H new ATOM 0 HB3 PHE A 93 165.989 -1.494 4.792 1.00 0.00 H new ATOM 0 HD1 PHE A 93 165.639 0.856 1.953 1.00 0.00 H new ATOM 0 HD2 PHE A 93 164.415 -2.922 3.588 1.00 0.00 H new ATOM 0 HE1 PHE A 93 164.674 0.219 -0.242 1.00 0.00 H new ATOM 0 HE2 PHE A 93 163.450 -3.559 1.393 1.00 0.00 H new ATOM 0 HZ PHE A 93 163.584 -1.991 -0.522 1.00 0.00 H new ATOM 237 N ASP A 94 165.861 0.541 7.129 1.00 0.00 N ATOM 238 CA ASP A 94 166.121 0.354 8.595 1.00 0.00 C ATOM 239 C ASP A 94 164.971 0.927 9.432 1.00 0.00 C ATOM 240 O ASP A 94 165.052 2.028 9.943 1.00 0.00 O ATOM 241 CB ASP A 94 167.416 1.122 8.876 1.00 0.00 C ATOM 242 CG ASP A 94 168.596 0.396 8.227 1.00 0.00 C ATOM 243 OD1 ASP A 94 168.554 -0.822 8.155 1.00 0.00 O ATOM 244 OD2 ASP A 94 169.525 1.070 7.812 1.00 0.00 O ATOM 0 H ASP A 94 166.529 1.140 6.644 1.00 0.00 H new ATOM 0 HA ASP A 94 166.203 -0.701 8.856 1.00 0.00 H new ATOM 0 HB2 ASP A 94 167.341 2.137 8.485 1.00 0.00 H new ATOM 0 HB3 ASP A 94 167.575 1.206 9.951 1.00 0.00 H new ATOM 249 N LYS A 95 163.902 0.183 9.571 1.00 0.00 N ATOM 250 CA LYS A 95 162.737 0.673 10.370 1.00 0.00 C ATOM 251 C LYS A 95 163.150 0.920 11.823 1.00 0.00 C ATOM 252 O LYS A 95 162.732 1.887 12.433 1.00 0.00 O ATOM 253 CB LYS A 95 161.698 -0.449 10.295 1.00 0.00 C ATOM 254 CG LYS A 95 161.174 -0.567 8.863 1.00 0.00 C ATOM 255 CD LYS A 95 160.314 0.652 8.530 1.00 0.00 C ATOM 256 CE LYS A 95 159.598 0.425 7.197 1.00 0.00 C ATOM 257 NZ LYS A 95 158.648 1.565 7.071 1.00 0.00 N ATOM 0 H LYS A 95 163.786 -0.745 9.164 1.00 0.00 H new ATOM 0 HA LYS A 95 162.348 1.616 9.986 1.00 0.00 H new ATOM 0 HB2 LYS A 95 162.144 -1.393 10.609 1.00 0.00 H new ATOM 0 HB3 LYS A 95 160.875 -0.242 10.979 1.00 0.00 H new ATOM 0 HG2 LYS A 95 162.008 -0.638 8.165 1.00 0.00 H new ATOM 0 HG3 LYS A 95 160.588 -1.479 8.754 1.00 0.00 H new ATOM 0 HD2 LYS A 95 159.585 0.823 9.322 1.00 0.00 H new ATOM 0 HD3 LYS A 95 160.937 1.545 8.473 1.00 0.00 H new ATOM 0 HE2 LYS A 95 160.305 0.407 6.367 1.00 0.00 H new ATOM 0 HE3 LYS A 95 159.072 -0.530 7.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 158.119 1.479 6.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 157.983 1.553 7.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 159.177 2.460 7.075 1.00 0.00 H new ATOM 271 N GLU A 96 163.966 0.060 12.384 1.00 0.00 N ATOM 272 CA GLU A 96 164.403 0.254 13.801 1.00 0.00 C ATOM 273 C GLU A 96 165.718 1.044 13.863 1.00 0.00 C ATOM 274 O GLU A 96 166.407 1.026 14.863 1.00 0.00 O ATOM 275 CB GLU A 96 164.602 -1.160 14.350 1.00 0.00 C ATOM 276 CG GLU A 96 163.242 -1.847 14.499 1.00 0.00 C ATOM 277 CD GLU A 96 162.427 -1.135 15.579 1.00 0.00 C ATOM 278 OE1 GLU A 96 162.885 -1.093 16.709 1.00 0.00 O ATOM 279 OE2 GLU A 96 161.356 -0.644 15.260 1.00 0.00 O ATOM 0 H GLU A 96 164.347 -0.766 11.922 1.00 0.00 H new ATOM 0 HA GLU A 96 163.673 0.821 14.378 1.00 0.00 H new ATOM 0 HB2 GLU A 96 165.240 -1.735 13.679 1.00 0.00 H new ATOM 0 HB3 GLU A 96 165.108 -1.119 15.315 1.00 0.00 H new ATOM 0 HG2 GLU A 96 162.706 -1.825 13.550 1.00 0.00 H new ATOM 0 HG3 GLU A 96 163.379 -2.895 14.764 1.00 0.00 H new ATOM 286 N SER A 97 166.047 1.763 12.812 1.00 0.00 N ATOM 287 CA SER A 97 167.291 2.604 12.772 1.00 0.00 C ATOM 288 C SER A 97 168.508 1.959 13.461 1.00 0.00 C ATOM 289 O SER A 97 169.008 2.470 14.448 1.00 0.00 O ATOM 290 CB SER A 97 166.905 3.907 13.473 1.00 0.00 C ATOM 291 OG SER A 97 166.368 4.812 12.517 1.00 0.00 O ATOM 0 H SER A 97 165.490 1.803 11.958 1.00 0.00 H new ATOM 0 HA SER A 97 167.612 2.744 11.740 1.00 0.00 H new ATOM 0 HB2 SER A 97 166.173 3.709 14.256 1.00 0.00 H new ATOM 0 HB3 SER A 97 167.778 4.346 13.957 1.00 0.00 H new ATOM 0 HG SER A 97 166.118 5.648 12.963 1.00 0.00 H new ATOM 297 N THR A 98 169.001 0.859 12.942 1.00 0.00 N ATOM 298 CA THR A 98 170.199 0.219 13.570 1.00 0.00 C ATOM 299 C THR A 98 171.465 0.766 12.908 1.00 0.00 C ATOM 300 O THR A 98 172.489 0.936 13.543 1.00 0.00 O ATOM 301 CB THR A 98 170.057 -1.287 13.315 1.00 0.00 C ATOM 302 OG1 THR A 98 170.094 -1.539 11.914 1.00 0.00 O ATOM 303 CG2 THR A 98 168.734 -1.791 13.902 1.00 0.00 C ATOM 0 H THR A 98 168.630 0.382 12.120 1.00 0.00 H new ATOM 0 HA THR A 98 170.268 0.425 14.638 1.00 0.00 H new ATOM 0 HB THR A 98 170.881 -1.814 13.796 1.00 0.00 H new ATOM 0 HG1 THR A 98 170.005 -2.501 11.752 1.00 0.00 H new ATOM 0 HG21 THR A 98 168.638 -2.861 13.718 1.00 0.00 H new ATOM 0 HG22 THR A 98 168.718 -1.605 14.976 1.00 0.00 H new ATOM 0 HG23 THR A 98 167.903 -1.266 13.430 1.00 0.00 H new ATOM 311 N GLY A 99 171.389 1.061 11.636 1.00 0.00 N ATOM 312 CA GLY A 99 172.569 1.622 10.912 1.00 0.00 C ATOM 313 C GLY A 99 173.423 0.502 10.301 1.00 0.00 C ATOM 314 O GLY A 99 174.553 0.730 9.911 1.00 0.00 O ATOM 0 H GLY A 99 170.554 0.936 11.064 1.00 0.00 H new ATOM 0 HA2 GLY A 99 172.231 2.296 10.125 1.00 0.00 H new ATOM 0 HA3 GLY A 99 173.175 2.212 11.599 1.00 0.00 H new ATOM 318 N LYS A 100 172.903 -0.698 10.208 1.00 0.00 N ATOM 319 CA LYS A 100 173.697 -1.817 9.617 1.00 0.00 C ATOM 320 C LYS A 100 172.856 -2.568 8.582 1.00 0.00 C ATOM 321 O LYS A 100 171.642 -2.598 8.670 1.00 0.00 O ATOM 322 CB LYS A 100 174.024 -2.732 10.799 1.00 0.00 C ATOM 323 CG LYS A 100 175.010 -2.029 11.732 1.00 0.00 C ATOM 324 CD LYS A 100 176.372 -1.914 11.045 1.00 0.00 C ATOM 325 CE LYS A 100 177.452 -1.632 12.093 1.00 0.00 C ATOM 326 NZ LYS A 100 177.810 -2.969 12.642 1.00 0.00 N ATOM 0 H LYS A 100 171.964 -0.949 10.516 1.00 0.00 H new ATOM 0 HA LYS A 100 174.594 -1.466 9.108 1.00 0.00 H new ATOM 0 HB2 LYS A 100 173.112 -2.984 11.340 1.00 0.00 H new ATOM 0 HB3 LYS A 100 174.451 -3.668 10.440 1.00 0.00 H new ATOM 0 HG2 LYS A 100 174.637 -1.038 11.992 1.00 0.00 H new ATOM 0 HG3 LYS A 100 175.107 -2.587 12.663 1.00 0.00 H new ATOM 0 HD2 LYS A 100 176.601 -2.836 10.511 1.00 0.00 H new ATOM 0 HD3 LYS A 100 176.351 -1.114 10.305 1.00 0.00 H new ATOM 0 HE2 LYS A 100 178.318 -1.143 11.647 1.00 0.00 H new ATOM 0 HE3 LYS A 100 177.080 -0.970 12.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 177.965 -2.893 13.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 177.036 -3.639 12.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 178.679 -3.311 12.185 1.00 0.00 H new ATOM 340 N VAL A 101 173.484 -3.186 7.612 1.00 0.00 N ATOM 341 CA VAL A 101 172.707 -3.949 6.585 1.00 0.00 C ATOM 342 C VAL A 101 173.531 -5.135 6.078 1.00 0.00 C ATOM 343 O VAL A 101 174.741 -5.160 6.200 1.00 0.00 O ATOM 344 CB VAL A 101 172.417 -2.954 5.454 1.00 0.00 C ATOM 345 CG1 VAL A 101 171.555 -1.811 5.988 1.00 0.00 C ATOM 346 CG2 VAL A 101 173.734 -2.388 4.912 1.00 0.00 C ATOM 0 H VAL A 101 174.496 -3.196 7.487 1.00 0.00 H new ATOM 0 HA VAL A 101 171.782 -4.357 6.992 1.00 0.00 H new ATOM 0 HB VAL A 101 171.887 -3.467 4.652 1.00 0.00 H new ATOM 0 HG11 VAL A 101 171.349 -1.104 5.184 1.00 0.00 H new ATOM 0 HG12 VAL A 101 170.615 -2.211 6.369 1.00 0.00 H new ATOM 0 HG13 VAL A 101 172.085 -1.301 6.793 1.00 0.00 H new ATOM 0 HG21 VAL A 101 173.523 -1.682 4.109 1.00 0.00 H new ATOM 0 HG22 VAL A 101 174.268 -1.877 5.714 1.00 0.00 H new ATOM 0 HG23 VAL A 101 174.349 -3.202 4.528 1.00 0.00 H new ATOM 356 N SER A 102 172.879 -6.114 5.506 1.00 0.00 N ATOM 357 CA SER A 102 173.609 -7.306 4.977 1.00 0.00 C ATOM 358 C SER A 102 174.180 -7.000 3.593 1.00 0.00 C ATOM 359 O SER A 102 173.581 -6.288 2.811 1.00 0.00 O ATOM 360 CB SER A 102 172.550 -8.404 4.880 1.00 0.00 C ATOM 361 OG SER A 102 171.376 -7.874 4.280 1.00 0.00 O ATOM 0 H SER A 102 171.867 -6.140 5.382 1.00 0.00 H new ATOM 0 HA SER A 102 174.445 -7.595 5.614 1.00 0.00 H new ATOM 0 HB2 SER A 102 172.928 -9.239 4.290 1.00 0.00 H new ATOM 0 HB3 SER A 102 172.321 -8.793 5.872 1.00 0.00 H new ATOM 0 HG SER A 102 170.696 -8.577 4.215 1.00 0.00 H new ATOM 367 N VAL A 103 175.336 -7.534 3.285 1.00 0.00 N ATOM 368 CA VAL A 103 175.956 -7.276 1.945 1.00 0.00 C ATOM 369 C VAL A 103 174.999 -7.686 0.816 1.00 0.00 C ATOM 370 O VAL A 103 174.911 -7.021 -0.198 1.00 0.00 O ATOM 371 CB VAL A 103 177.234 -8.129 1.918 1.00 0.00 C ATOM 372 CG1 VAL A 103 176.879 -9.614 2.060 1.00 0.00 C ATOM 373 CG2 VAL A 103 177.970 -7.906 0.592 1.00 0.00 C ATOM 0 H VAL A 103 175.879 -8.138 3.903 1.00 0.00 H new ATOM 0 HA VAL A 103 176.174 -6.219 1.795 1.00 0.00 H new ATOM 0 HB VAL A 103 177.875 -7.834 2.749 1.00 0.00 H new ATOM 0 HG11 VAL A 103 177.792 -10.210 2.040 1.00 0.00 H new ATOM 0 HG12 VAL A 103 176.361 -9.776 3.005 1.00 0.00 H new ATOM 0 HG13 VAL A 103 176.232 -9.914 1.236 1.00 0.00 H new ATOM 0 HG21 VAL A 103 178.876 -8.511 0.573 1.00 0.00 H new ATOM 0 HG22 VAL A 103 177.323 -8.195 -0.236 1.00 0.00 H new ATOM 0 HG23 VAL A 103 178.234 -6.853 0.495 1.00 0.00 H new ATOM 383 N GLY A 104 174.286 -8.775 0.982 1.00 0.00 N ATOM 384 CA GLY A 104 173.342 -9.227 -0.085 1.00 0.00 C ATOM 385 C GLY A 104 172.287 -8.147 -0.343 1.00 0.00 C ATOM 386 O GLY A 104 171.923 -7.880 -1.473 1.00 0.00 O ATOM 0 H GLY A 104 174.318 -9.369 1.811 1.00 0.00 H new ATOM 0 HA2 GLY A 104 173.891 -9.437 -1.003 1.00 0.00 H new ATOM 0 HA3 GLY A 104 172.857 -10.156 0.216 1.00 0.00 H new ATOM 390 N ASP A 105 171.799 -7.523 0.700 1.00 0.00 N ATOM 391 CA ASP A 105 170.768 -6.454 0.533 1.00 0.00 C ATOM 392 C ASP A 105 171.429 -5.131 0.137 1.00 0.00 C ATOM 393 O ASP A 105 170.916 -4.392 -0.683 1.00 0.00 O ATOM 394 CB ASP A 105 170.096 -6.330 1.899 1.00 0.00 C ATOM 395 CG ASP A 105 168.852 -5.448 1.779 1.00 0.00 C ATOM 396 OD1 ASP A 105 169.008 -4.270 1.507 1.00 0.00 O ATOM 397 OD2 ASP A 105 167.763 -5.967 1.960 1.00 0.00 O ATOM 0 H ASP A 105 172.072 -7.710 1.665 1.00 0.00 H new ATOM 0 HA ASP A 105 170.052 -6.696 -0.252 1.00 0.00 H new ATOM 0 HB2 ASP A 105 169.820 -7.317 2.271 1.00 0.00 H new ATOM 0 HB3 ASP A 105 170.791 -5.900 2.620 1.00 0.00 H new ATOM 402 N LEU A 106 172.558 -4.826 0.726 1.00 0.00 N ATOM 403 CA LEU A 106 173.257 -3.544 0.403 1.00 0.00 C ATOM 404 C LEU A 106 173.589 -3.484 -1.092 1.00 0.00 C ATOM 405 O LEU A 106 173.314 -2.499 -1.753 1.00 0.00 O ATOM 406 CB LEU A 106 174.542 -3.565 1.236 1.00 0.00 C ATOM 407 CG LEU A 106 175.320 -2.266 1.018 1.00 0.00 C ATOM 408 CD1 LEU A 106 176.156 -1.956 2.261 1.00 0.00 C ATOM 409 CD2 LEU A 106 176.244 -2.422 -0.191 1.00 0.00 C ATOM 0 H LEU A 106 173.027 -5.411 1.418 1.00 0.00 H new ATOM 0 HA LEU A 106 172.641 -2.673 0.629 1.00 0.00 H new ATOM 0 HB2 LEU A 106 174.300 -3.682 2.292 1.00 0.00 H new ATOM 0 HB3 LEU A 106 175.156 -4.420 0.953 1.00 0.00 H new ATOM 0 HG LEU A 106 174.620 -1.450 0.838 1.00 0.00 H new ATOM 0 HD11 LEU A 106 176.710 -1.030 2.105 1.00 0.00 H new ATOM 0 HD12 LEU A 106 175.498 -1.845 3.123 1.00 0.00 H new ATOM 0 HD13 LEU A 106 176.856 -2.772 2.442 1.00 0.00 H new ATOM 0 HD21 LEU A 106 176.799 -1.497 -0.347 1.00 0.00 H new ATOM 0 HD22 LEU A 106 176.943 -3.238 -0.011 1.00 0.00 H new ATOM 0 HD23 LEU A 106 175.649 -2.642 -1.077 1.00 0.00 H new ATOM 421 N ARG A 107 174.185 -4.519 -1.625 1.00 0.00 N ATOM 422 CA ARG A 107 174.544 -4.512 -3.077 1.00 0.00 C ATOM 423 C ARG A 107 173.284 -4.470 -3.946 1.00 0.00 C ATOM 424 O ARG A 107 173.302 -3.952 -5.048 1.00 0.00 O ATOM 425 CB ARG A 107 175.330 -5.804 -3.315 1.00 0.00 C ATOM 426 CG ARG A 107 176.075 -5.716 -4.651 1.00 0.00 C ATOM 427 CD ARG A 107 176.489 -7.121 -5.097 1.00 0.00 C ATOM 428 NE ARG A 107 175.209 -7.844 -5.331 1.00 0.00 N ATOM 429 CZ ARG A 107 174.551 -7.663 -6.442 1.00 0.00 C ATOM 430 NH1 ARG A 107 175.178 -7.702 -7.586 1.00 0.00 N ATOM 431 NH2 ARG A 107 173.264 -7.443 -6.412 1.00 0.00 N ATOM 0 H ARG A 107 174.439 -5.368 -1.120 1.00 0.00 H new ATOM 0 HA ARG A 107 175.132 -3.633 -3.342 1.00 0.00 H new ATOM 0 HB2 ARG A 107 176.038 -5.965 -2.502 1.00 0.00 H new ATOM 0 HB3 ARG A 107 174.652 -6.658 -3.321 1.00 0.00 H new ATOM 0 HG2 ARG A 107 175.437 -5.256 -5.406 1.00 0.00 H new ATOM 0 HG3 ARG A 107 176.955 -5.081 -4.548 1.00 0.00 H new ATOM 0 HD2 ARG A 107 177.093 -7.085 -6.003 1.00 0.00 H new ATOM 0 HD3 ARG A 107 177.088 -7.617 -4.333 1.00 0.00 H new ATOM 0 HE ARG A 107 174.847 -8.481 -4.622 1.00 0.00 H new ATOM 0 HH11 ARG A 107 176.183 -7.874 -7.611 1.00 0.00 H new ATOM 0 HH12 ARG A 107 174.663 -7.560 -8.455 1.00 0.00 H new ATOM 0 HH21 ARG A 107 172.772 -7.413 -5.519 1.00 0.00 H new ATOM 0 HH22 ARG A 107 172.750 -7.302 -7.282 1.00 0.00 H new ATOM 445 N TYR A 108 172.192 -5.022 -3.467 1.00 0.00 N ATOM 446 CA TYR A 108 170.940 -5.022 -4.284 1.00 0.00 C ATOM 447 C TYR A 108 170.393 -3.599 -4.436 1.00 0.00 C ATOM 448 O TYR A 108 170.038 -3.179 -5.521 1.00 0.00 O ATOM 449 CB TYR A 108 169.953 -5.912 -3.527 1.00 0.00 C ATOM 450 CG TYR A 108 168.686 -6.060 -4.336 1.00 0.00 C ATOM 451 CD1 TYR A 108 168.561 -7.107 -5.258 1.00 0.00 C ATOM 452 CD2 TYR A 108 167.636 -5.151 -4.165 1.00 0.00 C ATOM 453 CE1 TYR A 108 167.388 -7.245 -6.008 1.00 0.00 C ATOM 454 CE2 TYR A 108 166.461 -5.289 -4.915 1.00 0.00 C ATOM 455 CZ TYR A 108 166.338 -6.335 -5.836 1.00 0.00 C ATOM 456 OH TYR A 108 165.179 -6.470 -6.576 1.00 0.00 O ATOM 0 H TYR A 108 172.116 -5.468 -2.553 1.00 0.00 H new ATOM 0 HA TYR A 108 171.117 -5.394 -5.293 1.00 0.00 H new ATOM 0 HB2 TYR A 108 170.396 -6.891 -3.343 1.00 0.00 H new ATOM 0 HB3 TYR A 108 169.727 -5.477 -2.554 1.00 0.00 H new ATOM 0 HD1 TYR A 108 169.371 -7.809 -5.390 1.00 0.00 H new ATOM 0 HD2 TYR A 108 167.732 -4.343 -3.455 1.00 0.00 H new ATOM 0 HE1 TYR A 108 167.293 -8.053 -6.719 1.00 0.00 H new ATOM 0 HE2 TYR A 108 165.650 -4.588 -4.782 1.00 0.00 H new ATOM 0 HH TYR A 108 164.551 -5.757 -6.334 1.00 0.00 H new ATOM 466 N MET A 109 170.295 -2.861 -3.356 1.00 0.00 N ATOM 467 CA MET A 109 169.745 -1.476 -3.449 1.00 0.00 C ATOM 468 C MET A 109 170.734 -0.540 -4.127 1.00 0.00 C ATOM 469 O MET A 109 170.341 0.334 -4.878 1.00 0.00 O ATOM 470 CB MET A 109 169.518 -1.039 -2.008 1.00 0.00 C ATOM 471 CG MET A 109 168.080 -1.369 -1.595 1.00 0.00 C ATOM 472 SD MET A 109 167.174 0.157 -1.210 1.00 0.00 S ATOM 473 CE MET A 109 167.492 1.022 -2.774 1.00 0.00 C ATOM 0 H MET A 109 170.571 -3.158 -2.420 1.00 0.00 H new ATOM 0 HA MET A 109 168.830 -1.449 -4.041 1.00 0.00 H new ATOM 0 HB2 MET A 109 170.223 -1.545 -1.348 1.00 0.00 H new ATOM 0 HB3 MET A 109 169.700 0.031 -1.908 1.00 0.00 H new ATOM 0 HG2 MET A 109 167.577 -1.907 -2.399 1.00 0.00 H new ATOM 0 HG3 MET A 109 168.085 -2.027 -0.726 1.00 0.00 H new ATOM 0 HE1 MET A 109 166.714 1.767 -2.943 1.00 0.00 H new ATOM 0 HE2 MET A 109 168.463 1.516 -2.726 1.00 0.00 H new ATOM 0 HE3 MET A 109 167.491 0.304 -3.594 1.00 0.00 H new ATOM 483 N LEU A 110 172.010 -0.694 -3.873 1.00 0.00 N ATOM 484 CA LEU A 110 173.011 0.216 -4.514 1.00 0.00 C ATOM 485 C LEU A 110 172.836 0.174 -6.032 1.00 0.00 C ATOM 486 O LEU A 110 172.857 1.191 -6.698 1.00 0.00 O ATOM 487 CB LEU A 110 174.379 -0.345 -4.115 1.00 0.00 C ATOM 488 CG LEU A 110 175.410 0.785 -4.084 1.00 0.00 C ATOM 489 CD1 LEU A 110 175.405 1.443 -2.703 1.00 0.00 C ATOM 490 CD2 LEU A 110 176.801 0.213 -4.367 1.00 0.00 C ATOM 0 H LEU A 110 172.400 -1.405 -3.254 1.00 0.00 H new ATOM 0 HA LEU A 110 172.897 1.253 -4.199 1.00 0.00 H new ATOM 0 HB2 LEU A 110 174.317 -0.820 -3.136 1.00 0.00 H new ATOM 0 HB3 LEU A 110 174.688 -1.113 -4.823 1.00 0.00 H new ATOM 0 HG LEU A 110 175.158 1.526 -4.842 1.00 0.00 H new ATOM 0 HD11 LEU A 110 176.140 2.248 -2.681 1.00 0.00 H new ATOM 0 HD12 LEU A 110 174.415 1.849 -2.497 1.00 0.00 H new ATOM 0 HD13 LEU A 110 175.657 0.701 -1.945 1.00 0.00 H new ATOM 0 HD21 LEU A 110 177.536 1.017 -4.345 1.00 0.00 H new ATOM 0 HD22 LEU A 110 177.051 -0.528 -3.608 1.00 0.00 H new ATOM 0 HD23 LEU A 110 176.808 -0.258 -5.350 1.00 0.00 H new ATOM 502 N THR A 111 172.645 -1.002 -6.574 1.00 0.00 N ATOM 503 CA THR A 111 172.453 -1.127 -8.051 1.00 0.00 C ATOM 504 C THR A 111 171.137 -0.465 -8.487 1.00 0.00 C ATOM 505 O THR A 111 170.961 -0.103 -9.634 1.00 0.00 O ATOM 506 CB THR A 111 172.408 -2.636 -8.330 1.00 0.00 C ATOM 507 OG1 THR A 111 171.791 -3.313 -7.245 1.00 0.00 O ATOM 508 CG2 THR A 111 173.830 -3.165 -8.520 1.00 0.00 C ATOM 0 H THR A 111 172.614 -1.881 -6.058 1.00 0.00 H new ATOM 0 HA THR A 111 173.253 -0.633 -8.603 1.00 0.00 H new ATOM 0 HB THR A 111 171.829 -2.813 -9.236 1.00 0.00 H new ATOM 0 HG1 THR A 111 171.008 -2.806 -6.946 1.00 0.00 H new ATOM 0 HG21 THR A 111 173.796 -4.236 -8.718 1.00 0.00 H new ATOM 0 HG22 THR A 111 174.298 -2.655 -9.362 1.00 0.00 H new ATOM 0 HG23 THR A 111 174.410 -2.981 -7.616 1.00 0.00 H new ATOM 516 N GLY A 112 170.226 -0.286 -7.564 1.00 0.00 N ATOM 517 CA GLY A 112 168.926 0.375 -7.879 1.00 0.00 C ATOM 518 C GLY A 112 169.048 1.899 -7.736 1.00 0.00 C ATOM 519 O GLY A 112 168.180 2.642 -8.152 1.00 0.00 O ATOM 0 H GLY A 112 170.331 -0.575 -6.591 1.00 0.00 H new ATOM 0 HA2 GLY A 112 168.620 0.123 -8.894 1.00 0.00 H new ATOM 0 HA3 GLY A 112 168.150 0.002 -7.210 1.00 0.00 H new ATOM 523 N LEU A 113 170.096 2.364 -7.100 1.00 0.00 N ATOM 524 CA LEU A 113 170.272 3.827 -6.859 1.00 0.00 C ATOM 525 C LEU A 113 171.123 4.505 -7.947 1.00 0.00 C ATOM 526 O LEU A 113 171.506 5.651 -7.801 1.00 0.00 O ATOM 527 CB LEU A 113 171.001 3.895 -5.515 1.00 0.00 C ATOM 528 CG LEU A 113 170.403 5.009 -4.655 1.00 0.00 C ATOM 529 CD1 LEU A 113 170.995 4.937 -3.249 1.00 0.00 C ATOM 530 CD2 LEU A 113 170.736 6.364 -5.277 1.00 0.00 C ATOM 0 H LEU A 113 170.848 1.780 -6.733 1.00 0.00 H new ATOM 0 HA LEU A 113 169.314 4.347 -6.869 1.00 0.00 H new ATOM 0 HB2 LEU A 113 170.918 2.939 -4.997 1.00 0.00 H new ATOM 0 HB3 LEU A 113 172.063 4.079 -5.676 1.00 0.00 H new ATOM 0 HG LEU A 113 169.321 4.888 -4.602 1.00 0.00 H new ATOM 0 HD11 LEU A 113 170.570 5.730 -2.634 1.00 0.00 H new ATOM 0 HD12 LEU A 113 170.761 3.969 -2.805 1.00 0.00 H new ATOM 0 HD13 LEU A 113 172.077 5.060 -3.303 1.00 0.00 H new ATOM 0 HD21 LEU A 113 170.310 7.160 -4.665 1.00 0.00 H new ATOM 0 HD22 LEU A 113 171.818 6.485 -5.328 1.00 0.00 H new ATOM 0 HD23 LEU A 113 170.317 6.416 -6.282 1.00 0.00 H new ATOM 542 N GLY A 114 171.449 3.819 -9.013 1.00 0.00 N ATOM 543 CA GLY A 114 172.307 4.440 -10.074 1.00 0.00 C ATOM 544 C GLY A 114 173.727 3.875 -9.956 1.00 0.00 C ATOM 545 O GLY A 114 174.701 4.522 -10.287 1.00 0.00 O ATOM 0 H GLY A 114 171.160 2.858 -9.197 1.00 0.00 H new ATOM 0 HA2 GLY A 114 171.898 4.228 -11.062 1.00 0.00 H new ATOM 0 HA3 GLY A 114 172.322 5.524 -9.961 1.00 0.00 H new ATOM 549 N GLU A 115 173.827 2.650 -9.520 1.00 0.00 N ATOM 550 CA GLU A 115 175.158 1.984 -9.409 1.00 0.00 C ATOM 551 C GLU A 115 175.238 0.821 -10.400 1.00 0.00 C ATOM 552 O GLU A 115 174.460 -0.109 -10.324 1.00 0.00 O ATOM 553 CB GLU A 115 175.241 1.470 -7.973 1.00 0.00 C ATOM 554 CG GLU A 115 176.699 1.156 -7.631 1.00 0.00 C ATOM 555 CD GLU A 115 177.402 2.428 -7.146 1.00 0.00 C ATOM 556 OE1 GLU A 115 177.024 3.501 -7.590 1.00 0.00 O ATOM 557 OE2 GLU A 115 178.310 2.307 -6.340 1.00 0.00 O ATOM 0 H GLU A 115 173.035 2.075 -9.232 1.00 0.00 H new ATOM 0 HA GLU A 115 175.979 2.664 -9.637 1.00 0.00 H new ATOM 0 HB2 GLU A 115 174.847 2.217 -7.284 1.00 0.00 H new ATOM 0 HB3 GLU A 115 174.628 0.576 -7.859 1.00 0.00 H new ATOM 0 HG2 GLU A 115 176.744 0.387 -6.859 1.00 0.00 H new ATOM 0 HG3 GLU A 115 177.210 0.758 -8.507 1.00 0.00 H new ATOM 564 N LYS A 116 176.176 0.847 -11.314 1.00 0.00 N ATOM 565 CA LYS A 116 176.293 -0.286 -12.280 1.00 0.00 C ATOM 566 C LYS A 116 177.685 -0.907 -12.187 1.00 0.00 C ATOM 567 O LYS A 116 178.418 -0.995 -13.152 1.00 0.00 O ATOM 568 CB LYS A 116 175.992 0.277 -13.669 1.00 0.00 C ATOM 569 CG LYS A 116 174.511 0.651 -13.758 1.00 0.00 C ATOM 570 CD LYS A 116 174.209 1.215 -15.148 1.00 0.00 C ATOM 571 CE LYS A 116 172.727 1.588 -15.238 1.00 0.00 C ATOM 572 NZ LYS A 116 172.697 2.855 -16.021 1.00 0.00 N ATOM 0 H LYS A 116 176.859 1.596 -11.432 1.00 0.00 H new ATOM 0 HA LYS A 116 175.587 -1.086 -12.057 1.00 0.00 H new ATOM 0 HB2 LYS A 116 176.611 1.153 -13.860 1.00 0.00 H new ATOM 0 HB3 LYS A 116 176.238 -0.460 -14.433 1.00 0.00 H new ATOM 0 HG2 LYS A 116 173.892 -0.225 -13.567 1.00 0.00 H new ATOM 0 HG3 LYS A 116 174.265 1.388 -12.994 1.00 0.00 H new ATOM 0 HD2 LYS A 116 174.828 2.092 -15.338 1.00 0.00 H new ATOM 0 HD3 LYS A 116 174.456 0.478 -15.912 1.00 0.00 H new ATOM 0 HE2 LYS A 116 172.152 0.805 -15.732 1.00 0.00 H new ATOM 0 HE3 LYS A 116 172.293 1.725 -14.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 171.713 3.175 -16.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 173.247 3.584 -15.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 173.110 2.692 -16.961 1.00 0.00 H new ATOM 586 N LEU A 117 178.015 -1.380 -11.018 1.00 0.00 N ATOM 587 CA LEU A 117 179.318 -2.060 -10.792 1.00 0.00 C ATOM 588 C LEU A 117 179.113 -3.558 -11.025 1.00 0.00 C ATOM 589 O LEU A 117 178.042 -4.080 -10.775 1.00 0.00 O ATOM 590 CB LEU A 117 179.678 -1.777 -9.331 1.00 0.00 C ATOM 591 CG LEU A 117 179.793 -0.266 -9.111 1.00 0.00 C ATOM 592 CD1 LEU A 117 180.015 0.019 -7.626 1.00 0.00 C ATOM 593 CD2 LEU A 117 180.977 0.277 -9.915 1.00 0.00 C ATOM 0 H LEU A 117 177.421 -1.321 -10.191 1.00 0.00 H new ATOM 0 HA LEU A 117 180.110 -1.715 -11.456 1.00 0.00 H new ATOM 0 HB2 LEU A 117 178.916 -2.193 -8.672 1.00 0.00 H new ATOM 0 HB3 LEU A 117 180.620 -2.264 -9.078 1.00 0.00 H new ATOM 0 HG LEU A 117 178.874 0.219 -9.441 1.00 0.00 H new ATOM 0 HD11 LEU A 117 180.097 1.095 -7.470 1.00 0.00 H new ATOM 0 HD12 LEU A 117 179.173 -0.368 -7.051 1.00 0.00 H new ATOM 0 HD13 LEU A 117 180.933 -0.466 -7.296 1.00 0.00 H new ATOM 0 HD21 LEU A 117 181.060 1.353 -9.759 1.00 0.00 H new ATOM 0 HD22 LEU A 117 181.895 -0.209 -9.585 1.00 0.00 H new ATOM 0 HD23 LEU A 117 180.821 0.075 -10.975 1.00 0.00 H new ATOM 605 N THR A 118 180.115 -4.256 -11.489 1.00 0.00 N ATOM 606 CA THR A 118 179.957 -5.723 -11.722 1.00 0.00 C ATOM 607 C THR A 118 180.800 -6.510 -10.717 1.00 0.00 C ATOM 608 O THR A 118 181.879 -6.080 -10.360 1.00 0.00 O ATOM 609 CB THR A 118 180.463 -5.955 -13.146 1.00 0.00 C ATOM 610 OG1 THR A 118 181.761 -5.395 -13.283 1.00 0.00 O ATOM 611 CG2 THR A 118 179.511 -5.293 -14.143 1.00 0.00 C ATOM 0 H THR A 118 181.034 -3.876 -11.716 1.00 0.00 H new ATOM 0 HA THR A 118 178.925 -6.053 -11.598 1.00 0.00 H new ATOM 0 HB THR A 118 180.506 -7.026 -13.346 1.00 0.00 H new ATOM 0 HG1 THR A 118 182.087 -5.544 -14.195 1.00 0.00 H new ATOM 0 HG21 THR A 118 179.873 -5.459 -15.157 1.00 0.00 H new ATOM 0 HG22 THR A 118 178.516 -5.725 -14.038 1.00 0.00 H new ATOM 0 HG23 THR A 118 179.464 -4.222 -13.945 1.00 0.00 H new ATOM 619 N ASP A 119 180.310 -7.634 -10.226 1.00 0.00 N ATOM 620 CA ASP A 119 181.071 -8.447 -9.205 1.00 0.00 C ATOM 621 C ASP A 119 182.579 -8.497 -9.499 1.00 0.00 C ATOM 622 O ASP A 119 183.391 -8.573 -8.595 1.00 0.00 O ATOM 623 CB ASP A 119 180.474 -9.852 -9.309 1.00 0.00 C ATOM 624 CG ASP A 119 180.956 -10.705 -8.132 1.00 0.00 C ATOM 625 OD1 ASP A 119 182.072 -10.495 -7.688 1.00 0.00 O ATOM 626 OD2 ASP A 119 180.198 -11.556 -7.695 1.00 0.00 O ATOM 0 H ASP A 119 179.407 -8.027 -10.491 1.00 0.00 H new ATOM 0 HA ASP A 119 180.978 -8.009 -8.211 1.00 0.00 H new ATOM 0 HB2 ASP A 119 179.385 -9.796 -9.309 1.00 0.00 H new ATOM 0 HB3 ASP A 119 180.769 -10.314 -10.251 1.00 0.00 H new ATOM 631 N ALA A 120 182.958 -8.406 -10.749 1.00 0.00 N ATOM 632 CA ALA A 120 184.412 -8.393 -11.096 1.00 0.00 C ATOM 633 C ALA A 120 185.063 -7.163 -10.455 1.00 0.00 C ATOM 634 O ALA A 120 186.038 -7.269 -9.737 1.00 0.00 O ATOM 635 CB ALA A 120 184.458 -8.279 -12.622 1.00 0.00 C ATOM 0 H ALA A 120 182.323 -8.340 -11.545 1.00 0.00 H new ATOM 0 HA ALA A 120 184.940 -9.279 -10.743 1.00 0.00 H new ATOM 0 HB1 ALA A 120 185.496 -8.263 -12.955 1.00 0.00 H new ATOM 0 HB2 ALA A 120 183.947 -9.133 -13.066 1.00 0.00 H new ATOM 0 HB3 ALA A 120 183.963 -7.359 -12.933 1.00 0.00 H new ATOM 641 N GLU A 121 184.509 -6.002 -10.696 1.00 0.00 N ATOM 642 CA GLU A 121 185.064 -4.754 -10.090 1.00 0.00 C ATOM 643 C GLU A 121 184.660 -4.654 -8.613 1.00 0.00 C ATOM 644 O GLU A 121 185.457 -4.310 -7.762 1.00 0.00 O ATOM 645 CB GLU A 121 184.444 -3.612 -10.896 1.00 0.00 C ATOM 646 CG GLU A 121 185.091 -3.554 -12.282 1.00 0.00 C ATOM 647 CD GLU A 121 184.447 -2.432 -13.099 1.00 0.00 C ATOM 648 OE1 GLU A 121 183.389 -2.666 -13.658 1.00 0.00 O ATOM 649 OE2 GLU A 121 185.025 -1.359 -13.152 1.00 0.00 O ATOM 0 H GLU A 121 183.691 -5.864 -11.290 1.00 0.00 H new ATOM 0 HA GLU A 121 186.153 -4.730 -10.121 1.00 0.00 H new ATOM 0 HB2 GLU A 121 183.369 -3.762 -10.991 1.00 0.00 H new ATOM 0 HB3 GLU A 121 184.589 -2.665 -10.376 1.00 0.00 H new ATOM 0 HG2 GLU A 121 186.163 -3.380 -12.188 1.00 0.00 H new ATOM 0 HG3 GLU A 121 184.966 -4.508 -12.793 1.00 0.00 H new ATOM 656 N VAL A 122 183.421 -4.957 -8.310 1.00 0.00 N ATOM 657 CA VAL A 122 182.941 -4.890 -6.890 1.00 0.00 C ATOM 658 C VAL A 122 183.765 -5.828 -6.003 1.00 0.00 C ATOM 659 O VAL A 122 184.022 -5.522 -4.853 1.00 0.00 O ATOM 660 CB VAL A 122 181.470 -5.333 -6.929 1.00 0.00 C ATOM 661 CG1 VAL A 122 180.879 -5.310 -5.513 1.00 0.00 C ATOM 662 CG2 VAL A 122 180.671 -4.375 -7.815 1.00 0.00 C ATOM 0 H VAL A 122 182.717 -5.250 -8.987 1.00 0.00 H new ATOM 0 HA VAL A 122 183.046 -3.888 -6.474 1.00 0.00 H new ATOM 0 HB VAL A 122 181.416 -6.345 -7.331 1.00 0.00 H new ATOM 0 HG11 VAL A 122 179.836 -5.625 -5.549 1.00 0.00 H new ATOM 0 HG12 VAL A 122 181.442 -5.989 -4.873 1.00 0.00 H new ATOM 0 HG13 VAL A 122 180.939 -4.299 -5.110 1.00 0.00 H new ATOM 0 HG21 VAL A 122 179.628 -4.689 -7.843 1.00 0.00 H new ATOM 0 HG22 VAL A 122 180.735 -3.365 -7.409 1.00 0.00 H new ATOM 0 HG23 VAL A 122 181.080 -4.387 -8.825 1.00 0.00 H new ATOM 672 N ASP A 123 184.184 -6.957 -6.517 1.00 0.00 N ATOM 673 CA ASP A 123 184.997 -7.891 -5.678 1.00 0.00 C ATOM 674 C ASP A 123 186.324 -7.216 -5.313 1.00 0.00 C ATOM 675 O ASP A 123 186.820 -7.362 -4.213 1.00 0.00 O ATOM 676 CB ASP A 123 185.220 -9.140 -6.534 1.00 0.00 C ATOM 677 CG ASP A 123 186.046 -10.162 -5.749 1.00 0.00 C ATOM 678 OD1 ASP A 123 187.221 -9.908 -5.537 1.00 0.00 O ATOM 679 OD2 ASP A 123 185.490 -11.180 -5.374 1.00 0.00 O ATOM 0 H ASP A 123 184.001 -7.270 -7.470 1.00 0.00 H new ATOM 0 HA ASP A 123 184.501 -8.154 -4.744 1.00 0.00 H new ATOM 0 HB2 ASP A 123 184.261 -9.574 -6.818 1.00 0.00 H new ATOM 0 HB3 ASP A 123 185.735 -8.873 -7.457 1.00 0.00 H new ATOM 684 N GLU A 124 186.888 -6.465 -6.227 1.00 0.00 N ATOM 685 CA GLU A 124 188.175 -5.758 -5.937 1.00 0.00 C ATOM 686 C GLU A 124 187.995 -4.802 -4.754 1.00 0.00 C ATOM 687 O GLU A 124 188.800 -4.767 -3.844 1.00 0.00 O ATOM 688 CB GLU A 124 188.495 -4.967 -7.208 1.00 0.00 C ATOM 689 CG GLU A 124 188.690 -5.936 -8.375 1.00 0.00 C ATOM 690 CD GLU A 124 189.649 -5.319 -9.396 1.00 0.00 C ATOM 691 OE1 GLU A 124 190.845 -5.378 -9.166 1.00 0.00 O ATOM 692 OE2 GLU A 124 189.170 -4.797 -10.389 1.00 0.00 O ATOM 0 H GLU A 124 186.512 -6.311 -7.163 1.00 0.00 H new ATOM 0 HA GLU A 124 188.973 -6.453 -5.676 1.00 0.00 H new ATOM 0 HB2 GLU A 124 187.686 -4.272 -7.430 1.00 0.00 H new ATOM 0 HB3 GLU A 124 189.396 -4.371 -7.061 1.00 0.00 H new ATOM 0 HG2 GLU A 124 189.089 -6.883 -8.012 1.00 0.00 H new ATOM 0 HG3 GLU A 124 187.731 -6.153 -8.846 1.00 0.00 H new ATOM 699 N LEU A 125 186.939 -4.028 -4.764 1.00 0.00 N ATOM 700 CA LEU A 125 186.688 -3.067 -3.645 1.00 0.00 C ATOM 701 C LEU A 125 186.487 -3.823 -2.328 1.00 0.00 C ATOM 702 O LEU A 125 186.962 -3.416 -1.285 1.00 0.00 O ATOM 703 CB LEU A 125 185.396 -2.347 -4.040 1.00 0.00 C ATOM 704 CG LEU A 125 185.716 -1.151 -4.948 1.00 0.00 C ATOM 705 CD1 LEU A 125 186.435 -1.625 -6.214 1.00 0.00 C ATOM 706 CD2 LEU A 125 184.409 -0.466 -5.343 1.00 0.00 C ATOM 0 H LEU A 125 186.236 -4.020 -5.503 1.00 0.00 H new ATOM 0 HA LEU A 125 187.521 -2.380 -3.494 1.00 0.00 H new ATOM 0 HB2 LEU A 125 184.729 -3.037 -4.556 1.00 0.00 H new ATOM 0 HB3 LEU A 125 184.873 -2.006 -3.147 1.00 0.00 H new ATOM 0 HG LEU A 125 186.362 -0.456 -4.411 1.00 0.00 H new ATOM 0 HD11 LEU A 125 186.656 -0.767 -6.849 1.00 0.00 H new ATOM 0 HD12 LEU A 125 187.365 -2.123 -5.939 1.00 0.00 H new ATOM 0 HD13 LEU A 125 185.796 -2.323 -6.756 1.00 0.00 H new ATOM 0 HD21 LEU A 125 184.625 0.385 -5.988 1.00 0.00 H new ATOM 0 HD22 LEU A 125 183.774 -1.174 -5.876 1.00 0.00 H new ATOM 0 HD23 LEU A 125 183.894 -0.120 -4.447 1.00 0.00 H new ATOM 718 N LEU A 126 185.769 -4.914 -2.379 1.00 0.00 N ATOM 719 CA LEU A 126 185.504 -5.714 -1.142 1.00 0.00 C ATOM 720 C LEU A 126 186.800 -6.273 -0.544 1.00 0.00 C ATOM 721 O LEU A 126 186.826 -6.704 0.593 1.00 0.00 O ATOM 722 CB LEU A 126 184.597 -6.860 -1.593 1.00 0.00 C ATOM 723 CG LEU A 126 183.154 -6.362 -1.686 1.00 0.00 C ATOM 724 CD1 LEU A 126 182.312 -7.386 -2.445 1.00 0.00 C ATOM 725 CD2 LEU A 126 182.584 -6.183 -0.277 1.00 0.00 C ATOM 0 H LEU A 126 185.351 -5.290 -3.230 1.00 0.00 H new ATOM 0 HA LEU A 126 185.048 -5.099 -0.366 1.00 0.00 H new ATOM 0 HB2 LEU A 126 184.925 -7.238 -2.561 1.00 0.00 H new ATOM 0 HB3 LEU A 126 184.662 -7.689 -0.888 1.00 0.00 H new ATOM 0 HG LEU A 126 183.132 -5.408 -2.212 1.00 0.00 H new ATOM 0 HD11 LEU A 126 181.283 -7.033 -2.512 1.00 0.00 H new ATOM 0 HD12 LEU A 126 182.717 -7.518 -3.448 1.00 0.00 H new ATOM 0 HD13 LEU A 126 182.335 -8.339 -1.917 1.00 0.00 H new ATOM 0 HD21 LEU A 126 181.556 -5.828 -0.343 1.00 0.00 H new ATOM 0 HD22 LEU A 126 182.605 -7.138 0.248 1.00 0.00 H new ATOM 0 HD23 LEU A 126 183.185 -5.455 0.269 1.00 0.00 H new ATOM 737 N LYS A 127 187.867 -6.302 -1.308 1.00 0.00 N ATOM 738 CA LYS A 127 189.151 -6.875 -0.789 1.00 0.00 C ATOM 739 C LYS A 127 189.593 -6.164 0.494 1.00 0.00 C ATOM 740 O LYS A 127 190.350 -6.705 1.279 1.00 0.00 O ATOM 741 CB LYS A 127 190.179 -6.617 -1.894 1.00 0.00 C ATOM 742 CG LYS A 127 189.913 -7.554 -3.074 1.00 0.00 C ATOM 743 CD LYS A 127 190.943 -7.292 -4.174 1.00 0.00 C ATOM 744 CE LYS A 127 190.683 -8.232 -5.353 1.00 0.00 C ATOM 745 NZ LYS A 127 191.614 -9.375 -5.146 1.00 0.00 N ATOM 0 H LYS A 127 187.904 -5.955 -2.266 1.00 0.00 H new ATOM 0 HA LYS A 127 189.043 -7.933 -0.549 1.00 0.00 H new ATOM 0 HB2 LYS A 127 190.123 -5.579 -2.221 1.00 0.00 H new ATOM 0 HB3 LYS A 127 191.187 -6.776 -1.511 1.00 0.00 H new ATOM 0 HG2 LYS A 127 189.970 -8.592 -2.748 1.00 0.00 H new ATOM 0 HG3 LYS A 127 188.906 -7.395 -3.459 1.00 0.00 H new ATOM 0 HD2 LYS A 127 190.883 -6.254 -4.503 1.00 0.00 H new ATOM 0 HD3 LYS A 127 191.950 -7.447 -3.788 1.00 0.00 H new ATOM 0 HE2 LYS A 127 189.646 -8.566 -5.370 1.00 0.00 H new ATOM 0 HE3 LYS A 127 190.874 -7.735 -6.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 191.495 -10.064 -5.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 192.594 -9.028 -5.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 191.404 -9.833 -4.236 1.00 0.00 H new ATOM 759 N GLY A 128 189.133 -4.955 0.712 1.00 0.00 N ATOM 760 CA GLY A 128 189.533 -4.210 1.939 1.00 0.00 C ATOM 761 C GLY A 128 188.306 -3.934 2.814 1.00 0.00 C ATOM 762 O GLY A 128 188.296 -2.998 3.592 1.00 0.00 O ATOM 0 H GLY A 128 188.497 -4.455 0.090 1.00 0.00 H new ATOM 0 HA2 GLY A 128 190.267 -4.788 2.501 1.00 0.00 H new ATOM 0 HA3 GLY A 128 190.011 -3.270 1.663 1.00 0.00 H new ATOM 766 N VAL A 129 187.278 -4.740 2.703 1.00 0.00 N ATOM 767 CA VAL A 129 186.059 -4.519 3.543 1.00 0.00 C ATOM 768 C VAL A 129 185.986 -5.580 4.646 1.00 0.00 C ATOM 769 O VAL A 129 186.104 -6.766 4.406 1.00 0.00 O ATOM 770 CB VAL A 129 184.869 -4.616 2.585 1.00 0.00 C ATOM 771 CG1 VAL A 129 183.564 -4.410 3.358 1.00 0.00 C ATOM 772 CG2 VAL A 129 184.994 -3.531 1.512 1.00 0.00 C ATOM 0 H VAL A 129 187.230 -5.538 2.070 1.00 0.00 H new ATOM 0 HA VAL A 129 186.070 -3.551 4.044 1.00 0.00 H new ATOM 0 HB VAL A 129 184.862 -5.601 2.118 1.00 0.00 H new ATOM 0 HG11 VAL A 129 182.720 -4.480 2.672 1.00 0.00 H new ATOM 0 HG12 VAL A 129 183.471 -5.177 4.127 1.00 0.00 H new ATOM 0 HG13 VAL A 129 183.570 -3.426 3.827 1.00 0.00 H new ATOM 0 HG21 VAL A 129 184.148 -3.597 0.828 1.00 0.00 H new ATOM 0 HG22 VAL A 129 185.002 -2.550 1.986 1.00 0.00 H new ATOM 0 HG23 VAL A 129 185.921 -3.673 0.957 1.00 0.00 H new ATOM 782 N GLU A 130 185.817 -5.130 5.860 1.00 0.00 N ATOM 783 CA GLU A 130 185.758 -6.058 7.027 1.00 0.00 C ATOM 784 C GLU A 130 184.320 -6.281 7.509 1.00 0.00 C ATOM 785 O GLU A 130 183.748 -5.460 8.201 1.00 0.00 O ATOM 786 CB GLU A 130 186.571 -5.354 8.114 1.00 0.00 C ATOM 787 CG GLU A 130 186.699 -6.273 9.333 1.00 0.00 C ATOM 788 CD GLU A 130 187.675 -5.658 10.339 1.00 0.00 C ATOM 789 OE1 GLU A 130 187.717 -4.442 10.429 1.00 0.00 O ATOM 790 OE2 GLU A 130 188.363 -6.415 11.003 1.00 0.00 O ATOM 0 H GLU A 130 185.716 -4.143 6.096 1.00 0.00 H new ATOM 0 HA GLU A 130 186.144 -7.045 6.771 1.00 0.00 H new ATOM 0 HB2 GLU A 130 187.560 -5.097 7.734 1.00 0.00 H new ATOM 0 HB3 GLU A 130 186.086 -4.420 8.399 1.00 0.00 H new ATOM 0 HG2 GLU A 130 185.723 -6.415 9.798 1.00 0.00 H new ATOM 0 HG3 GLU A 130 187.051 -7.257 9.024 1.00 0.00 H new ATOM 797 N VAL A 131 183.756 -7.412 7.172 1.00 0.00 N ATOM 798 CA VAL A 131 182.376 -7.745 7.628 1.00 0.00 C ATOM 799 C VAL A 131 182.456 -8.375 9.024 1.00 0.00 C ATOM 800 O VAL A 131 183.497 -8.858 9.430 1.00 0.00 O ATOM 801 CB VAL A 131 181.839 -8.744 6.592 1.00 0.00 C ATOM 802 CG1 VAL A 131 182.729 -9.992 6.534 1.00 0.00 C ATOM 803 CG2 VAL A 131 180.422 -9.156 6.978 1.00 0.00 C ATOM 0 H VAL A 131 184.199 -8.126 6.594 1.00 0.00 H new ATOM 0 HA VAL A 131 181.724 -6.875 7.701 1.00 0.00 H new ATOM 0 HB VAL A 131 181.838 -8.267 5.612 1.00 0.00 H new ATOM 0 HG11 VAL A 131 182.332 -10.688 5.795 1.00 0.00 H new ATOM 0 HG12 VAL A 131 183.742 -9.704 6.254 1.00 0.00 H new ATOM 0 HG13 VAL A 131 182.746 -10.473 7.512 1.00 0.00 H new ATOM 0 HG21 VAL A 131 180.037 -9.865 6.245 1.00 0.00 H new ATOM 0 HG22 VAL A 131 180.434 -9.623 7.963 1.00 0.00 H new ATOM 0 HG23 VAL A 131 179.781 -8.275 7.002 1.00 0.00 H new ATOM 813 N ASP A 132 181.379 -8.354 9.768 1.00 0.00 N ATOM 814 CA ASP A 132 181.410 -8.931 11.147 1.00 0.00 C ATOM 815 C ASP A 132 180.896 -10.374 11.159 1.00 0.00 C ATOM 816 O ASP A 132 180.573 -10.948 10.138 1.00 0.00 O ATOM 817 CB ASP A 132 180.487 -8.031 11.969 1.00 0.00 C ATOM 818 CG ASP A 132 181.137 -6.658 12.153 1.00 0.00 C ATOM 819 OD1 ASP A 132 182.355 -6.604 12.234 1.00 0.00 O ATOM 820 OD2 ASP A 132 180.408 -5.682 12.210 1.00 0.00 O ATOM 0 H ASP A 132 180.481 -7.963 9.481 1.00 0.00 H new ATOM 0 HA ASP A 132 182.424 -8.965 11.545 1.00 0.00 H new ATOM 0 HB2 ASP A 132 179.525 -7.925 11.467 1.00 0.00 H new ATOM 0 HB3 ASP A 132 180.291 -8.485 12.941 1.00 0.00 H new ATOM 825 N SER A 133 180.834 -10.959 12.330 1.00 0.00 N ATOM 826 CA SER A 133 180.358 -12.373 12.462 1.00 0.00 C ATOM 827 C SER A 133 178.843 -12.497 12.211 1.00 0.00 C ATOM 828 O SER A 133 178.305 -13.588 12.220 1.00 0.00 O ATOM 829 CB SER A 133 180.687 -12.772 13.899 1.00 0.00 C ATOM 830 OG SER A 133 180.364 -11.697 14.771 1.00 0.00 O ATOM 0 H SER A 133 181.095 -10.513 13.209 1.00 0.00 H new ATOM 0 HA SER A 133 180.839 -13.016 11.725 1.00 0.00 H new ATOM 0 HB2 SER A 133 180.125 -13.663 14.179 1.00 0.00 H new ATOM 0 HB3 SER A 133 181.745 -13.021 13.986 1.00 0.00 H new ATOM 0 HG SER A 133 180.572 -11.951 15.694 1.00 0.00 H new ATOM 836 N ASN A 134 178.156 -11.407 11.964 1.00 0.00 N ATOM 837 CA ASN A 134 176.690 -11.484 11.687 1.00 0.00 C ATOM 838 C ASN A 134 176.417 -11.237 10.194 1.00 0.00 C ATOM 839 O ASN A 134 175.315 -11.446 9.721 1.00 0.00 O ATOM 840 CB ASN A 134 176.060 -10.386 12.545 1.00 0.00 C ATOM 841 CG ASN A 134 174.594 -10.728 12.819 1.00 0.00 C ATOM 842 OD1 ASN A 134 173.974 -11.452 12.065 1.00 0.00 O ATOM 843 ND2 ASN A 134 174.010 -10.235 13.877 1.00 0.00 N ATOM 0 H ASN A 134 178.550 -10.466 11.943 1.00 0.00 H new ATOM 0 HA ASN A 134 176.277 -12.465 11.924 1.00 0.00 H new ATOM 0 HB2 ASN A 134 176.603 -10.288 13.485 1.00 0.00 H new ATOM 0 HB3 ASN A 134 176.131 -9.426 12.034 1.00 0.00 H new ATOM 0 HD21 ASN A 134 173.034 -10.457 14.071 1.00 0.00 H new ATOM 0 HD22 ASN A 134 174.530 -9.627 14.510 1.00 0.00 H new ATOM 850 N GLY A 135 177.407 -10.800 9.449 1.00 0.00 N ATOM 851 CA GLY A 135 177.201 -10.547 7.993 1.00 0.00 C ATOM 852 C GLY A 135 176.655 -9.132 7.783 1.00 0.00 C ATOM 853 O GLY A 135 175.962 -8.863 6.820 1.00 0.00 O ATOM 0 H GLY A 135 178.349 -10.609 9.791 1.00 0.00 H new ATOM 0 HA2 GLY A 135 178.143 -10.666 7.457 1.00 0.00 H new ATOM 0 HA3 GLY A 135 176.506 -11.279 7.582 1.00 0.00 H new ATOM 857 N GLU A 136 176.953 -8.233 8.688 1.00 0.00 N ATOM 858 CA GLU A 136 176.441 -6.837 8.557 1.00 0.00 C ATOM 859 C GLU A 136 177.577 -5.859 8.256 1.00 0.00 C ATOM 860 O GLU A 136 178.654 -5.941 8.814 1.00 0.00 O ATOM 861 CB GLU A 136 175.806 -6.522 9.911 1.00 0.00 C ATOM 862 CG GLU A 136 174.525 -7.346 10.080 1.00 0.00 C ATOM 863 CD GLU A 136 173.877 -7.040 11.437 1.00 0.00 C ATOM 864 OE1 GLU A 136 174.576 -6.570 12.322 1.00 0.00 O ATOM 865 OE2 GLU A 136 172.690 -7.288 11.569 1.00 0.00 O ATOM 0 H GLU A 136 177.529 -8.407 9.512 1.00 0.00 H new ATOM 0 HA GLU A 136 175.731 -6.742 7.735 1.00 0.00 H new ATOM 0 HB2 GLU A 136 176.506 -6.750 10.715 1.00 0.00 H new ATOM 0 HB3 GLU A 136 175.578 -5.458 9.979 1.00 0.00 H new ATOM 0 HG2 GLU A 136 173.827 -7.117 9.275 1.00 0.00 H new ATOM 0 HG3 GLU A 136 174.755 -8.409 10.009 1.00 0.00 H new ATOM 872 N ILE A 137 177.325 -4.926 7.376 1.00 0.00 N ATOM 873 CA ILE A 137 178.360 -3.914 7.018 1.00 0.00 C ATOM 874 C ILE A 137 177.767 -2.508 7.145 1.00 0.00 C ATOM 875 O ILE A 137 176.614 -2.280 6.828 1.00 0.00 O ATOM 876 CB ILE A 137 178.744 -4.226 5.569 1.00 0.00 C ATOM 877 CG1 ILE A 137 179.363 -5.626 5.498 1.00 0.00 C ATOM 878 CG2 ILE A 137 179.768 -3.201 5.068 1.00 0.00 C ATOM 879 CD1 ILE A 137 178.263 -6.681 5.342 1.00 0.00 C ATOM 0 H ILE A 137 176.437 -4.822 6.885 1.00 0.00 H new ATOM 0 HA ILE A 137 179.231 -3.952 7.672 1.00 0.00 H new ATOM 0 HB ILE A 137 177.851 -4.181 4.946 1.00 0.00 H new ATOM 0 HG12 ILE A 137 180.055 -5.684 4.658 1.00 0.00 H new ATOM 0 HG13 ILE A 137 179.941 -5.823 6.401 1.00 0.00 H new ATOM 0 HG21 ILE A 137 180.037 -3.429 4.037 1.00 0.00 H new ATOM 0 HG22 ILE A 137 179.336 -2.201 5.118 1.00 0.00 H new ATOM 0 HG23 ILE A 137 180.660 -3.243 5.693 1.00 0.00 H new ATOM 0 HD11 ILE A 137 178.714 -7.672 5.293 1.00 0.00 H new ATOM 0 HD12 ILE A 137 177.588 -6.632 6.196 1.00 0.00 H new ATOM 0 HD13 ILE A 137 177.704 -6.491 4.426 1.00 0.00 H new ATOM 891 N ASP A 138 178.548 -1.574 7.613 1.00 0.00 N ATOM 892 CA ASP A 138 178.035 -0.179 7.774 1.00 0.00 C ATOM 893 C ASP A 138 177.796 0.447 6.395 1.00 0.00 C ATOM 894 O ASP A 138 178.716 0.652 5.626 1.00 0.00 O ATOM 895 CB ASP A 138 179.136 0.572 8.523 1.00 0.00 C ATOM 896 CG ASP A 138 178.586 1.901 9.045 1.00 0.00 C ATOM 897 OD1 ASP A 138 178.204 2.722 8.228 1.00 0.00 O ATOM 898 OD2 ASP A 138 178.555 2.074 10.252 1.00 0.00 O ATOM 0 H ASP A 138 179.519 -1.714 7.892 1.00 0.00 H new ATOM 0 HA ASP A 138 177.089 -0.144 8.313 1.00 0.00 H new ATOM 0 HB2 ASP A 138 179.503 -0.032 9.353 1.00 0.00 H new ATOM 0 HB3 ASP A 138 179.983 0.752 7.861 1.00 0.00 H new ATOM 903 N TYR A 139 176.559 0.720 6.072 1.00 0.00 N ATOM 904 CA TYR A 139 176.226 1.299 4.731 1.00 0.00 C ATOM 905 C TYR A 139 176.843 2.696 4.540 1.00 0.00 C ATOM 906 O TYR A 139 177.235 3.061 3.448 1.00 0.00 O ATOM 907 CB TYR A 139 174.682 1.365 4.699 1.00 0.00 C ATOM 908 CG TYR A 139 174.167 2.489 5.583 1.00 0.00 C ATOM 909 CD1 TYR A 139 173.980 2.283 6.956 1.00 0.00 C ATOM 910 CD2 TYR A 139 173.891 3.740 5.020 1.00 0.00 C ATOM 911 CE1 TYR A 139 173.516 3.329 7.761 1.00 0.00 C ATOM 912 CE2 TYR A 139 173.427 4.785 5.826 1.00 0.00 C ATOM 913 CZ TYR A 139 173.241 4.580 7.197 1.00 0.00 C ATOM 914 OH TYR A 139 172.787 5.612 7.994 1.00 0.00 O ATOM 0 H TYR A 139 175.757 0.566 6.683 1.00 0.00 H new ATOM 0 HA TYR A 139 176.631 0.691 3.922 1.00 0.00 H new ATOM 0 HB2 TYR A 139 174.342 1.518 3.675 1.00 0.00 H new ATOM 0 HB3 TYR A 139 174.267 0.415 5.034 1.00 0.00 H new ATOM 0 HD1 TYR A 139 174.194 1.318 7.392 1.00 0.00 H new ATOM 0 HD2 TYR A 139 174.036 3.899 3.962 1.00 0.00 H new ATOM 0 HE1 TYR A 139 173.370 3.171 8.819 1.00 0.00 H new ATOM 0 HE2 TYR A 139 173.213 5.749 5.390 1.00 0.00 H new ATOM 0 HH TYR A 139 172.646 6.411 7.445 1.00 0.00 H new ATOM 924 N LYS A 140 176.898 3.484 5.584 1.00 0.00 N ATOM 925 CA LYS A 140 177.451 4.865 5.446 1.00 0.00 C ATOM 926 C LYS A 140 178.962 4.830 5.205 1.00 0.00 C ATOM 927 O LYS A 140 179.504 5.635 4.472 1.00 0.00 O ATOM 928 CB LYS A 140 177.137 5.563 6.773 1.00 0.00 C ATOM 929 CG LYS A 140 175.874 6.427 6.624 1.00 0.00 C ATOM 930 CD LYS A 140 176.234 7.908 6.770 1.00 0.00 C ATOM 931 CE LYS A 140 175.001 8.691 7.225 1.00 0.00 C ATOM 932 NZ LYS A 140 175.286 10.106 6.858 1.00 0.00 N ATOM 0 H LYS A 140 176.585 3.232 6.522 1.00 0.00 H new ATOM 0 HA LYS A 140 177.013 5.387 4.595 1.00 0.00 H new ATOM 0 HB2 LYS A 140 176.990 4.821 7.558 1.00 0.00 H new ATOM 0 HB3 LYS A 140 177.980 6.185 7.075 1.00 0.00 H new ATOM 0 HG2 LYS A 140 175.415 6.250 5.652 1.00 0.00 H new ATOM 0 HG3 LYS A 140 175.140 6.146 7.379 1.00 0.00 H new ATOM 0 HD2 LYS A 140 177.041 8.027 7.493 1.00 0.00 H new ATOM 0 HD3 LYS A 140 176.597 8.300 5.820 1.00 0.00 H new ATOM 0 HE2 LYS A 140 174.099 8.329 6.731 1.00 0.00 H new ATOM 0 HE3 LYS A 140 174.841 8.586 8.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 174.484 10.706 7.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 176.146 10.425 7.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 175.427 10.176 5.830 1.00 0.00 H new ATOM 946 N LYS A 141 179.644 3.912 5.839 1.00 0.00 N ATOM 947 CA LYS A 141 181.127 3.827 5.681 1.00 0.00 C ATOM 948 C LYS A 141 181.521 3.336 4.283 1.00 0.00 C ATOM 949 O LYS A 141 182.428 3.865 3.669 1.00 0.00 O ATOM 950 CB LYS A 141 181.591 2.827 6.743 1.00 0.00 C ATOM 951 CG LYS A 141 181.343 3.411 8.136 1.00 0.00 C ATOM 952 CD LYS A 141 181.860 2.437 9.197 1.00 0.00 C ATOM 953 CE LYS A 141 181.510 2.966 10.590 1.00 0.00 C ATOM 954 NZ LYS A 141 182.330 4.198 10.752 1.00 0.00 N ATOM 0 H LYS A 141 179.236 3.215 6.462 1.00 0.00 H new ATOM 0 HA LYS A 141 181.589 4.807 5.801 1.00 0.00 H new ATOM 0 HB2 LYS A 141 181.054 1.885 6.631 1.00 0.00 H new ATOM 0 HB3 LYS A 141 182.651 2.607 6.612 1.00 0.00 H new ATOM 0 HG2 LYS A 141 181.847 4.373 8.234 1.00 0.00 H new ATOM 0 HG3 LYS A 141 180.278 3.592 8.282 1.00 0.00 H new ATOM 0 HD2 LYS A 141 181.417 1.452 9.049 1.00 0.00 H new ATOM 0 HD3 LYS A 141 182.939 2.319 9.102 1.00 0.00 H new ATOM 0 HE2 LYS A 141 180.446 3.187 10.672 1.00 0.00 H new ATOM 0 HE3 LYS A 141 181.744 2.232 11.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 182.458 4.399 11.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 183.259 4.058 10.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 181.846 4.999 10.298 1.00 0.00 H new ATOM 968 N PHE A 142 180.873 2.305 3.793 1.00 0.00 N ATOM 969 CA PHE A 142 181.246 1.758 2.453 1.00 0.00 C ATOM 970 C PHE A 142 180.822 2.714 1.341 1.00 0.00 C ATOM 971 O PHE A 142 181.450 2.779 0.303 1.00 0.00 O ATOM 972 CB PHE A 142 180.518 0.417 2.331 1.00 0.00 C ATOM 973 CG PHE A 142 180.986 -0.307 1.087 1.00 0.00 C ATOM 974 CD1 PHE A 142 182.355 -0.512 0.867 1.00 0.00 C ATOM 975 CD2 PHE A 142 180.049 -0.783 0.160 1.00 0.00 C ATOM 976 CE1 PHE A 142 182.786 -1.187 -0.280 1.00 0.00 C ATOM 977 CE2 PHE A 142 180.483 -1.461 -0.987 1.00 0.00 C ATOM 978 CZ PHE A 142 181.851 -1.663 -1.206 1.00 0.00 C ATOM 0 H PHE A 142 180.106 1.822 4.262 1.00 0.00 H new ATOM 0 HA PHE A 142 182.325 1.633 2.358 1.00 0.00 H new ATOM 0 HB2 PHE A 142 180.711 -0.194 3.213 1.00 0.00 H new ATOM 0 HB3 PHE A 142 179.441 0.580 2.285 1.00 0.00 H new ATOM 0 HD1 PHE A 142 183.077 -0.149 1.583 1.00 0.00 H new ATOM 0 HD2 PHE A 142 178.994 -0.627 0.329 1.00 0.00 H new ATOM 0 HE1 PHE A 142 183.841 -1.341 -0.451 1.00 0.00 H new ATOM 0 HE2 PHE A 142 179.762 -1.828 -1.702 1.00 0.00 H new ATOM 0 HZ PHE A 142 182.185 -2.186 -2.090 1.00 0.00 H new ATOM 988 N ILE A 143 179.778 3.469 1.555 1.00 0.00 N ATOM 989 CA ILE A 143 179.325 4.438 0.515 1.00 0.00 C ATOM 990 C ILE A 143 180.201 5.694 0.566 1.00 0.00 C ATOM 991 O ILE A 143 180.685 6.158 -0.450 1.00 0.00 O ATOM 992 CB ILE A 143 177.867 4.749 0.875 1.00 0.00 C ATOM 993 CG1 ILE A 143 177.028 3.477 0.731 1.00 0.00 C ATOM 994 CG2 ILE A 143 177.313 5.823 -0.059 1.00 0.00 C ATOM 995 CD1 ILE A 143 175.636 3.713 1.320 1.00 0.00 C ATOM 0 H ILE A 143 179.218 3.456 2.407 1.00 0.00 H new ATOM 0 HA ILE A 143 179.404 4.046 -0.499 1.00 0.00 H new ATOM 0 HB ILE A 143 177.824 5.110 1.902 1.00 0.00 H new ATOM 0 HG12 ILE A 143 176.947 3.199 -0.320 1.00 0.00 H new ATOM 0 HG13 ILE A 143 177.515 2.648 1.243 1.00 0.00 H new ATOM 0 HG21 ILE A 143 176.277 6.036 0.205 1.00 0.00 H new ATOM 0 HG22 ILE A 143 177.907 6.732 0.039 1.00 0.00 H new ATOM 0 HG23 ILE A 143 177.359 5.469 -1.089 1.00 0.00 H new ATOM 0 HD11 ILE A 143 175.039 2.807 1.217 1.00 0.00 H new ATOM 0 HD12 ILE A 143 175.726 3.970 2.375 1.00 0.00 H new ATOM 0 HD13 ILE A 143 175.149 4.530 0.788 1.00 0.00 H new ATOM 1007 N GLU A 144 180.423 6.235 1.736 1.00 0.00 N ATOM 1008 CA GLU A 144 181.289 7.451 1.851 1.00 0.00 C ATOM 1009 C GLU A 144 182.697 7.143 1.332 1.00 0.00 C ATOM 1010 O GLU A 144 183.392 8.025 0.865 1.00 0.00 O ATOM 1011 CB GLU A 144 181.332 7.779 3.344 1.00 0.00 C ATOM 1012 CG GLU A 144 179.962 8.292 3.795 1.00 0.00 C ATOM 1013 CD GLU A 144 179.713 9.678 3.197 1.00 0.00 C ATOM 1014 OE1 GLU A 144 180.495 10.571 3.479 1.00 0.00 O ATOM 1015 OE2 GLU A 144 178.746 9.821 2.468 1.00 0.00 O ATOM 0 H GLU A 144 180.043 5.889 2.617 1.00 0.00 H new ATOM 0 HA GLU A 144 180.904 8.285 1.265 1.00 0.00 H new ATOM 0 HB2 GLU A 144 181.605 6.891 3.914 1.00 0.00 H new ATOM 0 HB3 GLU A 144 182.096 8.531 3.540 1.00 0.00 H new ATOM 0 HG2 GLU A 144 179.181 7.602 3.477 1.00 0.00 H new ATOM 0 HG3 GLU A 144 179.921 8.341 4.883 1.00 0.00 H new ATOM 1022 N ASP A 145 183.115 5.902 1.391 1.00 0.00 N ATOM 1023 CA ASP A 145 184.472 5.551 0.877 1.00 0.00 C ATOM 1024 C ASP A 145 184.408 5.219 -0.625 1.00 0.00 C ATOM 1025 O ASP A 145 185.426 5.170 -1.290 1.00 0.00 O ATOM 1026 CB ASP A 145 184.943 4.352 1.701 1.00 0.00 C ATOM 1027 CG ASP A 145 186.416 4.068 1.396 1.00 0.00 C ATOM 1028 OD1 ASP A 145 186.704 3.692 0.272 1.00 0.00 O ATOM 1029 OD2 ASP A 145 187.228 4.232 2.291 1.00 0.00 O ATOM 0 H ASP A 145 182.578 5.123 1.771 1.00 0.00 H new ATOM 0 HA ASP A 145 185.170 6.382 0.977 1.00 0.00 H new ATOM 0 HB2 ASP A 145 184.814 4.555 2.764 1.00 0.00 H new ATOM 0 HB3 ASP A 145 184.337 3.476 1.467 1.00 0.00 H new ATOM 1034 N VAL A 146 183.228 5.041 -1.174 1.00 0.00 N ATOM 1035 CA VAL A 146 183.115 4.775 -2.641 1.00 0.00 C ATOM 1036 C VAL A 146 182.840 6.117 -3.334 1.00 0.00 C ATOM 1037 O VAL A 146 183.365 6.412 -4.390 1.00 0.00 O ATOM 1038 CB VAL A 146 181.939 3.796 -2.788 1.00 0.00 C ATOM 1039 CG1 VAL A 146 181.548 3.646 -4.264 1.00 0.00 C ATOM 1040 CG2 VAL A 146 182.354 2.429 -2.245 1.00 0.00 C ATOM 0 H VAL A 146 182.342 5.069 -0.669 1.00 0.00 H new ATOM 0 HA VAL A 146 184.011 4.346 -3.089 1.00 0.00 H new ATOM 0 HB VAL A 146 181.086 4.184 -2.230 1.00 0.00 H new ATOM 0 HG11 VAL A 146 180.714 2.950 -4.350 1.00 0.00 H new ATOM 0 HG12 VAL A 146 181.253 4.617 -4.663 1.00 0.00 H new ATOM 0 HG13 VAL A 146 182.399 3.265 -4.829 1.00 0.00 H new ATOM 0 HG21 VAL A 146 181.524 1.730 -2.346 1.00 0.00 H new ATOM 0 HG22 VAL A 146 183.211 2.059 -2.808 1.00 0.00 H new ATOM 0 HG23 VAL A 146 182.624 2.522 -1.193 1.00 0.00 H new ATOM 1050 N LEU A 147 182.033 6.935 -2.711 1.00 0.00 N ATOM 1051 CA LEU A 147 181.714 8.286 -3.271 1.00 0.00 C ATOM 1052 C LEU A 147 182.991 9.101 -3.514 1.00 0.00 C ATOM 1053 O LEU A 147 182.998 10.034 -4.294 1.00 0.00 O ATOM 1054 CB LEU A 147 180.850 8.967 -2.207 1.00 0.00 C ATOM 1055 CG LEU A 147 179.455 8.340 -2.203 1.00 0.00 C ATOM 1056 CD1 LEU A 147 178.674 8.839 -0.985 1.00 0.00 C ATOM 1057 CD2 LEU A 147 178.716 8.740 -3.481 1.00 0.00 C ATOM 0 H LEU A 147 181.574 6.723 -1.825 1.00 0.00 H new ATOM 0 HA LEU A 147 181.206 8.208 -4.232 1.00 0.00 H new ATOM 0 HB2 LEU A 147 181.311 8.859 -1.225 1.00 0.00 H new ATOM 0 HB3 LEU A 147 180.779 10.036 -2.410 1.00 0.00 H new ATOM 0 HG LEU A 147 179.544 7.255 -2.157 1.00 0.00 H new ATOM 0 HD11 LEU A 147 177.680 8.392 -0.982 1.00 0.00 H new ATOM 0 HD12 LEU A 147 179.201 8.556 -0.074 1.00 0.00 H new ATOM 0 HD13 LEU A 147 178.584 9.924 -1.030 1.00 0.00 H new ATOM 0 HD21 LEU A 147 177.721 8.294 -3.481 1.00 0.00 H new ATOM 0 HD22 LEU A 147 178.627 9.825 -3.525 1.00 0.00 H new ATOM 0 HD23 LEU A 147 179.272 8.386 -4.349 1.00 0.00 H new ATOM 1069 N ARG A 148 184.069 8.755 -2.853 1.00 0.00 N ATOM 1070 CA ARG A 148 185.350 9.508 -3.045 1.00 0.00 C ATOM 1071 C ARG A 148 185.774 9.472 -4.517 1.00 0.00 C ATOM 1072 O ARG A 148 185.513 8.516 -5.222 1.00 0.00 O ATOM 1073 CB ARG A 148 186.381 8.774 -2.183 1.00 0.00 C ATOM 1074 CG ARG A 148 186.068 9.005 -0.704 1.00 0.00 C ATOM 1075 CD ARG A 148 187.180 8.397 0.153 1.00 0.00 C ATOM 1076 NE ARG A 148 188.364 9.268 -0.081 1.00 0.00 N ATOM 1077 CZ ARG A 148 189.565 8.756 -0.069 1.00 0.00 C ATOM 1078 NH1 ARG A 148 189.931 7.975 0.910 1.00 0.00 N ATOM 1079 NH2 ARG A 148 190.398 9.024 -1.037 1.00 0.00 N ATOM 0 H ARG A 148 184.118 7.983 -2.188 1.00 0.00 H new ATOM 0 HA ARG A 148 185.251 10.556 -2.764 1.00 0.00 H new ATOM 0 HB2 ARG A 148 186.364 7.707 -2.407 1.00 0.00 H new ATOM 0 HB3 ARG A 148 187.384 9.132 -2.413 1.00 0.00 H new ATOM 0 HG2 ARG A 148 185.981 10.073 -0.502 1.00 0.00 H new ATOM 0 HG3 ARG A 148 185.109 8.553 -0.449 1.00 0.00 H new ATOM 0 HD2 ARG A 148 186.903 8.382 1.207 1.00 0.00 H new ATOM 0 HD3 ARG A 148 187.384 7.366 -0.138 1.00 0.00 H new ATOM 0 HE ARG A 148 188.237 10.266 -0.251 1.00 0.00 H new ATOM 0 HH11 ARG A 148 189.279 7.765 1.666 1.00 0.00 H new ATOM 0 HH12 ARG A 148 190.869 7.575 0.920 1.00 0.00 H new ATOM 0 HH21 ARG A 148 190.111 9.633 -1.803 1.00 0.00 H new ATOM 0 HH22 ARG A 148 191.336 8.624 -1.028 1.00 0.00 H new ATOM 1093 N GLN A 149 186.427 10.507 -4.982 1.00 0.00 N ATOM 1094 CA GLN A 149 186.873 10.541 -6.408 1.00 0.00 C ATOM 1095 C GLN A 149 188.030 11.532 -6.579 1.00 0.00 C ATOM 1096 O GLN A 149 188.113 12.458 -5.788 1.00 0.00 O ATOM 1097 CB GLN A 149 185.644 10.994 -7.205 1.00 0.00 C ATOM 1098 CG GLN A 149 185.172 12.365 -6.709 1.00 0.00 C ATOM 1099 CD GLN A 149 183.821 12.700 -7.343 1.00 0.00 C ATOM 1100 OE1 GLN A 149 182.971 11.843 -7.477 1.00 0.00 O ATOM 1101 NE2 GLN A 149 183.585 13.920 -7.741 1.00 0.00 N ATOM 1102 OXT GLN A 149 188.811 11.347 -7.498 1.00 0.00 O ATOM 0 H GLN A 149 186.671 11.332 -4.434 1.00 0.00 H new ATOM 0 HA GLN A 149 187.237 9.572 -6.748 1.00 0.00 H new ATOM 0 HB2 GLN A 149 185.888 11.046 -8.266 1.00 0.00 H new ATOM 0 HB3 GLN A 149 184.842 10.264 -7.098 1.00 0.00 H new ATOM 0 HG2 GLN A 149 185.084 12.360 -5.623 1.00 0.00 H new ATOM 0 HG3 GLN A 149 185.906 13.129 -6.966 1.00 0.00 H new ATOM 0 HE21 GLN A 149 184.299 14.640 -7.629 1.00 0.00 H new ATOM 0 HE22 GLN A 149 182.687 14.154 -8.164 1.00 0.00 H new TER 1111 GLN A 149