USER MOD reduce.3.24.130724 H: found=0, std=0, add=681, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 679 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 69 ASN : amide:sc= -0.217 K(o=-0.39,f=-2.5) USER MOD Set 1.2: A 70 THR OG1 : rot -160:sc= -0.173 USER MOD Set 2.1: A 43 GLN : amide:sc= -6.16! C(o=-7.4!,f=-13!) USER MOD Set 2.2: A 74 MET CE :methyl -108:sc= -1.25 (180deg=-0.236) USER MOD Set 3.1: A 12 GLN : amide:sc= -1.01 X(o=-2.3,f=-2.2) USER MOD Set 3.2: A 14 TYR OH : rot 30:sc= -1.27 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -119:sc= -0.0543 (180deg=-0.529) USER MOD Single : A 8 LYS NZ :NH3+ -179:sc= -0.295 (180deg=-0.295) USER MOD Single : A 15 SER OG : rot 180:sc= 0.00751 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -122:sc= 0.0378 USER MOD Single : A 24 THR OG1 : rot 180:sc= -1.38 USER MOD Single : A 29 LYS NZ :NH3+ 141:sc= -3.29! (180deg=-4.52!) USER MOD Single : A 30 GLN :FLIP amide:sc= -0.0661 F(o=-1,f=-0.066) USER MOD Single : A 33 LYS NZ :NH3+ -136:sc= 0.714 (180deg=-3.03!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot -76:sc= 0.535 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0117) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -0.256 X(o=-0.26,f=-0.51) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 170:sc= 1.18 (180deg=0.857) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 180:sc=-0.00186 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.408 0.123 -0.378 1.00 0.00 N ATOM 2 CA MET A 1 2.333 0.049 -1.502 1.00 0.00 C ATOM 3 C MET A 1 2.540 -1.397 -1.942 1.00 0.00 C ATOM 4 O MET A 1 2.483 -2.317 -1.127 1.00 0.00 O ATOM 5 CB MET A 1 3.677 0.677 -1.127 1.00 0.00 C ATOM 6 CG MET A 1 3.598 2.173 -0.868 1.00 0.00 C ATOM 7 SD MET A 1 3.805 3.149 -2.370 1.00 0.00 S ATOM 8 CE MET A 1 5.505 3.685 -2.194 1.00 0.00 C ATOM 0 H1 MET A 1 0.576 0.685 -0.649 1.00 0.00 H new ATOM 0 H2 MET A 1 1.106 -0.836 -0.113 1.00 0.00 H new ATOM 0 H3 MET A 1 1.881 0.573 0.432 1.00 0.00 H new ATOM 0 HA MET A 1 1.900 0.605 -2.333 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.064 0.182 -0.236 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.391 0.493 -1.929 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.635 2.409 -0.416 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.366 2.454 -0.148 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.783 4.301 -3.049 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.610 4.267 -1.278 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.158 2.814 -2.147 1.00 0.00 H new ATOM 18 N ALA A 2 2.779 -1.589 -3.235 1.00 0.00 N ATOM 19 CA ALA A 2 2.996 -2.923 -3.782 1.00 0.00 C ATOM 20 C ALA A 2 4.449 -3.115 -4.202 1.00 0.00 C ATOM 21 O ALA A 2 4.967 -2.375 -5.039 1.00 0.00 O ATOM 22 CB ALA A 2 2.067 -3.167 -4.962 1.00 0.00 C ATOM 0 H ALA A 2 2.827 -0.838 -3.923 1.00 0.00 H new ATOM 0 HA ALA A 2 2.772 -3.650 -3.001 1.00 0.00 H new ATOM 0 HB1 ALA A 2 2.240 -4.167 -5.361 1.00 0.00 H new ATOM 0 HB2 ALA A 2 1.031 -3.081 -4.633 1.00 0.00 H new ATOM 0 HB3 ALA A 2 2.263 -2.428 -5.739 1.00 0.00 H new ATOM 28 N LEU A 3 5.103 -4.111 -3.615 1.00 0.00 N ATOM 29 CA LEU A 3 6.499 -4.400 -3.927 1.00 0.00 C ATOM 30 C LEU A 3 6.604 -5.480 -4.999 1.00 0.00 C ATOM 31 O LEU A 3 6.232 -6.635 -4.790 1.00 0.00 O ATOM 32 CB LEU A 3 7.244 -4.841 -2.667 1.00 0.00 C ATOM 33 CG LEU A 3 7.916 -3.729 -1.861 1.00 0.00 C ATOM 34 CD1 LEU A 3 8.657 -4.310 -0.666 1.00 0.00 C ATOM 35 CD2 LEU A 3 8.865 -2.931 -2.742 1.00 0.00 C ATOM 0 H LEU A 3 4.689 -4.733 -2.920 1.00 0.00 H new ATOM 0 HA LEU A 3 6.956 -3.488 -4.310 1.00 0.00 H new ATOM 0 HB2 LEU A 3 6.540 -5.360 -2.016 1.00 0.00 H new ATOM 0 HB3 LEU A 3 8.006 -5.565 -2.954 1.00 0.00 H new ATOM 0 HG LEU A 3 7.143 -3.056 -1.491 1.00 0.00 H new ATOM 0 HD11 LEU A 3 9.129 -3.504 -0.104 1.00 0.00 H new ATOM 0 HD12 LEU A 3 7.953 -4.837 -0.022 1.00 0.00 H new ATOM 0 HD13 LEU A 3 9.421 -5.005 -1.014 1.00 0.00 H new ATOM 0 HD21 LEU A 3 9.334 -2.144 -2.152 1.00 0.00 H new ATOM 0 HD22 LEU A 3 9.634 -3.593 -3.141 1.00 0.00 H new ATOM 0 HD23 LEU A 3 8.308 -2.484 -3.565 1.00 0.00 H new ATOM 47 N PRO A 4 7.125 -5.099 -6.174 1.00 0.00 N ATOM 48 CA PRO A 4 7.295 -6.022 -7.301 1.00 0.00 C ATOM 49 C PRO A 4 8.383 -7.058 -7.043 1.00 0.00 C ATOM 50 O PRO A 4 9.280 -6.841 -6.228 1.00 0.00 O ATOM 51 CB PRO A 4 7.697 -5.101 -8.456 1.00 0.00 C ATOM 52 CG PRO A 4 8.318 -3.917 -7.798 1.00 0.00 C ATOM 53 CD PRO A 4 7.590 -3.739 -6.494 1.00 0.00 C ATOM 0 HA PRO A 4 6.392 -6.601 -7.493 1.00 0.00 H new ATOM 0 HB2 PRO A 4 8.399 -5.593 -9.129 1.00 0.00 H new ATOM 0 HB3 PRO A 4 6.831 -4.814 -9.053 1.00 0.00 H new ATOM 0 HG2 PRO A 4 9.383 -4.077 -7.632 1.00 0.00 H new ATOM 0 HG3 PRO A 4 8.223 -3.029 -8.423 1.00 0.00 H new ATOM 0 HD2 PRO A 4 8.247 -3.346 -5.718 1.00 0.00 H new ATOM 0 HD3 PRO A 4 6.757 -3.042 -6.591 1.00 0.00 H new ATOM 61 N ILE A 5 8.298 -8.185 -7.742 1.00 0.00 N ATOM 62 CA ILE A 5 9.277 -9.254 -7.589 1.00 0.00 C ATOM 63 C ILE A 5 9.460 -10.022 -8.894 1.00 0.00 C ATOM 64 O ILE A 5 8.487 -10.443 -9.520 1.00 0.00 O ATOM 65 CB ILE A 5 8.864 -10.240 -6.480 1.00 0.00 C ATOM 66 CG1 ILE A 5 9.105 -9.621 -5.102 1.00 0.00 C ATOM 67 CG2 ILE A 5 9.631 -11.547 -6.621 1.00 0.00 C ATOM 68 CD1 ILE A 5 9.644 -10.602 -4.084 1.00 0.00 C ATOM 0 H ILE A 5 7.561 -8.381 -8.420 1.00 0.00 H new ATOM 0 HA ILE A 5 10.220 -8.782 -7.312 1.00 0.00 H new ATOM 0 HB ILE A 5 7.800 -10.453 -6.581 1.00 0.00 H new ATOM 0 HG12 ILE A 5 9.806 -8.792 -5.203 1.00 0.00 H new ATOM 0 HG13 ILE A 5 8.169 -9.203 -4.732 1.00 0.00 H new ATOM 0 HG21 ILE A 5 9.328 -12.234 -5.830 1.00 0.00 H new ATOM 0 HG22 ILE A 5 9.414 -11.993 -7.592 1.00 0.00 H new ATOM 0 HG23 ILE A 5 10.700 -11.352 -6.542 1.00 0.00 H new ATOM 0 HD11 ILE A 5 9.791 -10.094 -3.131 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.934 -11.419 -3.954 1.00 0.00 H new ATOM 0 HD13 ILE A 5 10.596 -11.001 -4.432 1.00 0.00 H new ATOM 80 N ILE A 6 10.714 -10.203 -9.296 1.00 0.00 N ATOM 81 CA ILE A 6 11.025 -10.923 -10.525 1.00 0.00 C ATOM 82 C ILE A 6 11.332 -12.389 -10.240 1.00 0.00 C ATOM 83 O ILE A 6 12.062 -12.711 -9.302 1.00 0.00 O ATOM 84 CB ILE A 6 12.224 -10.292 -11.258 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.825 -8.948 -11.870 1.00 0.00 C ATOM 86 CG2 ILE A 6 12.743 -11.236 -12.333 1.00 0.00 C ATOM 87 CD1 ILE A 6 12.925 -7.910 -11.818 1.00 0.00 C ATOM 0 H ILE A 6 11.530 -9.861 -8.789 1.00 0.00 H new ATOM 0 HA ILE A 6 10.143 -10.856 -11.162 1.00 0.00 H new ATOM 0 HB ILE A 6 13.023 -10.119 -10.537 1.00 0.00 H new ATOM 0 HG12 ILE A 6 11.532 -9.103 -12.908 1.00 0.00 H new ATOM 0 HG13 ILE A 6 10.950 -8.565 -11.346 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.590 -10.777 -12.842 1.00 0.00 H new ATOM 0 HG22 ILE A 6 13.060 -12.172 -11.873 1.00 0.00 H new ATOM 0 HG23 ILE A 6 11.951 -11.436 -13.054 1.00 0.00 H new ATOM 0 HD11 ILE A 6 12.572 -6.983 -12.269 1.00 0.00 H new ATOM 0 HD12 ILE A 6 13.203 -7.726 -10.780 1.00 0.00 H new ATOM 0 HD13 ILE A 6 13.794 -8.273 -12.367 1.00 0.00 H new ATOM 99 N VAL A 7 10.770 -13.275 -11.056 1.00 0.00 N ATOM 100 CA VAL A 7 10.986 -14.708 -10.894 1.00 0.00 C ATOM 101 C VAL A 7 11.628 -15.311 -12.139 1.00 0.00 C ATOM 102 O VAL A 7 11.337 -14.900 -13.262 1.00 0.00 O ATOM 103 CB VAL A 7 9.665 -15.445 -10.603 1.00 0.00 C ATOM 104 CG1 VAL A 7 8.924 -15.744 -11.896 1.00 0.00 C ATOM 105 CG2 VAL A 7 9.930 -16.723 -9.822 1.00 0.00 C ATOM 0 H VAL A 7 10.162 -13.026 -11.836 1.00 0.00 H new ATOM 0 HA VAL A 7 11.658 -14.833 -10.045 1.00 0.00 H new ATOM 0 HB VAL A 7 9.034 -14.798 -9.993 1.00 0.00 H new ATOM 0 HG11 VAL A 7 7.994 -16.265 -11.670 1.00 0.00 H new ATOM 0 HG12 VAL A 7 8.701 -14.810 -12.412 1.00 0.00 H new ATOM 0 HG13 VAL A 7 9.545 -16.372 -12.535 1.00 0.00 H new ATOM 0 HG21 VAL A 7 8.986 -17.231 -9.625 1.00 0.00 H new ATOM 0 HG22 VAL A 7 10.580 -17.377 -10.404 1.00 0.00 H new ATOM 0 HG23 VAL A 7 10.414 -16.478 -8.877 1.00 0.00 H new ATOM 115 N LYS A 8 12.502 -16.290 -11.931 1.00 0.00 N ATOM 116 CA LYS A 8 13.185 -16.953 -13.035 1.00 0.00 C ATOM 117 C LYS A 8 12.908 -18.453 -13.024 1.00 0.00 C ATOM 118 O LYS A 8 13.184 -19.137 -12.038 1.00 0.00 O ATOM 119 CB LYS A 8 14.692 -16.701 -12.955 1.00 0.00 C ATOM 120 CG LYS A 8 15.357 -16.549 -14.312 1.00 0.00 C ATOM 121 CD LYS A 8 16.576 -15.645 -14.238 1.00 0.00 C ATOM 122 CE LYS A 8 16.181 -14.177 -14.223 1.00 0.00 C ATOM 123 NZ LYS A 8 16.378 -13.536 -15.553 1.00 0.00 N ATOM 0 H LYS A 8 12.754 -16.642 -11.007 1.00 0.00 H new ATOM 0 HA LYS A 8 12.803 -16.538 -13.967 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.870 -15.799 -12.370 1.00 0.00 H new ATOM 0 HB3 LYS A 8 15.162 -17.526 -12.420 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.652 -17.530 -14.685 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.642 -16.139 -15.025 1.00 0.00 H new ATOM 0 HD2 LYS A 8 17.149 -15.878 -13.340 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.227 -15.839 -15.091 1.00 0.00 H new ATOM 0 HE2 LYS A 8 15.136 -14.085 -13.927 1.00 0.00 H new ATOM 0 HE3 LYS A 8 16.772 -13.649 -13.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 16.114 -12.532 -15.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 17.377 -13.616 -15.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 15.782 -14.012 -16.260 1.00 0.00 H new ATOM 137 N TRP A 9 12.364 -18.958 -14.125 1.00 0.00 N ATOM 138 CA TRP A 9 12.052 -20.378 -14.242 1.00 0.00 C ATOM 139 C TRP A 9 12.237 -20.860 -15.676 1.00 0.00 C ATOM 140 O TRP A 9 11.635 -20.322 -16.605 1.00 0.00 O ATOM 141 CB TRP A 9 10.618 -20.645 -13.782 1.00 0.00 C ATOM 142 CG TRP A 9 10.132 -22.022 -14.121 1.00 0.00 C ATOM 143 CD1 TRP A 9 9.025 -22.343 -14.853 1.00 0.00 C ATOM 144 CD2 TRP A 9 10.737 -23.262 -13.740 1.00 0.00 C ATOM 145 NE1 TRP A 9 8.905 -23.708 -14.949 1.00 0.00 N ATOM 146 CE2 TRP A 9 9.943 -24.295 -14.276 1.00 0.00 C ATOM 147 CE3 TRP A 9 11.873 -23.600 -12.999 1.00 0.00 C ATOM 148 CZ2 TRP A 9 10.250 -25.640 -14.092 1.00 0.00 C ATOM 149 CZ3 TRP A 9 12.176 -24.936 -12.818 1.00 0.00 C ATOM 150 CH2 TRP A 9 11.368 -25.943 -13.363 1.00 0.00 C ATOM 0 H TRP A 9 12.130 -18.405 -14.950 1.00 0.00 H new ATOM 0 HA TRP A 9 12.740 -20.930 -13.602 1.00 0.00 H new ATOM 0 HB2 TRP A 9 10.557 -20.501 -12.703 1.00 0.00 H new ATOM 0 HB3 TRP A 9 9.955 -19.911 -14.239 1.00 0.00 H new ATOM 0 HD1 TRP A 9 8.344 -21.629 -15.292 1.00 0.00 H new ATOM 0 HE1 TRP A 9 8.163 -24.204 -15.442 1.00 0.00 H new ATOM 0 HE3 TRP A 9 12.502 -22.831 -12.576 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 9.628 -26.417 -14.510 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 13.051 -25.209 -12.247 1.00 0.00 H new ATOM 0 HH2 TRP A 9 11.633 -26.978 -13.205 1.00 0.00 H new ATOM 161 N GLY A 10 13.075 -21.878 -15.851 1.00 0.00 N ATOM 162 CA GLY A 10 13.324 -22.415 -17.176 1.00 0.00 C ATOM 163 C GLY A 10 13.808 -21.358 -18.148 1.00 0.00 C ATOM 164 O GLY A 10 13.561 -21.450 -19.350 1.00 0.00 O ATOM 0 H GLY A 10 13.586 -22.340 -15.099 1.00 0.00 H new ATOM 0 HA2 GLY A 10 14.067 -23.210 -17.109 1.00 0.00 H new ATOM 0 HA3 GLY A 10 12.409 -22.866 -17.560 1.00 0.00 H new ATOM 168 N GLY A 11 14.499 -20.348 -17.627 1.00 0.00 N ATOM 169 CA GLY A 11 15.006 -19.283 -18.472 1.00 0.00 C ATOM 170 C GLY A 11 13.991 -18.177 -18.683 1.00 0.00 C ATOM 171 O GLY A 11 14.312 -17.130 -19.243 1.00 0.00 O ATOM 0 H GLY A 11 14.716 -20.249 -16.635 1.00 0.00 H new ATOM 0 HA2 GLY A 11 15.907 -18.864 -18.023 1.00 0.00 H new ATOM 0 HA3 GLY A 11 15.294 -19.696 -19.438 1.00 0.00 H new ATOM 175 N GLN A 12 12.761 -18.412 -18.236 1.00 0.00 N ATOM 176 CA GLN A 12 11.695 -17.428 -18.382 1.00 0.00 C ATOM 177 C GLN A 12 11.687 -16.456 -17.206 1.00 0.00 C ATOM 178 O GLN A 12 11.995 -16.833 -16.076 1.00 0.00 O ATOM 179 CB GLN A 12 10.339 -18.127 -18.491 1.00 0.00 C ATOM 180 CG GLN A 12 10.311 -19.243 -19.522 1.00 0.00 C ATOM 181 CD GLN A 12 9.062 -20.098 -19.424 1.00 0.00 C ATOM 182 OE1 GLN A 12 8.838 -20.776 -18.421 1.00 0.00 O ATOM 183 NE2 GLN A 12 8.241 -20.069 -20.467 1.00 0.00 N ATOM 0 H GLN A 12 12.479 -19.274 -17.770 1.00 0.00 H new ATOM 0 HA GLN A 12 11.879 -16.863 -19.296 1.00 0.00 H new ATOM 0 HB2 GLN A 12 10.072 -18.537 -17.517 1.00 0.00 H new ATOM 0 HB3 GLN A 12 9.579 -17.389 -18.746 1.00 0.00 H new ATOM 0 HG2 GLN A 12 10.373 -18.811 -20.521 1.00 0.00 H new ATOM 0 HG3 GLN A 12 11.190 -19.874 -19.392 1.00 0.00 H new ATOM 0 HE21 GLN A 12 8.466 -19.492 -21.278 1.00 0.00 H new ATOM 0 HE22 GLN A 12 7.385 -20.623 -20.458 1.00 0.00 H new ATOM 192 N GLU A 13 11.331 -15.205 -17.482 1.00 0.00 N ATOM 193 CA GLU A 13 11.284 -14.180 -16.446 1.00 0.00 C ATOM 194 C GLU A 13 9.867 -13.638 -16.280 1.00 0.00 C ATOM 195 O GLU A 13 9.195 -13.317 -17.261 1.00 0.00 O ATOM 196 CB GLU A 13 12.242 -13.036 -16.785 1.00 0.00 C ATOM 197 CG GLU A 13 12.920 -12.428 -15.569 1.00 0.00 C ATOM 198 CD GLU A 13 12.804 -10.917 -15.531 1.00 0.00 C ATOM 199 OE1 GLU A 13 11.721 -10.414 -15.166 1.00 0.00 O ATOM 200 OE2 GLU A 13 13.797 -10.237 -15.865 1.00 0.00 O ATOM 0 H GLU A 13 11.071 -14.878 -18.413 1.00 0.00 H new ATOM 0 HA GLU A 13 11.593 -14.637 -15.506 1.00 0.00 H new ATOM 0 HB2 GLU A 13 13.006 -13.404 -17.470 1.00 0.00 H new ATOM 0 HB3 GLU A 13 11.691 -12.256 -17.311 1.00 0.00 H new ATOM 0 HG2 GLU A 13 12.478 -12.845 -14.664 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.973 -12.708 -15.567 1.00 0.00 H new ATOM 207 N TYR A 14 9.420 -13.540 -15.034 1.00 0.00 N ATOM 208 CA TYR A 14 8.082 -13.041 -14.739 1.00 0.00 C ATOM 209 C TYR A 14 8.092 -12.159 -13.494 1.00 0.00 C ATOM 210 O TYR A 14 8.492 -12.594 -12.414 1.00 0.00 O ATOM 211 CB TYR A 14 7.111 -14.207 -14.543 1.00 0.00 C ATOM 212 CG TYR A 14 7.159 -15.228 -15.657 1.00 0.00 C ATOM 213 CD1 TYR A 14 6.530 -14.990 -16.872 1.00 0.00 C ATOM 214 CD2 TYR A 14 7.835 -16.432 -15.493 1.00 0.00 C ATOM 215 CE1 TYR A 14 6.571 -15.921 -17.892 1.00 0.00 C ATOM 216 CE2 TYR A 14 7.883 -17.368 -16.508 1.00 0.00 C ATOM 217 CZ TYR A 14 7.249 -17.108 -17.706 1.00 0.00 C ATOM 218 OH TYR A 14 7.293 -18.037 -18.719 1.00 0.00 O ATOM 0 H TYR A 14 9.964 -13.799 -14.211 1.00 0.00 H new ATOM 0 HA TYR A 14 7.751 -12.440 -15.586 1.00 0.00 H new ATOM 0 HB2 TYR A 14 7.336 -14.702 -13.598 1.00 0.00 H new ATOM 0 HB3 TYR A 14 6.097 -13.815 -14.464 1.00 0.00 H new ATOM 0 HD1 TYR A 14 6.000 -14.061 -17.022 1.00 0.00 H new ATOM 0 HD2 TYR A 14 8.331 -16.639 -14.556 1.00 0.00 H new ATOM 0 HE1 TYR A 14 6.075 -15.721 -18.830 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.414 -18.298 -16.365 1.00 0.00 H new ATOM 0 HH TYR A 14 7.250 -17.579 -19.585 1.00 0.00 H new ATOM 228 N SER A 15 7.648 -10.916 -13.654 1.00 0.00 N ATOM 229 CA SER A 15 7.608 -9.970 -12.545 1.00 0.00 C ATOM 230 C SER A 15 6.217 -9.925 -11.920 1.00 0.00 C ATOM 231 O SER A 15 5.214 -10.172 -12.589 1.00 0.00 O ATOM 232 CB SER A 15 8.010 -8.574 -13.024 1.00 0.00 C ATOM 233 OG SER A 15 7.405 -8.267 -14.268 1.00 0.00 O ATOM 0 H SER A 15 7.311 -10.541 -14.541 1.00 0.00 H new ATOM 0 HA SER A 15 8.317 -10.305 -11.788 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.716 -7.833 -12.281 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.094 -8.517 -13.120 1.00 0.00 H new ATOM 0 HG SER A 15 7.677 -7.369 -14.551 1.00 0.00 H new ATOM 239 N VAL A 16 6.165 -9.607 -10.630 1.00 0.00 N ATOM 240 CA VAL A 16 4.898 -9.527 -9.913 1.00 0.00 C ATOM 241 C VAL A 16 4.495 -8.077 -9.668 1.00 0.00 C ATOM 242 O VAL A 16 5.347 -7.207 -9.479 1.00 0.00 O ATOM 243 CB VAL A 16 4.971 -10.263 -8.562 1.00 0.00 C ATOM 244 CG1 VAL A 16 5.033 -9.268 -7.414 1.00 0.00 C ATOM 245 CG2 VAL A 16 3.784 -11.201 -8.402 1.00 0.00 C ATOM 0 H VAL A 16 6.986 -9.401 -10.060 1.00 0.00 H new ATOM 0 HA VAL A 16 4.148 -10.008 -10.541 1.00 0.00 H new ATOM 0 HB VAL A 16 5.883 -10.860 -8.542 1.00 0.00 H new ATOM 0 HG11 VAL A 16 5.084 -9.807 -6.468 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.918 -8.641 -7.523 1.00 0.00 H new ATOM 0 HG13 VAL A 16 4.141 -8.641 -7.427 1.00 0.00 H new ATOM 0 HG21 VAL A 16 3.852 -11.713 -7.442 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.858 -10.627 -8.443 1.00 0.00 H new ATOM 0 HG23 VAL A 16 3.790 -11.936 -9.207 1.00 0.00 H new ATOM 255 N THR A 17 3.191 -7.823 -9.671 1.00 0.00 N ATOM 256 CA THR A 17 2.674 -6.478 -9.450 1.00 0.00 C ATOM 257 C THR A 17 1.261 -6.519 -8.878 1.00 0.00 C ATOM 258 O THR A 17 0.357 -5.850 -9.379 1.00 0.00 O ATOM 259 CB THR A 17 2.663 -5.659 -10.754 1.00 0.00 C ATOM 260 OG1 THR A 17 2.155 -6.456 -11.830 1.00 0.00 O ATOM 261 CG2 THR A 17 4.062 -5.169 -11.097 1.00 0.00 C ATOM 0 H THR A 17 2.473 -8.531 -9.824 1.00 0.00 H new ATOM 0 HA THR A 17 3.340 -5.998 -8.733 1.00 0.00 H new ATOM 0 HB THR A 17 2.017 -4.793 -10.607 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.150 -5.927 -12.655 1.00 0.00 H new ATOM 0 HG21 THR A 17 4.029 -4.593 -12.022 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.435 -4.538 -10.290 1.00 0.00 H new ATOM 0 HG23 THR A 17 4.726 -6.024 -11.225 1.00 0.00 H new ATOM 269 N THR A 18 1.077 -7.309 -7.825 1.00 0.00 N ATOM 270 CA THR A 18 -0.226 -7.438 -7.184 1.00 0.00 C ATOM 271 C THR A 18 -0.109 -7.306 -5.670 1.00 0.00 C ATOM 272 O THR A 18 -0.975 -6.718 -5.019 1.00 0.00 O ATOM 273 CB THR A 18 -0.886 -8.788 -7.521 1.00 0.00 C ATOM 274 OG1 THR A 18 -1.883 -9.103 -6.543 1.00 0.00 O ATOM 275 CG2 THR A 18 0.150 -9.900 -7.573 1.00 0.00 C ATOM 0 H THR A 18 1.814 -7.870 -7.398 1.00 0.00 H new ATOM 0 HA THR A 18 -0.849 -6.631 -7.569 1.00 0.00 H new ATOM 0 HB THR A 18 -1.353 -8.704 -8.502 1.00 0.00 H new ATOM 0 HG1 THR A 18 -2.299 -9.962 -6.765 1.00 0.00 H new ATOM 0 HG21 THR A 18 -0.341 -10.843 -7.813 1.00 0.00 H new ATOM 0 HG22 THR A 18 0.891 -9.671 -8.339 1.00 0.00 H new ATOM 0 HG23 THR A 18 0.643 -9.983 -6.605 1.00 0.00 H new ATOM 283 N LEU A 19 0.965 -7.855 -5.114 1.00 0.00 N ATOM 284 CA LEU A 19 1.195 -7.798 -3.674 1.00 0.00 C ATOM 285 C LEU A 19 2.599 -7.288 -3.367 1.00 0.00 C ATOM 286 O LEU A 19 3.307 -6.814 -4.256 1.00 0.00 O ATOM 287 CB LEU A 19 0.994 -9.180 -3.050 1.00 0.00 C ATOM 288 CG LEU A 19 2.010 -10.250 -3.449 1.00 0.00 C ATOM 289 CD1 LEU A 19 2.231 -11.229 -2.306 1.00 0.00 C ATOM 290 CD2 LEU A 19 1.549 -10.984 -4.700 1.00 0.00 C ATOM 0 H LEU A 19 1.690 -8.345 -5.638 1.00 0.00 H new ATOM 0 HA LEU A 19 0.474 -7.104 -3.243 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.015 -9.074 -1.965 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -0.002 -9.535 -3.316 1.00 0.00 H new ATOM 0 HG LEU A 19 2.958 -9.759 -3.669 1.00 0.00 H new ATOM 0 HD11 LEU A 19 2.957 -11.983 -2.608 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.607 -10.692 -1.435 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.288 -11.714 -2.055 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.285 -11.742 -4.969 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.589 -11.463 -4.508 1.00 0.00 H new ATOM 0 HD23 LEU A 19 1.443 -10.274 -5.520 1.00 0.00 H new ATOM 302 N SER A 20 2.997 -7.390 -2.103 1.00 0.00 N ATOM 303 CA SER A 20 4.317 -6.938 -1.678 1.00 0.00 C ATOM 304 C SER A 20 5.121 -8.091 -1.085 1.00 0.00 C ATOM 305 O SER A 20 4.556 -9.070 -0.598 1.00 0.00 O ATOM 306 CB SER A 20 4.187 -5.811 -0.652 1.00 0.00 C ATOM 307 OG SER A 20 2.827 -5.494 -0.412 1.00 0.00 O ATOM 0 H SER A 20 2.424 -7.782 -1.355 1.00 0.00 H new ATOM 0 HA SER A 20 4.845 -6.563 -2.554 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.665 -6.108 0.282 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.712 -4.926 -1.011 1.00 0.00 H new ATOM 0 HG SER A 20 2.672 -4.547 -0.611 1.00 0.00 H new ATOM 313 N GLU A 21 6.444 -7.967 -1.130 1.00 0.00 N ATOM 314 CA GLU A 21 7.326 -8.998 -0.597 1.00 0.00 C ATOM 315 C GLU A 21 7.061 -9.228 0.888 1.00 0.00 C ATOM 316 O GLU A 21 7.379 -10.286 1.430 1.00 0.00 O ATOM 317 CB GLU A 21 8.790 -8.609 -0.811 1.00 0.00 C ATOM 318 CG GLU A 21 9.314 -7.621 0.217 1.00 0.00 C ATOM 319 CD GLU A 21 10.750 -7.211 -0.045 1.00 0.00 C ATOM 320 OE1 GLU A 21 11.395 -7.835 -0.914 1.00 0.00 O ATOM 321 OE2 GLU A 21 11.229 -6.268 0.618 1.00 0.00 O ATOM 0 H GLU A 21 6.928 -7.163 -1.530 1.00 0.00 H new ATOM 0 HA GLU A 21 7.122 -9.926 -1.132 1.00 0.00 H new ATOM 0 HB2 GLU A 21 9.404 -9.509 -0.783 1.00 0.00 H new ATOM 0 HB3 GLU A 21 8.901 -8.178 -1.806 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.681 -6.733 0.217 1.00 0.00 H new ATOM 0 HG3 GLU A 21 9.242 -8.064 1.210 1.00 0.00 H new ATOM 328 N ASP A 22 6.477 -8.228 1.540 1.00 0.00 N ATOM 329 CA ASP A 22 6.168 -8.320 2.962 1.00 0.00 C ATOM 330 C ASP A 22 4.810 -8.979 3.182 1.00 0.00 C ATOM 331 O ASP A 22 4.311 -9.036 4.306 1.00 0.00 O ATOM 332 CB ASP A 22 6.184 -6.930 3.599 1.00 0.00 C ATOM 333 CG ASP A 22 5.142 -6.006 2.999 1.00 0.00 C ATOM 334 OD1 ASP A 22 3.936 -6.280 3.171 1.00 0.00 O ATOM 335 OD2 ASP A 22 5.533 -5.008 2.359 1.00 0.00 O ATOM 0 H ASP A 22 6.208 -7.345 1.106 1.00 0.00 H new ATOM 0 HA ASP A 22 6.931 -8.937 3.436 1.00 0.00 H new ATOM 0 HB2 ASP A 22 6.009 -7.023 4.671 1.00 0.00 H new ATOM 0 HB3 ASP A 22 7.172 -6.488 3.474 1.00 0.00 H new ATOM 340 N ASP A 23 4.217 -9.475 2.101 1.00 0.00 N ATOM 341 CA ASP A 23 2.917 -10.130 2.175 1.00 0.00 C ATOM 342 C ASP A 23 3.064 -11.581 2.622 1.00 0.00 C ATOM 343 O ASP A 23 2.741 -11.928 3.759 1.00 0.00 O ATOM 344 CB ASP A 23 2.213 -10.070 0.819 1.00 0.00 C ATOM 345 CG ASP A 23 0.705 -10.152 0.944 1.00 0.00 C ATOM 346 OD1 ASP A 23 0.220 -10.968 1.758 1.00 0.00 O ATOM 347 OD2 ASP A 23 0.008 -9.401 0.231 1.00 0.00 O ATOM 0 H ASP A 23 4.617 -9.436 1.163 1.00 0.00 H new ATOM 0 HA ASP A 23 2.313 -9.601 2.912 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.483 -9.142 0.314 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.567 -10.889 0.193 1.00 0.00 H new ATOM 352 N THR A 24 3.553 -12.426 1.720 1.00 0.00 N ATOM 353 CA THR A 24 3.741 -13.840 2.020 1.00 0.00 C ATOM 354 C THR A 24 4.229 -14.602 0.793 1.00 0.00 C ATOM 355 O THR A 24 3.938 -14.224 -0.342 1.00 0.00 O ATOM 356 CB THR A 24 2.437 -14.485 2.525 1.00 0.00 C ATOM 357 OG1 THR A 24 1.324 -13.631 2.239 1.00 0.00 O ATOM 358 CG2 THR A 24 2.509 -14.748 4.022 1.00 0.00 C ATOM 0 H THR A 24 3.826 -12.156 0.775 1.00 0.00 H new ATOM 0 HA THR A 24 4.495 -13.899 2.805 1.00 0.00 H new ATOM 0 HB THR A 24 2.305 -15.436 2.010 1.00 0.00 H new ATOM 0 HG1 THR A 24 0.499 -14.049 2.563 1.00 0.00 H new ATOM 0 HG21 THR A 24 1.577 -15.204 4.357 1.00 0.00 H new ATOM 0 HG22 THR A 24 3.339 -15.422 4.233 1.00 0.00 H new ATOM 0 HG23 THR A 24 2.663 -13.807 4.550 1.00 0.00 H new ATOM 366 N VAL A 25 4.974 -15.678 1.028 1.00 0.00 N ATOM 367 CA VAL A 25 5.501 -16.494 -0.059 1.00 0.00 C ATOM 368 C VAL A 25 4.374 -17.107 -0.883 1.00 0.00 C ATOM 369 O VAL A 25 4.338 -16.967 -2.106 1.00 0.00 O ATOM 370 CB VAL A 25 6.404 -17.623 0.475 1.00 0.00 C ATOM 371 CG1 VAL A 25 6.237 -18.881 -0.363 1.00 0.00 C ATOM 372 CG2 VAL A 25 7.858 -17.176 0.497 1.00 0.00 C ATOM 0 H VAL A 25 5.226 -16.004 1.961 1.00 0.00 H new ATOM 0 HA VAL A 25 6.092 -15.833 -0.693 1.00 0.00 H new ATOM 0 HB VAL A 25 6.103 -17.853 1.497 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.882 -19.667 0.029 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.199 -19.210 -0.323 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.510 -18.669 -1.397 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.482 -17.985 0.877 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.174 -16.917 -0.513 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.961 -16.305 1.144 1.00 0.00 H new ATOM 382 N LEU A 26 3.455 -17.785 -0.205 1.00 0.00 N ATOM 383 CA LEU A 26 2.324 -18.419 -0.875 1.00 0.00 C ATOM 384 C LEU A 26 1.493 -17.390 -1.633 1.00 0.00 C ATOM 385 O LEU A 26 0.776 -17.728 -2.575 1.00 0.00 O ATOM 386 CB LEU A 26 1.447 -19.149 0.144 1.00 0.00 C ATOM 387 CG LEU A 26 0.057 -18.558 0.379 1.00 0.00 C ATOM 388 CD1 LEU A 26 -0.918 -19.048 -0.681 1.00 0.00 C ATOM 389 CD2 LEU A 26 -0.444 -18.911 1.771 1.00 0.00 C ATOM 0 H LEU A 26 3.470 -17.910 0.807 1.00 0.00 H new ATOM 0 HA LEU A 26 2.716 -19.141 -1.592 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.330 -20.183 -0.182 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.975 -19.173 1.097 1.00 0.00 H new ATOM 0 HG LEU A 26 0.127 -17.473 0.304 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.902 -18.617 -0.497 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.567 -18.744 -1.667 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.985 -20.135 -0.639 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.435 -18.482 1.921 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.498 -19.995 1.874 1.00 0.00 H new ATOM 0 HD23 LEU A 26 0.242 -18.510 2.517 1.00 0.00 H new ATOM 401 N ASP A 27 1.596 -16.132 -1.217 1.00 0.00 N ATOM 402 CA ASP A 27 0.856 -15.052 -1.859 1.00 0.00 C ATOM 403 C ASP A 27 1.491 -14.676 -3.195 1.00 0.00 C ATOM 404 O ASP A 27 0.803 -14.556 -4.209 1.00 0.00 O ATOM 405 CB ASP A 27 0.802 -13.828 -0.944 1.00 0.00 C ATOM 406 CG ASP A 27 -0.247 -12.824 -1.381 1.00 0.00 C ATOM 407 OD1 ASP A 27 -0.414 -12.634 -2.604 1.00 0.00 O ATOM 408 OD2 ASP A 27 -0.901 -12.227 -0.499 1.00 0.00 O ATOM 0 H ASP A 27 2.185 -15.836 -0.438 1.00 0.00 H new ATOM 0 HA ASP A 27 -0.159 -15.402 -2.046 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.590 -14.149 0.076 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.779 -13.345 -0.930 1.00 0.00 H new ATOM 413 N LEU A 28 2.806 -14.491 -3.187 1.00 0.00 N ATOM 414 CA LEU A 28 3.535 -14.129 -4.397 1.00 0.00 C ATOM 415 C LEU A 28 3.772 -15.351 -5.277 1.00 0.00 C ATOM 416 O LEU A 28 3.483 -15.334 -6.474 1.00 0.00 O ATOM 417 CB LEU A 28 4.873 -13.480 -4.035 1.00 0.00 C ATOM 418 CG LEU A 28 5.434 -12.486 -5.053 1.00 0.00 C ATOM 419 CD1 LEU A 28 6.075 -11.302 -4.347 1.00 0.00 C ATOM 420 CD2 LEU A 28 6.438 -13.171 -5.969 1.00 0.00 C ATOM 0 H LEU A 28 3.390 -14.586 -2.356 1.00 0.00 H new ATOM 0 HA LEU A 28 2.930 -13.414 -4.955 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.758 -12.966 -3.081 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.609 -14.270 -3.885 1.00 0.00 H new ATOM 0 HG LEU A 28 4.610 -12.115 -5.662 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.468 -10.606 -5.088 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.329 -10.796 -3.734 1.00 0.00 H new ATOM 0 HD13 LEU A 28 6.888 -11.654 -3.712 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.827 -12.449 -6.687 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.260 -13.570 -5.374 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.947 -13.985 -6.503 1.00 0.00 H new ATOM 432 N LYS A 29 4.298 -16.414 -4.677 1.00 0.00 N ATOM 433 CA LYS A 29 4.571 -17.648 -5.404 1.00 0.00 C ATOM 434 C LYS A 29 3.345 -18.096 -6.193 1.00 0.00 C ATOM 435 O LYS A 29 3.451 -18.470 -7.361 1.00 0.00 O ATOM 436 CB LYS A 29 4.998 -18.752 -4.434 1.00 0.00 C ATOM 437 CG LYS A 29 6.504 -18.881 -4.285 1.00 0.00 C ATOM 438 CD LYS A 29 7.102 -17.667 -3.593 1.00 0.00 C ATOM 439 CE LYS A 29 7.422 -16.561 -4.587 1.00 0.00 C ATOM 440 NZ LYS A 29 8.717 -15.894 -4.276 1.00 0.00 N ATOM 0 H LYS A 29 4.544 -16.445 -3.688 1.00 0.00 H new ATOM 0 HA LYS A 29 5.383 -17.456 -6.105 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.560 -18.554 -3.456 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.592 -19.703 -4.778 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.738 -19.779 -3.713 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.959 -19.001 -5.268 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.404 -17.294 -2.844 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.011 -17.958 -3.066 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.460 -16.977 -5.594 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.621 -15.822 -4.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.221 -15.685 -5.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.537 -15.007 -3.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.299 -16.523 -3.686 1.00 0.00 H new ATOM 454 N GLN A 30 2.184 -18.054 -5.548 1.00 0.00 N ATOM 455 CA GLN A 30 0.938 -18.456 -6.192 1.00 0.00 C ATOM 456 C GLN A 30 0.701 -17.653 -7.467 1.00 0.00 C ATOM 457 O GLN A 30 0.111 -18.152 -8.426 1.00 0.00 O ATOM 458 CB GLN A 30 -0.239 -18.272 -5.232 1.00 0.00 C ATOM 459 CG GLN A 30 -0.621 -16.818 -5.011 1.00 0.00 C ATOM 460 CD GLN A 30 -2.018 -16.500 -5.507 1.00 0.00 C ATOM 461 OE1 GLN A 30 -2.353 -16.997 -6.692 1.00 0.00 O flip ATOM 462 NE2 GLN A 30 -2.788 -15.815 -4.834 1.00 0.00 N flip ATOM 0 H GLN A 30 2.079 -17.746 -4.581 1.00 0.00 H new ATOM 0 HA GLN A 30 1.019 -19.510 -6.458 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -1.103 -18.811 -5.622 1.00 0.00 H new ATOM 0 HB3 GLN A 30 0.012 -18.723 -4.272 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -0.556 -16.587 -3.948 1.00 0.00 H new ATOM 0 HG3 GLN A 30 0.097 -16.176 -5.522 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -2.490 -15.453 -3.928 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -3.725 -15.609 -5.182 1.00 0.00 H new ATOM 471 N PHE A 31 1.162 -16.407 -7.470 1.00 0.00 N ATOM 472 CA PHE A 31 0.999 -15.534 -8.627 1.00 0.00 C ATOM 473 C PHE A 31 1.884 -15.991 -9.782 1.00 0.00 C ATOM 474 O PHE A 31 1.399 -16.265 -10.881 1.00 0.00 O ATOM 475 CB PHE A 31 1.334 -14.089 -8.253 1.00 0.00 C ATOM 476 CG PHE A 31 0.810 -13.079 -9.234 1.00 0.00 C ATOM 477 CD1 PHE A 31 -0.496 -12.625 -9.149 1.00 0.00 C ATOM 478 CD2 PHE A 31 1.623 -12.585 -10.241 1.00 0.00 C ATOM 479 CE1 PHE A 31 -0.981 -11.696 -10.051 1.00 0.00 C ATOM 480 CE2 PHE A 31 1.144 -11.656 -11.145 1.00 0.00 C ATOM 481 CZ PHE A 31 -0.159 -11.211 -11.050 1.00 0.00 C ATOM 0 H PHE A 31 1.652 -15.979 -6.684 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.042 -15.587 -8.947 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.923 -13.873 -7.267 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.416 -13.983 -8.178 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.142 -13.001 -8.370 1.00 0.00 H new ATOM 0 HD2 PHE A 31 2.643 -12.930 -10.321 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -2.001 -11.350 -9.975 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.789 -11.279 -11.925 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.535 -10.485 -11.755 1.00 0.00 H new ATOM 491 N LEU A 32 3.186 -16.070 -9.527 1.00 0.00 N ATOM 492 CA LEU A 32 4.141 -16.493 -10.545 1.00 0.00 C ATOM 493 C LEU A 32 3.921 -17.954 -10.925 1.00 0.00 C ATOM 494 O LEU A 32 4.238 -18.372 -12.039 1.00 0.00 O ATOM 495 CB LEU A 32 5.572 -16.295 -10.043 1.00 0.00 C ATOM 496 CG LEU A 32 5.890 -16.889 -8.670 1.00 0.00 C ATOM 497 CD1 LEU A 32 6.304 -18.346 -8.801 1.00 0.00 C ATOM 498 CD2 LEU A 32 6.981 -16.083 -7.981 1.00 0.00 C ATOM 0 H LEU A 32 3.604 -15.847 -8.624 1.00 0.00 H new ATOM 0 HA LEU A 32 3.985 -15.879 -11.432 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.255 -16.731 -10.772 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.780 -15.225 -10.011 1.00 0.00 H new ATOM 0 HG LEU A 32 4.989 -16.843 -8.058 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.526 -18.751 -7.814 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.492 -18.916 -9.253 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.191 -18.417 -9.430 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.195 -16.520 -7.005 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.884 -16.098 -8.591 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.647 -15.054 -7.852 1.00 0.00 H new ATOM 510 N LYS A 33 3.373 -18.726 -9.993 1.00 0.00 N ATOM 511 CA LYS A 33 3.106 -20.140 -10.230 1.00 0.00 C ATOM 512 C LYS A 33 2.155 -20.324 -11.408 1.00 0.00 C ATOM 513 O LYS A 33 2.252 -21.302 -12.151 1.00 0.00 O ATOM 514 CB LYS A 33 2.511 -20.785 -8.976 1.00 0.00 C ATOM 515 CG LYS A 33 1.290 -21.644 -9.255 1.00 0.00 C ATOM 516 CD LYS A 33 1.674 -22.971 -9.888 1.00 0.00 C ATOM 517 CE LYS A 33 0.476 -23.648 -10.535 1.00 0.00 C ATOM 518 NZ LYS A 33 0.429 -23.407 -12.004 1.00 0.00 N ATOM 0 H LYS A 33 3.105 -18.396 -9.066 1.00 0.00 H new ATOM 0 HA LYS A 33 4.051 -20.627 -10.469 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.274 -21.398 -8.496 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.240 -20.002 -8.268 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.752 -21.826 -8.325 1.00 0.00 H new ATOM 0 HG3 LYS A 33 0.610 -21.107 -9.917 1.00 0.00 H new ATOM 0 HD2 LYS A 33 2.449 -22.807 -10.637 1.00 0.00 H new ATOM 0 HD3 LYS A 33 2.098 -23.628 -9.129 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.518 -24.720 -10.344 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.441 -23.278 -10.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -0.544 -23.174 -12.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.058 -22.615 -12.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.740 -24.263 -12.506 1.00 0.00 H new ATOM 532 N THR A 34 1.237 -19.377 -11.576 1.00 0.00 N ATOM 533 CA THR A 34 0.270 -19.435 -12.665 1.00 0.00 C ATOM 534 C THR A 34 0.933 -19.140 -14.006 1.00 0.00 C ATOM 535 O THR A 34 0.458 -19.578 -15.054 1.00 0.00 O ATOM 536 CB THR A 34 -0.884 -18.438 -12.445 1.00 0.00 C ATOM 537 OG1 THR A 34 -2.053 -18.881 -13.143 1.00 0.00 O ATOM 538 CG2 THR A 34 -0.496 -17.048 -12.925 1.00 0.00 C ATOM 0 H THR A 34 1.143 -18.561 -10.972 1.00 0.00 H new ATOM 0 HA THR A 34 -0.132 -20.448 -12.677 1.00 0.00 H new ATOM 0 HB THR A 34 -1.096 -18.390 -11.377 1.00 0.00 H new ATOM 0 HG1 THR A 34 -2.783 -18.243 -12.997 1.00 0.00 H new ATOM 0 HG21 THR A 34 -1.326 -16.361 -12.760 1.00 0.00 H new ATOM 0 HG22 THR A 34 0.377 -16.702 -12.371 1.00 0.00 H new ATOM 0 HG23 THR A 34 -0.260 -17.083 -13.989 1.00 0.00 H new ATOM 546 N LEU A 35 2.033 -18.396 -13.965 1.00 0.00 N ATOM 547 CA LEU A 35 2.762 -18.043 -15.178 1.00 0.00 C ATOM 548 C LEU A 35 3.920 -19.007 -15.417 1.00 0.00 C ATOM 549 O LEU A 35 4.411 -19.139 -16.539 1.00 0.00 O ATOM 550 CB LEU A 35 3.288 -16.610 -15.082 1.00 0.00 C ATOM 551 CG LEU A 35 2.242 -15.528 -14.811 1.00 0.00 C ATOM 552 CD1 LEU A 35 2.887 -14.150 -14.812 1.00 0.00 C ATOM 553 CD2 LEU A 35 1.124 -15.597 -15.841 1.00 0.00 C ATOM 0 H LEU A 35 2.439 -18.026 -13.106 1.00 0.00 H new ATOM 0 HA LEU A 35 2.074 -18.115 -16.020 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.036 -16.571 -14.290 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.798 -16.368 -16.014 1.00 0.00 H new ATOM 0 HG LEU A 35 1.812 -15.704 -13.825 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.128 -13.393 -14.618 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.651 -14.105 -14.036 1.00 0.00 H new ATOM 0 HD13 LEU A 35 3.345 -13.963 -15.783 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.389 -14.820 -15.633 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.538 -15.447 -16.838 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.643 -16.574 -15.791 1.00 0.00 H new ATOM 565 N THR A 36 4.352 -19.681 -14.356 1.00 0.00 N ATOM 566 CA THR A 36 5.451 -20.633 -14.450 1.00 0.00 C ATOM 567 C THR A 36 4.936 -22.068 -14.454 1.00 0.00 C ATOM 568 O THR A 36 5.602 -22.975 -14.951 1.00 0.00 O ATOM 569 CB THR A 36 6.445 -20.461 -13.286 1.00 0.00 C ATOM 570 OG1 THR A 36 5.769 -20.631 -12.035 1.00 0.00 O ATOM 571 CG2 THR A 36 7.099 -19.088 -13.332 1.00 0.00 C ATOM 0 H THR A 36 3.957 -19.585 -13.421 1.00 0.00 H new ATOM 0 HA THR A 36 5.965 -20.430 -15.390 1.00 0.00 H new ATOM 0 HB THR A 36 7.221 -21.220 -13.385 1.00 0.00 H new ATOM 0 HG1 THR A 36 5.249 -19.825 -11.832 1.00 0.00 H new ATOM 0 HG21 THR A 36 7.797 -18.989 -12.501 1.00 0.00 H new ATOM 0 HG22 THR A 36 7.637 -18.973 -14.273 1.00 0.00 H new ATOM 0 HG23 THR A 36 6.332 -18.317 -13.256 1.00 0.00 H new ATOM 579 N GLY A 37 3.744 -22.267 -13.898 1.00 0.00 N ATOM 580 CA GLY A 37 3.160 -23.594 -13.849 1.00 0.00 C ATOM 581 C GLY A 37 3.572 -24.364 -12.610 1.00 0.00 C ATOM 582 O GLY A 37 2.840 -25.233 -12.138 1.00 0.00 O ATOM 0 H GLY A 37 3.173 -21.532 -13.481 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.074 -23.511 -13.876 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.459 -24.152 -14.736 1.00 0.00 H new ATOM 586 N VAL A 38 4.749 -24.045 -12.082 1.00 0.00 N ATOM 587 CA VAL A 38 5.258 -24.713 -10.890 1.00 0.00 C ATOM 588 C VAL A 38 4.783 -24.012 -9.622 1.00 0.00 C ATOM 589 O VAL A 38 4.844 -22.787 -9.517 1.00 0.00 O ATOM 590 CB VAL A 38 6.798 -24.764 -10.889 1.00 0.00 C ATOM 591 CG1 VAL A 38 7.297 -25.809 -9.903 1.00 0.00 C ATOM 592 CG2 VAL A 38 7.322 -25.047 -12.289 1.00 0.00 C ATOM 0 H VAL A 38 5.368 -23.328 -12.461 1.00 0.00 H new ATOM 0 HA VAL A 38 4.868 -25.731 -10.907 1.00 0.00 H new ATOM 0 HB VAL A 38 7.176 -23.792 -10.574 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.387 -25.831 -9.916 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.951 -25.558 -8.900 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.911 -26.789 -10.185 1.00 0.00 H new ATOM 0 HG21 VAL A 38 8.411 -25.080 -12.270 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.936 -26.006 -12.635 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.994 -24.258 -12.966 1.00 0.00 H new ATOM 602 N LEU A 39 4.311 -24.798 -8.660 1.00 0.00 N ATOM 603 CA LEU A 39 3.825 -24.253 -7.397 1.00 0.00 C ATOM 604 C LEU A 39 4.874 -24.404 -6.300 1.00 0.00 C ATOM 605 O LEU A 39 5.797 -25.213 -6.397 1.00 0.00 O ATOM 606 CB LEU A 39 2.531 -24.954 -6.981 1.00 0.00 C ATOM 607 CG LEU A 39 2.375 -26.404 -7.441 1.00 0.00 C ATOM 608 CD1 LEU A 39 2.131 -26.465 -8.941 1.00 0.00 C ATOM 609 CD2 LEU A 39 3.605 -27.218 -7.065 1.00 0.00 C ATOM 0 H LEU A 39 4.255 -25.814 -8.731 1.00 0.00 H new ATOM 0 HA LEU A 39 3.626 -23.191 -7.540 1.00 0.00 H new ATOM 0 HB2 LEU A 39 2.462 -24.929 -5.893 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.689 -24.379 -7.367 1.00 0.00 H new ATOM 0 HG LEU A 39 1.511 -26.834 -6.935 1.00 0.00 H new ATOM 0 HD11 LEU A 39 2.023 -27.505 -9.250 1.00 0.00 H new ATOM 0 HD12 LEU A 39 1.220 -25.917 -9.184 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.975 -26.017 -9.465 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.477 -28.247 -7.400 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.486 -26.788 -7.542 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.735 -27.202 -5.983 1.00 0.00 H new ATOM 621 N PRO A 40 4.730 -23.608 -5.230 1.00 0.00 N ATOM 622 CA PRO A 40 5.654 -23.637 -4.092 1.00 0.00 C ATOM 623 C PRO A 40 5.532 -24.920 -3.277 1.00 0.00 C ATOM 624 O PRO A 40 6.452 -25.294 -2.551 1.00 0.00 O ATOM 625 CB PRO A 40 5.224 -22.429 -3.256 1.00 0.00 C ATOM 626 CG PRO A 40 3.792 -22.217 -3.606 1.00 0.00 C ATOM 627 CD PRO A 40 3.653 -22.621 -5.047 1.00 0.00 C ATOM 0 HA PRO A 40 6.695 -23.603 -4.412 1.00 0.00 H new ATOM 0 HB2 PRO A 40 5.347 -22.621 -2.190 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.824 -21.550 -3.493 1.00 0.00 H new ATOM 0 HG2 PRO A 40 3.142 -22.816 -2.968 1.00 0.00 H new ATOM 0 HG3 PRO A 40 3.506 -21.175 -3.464 1.00 0.00 H new ATOM 0 HD2 PRO A 40 2.673 -23.053 -5.250 1.00 0.00 H new ATOM 0 HD3 PRO A 40 3.771 -21.769 -5.716 1.00 0.00 H new ATOM 635 N GLU A 41 4.390 -25.589 -3.404 1.00 0.00 N ATOM 636 CA GLU A 41 4.149 -26.831 -2.678 1.00 0.00 C ATOM 637 C GLU A 41 5.064 -27.942 -3.182 1.00 0.00 C ATOM 638 O GLU A 41 5.273 -28.946 -2.501 1.00 0.00 O ATOM 639 CB GLU A 41 2.686 -27.255 -2.822 1.00 0.00 C ATOM 640 CG GLU A 41 2.313 -27.689 -4.229 1.00 0.00 C ATOM 641 CD GLU A 41 0.956 -28.361 -4.292 1.00 0.00 C ATOM 642 OE1 GLU A 41 0.896 -29.595 -4.104 1.00 0.00 O ATOM 643 OE2 GLU A 41 -0.046 -27.655 -4.530 1.00 0.00 O ATOM 0 H GLU A 41 3.618 -25.292 -4.002 1.00 0.00 H new ATOM 0 HA GLU A 41 4.367 -26.655 -1.625 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.485 -28.075 -2.133 1.00 0.00 H new ATOM 0 HB3 GLU A 41 2.045 -26.425 -2.525 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.314 -26.819 -4.886 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.072 -28.375 -4.607 1.00 0.00 H new ATOM 650 N ARG A 42 5.607 -27.756 -4.381 1.00 0.00 N ATOM 651 CA ARG A 42 6.498 -28.743 -4.978 1.00 0.00 C ATOM 652 C ARG A 42 7.958 -28.339 -4.794 1.00 0.00 C ATOM 653 O ARG A 42 8.806 -29.171 -4.471 1.00 0.00 O ATOM 654 CB ARG A 42 6.188 -28.908 -6.467 1.00 0.00 C ATOM 655 CG ARG A 42 5.113 -29.943 -6.754 1.00 0.00 C ATOM 656 CD ARG A 42 5.648 -31.359 -6.602 1.00 0.00 C ATOM 657 NE ARG A 42 5.510 -31.852 -5.235 1.00 0.00 N ATOM 658 CZ ARG A 42 5.979 -33.026 -4.826 1.00 0.00 C ATOM 659 NH1 ARG A 42 6.615 -33.821 -5.676 1.00 0.00 N ATOM 660 NH2 ARG A 42 5.814 -33.405 -3.566 1.00 0.00 N ATOM 0 H ARG A 42 5.445 -26.931 -4.958 1.00 0.00 H new ATOM 0 HA ARG A 42 6.335 -29.695 -4.472 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.872 -27.947 -6.872 1.00 0.00 H new ATOM 0 HB3 ARG A 42 7.101 -29.190 -6.991 1.00 0.00 H new ATOM 0 HG2 ARG A 42 4.273 -29.795 -6.075 1.00 0.00 H new ATOM 0 HG3 ARG A 42 4.733 -29.803 -7.766 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.115 -32.023 -7.282 1.00 0.00 H new ATOM 0 HD3 ARG A 42 6.699 -31.383 -6.892 1.00 0.00 H new ATOM 0 HE ARG A 42 5.027 -31.263 -4.557 1.00 0.00 H new ATOM 0 HH11 ARG A 42 6.745 -33.532 -6.645 1.00 0.00 H new ATOM 0 HH12 ARG A 42 6.974 -34.722 -5.360 1.00 0.00 H new ATOM 0 HH21 ARG A 42 5.327 -32.795 -2.910 1.00 0.00 H new ATOM 0 HH22 ARG A 42 6.174 -34.306 -3.253 1.00 0.00 H new ATOM 674 N GLN A 43 8.243 -27.058 -5.002 1.00 0.00 N ATOM 675 CA GLN A 43 9.601 -26.545 -4.860 1.00 0.00 C ATOM 676 C GLN A 43 9.598 -25.176 -4.187 1.00 0.00 C ATOM 677 O GLN A 43 8.543 -24.646 -3.839 1.00 0.00 O ATOM 678 CB GLN A 43 10.280 -26.453 -6.227 1.00 0.00 C ATOM 679 CG GLN A 43 9.310 -26.213 -7.373 1.00 0.00 C ATOM 680 CD GLN A 43 9.852 -25.240 -8.402 1.00 0.00 C ATOM 681 OE1 GLN A 43 10.335 -25.644 -9.460 1.00 0.00 O ATOM 682 NE2 GLN A 43 9.774 -23.950 -8.097 1.00 0.00 N ATOM 0 H GLN A 43 7.553 -26.356 -5.269 1.00 0.00 H new ATOM 0 HA GLN A 43 10.160 -27.238 -4.231 1.00 0.00 H new ATOM 0 HB2 GLN A 43 11.012 -25.646 -6.206 1.00 0.00 H new ATOM 0 HB3 GLN A 43 10.829 -27.376 -6.414 1.00 0.00 H new ATOM 0 HG2 GLN A 43 9.086 -27.162 -7.859 1.00 0.00 H new ATOM 0 HG3 GLN A 43 8.371 -25.829 -6.975 1.00 0.00 H new ATOM 0 HE21 GLN A 43 9.366 -23.660 -7.208 1.00 0.00 H new ATOM 0 HE22 GLN A 43 10.122 -23.249 -8.751 1.00 0.00 H new ATOM 691 N LYS A 44 10.786 -24.609 -4.006 1.00 0.00 N ATOM 692 CA LYS A 44 10.921 -23.301 -3.375 1.00 0.00 C ATOM 693 C LYS A 44 11.861 -22.406 -4.177 1.00 0.00 C ATOM 694 O LYS A 44 12.746 -22.891 -4.883 1.00 0.00 O ATOM 695 CB LYS A 44 11.442 -23.454 -1.945 1.00 0.00 C ATOM 696 CG LYS A 44 12.787 -24.154 -1.858 1.00 0.00 C ATOM 697 CD LYS A 44 12.624 -25.651 -1.652 1.00 0.00 C ATOM 698 CE LYS A 44 13.731 -26.432 -2.343 1.00 0.00 C ATOM 699 NZ LYS A 44 14.889 -26.672 -1.437 1.00 0.00 N ATOM 0 H LYS A 44 11.669 -25.035 -4.287 1.00 0.00 H new ATOM 0 HA LYS A 44 9.937 -22.834 -3.348 1.00 0.00 H new ATOM 0 HB2 LYS A 44 11.526 -22.467 -1.491 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.712 -24.014 -1.360 1.00 0.00 H new ATOM 0 HG2 LYS A 44 13.353 -23.971 -2.771 1.00 0.00 H new ATOM 0 HG3 LYS A 44 13.365 -23.733 -1.035 1.00 0.00 H new ATOM 0 HD2 LYS A 44 12.630 -25.875 -0.585 1.00 0.00 H new ATOM 0 HD3 LYS A 44 11.656 -25.969 -2.039 1.00 0.00 H new ATOM 0 HE2 LYS A 44 13.338 -27.387 -2.692 1.00 0.00 H new ATOM 0 HE3 LYS A 44 14.066 -25.885 -3.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 15.622 -27.207 -1.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 15.280 -25.760 -1.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 14.575 -27.216 -0.609 1.00 0.00 H new ATOM 713 N LEU A 45 11.664 -21.097 -4.063 1.00 0.00 N ATOM 714 CA LEU A 45 12.495 -20.133 -4.776 1.00 0.00 C ATOM 715 C LEU A 45 13.748 -19.796 -3.975 1.00 0.00 C ATOM 716 O LEU A 45 13.688 -19.609 -2.758 1.00 0.00 O ATOM 717 CB LEU A 45 11.700 -18.858 -5.062 1.00 0.00 C ATOM 718 CG LEU A 45 11.022 -18.782 -6.430 1.00 0.00 C ATOM 719 CD1 LEU A 45 9.757 -17.942 -6.353 1.00 0.00 C ATOM 720 CD2 LEU A 45 11.979 -18.214 -7.468 1.00 0.00 C ATOM 0 H LEU A 45 10.936 -20.679 -3.484 1.00 0.00 H new ATOM 0 HA LEU A 45 12.801 -20.583 -5.721 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.935 -18.751 -4.293 1.00 0.00 H new ATOM 0 HB3 LEU A 45 12.372 -18.005 -4.964 1.00 0.00 H new ATOM 0 HG LEU A 45 10.745 -19.792 -6.734 1.00 0.00 H new ATOM 0 HD11 LEU A 45 9.288 -17.899 -7.336 1.00 0.00 H new ATOM 0 HD12 LEU A 45 9.065 -18.391 -5.640 1.00 0.00 H new ATOM 0 HD13 LEU A 45 10.010 -16.933 -6.027 1.00 0.00 H new ATOM 0 HD21 LEU A 45 11.480 -18.167 -8.436 1.00 0.00 H new ATOM 0 HD22 LEU A 45 12.287 -17.212 -7.169 1.00 0.00 H new ATOM 0 HD23 LEU A 45 12.857 -18.856 -7.543 1.00 0.00 H new ATOM 732 N LEU A 46 14.881 -19.718 -4.663 1.00 0.00 N ATOM 733 CA LEU A 46 16.149 -19.401 -4.016 1.00 0.00 C ATOM 734 C LEU A 46 15.976 -18.278 -2.999 1.00 0.00 C ATOM 735 O LEU A 46 15.283 -17.294 -3.257 1.00 0.00 O ATOM 736 CB LEU A 46 17.192 -19.002 -5.062 1.00 0.00 C ATOM 737 CG LEU A 46 18.234 -20.065 -5.410 1.00 0.00 C ATOM 738 CD1 LEU A 46 19.151 -19.570 -6.518 1.00 0.00 C ATOM 739 CD2 LEU A 46 19.041 -20.445 -4.178 1.00 0.00 C ATOM 0 H LEU A 46 14.948 -19.870 -5.669 1.00 0.00 H new ATOM 0 HA LEU A 46 16.493 -20.292 -3.490 1.00 0.00 H new ATOM 0 HB2 LEU A 46 16.671 -18.720 -5.977 1.00 0.00 H new ATOM 0 HB3 LEU A 46 17.713 -18.114 -4.705 1.00 0.00 H new ATOM 0 HG LEU A 46 17.713 -20.954 -5.766 1.00 0.00 H new ATOM 0 HD11 LEU A 46 19.886 -20.340 -6.753 1.00 0.00 H new ATOM 0 HD12 LEU A 46 18.561 -19.349 -7.407 1.00 0.00 H new ATOM 0 HD13 LEU A 46 19.664 -18.666 -6.189 1.00 0.00 H new ATOM 0 HD21 LEU A 46 19.778 -21.203 -4.445 1.00 0.00 H new ATOM 0 HD22 LEU A 46 19.551 -19.563 -3.791 1.00 0.00 H new ATOM 0 HD23 LEU A 46 18.373 -20.842 -3.414 1.00 0.00 H new ATOM 751 N GLY A 47 16.612 -18.430 -1.842 1.00 0.00 N ATOM 752 CA GLY A 47 16.517 -17.420 -0.804 1.00 0.00 C ATOM 753 C GLY A 47 17.168 -17.858 0.493 1.00 0.00 C ATOM 754 O GLY A 47 18.359 -17.628 0.708 1.00 0.00 O ATOM 0 H GLY A 47 17.192 -19.235 -1.605 1.00 0.00 H new ATOM 0 HA2 GLY A 47 16.989 -16.501 -1.151 1.00 0.00 H new ATOM 0 HA3 GLY A 47 15.468 -17.190 -0.620 1.00 0.00 H new ATOM 758 N LEU A 48 16.386 -18.490 1.361 1.00 0.00 N ATOM 759 CA LEU A 48 16.893 -18.960 2.646 1.00 0.00 C ATOM 760 C LEU A 48 15.830 -19.763 3.389 1.00 0.00 C ATOM 761 O LEU A 48 14.660 -19.769 3.007 1.00 0.00 O ATOM 762 CB LEU A 48 17.345 -17.776 3.502 1.00 0.00 C ATOM 763 CG LEU A 48 18.571 -18.016 4.384 1.00 0.00 C ATOM 764 CD1 LEU A 48 19.779 -18.375 3.533 1.00 0.00 C ATOM 765 CD2 LEU A 48 18.862 -16.790 5.237 1.00 0.00 C ATOM 0 H LEU A 48 15.399 -18.689 1.199 1.00 0.00 H new ATOM 0 HA LEU A 48 17.747 -19.610 2.456 1.00 0.00 H new ATOM 0 HB2 LEU A 48 17.556 -16.935 2.841 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.514 -17.478 4.142 1.00 0.00 H new ATOM 0 HG LEU A 48 18.359 -18.854 5.048 1.00 0.00 H new ATOM 0 HD11 LEU A 48 20.642 -18.542 4.178 1.00 0.00 H new ATOM 0 HD12 LEU A 48 19.568 -19.282 2.966 1.00 0.00 H new ATOM 0 HD13 LEU A 48 19.994 -17.558 2.844 1.00 0.00 H new ATOM 0 HD21 LEU A 48 19.738 -16.979 5.858 1.00 0.00 H new ATOM 0 HD22 LEU A 48 19.054 -15.934 4.590 1.00 0.00 H new ATOM 0 HD23 LEU A 48 18.004 -16.578 5.874 1.00 0.00 H new ATOM 777 N LYS A 49 16.245 -20.439 4.455 1.00 0.00 N ATOM 778 CA LYS A 49 15.329 -21.243 5.256 1.00 0.00 C ATOM 779 C LYS A 49 15.143 -20.636 6.643 1.00 0.00 C ATOM 780 O LYS A 49 16.107 -20.211 7.280 1.00 0.00 O ATOM 781 CB LYS A 49 15.852 -22.676 5.381 1.00 0.00 C ATOM 782 CG LYS A 49 16.452 -23.218 4.095 1.00 0.00 C ATOM 783 CD LYS A 49 16.472 -24.738 4.086 1.00 0.00 C ATOM 784 CE LYS A 49 17.340 -25.277 2.960 1.00 0.00 C ATOM 785 NZ LYS A 49 18.791 -25.170 3.278 1.00 0.00 N ATOM 0 H LYS A 49 17.210 -20.446 4.784 1.00 0.00 H new ATOM 0 HA LYS A 49 14.362 -21.258 4.752 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.606 -22.712 6.167 1.00 0.00 H new ATOM 0 HB3 LYS A 49 15.035 -23.326 5.693 1.00 0.00 H new ATOM 0 HG2 LYS A 49 15.877 -22.856 3.243 1.00 0.00 H new ATOM 0 HG3 LYS A 49 17.467 -22.839 3.978 1.00 0.00 H new ATOM 0 HD2 LYS A 49 16.846 -25.104 5.042 1.00 0.00 H new ATOM 0 HD3 LYS A 49 15.455 -25.116 3.976 1.00 0.00 H new ATOM 0 HE2 LYS A 49 17.085 -26.320 2.773 1.00 0.00 H new ATOM 0 HE3 LYS A 49 17.128 -24.727 2.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 19.346 -25.624 2.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 19.058 -24.167 3.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 18.984 -25.644 4.183 1.00 0.00 H new ATOM 799 N VAL A 50 13.898 -20.601 7.107 1.00 0.00 N ATOM 800 CA VAL A 50 13.586 -20.049 8.420 1.00 0.00 C ATOM 801 C VAL A 50 13.098 -21.136 9.371 1.00 0.00 C ATOM 802 O VAL A 50 12.271 -21.972 9.005 1.00 0.00 O ATOM 803 CB VAL A 50 12.515 -18.947 8.325 1.00 0.00 C ATOM 804 CG1 VAL A 50 11.206 -19.517 7.802 1.00 0.00 C ATOM 805 CG2 VAL A 50 12.313 -18.283 9.679 1.00 0.00 C ATOM 0 H VAL A 50 13.089 -20.949 6.593 1.00 0.00 H new ATOM 0 HA VAL A 50 14.508 -19.617 8.809 1.00 0.00 H new ATOM 0 HB VAL A 50 12.860 -18.189 7.621 1.00 0.00 H new ATOM 0 HG11 VAL A 50 10.462 -18.723 7.742 1.00 0.00 H new ATOM 0 HG12 VAL A 50 11.364 -19.942 6.811 1.00 0.00 H new ATOM 0 HG13 VAL A 50 10.852 -20.296 8.478 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.553 -17.507 9.594 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.990 -19.029 10.405 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.251 -17.837 10.009 1.00 0.00 H new ATOM 815 N LYS A 51 13.615 -21.119 10.595 1.00 0.00 N ATOM 816 CA LYS A 51 13.232 -22.102 11.602 1.00 0.00 C ATOM 817 C LYS A 51 13.557 -23.516 11.133 1.00 0.00 C ATOM 818 O LYS A 51 12.994 -24.490 11.630 1.00 0.00 O ATOM 819 CB LYS A 51 11.738 -21.987 11.913 1.00 0.00 C ATOM 820 CG LYS A 51 11.272 -20.561 12.147 1.00 0.00 C ATOM 821 CD LYS A 51 10.244 -20.485 13.263 1.00 0.00 C ATOM 822 CE LYS A 51 8.837 -20.308 12.713 1.00 0.00 C ATOM 823 NZ LYS A 51 7.813 -20.314 13.795 1.00 0.00 N ATOM 0 H LYS A 51 14.301 -20.435 10.914 1.00 0.00 H new ATOM 0 HA LYS A 51 13.803 -21.899 12.508 1.00 0.00 H new ATOM 0 HB2 LYS A 51 11.170 -22.415 11.087 1.00 0.00 H new ATOM 0 HB3 LYS A 51 11.513 -22.583 12.797 1.00 0.00 H new ATOM 0 HG2 LYS A 51 12.128 -19.934 12.397 1.00 0.00 H new ATOM 0 HG3 LYS A 51 10.842 -20.162 11.228 1.00 0.00 H new ATOM 0 HD2 LYS A 51 10.289 -21.393 13.864 1.00 0.00 H new ATOM 0 HD3 LYS A 51 10.485 -19.653 13.925 1.00 0.00 H new ATOM 0 HE2 LYS A 51 8.778 -19.369 12.162 1.00 0.00 H new ATOM 0 HE3 LYS A 51 8.621 -21.107 12.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 6.868 -20.191 13.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 7.852 -21.220 14.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 8.004 -19.536 14.458 1.00 0.00 H new ATOM 837 N GLY A 52 14.472 -23.621 10.174 1.00 0.00 N ATOM 838 CA GLY A 52 14.858 -24.921 9.656 1.00 0.00 C ATOM 839 C GLY A 52 13.970 -25.377 8.515 1.00 0.00 C ATOM 840 O GLY A 52 14.228 -26.406 7.891 1.00 0.00 O ATOM 0 H GLY A 52 14.953 -22.829 9.747 1.00 0.00 H new ATOM 0 HA2 GLY A 52 15.892 -24.880 9.314 1.00 0.00 H new ATOM 0 HA3 GLY A 52 14.817 -25.656 10.460 1.00 0.00 H new ATOM 844 N LYS A 53 12.920 -24.610 8.242 1.00 0.00 N ATOM 845 CA LYS A 53 11.989 -24.940 7.169 1.00 0.00 C ATOM 846 C LYS A 53 12.333 -24.173 5.896 1.00 0.00 C ATOM 847 O LYS A 53 12.775 -23.025 5.935 1.00 0.00 O ATOM 848 CB LYS A 53 10.554 -24.625 7.596 1.00 0.00 C ATOM 849 CG LYS A 53 9.987 -25.613 8.600 1.00 0.00 C ATOM 850 CD LYS A 53 8.958 -26.531 7.961 1.00 0.00 C ATOM 851 CE LYS A 53 8.223 -27.357 9.004 1.00 0.00 C ATOM 852 NZ LYS A 53 9.084 -28.435 9.566 1.00 0.00 N ATOM 0 H LYS A 53 12.692 -23.755 8.749 1.00 0.00 H new ATOM 0 HA LYS A 53 12.074 -26.007 6.963 1.00 0.00 H new ATOM 0 HB2 LYS A 53 10.524 -23.624 8.027 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.916 -24.611 6.712 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.796 -26.210 9.021 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.528 -25.070 9.426 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.241 -25.937 7.395 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.452 -27.195 7.252 1.00 0.00 H new ATOM 0 HE2 LYS A 53 7.884 -26.706 9.810 1.00 0.00 H new ATOM 0 HE3 LYS A 53 7.333 -27.799 8.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 8.546 -28.975 10.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 9.387 -29.071 8.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.921 -28.012 10.016 1.00 0.00 H new ATOM 866 N PRO A 54 12.124 -24.820 4.740 1.00 0.00 N ATOM 867 CA PRO A 54 12.403 -24.216 3.433 1.00 0.00 C ATOM 868 C PRO A 54 11.429 -23.093 3.094 1.00 0.00 C ATOM 869 O PRO A 54 10.656 -23.196 2.142 1.00 0.00 O ATOM 870 CB PRO A 54 12.233 -25.385 2.459 1.00 0.00 C ATOM 871 CG PRO A 54 11.303 -26.322 3.150 1.00 0.00 C ATOM 872 CD PRO A 54 11.599 -26.191 4.619 1.00 0.00 C ATOM 0 HA PRO A 54 13.390 -23.755 3.399 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.822 -25.050 1.507 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.189 -25.863 2.244 1.00 0.00 H new ATOM 0 HG2 PRO A 54 10.264 -26.069 2.937 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.457 -27.346 2.811 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.703 -26.333 5.224 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.328 -26.931 4.950 1.00 0.00 H new ATOM 880 N ALA A 55 11.472 -22.022 3.879 1.00 0.00 N ATOM 881 CA ALA A 55 10.595 -20.878 3.660 1.00 0.00 C ATOM 882 C ALA A 55 9.148 -21.324 3.474 1.00 0.00 C ATOM 883 O ALA A 55 8.680 -21.490 2.348 1.00 0.00 O ATOM 884 CB ALA A 55 11.062 -20.079 2.452 1.00 0.00 C ATOM 0 H ALA A 55 12.105 -21.922 4.673 1.00 0.00 H new ATOM 0 HA ALA A 55 10.641 -20.241 4.543 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.398 -19.228 2.300 1.00 0.00 H new ATOM 0 HB2 ALA A 55 12.077 -19.721 2.623 1.00 0.00 H new ATOM 0 HB3 ALA A 55 11.045 -20.715 1.567 1.00 0.00 H new ATOM 890 N GLU A 56 8.446 -21.516 4.586 1.00 0.00 N ATOM 891 CA GLU A 56 7.052 -21.944 4.545 1.00 0.00 C ATOM 892 C GLU A 56 6.233 -21.041 3.628 1.00 0.00 C ATOM 893 O GLU A 56 6.712 -20.004 3.171 1.00 0.00 O ATOM 894 CB GLU A 56 6.452 -21.940 5.952 1.00 0.00 C ATOM 895 CG GLU A 56 5.472 -23.075 6.199 1.00 0.00 C ATOM 896 CD GLU A 56 6.073 -24.437 5.913 1.00 0.00 C ATOM 897 OE1 GLU A 56 7.316 -24.536 5.845 1.00 0.00 O ATOM 898 OE2 GLU A 56 5.300 -25.405 5.758 1.00 0.00 O ATOM 0 H GLU A 56 8.819 -21.382 5.526 1.00 0.00 H new ATOM 0 HA GLU A 56 7.022 -22.959 4.149 1.00 0.00 H new ATOM 0 HB2 GLU A 56 7.259 -22.003 6.682 1.00 0.00 H new ATOM 0 HB3 GLU A 56 5.944 -20.990 6.119 1.00 0.00 H new ATOM 0 HG2 GLU A 56 5.136 -23.041 7.235 1.00 0.00 H new ATOM 0 HG3 GLU A 56 4.591 -22.932 5.573 1.00 0.00 H new ATOM 905 N ASN A 57 4.994 -21.443 3.363 1.00 0.00 N ATOM 906 CA ASN A 57 4.108 -20.671 2.500 1.00 0.00 C ATOM 907 C ASN A 57 3.701 -19.362 3.169 1.00 0.00 C ATOM 908 O ASN A 57 3.488 -18.351 2.500 1.00 0.00 O ATOM 909 CB ASN A 57 2.862 -21.488 2.152 1.00 0.00 C ATOM 910 CG ASN A 57 3.151 -22.974 2.061 1.00 0.00 C ATOM 911 OD1 ASN A 57 4.159 -23.387 1.488 1.00 0.00 O ATOM 912 ND2 ASN A 57 2.265 -23.785 2.628 1.00 0.00 N ATOM 0 H ASN A 57 4.581 -22.299 3.734 1.00 0.00 H new ATOM 0 HA ASN A 57 4.649 -20.437 1.583 1.00 0.00 H new ATOM 0 HB2 ASN A 57 2.095 -21.315 2.907 1.00 0.00 H new ATOM 0 HB3 ASN A 57 2.457 -21.141 1.202 1.00 0.00 H new ATOM 0 HD21 ASN A 57 2.406 -24.795 2.599 1.00 0.00 H new ATOM 0 HD22 ASN A 57 1.443 -23.398 3.092 1.00 0.00 H new ATOM 919 N ASP A 58 3.596 -19.389 4.493 1.00 0.00 N ATOM 920 CA ASP A 58 3.217 -18.204 5.254 1.00 0.00 C ATOM 921 C ASP A 58 4.413 -17.278 5.450 1.00 0.00 C ATOM 922 O ASP A 58 4.267 -16.150 5.923 1.00 0.00 O ATOM 923 CB ASP A 58 2.640 -18.607 6.612 1.00 0.00 C ATOM 924 CG ASP A 58 2.094 -17.422 7.384 1.00 0.00 C ATOM 925 OD1 ASP A 58 1.023 -16.907 7.002 1.00 0.00 O ATOM 926 OD2 ASP A 58 2.738 -17.010 8.371 1.00 0.00 O ATOM 0 H ASP A 58 3.768 -20.218 5.062 1.00 0.00 H new ATOM 0 HA ASP A 58 2.455 -17.668 4.689 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.845 -19.338 6.463 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.415 -19.095 7.202 1.00 0.00 H new ATOM 931 N VAL A 59 5.596 -17.761 5.084 1.00 0.00 N ATOM 932 CA VAL A 59 6.817 -16.977 5.219 1.00 0.00 C ATOM 933 C VAL A 59 6.859 -15.844 4.199 1.00 0.00 C ATOM 934 O VAL A 59 6.630 -16.057 3.008 1.00 0.00 O ATOM 935 CB VAL A 59 8.070 -17.856 5.046 1.00 0.00 C ATOM 936 CG1 VAL A 59 9.325 -16.997 5.020 1.00 0.00 C ATOM 937 CG2 VAL A 59 8.149 -18.895 6.153 1.00 0.00 C ATOM 0 H VAL A 59 5.734 -18.692 4.691 1.00 0.00 H new ATOM 0 HA VAL A 59 6.813 -16.556 6.224 1.00 0.00 H new ATOM 0 HB VAL A 59 7.996 -18.379 4.093 1.00 0.00 H new ATOM 0 HG11 VAL A 59 10.200 -17.635 4.897 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.268 -16.295 4.188 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.407 -16.445 5.956 1.00 0.00 H new ATOM 0 HG21 VAL A 59 9.040 -19.507 6.015 1.00 0.00 H new ATOM 0 HG22 VAL A 59 8.199 -18.394 7.120 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.264 -19.530 6.120 1.00 0.00 H new ATOM 947 N LYS A 60 7.153 -14.639 4.674 1.00 0.00 N ATOM 948 CA LYS A 60 7.227 -13.471 3.804 1.00 0.00 C ATOM 949 C LYS A 60 8.392 -13.592 2.828 1.00 0.00 C ATOM 950 O LYS A 60 9.348 -14.329 3.074 1.00 0.00 O ATOM 951 CB LYS A 60 7.378 -12.197 4.639 1.00 0.00 C ATOM 952 CG LYS A 60 6.669 -12.261 5.981 1.00 0.00 C ATOM 953 CD LYS A 60 6.040 -10.926 6.344 1.00 0.00 C ATOM 954 CE LYS A 60 4.540 -11.056 6.556 1.00 0.00 C ATOM 955 NZ LYS A 60 4.210 -11.467 7.948 1.00 0.00 N ATOM 0 H LYS A 60 7.344 -14.445 5.657 1.00 0.00 H new ATOM 0 HA LYS A 60 6.301 -13.416 3.232 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.438 -12.006 4.806 1.00 0.00 H new ATOM 0 HB3 LYS A 60 6.988 -11.352 4.071 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.898 -13.031 5.950 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.379 -12.552 6.755 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.504 -10.538 7.251 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.235 -10.203 5.552 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.058 -10.104 6.335 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.136 -11.788 5.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.178 -11.544 8.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.648 -12.388 8.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.573 -10.756 8.615 1.00 0.00 H new ATOM 969 N LEU A 61 8.308 -12.865 1.719 1.00 0.00 N ATOM 970 CA LEU A 61 9.357 -12.890 0.706 1.00 0.00 C ATOM 971 C LEU A 61 10.624 -12.212 1.217 1.00 0.00 C ATOM 972 O LEU A 61 11.653 -12.859 1.407 1.00 0.00 O ATOM 973 CB LEU A 61 8.875 -12.200 -0.572 1.00 0.00 C ATOM 974 CG LEU A 61 7.750 -12.904 -1.331 1.00 0.00 C ATOM 975 CD1 LEU A 61 8.043 -14.390 -1.463 1.00 0.00 C ATOM 976 CD2 LEU A 61 6.415 -12.681 -0.633 1.00 0.00 C ATOM 0 H LEU A 61 7.524 -12.251 1.499 1.00 0.00 H new ATOM 0 HA LEU A 61 9.589 -13.932 0.484 1.00 0.00 H new ATOM 0 HB2 LEU A 61 8.539 -11.196 -0.314 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.726 -12.089 -1.244 1.00 0.00 H new ATOM 0 HG LEU A 61 7.690 -12.477 -2.332 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.231 -14.874 -2.006 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.977 -14.530 -2.007 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.131 -14.833 -0.471 1.00 0.00 H new ATOM 0 HD21 LEU A 61 5.626 -13.189 -1.187 1.00 0.00 H new ATOM 0 HD22 LEU A 61 6.463 -13.081 0.380 1.00 0.00 H new ATOM 0 HD23 LEU A 61 6.200 -11.613 -0.592 1.00 0.00 H new ATOM 988 N GLY A 62 10.541 -10.903 1.439 1.00 0.00 N ATOM 989 CA GLY A 62 11.687 -10.159 1.927 1.00 0.00 C ATOM 990 C GLY A 62 12.260 -10.748 3.201 1.00 0.00 C ATOM 991 O GLY A 62 13.362 -10.391 3.617 1.00 0.00 O ATOM 0 H GLY A 62 9.700 -10.345 1.289 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.460 -10.142 1.158 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.395 -9.125 2.108 1.00 0.00 H new ATOM 995 N ALA A 63 11.511 -11.653 3.822 1.00 0.00 N ATOM 996 CA ALA A 63 11.951 -12.293 5.056 1.00 0.00 C ATOM 997 C ALA A 63 13.263 -13.041 4.848 1.00 0.00 C ATOM 998 O ALA A 63 14.272 -12.736 5.486 1.00 0.00 O ATOM 999 CB ALA A 63 10.877 -13.239 5.572 1.00 0.00 C ATOM 0 H ALA A 63 10.596 -11.960 3.491 1.00 0.00 H new ATOM 0 HA ALA A 63 12.121 -11.515 5.800 1.00 0.00 H new ATOM 0 HB1 ALA A 63 11.219 -13.710 6.494 1.00 0.00 H new ATOM 0 HB2 ALA A 63 9.963 -12.679 5.768 1.00 0.00 H new ATOM 0 HB3 ALA A 63 10.679 -14.007 4.824 1.00 0.00 H new ATOM 1005 N LEU A 64 13.243 -14.023 3.953 1.00 0.00 N ATOM 1006 CA LEU A 64 14.432 -14.816 3.661 1.00 0.00 C ATOM 1007 C LEU A 64 14.755 -14.786 2.171 1.00 0.00 C ATOM 1008 O LEU A 64 15.921 -14.799 1.776 1.00 0.00 O ATOM 1009 CB LEU A 64 14.230 -16.261 4.121 1.00 0.00 C ATOM 1010 CG LEU A 64 12.781 -16.711 4.306 1.00 0.00 C ATOM 1011 CD1 LEU A 64 12.075 -16.803 2.962 1.00 0.00 C ATOM 1012 CD2 LEU A 64 12.725 -18.047 5.033 1.00 0.00 C ATOM 0 H LEU A 64 12.417 -14.289 3.417 1.00 0.00 H new ATOM 0 HA LEU A 64 15.271 -14.381 4.204 1.00 0.00 H new ATOM 0 HB2 LEU A 64 14.705 -16.922 3.395 1.00 0.00 H new ATOM 0 HB3 LEU A 64 14.755 -16.397 5.067 1.00 0.00 H new ATOM 0 HG LEU A 64 12.265 -15.968 4.914 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.045 -17.125 3.114 1.00 0.00 H new ATOM 0 HD12 LEU A 64 12.083 -15.826 2.479 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.591 -17.525 2.329 1.00 0.00 H new ATOM 0 HD21 LEU A 64 11.686 -18.351 5.156 1.00 0.00 H new ATOM 0 HD22 LEU A 64 13.257 -18.800 4.452 1.00 0.00 H new ATOM 0 HD23 LEU A 64 13.192 -17.948 6.013 1.00 0.00 H new ATOM 1024 N LYS A 65 13.714 -14.742 1.346 1.00 0.00 N ATOM 1025 CA LYS A 65 13.885 -14.706 -0.102 1.00 0.00 C ATOM 1026 C LYS A 65 14.910 -13.649 -0.502 1.00 0.00 C ATOM 1027 O LYS A 65 16.091 -13.950 -0.678 1.00 0.00 O ATOM 1028 CB LYS A 65 12.547 -14.420 -0.787 1.00 0.00 C ATOM 1029 CG LYS A 65 11.473 -15.448 -0.477 1.00 0.00 C ATOM 1030 CD LYS A 65 11.762 -16.778 -1.153 1.00 0.00 C ATOM 1031 CE LYS A 65 11.991 -17.883 -0.134 1.00 0.00 C ATOM 1032 NZ LYS A 65 11.805 -19.235 -0.730 1.00 0.00 N ATOM 0 H LYS A 65 12.742 -14.730 1.656 1.00 0.00 H new ATOM 0 HA LYS A 65 14.250 -15.681 -0.425 1.00 0.00 H new ATOM 0 HB2 LYS A 65 12.195 -13.435 -0.480 1.00 0.00 H new ATOM 0 HB3 LYS A 65 12.701 -14.382 -1.865 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.408 -15.594 0.601 1.00 0.00 H new ATOM 0 HG3 LYS A 65 10.504 -15.074 -0.807 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.928 -17.047 -1.801 1.00 0.00 H new ATOM 0 HD3 LYS A 65 12.642 -16.680 -1.789 1.00 0.00 H new ATOM 0 HE2 LYS A 65 13.000 -17.800 0.271 1.00 0.00 H new ATOM 0 HE3 LYS A 65 11.301 -17.756 0.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 12.132 -19.959 -0.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.798 -19.387 -0.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 12.356 -19.305 -1.609 1.00 0.00 H new ATOM 1046 N LEU A 66 14.451 -12.410 -0.642 1.00 0.00 N ATOM 1047 CA LEU A 66 15.328 -11.308 -1.020 1.00 0.00 C ATOM 1048 C LEU A 66 14.531 -10.024 -1.228 1.00 0.00 C ATOM 1049 O LEU A 66 13.337 -9.967 -0.932 1.00 0.00 O ATOM 1050 CB LEU A 66 16.097 -11.656 -2.297 1.00 0.00 C ATOM 1051 CG LEU A 66 15.316 -12.428 -3.361 1.00 0.00 C ATOM 1052 CD1 LEU A 66 14.174 -11.582 -3.903 1.00 0.00 C ATOM 1053 CD2 LEU A 66 16.240 -12.865 -4.488 1.00 0.00 C ATOM 0 H LEU A 66 13.477 -12.144 -0.499 1.00 0.00 H new ATOM 0 HA LEU A 66 16.037 -11.147 -0.208 1.00 0.00 H new ATOM 0 HB2 LEU A 66 16.460 -10.730 -2.742 1.00 0.00 H new ATOM 0 HB3 LEU A 66 16.973 -12.242 -2.021 1.00 0.00 H new ATOM 0 HG LEU A 66 14.893 -13.320 -2.899 1.00 0.00 H new ATOM 0 HD11 LEU A 66 13.629 -12.148 -4.659 1.00 0.00 H new ATOM 0 HD12 LEU A 66 13.498 -11.319 -3.089 1.00 0.00 H new ATOM 0 HD13 LEU A 66 14.575 -10.672 -4.350 1.00 0.00 H new ATOM 0 HD21 LEU A 66 15.667 -13.413 -5.236 1.00 0.00 H new ATOM 0 HD22 LEU A 66 16.692 -11.987 -4.949 1.00 0.00 H new ATOM 0 HD23 LEU A 66 17.023 -13.509 -4.087 1.00 0.00 H new ATOM 1065 N LYS A 67 15.198 -8.995 -1.739 1.00 0.00 N ATOM 1066 CA LYS A 67 14.553 -7.712 -1.990 1.00 0.00 C ATOM 1067 C LYS A 67 13.461 -7.850 -3.047 1.00 0.00 C ATOM 1068 O LYS A 67 13.371 -8.854 -3.754 1.00 0.00 O ATOM 1069 CB LYS A 67 15.586 -6.678 -2.441 1.00 0.00 C ATOM 1070 CG LYS A 67 15.991 -5.706 -1.346 1.00 0.00 C ATOM 1071 CD LYS A 67 17.078 -6.288 -0.459 1.00 0.00 C ATOM 1072 CE LYS A 67 17.568 -5.273 0.562 1.00 0.00 C ATOM 1073 NZ LYS A 67 18.219 -5.929 1.730 1.00 0.00 N ATOM 0 H LYS A 67 16.187 -9.025 -1.988 1.00 0.00 H new ATOM 0 HA LYS A 67 14.094 -7.376 -1.060 1.00 0.00 H new ATOM 0 HB2 LYS A 67 16.474 -7.197 -2.801 1.00 0.00 H new ATOM 0 HB3 LYS A 67 15.182 -6.116 -3.283 1.00 0.00 H new ATOM 0 HG2 LYS A 67 16.344 -4.778 -1.795 1.00 0.00 H new ATOM 0 HG3 LYS A 67 15.120 -5.456 -0.740 1.00 0.00 H new ATOM 0 HD2 LYS A 67 16.695 -7.169 0.057 1.00 0.00 H new ATOM 0 HD3 LYS A 67 17.914 -6.618 -1.076 1.00 0.00 H new ATOM 0 HE2 LYS A 67 18.275 -4.593 0.087 1.00 0.00 H new ATOM 0 HE3 LYS A 67 16.728 -4.670 0.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 18.539 -5.203 2.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 17.537 -6.559 2.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 19.036 -6.484 1.405 1.00 0.00 H new ATOM 1087 N PRO A 68 12.612 -6.818 -3.160 1.00 0.00 N ATOM 1088 CA PRO A 68 11.513 -6.800 -4.129 1.00 0.00 C ATOM 1089 C PRO A 68 12.009 -6.675 -5.566 1.00 0.00 C ATOM 1090 O PRO A 68 11.790 -7.564 -6.387 1.00 0.00 O ATOM 1091 CB PRO A 68 10.709 -5.559 -3.732 1.00 0.00 C ATOM 1092 CG PRO A 68 11.693 -4.673 -3.049 1.00 0.00 C ATOM 1093 CD PRO A 68 12.659 -5.589 -2.350 1.00 0.00 C ATOM 0 HA PRO A 68 10.935 -7.724 -4.106 1.00 0.00 H new ATOM 0 HB2 PRO A 68 10.277 -5.071 -4.606 1.00 0.00 H new ATOM 0 HB3 PRO A 68 9.883 -5.818 -3.070 1.00 0.00 H new ATOM 0 HG2 PRO A 68 12.209 -4.036 -3.767 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.196 -4.013 -2.338 1.00 0.00 H new ATOM 0 HD2 PRO A 68 13.663 -5.166 -2.320 1.00 0.00 H new ATOM 0 HD3 PRO A 68 12.360 -5.776 -1.318 1.00 0.00 H new ATOM 1101 N ASN A 69 12.679 -5.566 -5.861 1.00 0.00 N ATOM 1102 CA ASN A 69 13.206 -5.325 -7.200 1.00 0.00 C ATOM 1103 C ASN A 69 14.139 -6.454 -7.628 1.00 0.00 C ATOM 1104 O ASN A 69 14.366 -6.670 -8.819 1.00 0.00 O ATOM 1105 CB ASN A 69 13.950 -3.989 -7.245 1.00 0.00 C ATOM 1106 CG ASN A 69 14.940 -3.840 -6.106 1.00 0.00 C ATOM 1107 OD1 ASN A 69 15.863 -4.642 -5.961 1.00 0.00 O ATOM 1108 ND2 ASN A 69 14.752 -2.810 -5.289 1.00 0.00 N ATOM 0 H ASN A 69 12.870 -4.820 -5.192 1.00 0.00 H new ATOM 0 HA ASN A 69 12.366 -5.289 -7.893 1.00 0.00 H new ATOM 0 HB2 ASN A 69 14.477 -3.902 -8.195 1.00 0.00 H new ATOM 0 HB3 ASN A 69 13.229 -3.173 -7.205 1.00 0.00 H new ATOM 0 HD21 ASN A 69 15.386 -2.659 -4.504 1.00 0.00 H new ATOM 0 HD22 ASN A 69 13.974 -2.170 -5.446 1.00 0.00 H new ATOM 1115 N THR A 70 14.678 -7.173 -6.648 1.00 0.00 N ATOM 1116 CA THR A 70 15.586 -8.280 -6.922 1.00 0.00 C ATOM 1117 C THR A 70 14.842 -9.465 -7.527 1.00 0.00 C ATOM 1118 O THR A 70 13.681 -9.714 -7.202 1.00 0.00 O ATOM 1119 CB THR A 70 16.311 -8.741 -5.644 1.00 0.00 C ATOM 1120 OG1 THR A 70 17.092 -7.667 -5.108 1.00 0.00 O ATOM 1121 CG2 THR A 70 17.211 -9.933 -5.933 1.00 0.00 C ATOM 0 H THR A 70 14.501 -7.008 -5.657 1.00 0.00 H new ATOM 0 HA THR A 70 16.323 -7.915 -7.637 1.00 0.00 H new ATOM 0 HB THR A 70 15.559 -9.041 -4.915 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.779 -8.029 -4.510 1.00 0.00 H new ATOM 0 HG21 THR A 70 17.713 -10.241 -5.016 1.00 0.00 H new ATOM 0 HG22 THR A 70 16.610 -10.759 -6.313 1.00 0.00 H new ATOM 0 HG23 THR A 70 17.956 -9.654 -6.678 1.00 0.00 H new ATOM 1129 N LYS A 71 15.518 -10.195 -8.407 1.00 0.00 N ATOM 1130 CA LYS A 71 14.923 -11.357 -9.057 1.00 0.00 C ATOM 1131 C LYS A 71 15.323 -12.644 -8.343 1.00 0.00 C ATOM 1132 O LYS A 71 16.432 -12.754 -7.818 1.00 0.00 O ATOM 1133 CB LYS A 71 15.350 -11.420 -10.525 1.00 0.00 C ATOM 1134 CG LYS A 71 16.855 -11.492 -10.718 1.00 0.00 C ATOM 1135 CD LYS A 71 17.455 -10.113 -10.937 1.00 0.00 C ATOM 1136 CE LYS A 71 17.537 -9.770 -12.417 1.00 0.00 C ATOM 1137 NZ LYS A 71 18.797 -10.271 -13.033 1.00 0.00 N ATOM 0 H LYS A 71 16.480 -10.002 -8.687 1.00 0.00 H new ATOM 0 HA LYS A 71 13.839 -11.256 -9.005 1.00 0.00 H new ATOM 0 HB2 LYS A 71 14.890 -12.291 -10.991 1.00 0.00 H new ATOM 0 HB3 LYS A 71 14.967 -10.541 -11.044 1.00 0.00 H new ATOM 0 HG2 LYS A 71 17.313 -11.955 -9.844 1.00 0.00 H new ATOM 0 HG3 LYS A 71 17.083 -12.129 -11.572 1.00 0.00 H new ATOM 0 HD2 LYS A 71 16.851 -9.366 -10.422 1.00 0.00 H new ATOM 0 HD3 LYS A 71 18.452 -10.075 -10.498 1.00 0.00 H new ATOM 0 HE2 LYS A 71 16.682 -10.201 -12.938 1.00 0.00 H new ATOM 0 HE3 LYS A 71 17.476 -8.689 -12.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 18.815 -10.017 -14.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 19.613 -9.841 -12.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 18.844 -11.305 -12.935 1.00 0.00 H new ATOM 1151 N ILE A 72 14.416 -13.615 -8.330 1.00 0.00 N ATOM 1152 CA ILE A 72 14.677 -14.895 -7.684 1.00 0.00 C ATOM 1153 C ILE A 72 14.658 -16.036 -8.695 1.00 0.00 C ATOM 1154 O ILE A 72 14.051 -15.924 -9.760 1.00 0.00 O ATOM 1155 CB ILE A 72 13.646 -15.187 -6.578 1.00 0.00 C ATOM 1156 CG1 ILE A 72 12.641 -14.039 -6.471 1.00 0.00 C ATOM 1157 CG2 ILE A 72 14.347 -15.410 -5.246 1.00 0.00 C ATOM 1158 CD1 ILE A 72 11.637 -14.216 -5.353 1.00 0.00 C ATOM 0 H ILE A 72 13.494 -13.539 -8.760 1.00 0.00 H new ATOM 0 HA ILE A 72 15.669 -14.826 -7.237 1.00 0.00 H new ATOM 0 HB ILE A 72 13.104 -16.096 -6.838 1.00 0.00 H new ATOM 0 HG12 ILE A 72 13.183 -13.106 -6.317 1.00 0.00 H new ATOM 0 HG13 ILE A 72 12.107 -13.945 -7.417 1.00 0.00 H new ATOM 0 HG21 ILE A 72 13.605 -15.615 -4.474 1.00 0.00 H new ATOM 0 HG22 ILE A 72 15.027 -16.258 -5.330 1.00 0.00 H new ATOM 0 HG23 ILE A 72 14.912 -14.517 -4.978 1.00 0.00 H new ATOM 0 HD11 ILE A 72 10.956 -13.365 -5.337 1.00 0.00 H new ATOM 0 HD12 ILE A 72 11.069 -15.132 -5.516 1.00 0.00 H new ATOM 0 HD13 ILE A 72 12.162 -14.279 -4.400 1.00 0.00 H new ATOM 1170 N MET A 73 15.326 -17.133 -8.354 1.00 0.00 N ATOM 1171 CA MET A 73 15.383 -18.296 -9.232 1.00 0.00 C ATOM 1172 C MET A 73 14.519 -19.430 -8.689 1.00 0.00 C ATOM 1173 O MET A 73 14.434 -19.632 -7.478 1.00 0.00 O ATOM 1174 CB MET A 73 16.829 -18.772 -9.389 1.00 0.00 C ATOM 1175 CG MET A 73 17.577 -18.080 -10.517 1.00 0.00 C ATOM 1176 SD MET A 73 19.252 -18.712 -10.730 1.00 0.00 S ATOM 1177 CE MET A 73 19.082 -19.611 -12.270 1.00 0.00 C ATOM 0 H MET A 73 15.835 -17.241 -7.477 1.00 0.00 H new ATOM 0 HA MET A 73 14.996 -18.003 -10.208 1.00 0.00 H new ATOM 0 HB2 MET A 73 17.362 -18.603 -8.453 1.00 0.00 H new ATOM 0 HB3 MET A 73 16.832 -19.847 -9.568 1.00 0.00 H new ATOM 0 HG2 MET A 73 17.023 -18.208 -11.447 1.00 0.00 H new ATOM 0 HG3 MET A 73 17.620 -17.009 -10.316 1.00 0.00 H new ATOM 0 HE1 MET A 73 20.038 -20.061 -12.536 1.00 0.00 H new ATOM 0 HE2 MET A 73 18.333 -20.394 -12.153 1.00 0.00 H new ATOM 0 HE3 MET A 73 18.771 -18.926 -13.059 1.00 0.00 H new ATOM 1187 N MET A 74 13.879 -20.165 -9.592 1.00 0.00 N ATOM 1188 CA MET A 74 13.022 -21.279 -9.203 1.00 0.00 C ATOM 1189 C MET A 74 13.739 -22.611 -9.398 1.00 0.00 C ATOM 1190 O MET A 74 14.236 -22.905 -10.485 1.00 0.00 O ATOM 1191 CB MET A 74 11.725 -21.260 -10.014 1.00 0.00 C ATOM 1192 CG MET A 74 10.546 -20.666 -9.262 1.00 0.00 C ATOM 1193 SD MET A 74 8.962 -21.063 -10.028 1.00 0.00 S ATOM 1194 CE MET A 74 7.952 -21.365 -8.580 1.00 0.00 C ATOM 0 H MET A 74 13.937 -20.009 -10.598 1.00 0.00 H new ATOM 0 HA MET A 74 12.782 -21.168 -8.146 1.00 0.00 H new ATOM 0 HB2 MET A 74 11.887 -20.689 -10.929 1.00 0.00 H new ATOM 0 HB3 MET A 74 11.478 -22.279 -10.313 1.00 0.00 H new ATOM 0 HG2 MET A 74 10.552 -21.034 -8.236 1.00 0.00 H new ATOM 0 HG3 MET A 74 10.660 -19.583 -9.212 1.00 0.00 H new ATOM 0 HE1 MET A 74 7.746 -22.432 -8.496 1.00 0.00 H new ATOM 0 HE2 MET A 74 8.482 -21.027 -7.690 1.00 0.00 H new ATOM 0 HE3 MET A 74 7.013 -20.820 -8.672 1.00 0.00 H new ATOM 1204 N MET A 75 13.789 -23.412 -8.339 1.00 0.00 N ATOM 1205 CA MET A 75 14.445 -24.713 -8.396 1.00 0.00 C ATOM 1206 C MET A 75 13.459 -25.833 -8.079 1.00 0.00 C ATOM 1207 O MET A 75 12.988 -25.957 -6.949 1.00 0.00 O ATOM 1208 CB MET A 75 15.619 -24.759 -7.416 1.00 0.00 C ATOM 1209 CG MET A 75 16.616 -23.629 -7.610 1.00 0.00 C ATOM 1210 SD MET A 75 18.320 -24.213 -7.702 1.00 0.00 S ATOM 1211 CE MET A 75 18.776 -24.202 -5.970 1.00 0.00 C ATOM 0 H MET A 75 13.383 -23.183 -7.432 1.00 0.00 H new ATOM 0 HA MET A 75 14.820 -24.859 -9.409 1.00 0.00 H new ATOM 0 HB2 MET A 75 15.233 -24.721 -6.397 1.00 0.00 H new ATOM 0 HB3 MET A 75 16.136 -25.712 -7.526 1.00 0.00 H new ATOM 0 HG2 MET A 75 16.372 -23.087 -8.524 1.00 0.00 H new ATOM 0 HG3 MET A 75 16.523 -22.922 -6.786 1.00 0.00 H new ATOM 0 HE1 MET A 75 19.807 -24.540 -5.863 1.00 0.00 H new ATOM 0 HE2 MET A 75 18.683 -23.190 -5.576 1.00 0.00 H new ATOM 0 HE3 MET A 75 18.116 -24.869 -5.416 1.00 0.00 H new ATOM 1221 N GLY A 76 13.150 -26.647 -9.084 1.00 0.00 N ATOM 1222 CA GLY A 76 12.222 -27.745 -8.891 1.00 0.00 C ATOM 1223 C GLY A 76 11.587 -28.202 -10.190 1.00 0.00 C ATOM 1224 O GLY A 76 12.178 -28.065 -11.261 1.00 0.00 O ATOM 0 H GLY A 76 13.526 -26.565 -10.029 1.00 0.00 H new ATOM 0 HA2 GLY A 76 12.746 -28.583 -8.432 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.440 -27.438 -8.196 1.00 0.00 H new ATOM 1228 N THR A 77 10.379 -28.749 -10.096 1.00 0.00 N ATOM 1229 CA THR A 77 9.664 -29.230 -11.271 1.00 0.00 C ATOM 1230 C THR A 77 8.215 -28.756 -11.266 1.00 0.00 C ATOM 1231 O THR A 77 7.594 -28.640 -10.210 1.00 0.00 O ATOM 1232 CB THR A 77 9.689 -30.768 -11.353 1.00 0.00 C ATOM 1233 OG1 THR A 77 8.621 -31.232 -12.186 1.00 0.00 O ATOM 1234 CG2 THR A 77 9.563 -31.386 -9.968 1.00 0.00 C ATOM 0 H THR A 77 9.875 -28.870 -9.217 1.00 0.00 H new ATOM 0 HA THR A 77 10.175 -28.819 -12.142 1.00 0.00 H new ATOM 0 HB THR A 77 10.643 -31.071 -11.784 1.00 0.00 H new ATOM 0 HG1 THR A 77 8.645 -32.211 -12.234 1.00 0.00 H new ATOM 0 HG21 THR A 77 9.583 -32.473 -10.051 1.00 0.00 H new ATOM 0 HG22 THR A 77 10.393 -31.054 -9.345 1.00 0.00 H new ATOM 0 HG23 THR A 77 8.622 -31.074 -9.515 1.00 0.00 H new ATOM 1242 N ARG A 78 7.682 -28.484 -12.453 1.00 0.00 N ATOM 1243 CA ARG A 78 6.306 -28.022 -12.585 1.00 0.00 C ATOM 1244 C ARG A 78 5.323 -29.151 -12.288 1.00 0.00 C ATOM 1245 O ARG A 78 5.683 -30.327 -12.328 1.00 0.00 O ATOM 1246 CB ARG A 78 6.061 -27.476 -13.993 1.00 0.00 C ATOM 1247 CG ARG A 78 6.320 -28.492 -15.094 1.00 0.00 C ATOM 1248 CD ARG A 78 5.169 -29.477 -15.224 1.00 0.00 C ATOM 1249 NE ARG A 78 4.945 -29.877 -16.611 1.00 0.00 N ATOM 1250 CZ ARG A 78 4.431 -29.072 -17.534 1.00 0.00 C ATOM 1251 NH1 ARG A 78 4.090 -27.830 -17.220 1.00 0.00 N ATOM 1252 NH2 ARG A 78 4.258 -29.509 -18.775 1.00 0.00 N ATOM 0 H ARG A 78 8.183 -28.576 -13.337 1.00 0.00 H new ATOM 0 HA ARG A 78 6.146 -27.224 -11.860 1.00 0.00 H new ATOM 0 HB2 ARG A 78 5.030 -27.130 -14.065 1.00 0.00 H new ATOM 0 HB3 ARG A 78 6.701 -26.608 -14.153 1.00 0.00 H new ATOM 0 HG2 ARG A 78 6.466 -27.974 -16.042 1.00 0.00 H new ATOM 0 HG3 ARG A 78 7.242 -29.034 -14.882 1.00 0.00 H new ATOM 0 HD2 ARG A 78 5.378 -30.361 -14.621 1.00 0.00 H new ATOM 0 HD3 ARG A 78 4.260 -29.027 -14.825 1.00 0.00 H new ATOM 0 HE ARG A 78 5.197 -30.826 -16.886 1.00 0.00 H new ATOM 0 HH11 ARG A 78 4.222 -27.490 -16.267 1.00 0.00 H new ATOM 0 HH12 ARG A 78 3.696 -27.214 -17.931 1.00 0.00 H new ATOM 0 HH21 ARG A 78 4.520 -30.464 -19.021 1.00 0.00 H new ATOM 0 HH22 ARG A 78 3.863 -28.890 -19.483 1.00 0.00 H new ATOM 1266 N GLU A 79 4.080 -28.783 -11.990 1.00 0.00 N ATOM 1267 CA GLU A 79 3.046 -29.765 -11.684 1.00 0.00 C ATOM 1268 C GLU A 79 1.659 -29.207 -11.987 1.00 0.00 C ATOM 1269 O GLU A 79 1.448 -27.995 -11.961 1.00 0.00 O ATOM 1270 CB GLU A 79 3.129 -30.186 -10.216 1.00 0.00 C ATOM 1271 CG GLU A 79 4.175 -31.255 -9.947 1.00 0.00 C ATOM 1272 CD GLU A 79 3.999 -32.478 -10.827 1.00 0.00 C ATOM 1273 OE1 GLU A 79 2.857 -32.970 -10.938 1.00 0.00 O ATOM 1274 OE2 GLU A 79 5.004 -32.941 -11.405 1.00 0.00 O ATOM 0 H GLU A 79 3.765 -27.813 -11.954 1.00 0.00 H new ATOM 0 HA GLU A 79 3.213 -30.638 -12.314 1.00 0.00 H new ATOM 0 HB2 GLU A 79 3.353 -29.310 -9.608 1.00 0.00 H new ATOM 0 HB3 GLU A 79 2.154 -30.555 -9.897 1.00 0.00 H new ATOM 0 HG2 GLU A 79 5.168 -30.835 -10.109 1.00 0.00 H new ATOM 0 HG3 GLU A 79 4.122 -31.554 -8.900 1.00 0.00 H new ATOM 1281 N GLU A 80 0.718 -30.100 -12.276 1.00 0.00 N ATOM 1282 CA GLU A 80 -0.649 -29.696 -12.585 1.00 0.00 C ATOM 1283 C GLU A 80 -1.610 -30.143 -11.488 1.00 0.00 C ATOM 1284 O GLU A 80 -1.732 -31.335 -11.203 1.00 0.00 O ATOM 1285 CB GLU A 80 -1.085 -30.281 -13.931 1.00 0.00 C ATOM 1286 CG GLU A 80 -2.353 -29.652 -14.485 1.00 0.00 C ATOM 1287 CD GLU A 80 -3.611 -30.288 -13.926 1.00 0.00 C ATOM 1288 OE1 GLU A 80 -3.816 -31.498 -14.156 1.00 0.00 O ATOM 1289 OE2 GLU A 80 -4.390 -29.576 -13.260 1.00 0.00 O ATOM 0 H GLU A 80 0.877 -31.107 -12.303 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.675 -28.608 -12.644 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.279 -30.150 -14.653 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -1.241 -31.354 -13.818 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.356 -28.586 -14.255 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -2.355 -29.744 -15.571 1.00 0.00 H new ATOM 1296 N SER A 81 -2.290 -29.179 -10.876 1.00 0.00 N ATOM 1297 CA SER A 81 -3.238 -29.473 -9.807 1.00 0.00 C ATOM 1298 C SER A 81 -4.500 -30.124 -10.364 1.00 0.00 C ATOM 1299 O SER A 81 -5.472 -30.334 -9.640 1.00 0.00 O ATOM 1300 CB SER A 81 -3.601 -28.192 -9.053 1.00 0.00 C ATOM 1301 OG SER A 81 -2.471 -27.653 -8.390 1.00 0.00 O ATOM 0 H SER A 81 -2.202 -28.188 -11.102 1.00 0.00 H new ATOM 0 HA SER A 81 -2.765 -30.171 -9.117 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.002 -27.457 -9.751 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.386 -28.404 -8.327 1.00 0.00 H new ATOM 0 HG SER A 81 -2.729 -26.834 -7.917 1.00 0.00 H new TER 1307 SER A 81