USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 913 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 108 THR OG1 : rot 52:sc= -0.627! USER MOD Set 1.2: A 110 ASN :FLIP amide:sc= -11! C(o=-14!,f=-12!) USER MOD Set 2.1: A 94 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.118) USER MOD Set 2.2: A 103 THR OG1 : rot -150:sc= -2.16! USER MOD Set 3.1: A 40 HIS :FLIP no HD1:sc= -1.24! F(o=-1.1,f=-0.44!) USER MOD Set 3.2: A 74 SER OG : rot 129:sc= 0.798 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 150:sc= 0.157! (180deg=-1.73!) USER MOD Single : A 2 CYS SG : rot -12:sc= -0.889! USER MOD Single : A 4 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00205) USER MOD Single : A 7 MET CE :methyl 158:sc= -0.276 (180deg=-1.62!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= -1.14 X(o=-1.1,f=-0.68) USER MOD Single : A 19 LYS NZ :NH3+ 141:sc= 0.466 (180deg=-1.45) USER MOD Single : A 21 TYR OH : rot 54:sc= 0.516 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN :FLIP amide:sc= -0.955 F(o=-3.5!,f=-0.96) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0.0205 USER MOD Single : A 37 LYS NZ :NH3+ 162:sc= -0.201 (180deg=-0.656) USER MOD Single : A 41 TYR OH : rot 159:sc= 0.138 USER MOD Single : A 45 CYS SG : rot 3:sc= -2.34! USER MOD Single : A 47 GLN :FLIP amide:sc= -3.5 F(o=-5.1!,f=-3.5) USER MOD Single : A 57 LYS NZ :NH3+ -129:sc= -2.15! (180deg=-2.47!) USER MOD Single : A 62 ASN :FLIP amide:sc= -0.391! C(o=-13!,f=-0.39!) USER MOD Single : A 66 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.00538) USER MOD Single : A 67 HIS : no HD1:sc= -2.11! C(o=-2.1!,f=-4!) USER MOD Single : A 68 HIS : no HE2:sc= -0.829 K(o=-0.83,f=-1.4) USER MOD Single : A 70 THR OG1 : rot 108:sc= -4.7! USER MOD Single : A 77 TYR OH : rot -140:sc= -0.387 USER MOD Single : A 80 HIS : no HD1:sc= -0.506 K(o=-0.51,f=-3.8!) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 CYS SG : rot 120:sc= -4.89! USER MOD Single : A 85 LYS NZ :NH3+ 152:sc= -0.101 (180deg=-0.639) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -115:sc= 0.701 (180deg=-0.944) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ -164:sc= 0.538 (180deg=0.0837!) USER MOD Single : A 111 GLN : amide:sc= -0.0718 K(o=-0.072,f=-0.72) USER MOD Single : A 114 LYS NZ :NH3+ -126:sc= -2.27 (180deg=-4.21!) USER MOD Single : A 118 GLN : amide:sc= -4.74! C(o=-4.7!,f=-4.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.708 -13.347 83.794 1.00 0.00 N ATOM 2 CA MET A 1 -11.248 -13.150 83.572 1.00 0.00 C ATOM 3 C MET A 1 -10.928 -11.652 83.543 1.00 0.00 C ATOM 4 O MET A 1 -11.597 -10.877 82.890 1.00 0.00 O ATOM 5 CB MET A 1 -10.843 -13.785 82.237 1.00 0.00 C ATOM 6 CG MET A 1 -11.894 -13.462 81.170 1.00 0.00 C ATOM 7 SD MET A 1 -13.334 -14.535 81.393 1.00 0.00 S ATOM 8 CE MET A 1 -12.819 -15.853 80.265 1.00 0.00 C ATOM 0 H1 MET A 1 -13.013 -14.228 83.333 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.899 -13.406 84.815 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.232 -12.545 83.389 1.00 0.00 H new ATOM 0 HA MET A 1 -10.693 -13.622 84.383 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.868 -13.410 81.926 1.00 0.00 H new ATOM 0 HB3 MET A 1 -10.747 -14.865 82.351 1.00 0.00 H new ATOM 0 HG2 MET A 1 -12.192 -12.416 81.244 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.472 -13.604 80.175 1.00 0.00 H new ATOM 0 HE1 MET A 1 -13.578 -16.635 80.249 1.00 0.00 H new ATOM 0 HE2 MET A 1 -12.696 -15.446 79.261 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.872 -16.273 80.604 1.00 0.00 H new ATOM 20 N CYS A 2 -9.904 -11.240 84.245 1.00 0.00 N ATOM 21 CA CYS A 2 -9.533 -9.795 84.257 1.00 0.00 C ATOM 22 C CYS A 2 -8.041 -9.655 84.578 1.00 0.00 C ATOM 23 O CYS A 2 -7.484 -10.415 85.347 1.00 0.00 O ATOM 24 CB CYS A 2 -10.352 -9.059 85.321 1.00 0.00 C ATOM 25 SG CYS A 2 -12.115 -9.341 85.030 1.00 0.00 S ATOM 0 H CYS A 2 -9.308 -11.844 84.811 1.00 0.00 H new ATOM 0 HA CYS A 2 -9.740 -9.362 83.278 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -10.076 -9.411 86.315 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -10.134 -7.992 85.289 1.00 0.00 H new ATOM 0 HG CYS A 2 -12.281 -9.882 83.859 1.00 0.00 H new ATOM 31 N ASP A 3 -7.390 -8.686 83.994 1.00 0.00 N ATOM 32 CA ASP A 3 -5.937 -8.495 84.264 1.00 0.00 C ATOM 33 C ASP A 3 -5.726 -8.230 85.752 1.00 0.00 C ATOM 34 O ASP A 3 -4.702 -8.558 86.315 1.00 0.00 O ATOM 35 CB ASP A 3 -5.421 -7.297 83.465 1.00 0.00 C ATOM 36 CG ASP A 3 -5.817 -7.449 81.995 1.00 0.00 C ATOM 37 OD1 ASP A 3 -5.235 -8.288 81.327 1.00 0.00 O ATOM 38 OD2 ASP A 3 -6.696 -6.722 81.560 1.00 0.00 O ATOM 0 H ASP A 3 -7.802 -8.019 83.342 1.00 0.00 H new ATOM 0 HA ASP A 3 -5.395 -9.394 83.969 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -5.834 -6.373 83.869 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -4.337 -7.228 83.554 1.00 0.00 H new ATOM 43 N LYS A 4 -6.686 -7.628 86.384 1.00 0.00 N ATOM 44 CA LYS A 4 -6.556 -7.316 87.834 1.00 0.00 C ATOM 45 C LYS A 4 -6.126 -8.565 88.613 1.00 0.00 C ATOM 46 O LYS A 4 -5.084 -8.582 89.232 1.00 0.00 O ATOM 47 CB LYS A 4 -7.900 -6.810 88.357 1.00 0.00 C ATOM 48 CG LYS A 4 -8.219 -5.461 87.706 1.00 0.00 C ATOM 49 CD LYS A 4 -9.414 -4.818 88.412 1.00 0.00 C ATOM 50 CE LYS A 4 -9.590 -3.381 87.915 1.00 0.00 C ATOM 51 NZ LYS A 4 -10.164 -3.394 86.540 1.00 0.00 N ATOM 0 H LYS A 4 -7.565 -7.334 85.957 1.00 0.00 H new ATOM 0 HA LYS A 4 -5.795 -6.548 87.971 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.686 -7.531 88.132 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -7.865 -6.705 89.441 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.352 -4.803 87.766 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.441 -5.600 86.648 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -10.318 -5.395 88.217 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.259 -4.824 89.491 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -10.247 -2.830 88.589 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -8.630 -2.866 87.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.299 -2.417 86.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -9.514 -3.890 85.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -11.081 -3.885 86.551 1.00 0.00 H new ATOM 65 N GLU A 5 -6.915 -9.605 88.604 1.00 0.00 N ATOM 66 CA GLU A 5 -6.524 -10.830 89.365 1.00 0.00 C ATOM 67 C GLU A 5 -5.142 -11.316 88.912 1.00 0.00 C ATOM 68 O GLU A 5 -4.259 -11.527 89.717 1.00 0.00 O ATOM 69 CB GLU A 5 -7.561 -11.941 89.152 1.00 0.00 C ATOM 70 CG GLU A 5 -8.015 -11.975 87.691 1.00 0.00 C ATOM 71 CD GLU A 5 -9.094 -13.046 87.523 1.00 0.00 C ATOM 72 OE1 GLU A 5 -10.226 -12.782 87.895 1.00 0.00 O ATOM 73 OE2 GLU A 5 -8.770 -14.114 87.028 1.00 0.00 O ATOM 0 H GLU A 5 -7.805 -9.662 88.109 1.00 0.00 H new ATOM 0 HA GLU A 5 -6.483 -10.582 90.426 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -7.133 -12.904 89.429 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -8.420 -11.775 89.802 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -8.404 -11.001 87.396 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -7.168 -12.190 87.040 1.00 0.00 H new ATOM 80 N PHE A 6 -4.941 -11.501 87.635 1.00 0.00 N ATOM 81 CA PHE A 6 -3.608 -11.978 87.158 1.00 0.00 C ATOM 82 C PHE A 6 -2.533 -10.958 87.548 1.00 0.00 C ATOM 83 O PHE A 6 -1.504 -11.298 88.098 1.00 0.00 O ATOM 84 CB PHE A 6 -3.635 -12.134 85.635 1.00 0.00 C ATOM 85 CG PHE A 6 -2.255 -12.501 85.140 1.00 0.00 C ATOM 86 CD1 PHE A 6 -1.765 -13.798 85.333 1.00 0.00 C ATOM 87 CD2 PHE A 6 -1.466 -11.543 84.493 1.00 0.00 C ATOM 88 CE1 PHE A 6 -0.486 -14.138 84.875 1.00 0.00 C ATOM 89 CE2 PHE A 6 -0.187 -11.883 84.035 1.00 0.00 C ATOM 90 CZ PHE A 6 0.304 -13.180 84.228 1.00 0.00 C ATOM 0 H PHE A 6 -5.636 -11.344 86.905 1.00 0.00 H new ATOM 0 HA PHE A 6 -3.381 -12.940 87.617 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -4.352 -12.905 85.351 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -3.964 -11.205 85.170 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -2.373 -14.536 85.835 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -1.843 -10.542 84.347 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -0.109 -15.139 85.021 1.00 0.00 H new ATOM 0 HE2 PHE A 6 0.421 -11.145 83.533 1.00 0.00 H new ATOM 0 HZ PHE A 6 1.292 -13.441 83.878 1.00 0.00 H new ATOM 100 N MET A 7 -2.771 -9.712 87.260 1.00 0.00 N ATOM 101 CA MET A 7 -1.783 -8.644 87.596 1.00 0.00 C ATOM 102 C MET A 7 -1.666 -8.484 89.119 1.00 0.00 C ATOM 103 O MET A 7 -0.594 -8.552 89.687 1.00 0.00 O ATOM 104 CB MET A 7 -2.279 -7.330 86.988 1.00 0.00 C ATOM 105 CG MET A 7 -1.303 -6.196 87.307 1.00 0.00 C ATOM 106 SD MET A 7 -1.557 -4.840 86.132 1.00 0.00 S ATOM 107 CE MET A 7 -3.368 -4.799 86.196 1.00 0.00 C ATOM 0 H MET A 7 -3.619 -9.380 86.800 1.00 0.00 H new ATOM 0 HA MET A 7 -0.804 -8.910 87.198 1.00 0.00 H new ATOM 0 HB2 MET A 7 -2.382 -7.437 85.908 1.00 0.00 H new ATOM 0 HB3 MET A 7 -3.267 -7.090 87.381 1.00 0.00 H new ATOM 0 HG2 MET A 7 -1.458 -5.843 88.327 1.00 0.00 H new ATOM 0 HG3 MET A 7 -0.276 -6.557 87.247 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.722 -3.821 85.870 1.00 0.00 H new ATOM 0 HE2 MET A 7 -3.773 -5.569 85.539 1.00 0.00 H new ATOM 0 HE3 MET A 7 -3.700 -4.983 87.218 1.00 0.00 H new ATOM 117 N TRP A 8 -2.768 -8.253 89.775 1.00 0.00 N ATOM 118 CA TRP A 8 -2.754 -8.064 91.255 1.00 0.00 C ATOM 119 C TRP A 8 -2.035 -9.226 91.947 1.00 0.00 C ATOM 120 O TRP A 8 -1.846 -9.220 93.150 1.00 0.00 O ATOM 121 CB TRP A 8 -4.197 -7.987 91.752 1.00 0.00 C ATOM 122 CG TRP A 8 -4.212 -7.590 93.191 1.00 0.00 C ATOM 123 CD1 TRP A 8 -4.524 -8.413 94.217 1.00 0.00 C ATOM 124 CD2 TRP A 8 -3.912 -6.292 93.782 1.00 0.00 C ATOM 125 NE1 TRP A 8 -4.440 -7.703 95.400 1.00 0.00 N ATOM 126 CE2 TRP A 8 -4.069 -6.391 95.184 1.00 0.00 C ATOM 127 CE3 TRP A 8 -3.535 -5.049 93.243 1.00 0.00 C ATOM 128 CZ2 TRP A 8 -3.843 -5.301 96.025 1.00 0.00 C ATOM 129 CZ3 TRP A 8 -3.308 -3.948 94.087 1.00 0.00 C ATOM 130 CH2 TRP A 8 -3.468 -4.073 95.474 1.00 0.00 C ATOM 0 H TRP A 8 -3.690 -8.186 89.345 1.00 0.00 H new ATOM 0 HA TRP A 8 -2.220 -7.144 91.492 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -4.758 -7.264 91.159 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -4.687 -8.952 91.626 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -4.795 -9.455 94.127 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -4.629 -8.100 96.320 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -3.419 -4.940 92.175 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -3.957 -5.406 97.094 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -3.009 -3.000 93.664 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -3.302 -3.221 96.116 1.00 0.00 H new ATOM 141 N ALA A 9 -1.627 -10.222 91.210 1.00 0.00 N ATOM 142 CA ALA A 9 -0.918 -11.369 91.843 1.00 0.00 C ATOM 143 C ALA A 9 0.576 -11.054 91.921 1.00 0.00 C ATOM 144 O ALA A 9 1.202 -11.192 92.952 1.00 0.00 O ATOM 145 CB ALA A 9 -1.131 -12.634 91.014 1.00 0.00 C ATOM 0 H ALA A 9 -1.753 -10.291 90.200 1.00 0.00 H new ATOM 0 HA ALA A 9 -1.314 -11.531 92.846 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.610 -13.468 91.483 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.196 -12.857 90.958 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -0.739 -12.480 90.009 1.00 0.00 H new ATOM 151 N LEU A 10 1.140 -10.610 90.835 1.00 0.00 N ATOM 152 CA LEU A 10 2.580 -10.249 90.818 1.00 0.00 C ATOM 153 C LEU A 10 2.814 -9.201 91.909 1.00 0.00 C ATOM 154 O LEU A 10 3.931 -8.833 92.223 1.00 0.00 O ATOM 155 CB LEU A 10 2.924 -9.654 89.446 1.00 0.00 C ATOM 156 CG LEU A 10 2.626 -10.681 88.339 1.00 0.00 C ATOM 157 CD1 LEU A 10 1.267 -10.383 87.692 1.00 0.00 C ATOM 158 CD2 LEU A 10 3.711 -10.605 87.262 1.00 0.00 C ATOM 0 H LEU A 10 0.656 -10.481 89.946 1.00 0.00 H new ATOM 0 HA LEU A 10 3.205 -11.124 90.997 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.344 -8.747 89.278 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.976 -9.370 89.417 1.00 0.00 H new ATOM 0 HG LEU A 10 2.608 -11.676 88.783 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.067 -11.116 86.911 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.484 -10.437 88.449 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.283 -9.384 87.257 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.498 -11.333 86.479 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.727 -9.604 86.832 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.682 -10.824 87.707 1.00 0.00 H new ATOM 170 N LYS A 11 1.736 -8.713 92.465 1.00 0.00 N ATOM 171 CA LYS A 11 1.799 -7.663 93.526 1.00 0.00 C ATOM 172 C LYS A 11 1.858 -8.282 94.929 1.00 0.00 C ATOM 173 O LYS A 11 2.888 -8.315 95.575 1.00 0.00 O ATOM 174 CB LYS A 11 0.525 -6.822 93.420 1.00 0.00 C ATOM 175 CG LYS A 11 0.434 -5.840 94.599 1.00 0.00 C ATOM 176 CD LYS A 11 0.212 -4.434 94.052 1.00 0.00 C ATOM 177 CE LYS A 11 1.522 -3.924 93.450 1.00 0.00 C ATOM 178 NZ LYS A 11 1.224 -2.918 92.392 1.00 0.00 N ATOM 0 H LYS A 11 0.790 -9.006 92.221 1.00 0.00 H new ATOM 0 HA LYS A 11 2.698 -7.064 93.381 1.00 0.00 H new ATOM 0 HB2 LYS A 11 0.521 -6.272 92.479 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.349 -7.473 93.412 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -0.385 -6.121 95.262 1.00 0.00 H new ATOM 0 HG3 LYS A 11 1.349 -5.875 95.190 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -0.572 -4.444 93.295 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -0.121 -3.768 94.848 1.00 0.00 H new ATOM 0 HE2 LYS A 11 2.142 -3.477 94.227 1.00 0.00 H new ATOM 0 HE3 LYS A 11 2.088 -4.754 93.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 2.115 -2.571 91.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.648 -3.359 91.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 0.701 -2.121 92.808 1.00 0.00 H new ATOM 192 N ASN A 12 0.733 -8.724 95.408 1.00 0.00 N ATOM 193 CA ASN A 12 0.652 -9.296 96.786 1.00 0.00 C ATOM 194 C ASN A 12 1.290 -10.682 96.837 1.00 0.00 C ATOM 195 O ASN A 12 1.052 -11.454 97.746 1.00 0.00 O ATOM 196 CB ASN A 12 -0.820 -9.409 97.170 1.00 0.00 C ATOM 197 CG ASN A 12 -0.943 -9.841 98.630 1.00 0.00 C ATOM 198 OD1 ASN A 12 -1.739 -10.701 98.956 1.00 0.00 O ATOM 199 ND2 ASN A 12 -0.185 -9.280 99.531 1.00 0.00 N ATOM 0 H ASN A 12 -0.150 -8.715 94.898 1.00 0.00 H new ATOM 0 HA ASN A 12 1.187 -8.645 97.478 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -1.318 -8.451 97.022 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -1.319 -10.131 96.524 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -0.260 -9.563 100.508 1.00 0.00 H new ATOM 0 HD22 ASN A 12 0.483 -8.559 99.258 1.00 0.00 H new ATOM 206 N GLY A 13 2.125 -10.992 95.894 1.00 0.00 N ATOM 207 CA GLY A 13 2.809 -12.307 95.911 1.00 0.00 C ATOM 208 C GLY A 13 1.821 -13.460 95.754 1.00 0.00 C ATOM 209 O GLY A 13 2.118 -14.579 96.125 1.00 0.00 O ATOM 0 H GLY A 13 2.365 -10.388 95.108 1.00 0.00 H new ATOM 0 HA2 GLY A 13 3.544 -12.345 95.107 1.00 0.00 H new ATOM 0 HA3 GLY A 13 3.355 -12.421 96.847 1.00 0.00 H new ATOM 213 N ASP A 14 0.666 -13.233 95.191 1.00 0.00 N ATOM 214 CA ASP A 14 -0.266 -14.372 95.003 1.00 0.00 C ATOM 215 C ASP A 14 0.354 -15.271 93.949 1.00 0.00 C ATOM 216 O ASP A 14 -0.224 -15.576 92.926 1.00 0.00 O ATOM 217 CB ASP A 14 -1.633 -13.890 94.545 1.00 0.00 C ATOM 218 CG ASP A 14 -2.024 -12.632 95.321 1.00 0.00 C ATOM 219 OD1 ASP A 14 -1.680 -12.552 96.489 1.00 0.00 O ATOM 220 OD2 ASP A 14 -2.665 -11.773 94.738 1.00 0.00 O ATOM 0 H ASP A 14 0.335 -12.327 94.860 1.00 0.00 H new ATOM 0 HA ASP A 14 -0.415 -14.904 95.942 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.615 -13.678 93.476 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -2.376 -14.672 94.703 1.00 0.00 H new ATOM 225 N LEU A 15 1.558 -15.656 94.215 1.00 0.00 N ATOM 226 CA LEU A 15 2.337 -16.511 93.297 1.00 0.00 C ATOM 227 C LEU A 15 1.484 -17.695 92.829 1.00 0.00 C ATOM 228 O LEU A 15 1.664 -18.222 91.750 1.00 0.00 O ATOM 229 CB LEU A 15 3.574 -16.980 94.082 1.00 0.00 C ATOM 230 CG LEU A 15 4.510 -17.833 93.224 1.00 0.00 C ATOM 231 CD1 LEU A 15 3.957 -19.257 93.100 1.00 0.00 C ATOM 232 CD2 LEU A 15 4.672 -17.211 91.832 1.00 0.00 C ATOM 0 H LEU A 15 2.055 -15.402 95.068 1.00 0.00 H new ATOM 0 HA LEU A 15 2.641 -15.970 92.401 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.116 -16.112 94.456 1.00 0.00 H new ATOM 0 HB3 LEU A 15 3.255 -17.555 94.951 1.00 0.00 H new ATOM 0 HG LEU A 15 5.487 -17.872 93.706 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.630 -19.857 92.487 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.874 -19.703 94.091 1.00 0.00 H new ATOM 0 HD13 LEU A 15 2.973 -19.226 92.633 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.341 -17.829 91.233 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.699 -17.152 91.345 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.092 -16.210 91.928 1.00 0.00 H new ATOM 244 N ASP A 16 0.552 -18.113 93.629 1.00 0.00 N ATOM 245 CA ASP A 16 -0.320 -19.247 93.239 1.00 0.00 C ATOM 246 C ASP A 16 -1.240 -18.827 92.086 1.00 0.00 C ATOM 247 O ASP A 16 -1.642 -19.635 91.269 1.00 0.00 O ATOM 248 CB ASP A 16 -1.163 -19.649 94.441 1.00 0.00 C ATOM 249 CG ASP A 16 -0.261 -20.263 95.513 1.00 0.00 C ATOM 250 OD1 ASP A 16 0.906 -19.908 95.551 1.00 0.00 O ATOM 251 OD2 ASP A 16 -0.750 -21.079 96.276 1.00 0.00 O ATOM 0 H ASP A 16 0.355 -17.713 94.546 1.00 0.00 H new ATOM 0 HA ASP A 16 0.293 -20.087 92.913 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.682 -18.779 94.842 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.927 -20.365 94.140 1.00 0.00 H new ATOM 256 N GLU A 17 -1.593 -17.569 92.026 1.00 0.00 N ATOM 257 CA GLU A 17 -2.506 -17.093 90.940 1.00 0.00 C ATOM 258 C GLU A 17 -1.737 -16.958 89.619 1.00 0.00 C ATOM 259 O GLU A 17 -2.205 -17.379 88.578 1.00 0.00 O ATOM 260 CB GLU A 17 -3.105 -15.738 91.324 1.00 0.00 C ATOM 261 CG GLU A 17 -4.155 -15.935 92.421 1.00 0.00 C ATOM 262 CD GLU A 17 -4.795 -14.589 92.762 1.00 0.00 C ATOM 263 OE1 GLU A 17 -5.111 -13.854 91.840 1.00 0.00 O ATOM 264 OE2 GLU A 17 -4.959 -14.314 93.940 1.00 0.00 O ATOM 0 H GLU A 17 -1.289 -16.849 92.682 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.306 -17.822 90.811 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.320 -15.068 91.674 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.559 -15.269 90.451 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.918 -16.638 92.087 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -3.692 -16.365 93.309 1.00 0.00 H new ATOM 271 N VAL A 18 -0.558 -16.393 89.642 1.00 0.00 N ATOM 272 CA VAL A 18 0.219 -16.263 88.369 1.00 0.00 C ATOM 273 C VAL A 18 0.594 -17.666 87.900 1.00 0.00 C ATOM 274 O VAL A 18 0.582 -17.972 86.724 1.00 0.00 O ATOM 275 CB VAL A 18 1.521 -15.473 88.610 1.00 0.00 C ATOM 276 CG1 VAL A 18 1.413 -14.059 88.033 1.00 0.00 C ATOM 277 CG2 VAL A 18 1.808 -15.395 90.111 1.00 0.00 C ATOM 0 H VAL A 18 -0.102 -16.020 90.475 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.386 -15.740 87.628 1.00 0.00 H new ATOM 0 HB VAL A 18 2.337 -15.992 88.107 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.343 -13.520 88.215 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.231 -14.117 86.960 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.588 -13.532 88.513 1.00 0.00 H new ATOM 0 HG21 VAL A 18 2.729 -14.836 90.277 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.982 -14.891 90.614 1.00 0.00 H new ATOM 0 HG23 VAL A 18 1.918 -16.402 90.513 1.00 0.00 H new ATOM 287 N LYS A 19 0.935 -18.508 88.835 1.00 0.00 N ATOM 288 CA LYS A 19 1.332 -19.904 88.512 1.00 0.00 C ATOM 289 C LYS A 19 0.194 -20.625 87.789 1.00 0.00 C ATOM 290 O LYS A 19 0.417 -21.491 86.972 1.00 0.00 O ATOM 291 CB LYS A 19 1.648 -20.631 89.822 1.00 0.00 C ATOM 292 CG LYS A 19 2.292 -21.992 89.535 1.00 0.00 C ATOM 293 CD LYS A 19 3.115 -22.431 90.754 1.00 0.00 C ATOM 294 CE LYS A 19 4.526 -21.838 90.667 1.00 0.00 C ATOM 295 NZ LYS A 19 5.425 -22.802 89.973 1.00 0.00 N ATOM 0 H LYS A 19 0.955 -18.281 89.829 1.00 0.00 H new ATOM 0 HA LYS A 19 2.206 -19.896 87.861 1.00 0.00 H new ATOM 0 HB2 LYS A 19 2.320 -20.024 90.429 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.733 -20.769 90.399 1.00 0.00 H new ATOM 0 HG2 LYS A 19 1.523 -22.732 89.316 1.00 0.00 H new ATOM 0 HG3 LYS A 19 2.931 -21.926 88.655 1.00 0.00 H new ATOM 0 HD2 LYS A 19 2.628 -22.101 91.672 1.00 0.00 H new ATOM 0 HD3 LYS A 19 3.169 -23.519 90.795 1.00 0.00 H new ATOM 0 HE2 LYS A 19 4.502 -20.892 90.126 1.00 0.00 H new ATOM 0 HE3 LYS A 19 4.905 -21.625 91.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 6.074 -22.283 89.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 5.974 -23.334 90.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 4.855 -23.463 89.408 1.00 0.00 H new ATOM 309 N ASP A 20 -1.022 -20.281 88.093 1.00 0.00 N ATOM 310 CA ASP A 20 -2.177 -20.956 87.436 1.00 0.00 C ATOM 311 C ASP A 20 -2.164 -20.673 85.929 1.00 0.00 C ATOM 312 O ASP A 20 -2.193 -21.580 85.121 1.00 0.00 O ATOM 313 CB ASP A 20 -3.482 -20.436 88.045 1.00 0.00 C ATOM 314 CG ASP A 20 -4.661 -21.259 87.519 1.00 0.00 C ATOM 315 OD1 ASP A 20 -4.554 -21.772 86.418 1.00 0.00 O ATOM 316 OD2 ASP A 20 -5.648 -21.361 88.228 1.00 0.00 O ATOM 0 H ASP A 20 -1.270 -19.559 88.770 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.101 -22.032 87.595 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.438 -20.500 89.132 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.619 -19.384 87.793 1.00 0.00 H new ATOM 321 N TYR A 21 -2.125 -19.428 85.539 1.00 0.00 N ATOM 322 CA TYR A 21 -2.116 -19.112 84.078 1.00 0.00 C ATOM 323 C TYR A 21 -0.831 -19.646 83.434 1.00 0.00 C ATOM 324 O TYR A 21 -0.864 -20.308 82.416 1.00 0.00 O ATOM 325 CB TYR A 21 -2.205 -17.597 83.886 1.00 0.00 C ATOM 326 CG TYR A 21 -3.571 -17.121 84.325 1.00 0.00 C ATOM 327 CD1 TYR A 21 -3.838 -16.922 85.685 1.00 0.00 C ATOM 328 CD2 TYR A 21 -4.571 -16.886 83.375 1.00 0.00 C ATOM 329 CE1 TYR A 21 -5.105 -16.489 86.094 1.00 0.00 C ATOM 330 CE2 TYR A 21 -5.838 -16.453 83.784 1.00 0.00 C ATOM 331 CZ TYR A 21 -6.105 -16.255 85.143 1.00 0.00 C ATOM 332 OH TYR A 21 -7.353 -15.828 85.545 1.00 0.00 O ATOM 0 H TYR A 21 -2.099 -18.620 86.161 1.00 0.00 H new ATOM 0 HA TYR A 21 -2.972 -19.588 83.600 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -1.429 -17.098 84.467 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.036 -17.340 82.840 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -3.066 -17.103 86.419 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -4.365 -17.039 82.326 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -5.311 -16.336 87.143 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.609 -16.272 83.050 1.00 0.00 H new ATOM 0 HH TYR A 21 -7.262 -15.020 86.092 1.00 0.00 H new ATOM 342 N VAL A 22 0.299 -19.359 84.020 1.00 0.00 N ATOM 343 CA VAL A 22 1.590 -19.841 83.452 1.00 0.00 C ATOM 344 C VAL A 22 1.673 -21.365 83.576 1.00 0.00 C ATOM 345 O VAL A 22 2.323 -22.024 82.786 1.00 0.00 O ATOM 346 CB VAL A 22 2.744 -19.178 84.205 1.00 0.00 C ATOM 347 CG1 VAL A 22 4.065 -19.855 83.835 1.00 0.00 C ATOM 348 CG2 VAL A 22 2.803 -17.700 83.815 1.00 0.00 C ATOM 0 H VAL A 22 0.384 -18.807 84.874 1.00 0.00 H new ATOM 0 HA VAL A 22 1.653 -19.577 82.396 1.00 0.00 H new ATOM 0 HB VAL A 22 2.584 -19.276 85.279 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.882 -19.377 84.375 1.00 0.00 H new ATOM 0 HG12 VAL A 22 4.021 -20.911 84.103 1.00 0.00 H new ATOM 0 HG13 VAL A 22 4.235 -19.760 82.762 1.00 0.00 H new ATOM 0 HG21 VAL A 22 3.623 -17.216 84.346 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.965 -17.613 82.741 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.863 -17.216 84.080 1.00 0.00 H new ATOM 358 N ALA A 23 1.007 -21.937 84.545 1.00 0.00 N ATOM 359 CA ALA A 23 1.038 -23.418 84.687 1.00 0.00 C ATOM 360 C ALA A 23 0.461 -24.022 83.409 1.00 0.00 C ATOM 361 O ALA A 23 0.667 -25.178 83.097 1.00 0.00 O ATOM 362 CB ALA A 23 0.174 -23.845 85.877 1.00 0.00 C ATOM 0 H ALA A 23 0.446 -21.443 85.240 1.00 0.00 H new ATOM 0 HA ALA A 23 2.060 -23.759 84.852 1.00 0.00 H new ATOM 0 HB1 ALA A 23 0.201 -24.930 85.975 1.00 0.00 H new ATOM 0 HB2 ALA A 23 0.559 -23.388 86.789 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -0.854 -23.521 85.715 1.00 0.00 H new ATOM 368 N LYS A 24 -0.264 -23.228 82.675 1.00 0.00 N ATOM 369 CA LYS A 24 -0.876 -23.692 81.413 1.00 0.00 C ATOM 370 C LYS A 24 0.209 -24.240 80.484 1.00 0.00 C ATOM 371 O LYS A 24 0.425 -25.433 80.402 1.00 0.00 O ATOM 372 CB LYS A 24 -1.560 -22.482 80.775 1.00 0.00 C ATOM 373 CG LYS A 24 -2.295 -22.882 79.497 1.00 0.00 C ATOM 374 CD LYS A 24 -3.662 -23.482 79.844 1.00 0.00 C ATOM 375 CE LYS A 24 -4.590 -22.402 80.420 1.00 0.00 C ATOM 376 NZ LYS A 24 -6.003 -22.729 80.076 1.00 0.00 N ATOM 0 H LYS A 24 -0.459 -22.254 82.908 1.00 0.00 H new ATOM 0 HA LYS A 24 -1.597 -24.489 81.594 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -2.264 -22.043 81.482 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -0.817 -21.717 80.548 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -2.424 -22.011 78.854 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -1.702 -23.606 78.938 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.111 -23.919 78.952 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -3.539 -24.288 80.567 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -4.471 -22.344 81.502 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -4.323 -21.425 80.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -6.633 -21.999 80.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.110 -22.763 79.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.254 -23.654 80.480 1.00 0.00 H new ATOM 390 N GLY A 25 0.905 -23.379 79.798 1.00 0.00 N ATOM 391 CA GLY A 25 1.980 -23.858 78.883 1.00 0.00 C ATOM 392 C GLY A 25 2.864 -22.694 78.432 1.00 0.00 C ATOM 393 O GLY A 25 2.535 -21.972 77.511 1.00 0.00 O ATOM 0 H GLY A 25 0.778 -22.367 79.830 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.588 -24.608 79.389 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.535 -24.342 78.013 1.00 0.00 H new ATOM 397 N GLU A 26 3.989 -22.523 79.070 1.00 0.00 N ATOM 398 CA GLU A 26 4.933 -21.425 78.699 1.00 0.00 C ATOM 399 C GLU A 26 4.174 -20.189 78.209 1.00 0.00 C ATOM 400 O GLU A 26 3.852 -20.057 77.043 1.00 0.00 O ATOM 401 CB GLU A 26 5.912 -21.900 77.618 1.00 0.00 C ATOM 402 CG GLU A 26 5.184 -22.736 76.565 1.00 0.00 C ATOM 403 CD GLU A 26 6.170 -23.114 75.458 1.00 0.00 C ATOM 404 OE1 GLU A 26 6.895 -24.077 75.641 1.00 0.00 O ATOM 405 OE2 GLU A 26 6.187 -22.429 74.448 1.00 0.00 O ATOM 0 H GLU A 26 4.301 -23.107 79.846 1.00 0.00 H new ATOM 0 HA GLU A 26 5.495 -21.153 79.592 1.00 0.00 H new ATOM 0 HB2 GLU A 26 6.385 -21.040 77.144 1.00 0.00 H new ATOM 0 HB3 GLU A 26 6.707 -22.490 78.073 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.767 -23.634 77.020 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.349 -22.173 76.149 1.00 0.00 H new ATOM 412 N ASP A 27 3.916 -19.274 79.094 1.00 0.00 N ATOM 413 CA ASP A 27 3.210 -18.017 78.719 1.00 0.00 C ATOM 414 C ASP A 27 3.823 -16.897 79.549 1.00 0.00 C ATOM 415 O ASP A 27 3.147 -16.004 80.020 1.00 0.00 O ATOM 416 CB ASP A 27 1.718 -18.137 79.041 1.00 0.00 C ATOM 417 CG ASP A 27 1.021 -18.943 77.944 1.00 0.00 C ATOM 418 OD1 ASP A 27 0.815 -18.394 76.874 1.00 0.00 O ATOM 419 OD2 ASP A 27 0.707 -20.095 78.192 1.00 0.00 O ATOM 0 H ASP A 27 4.168 -19.343 80.080 1.00 0.00 H new ATOM 0 HA ASP A 27 3.314 -17.819 77.652 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.582 -18.624 80.007 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.271 -17.146 79.118 1.00 0.00 H new ATOM 424 N VAL A 28 5.108 -16.967 79.759 1.00 0.00 N ATOM 425 CA VAL A 28 5.798 -15.946 80.591 1.00 0.00 C ATOM 426 C VAL A 28 6.511 -14.925 79.704 1.00 0.00 C ATOM 427 O VAL A 28 7.710 -14.739 79.782 1.00 0.00 O ATOM 428 CB VAL A 28 6.797 -16.666 81.490 1.00 0.00 C ATOM 429 CG1 VAL A 28 6.023 -17.588 82.437 1.00 0.00 C ATOM 430 CG2 VAL A 28 7.751 -17.511 80.636 1.00 0.00 C ATOM 0 H VAL A 28 5.715 -17.697 79.385 1.00 0.00 H new ATOM 0 HA VAL A 28 5.073 -15.404 81.198 1.00 0.00 H new ATOM 0 HB VAL A 28 7.375 -15.936 82.057 1.00 0.00 H new ATOM 0 HG11 VAL A 28 6.723 -18.112 83.088 1.00 0.00 H new ATOM 0 HG12 VAL A 28 5.338 -16.995 83.043 1.00 0.00 H new ATOM 0 HG13 VAL A 28 5.456 -18.315 81.855 1.00 0.00 H new ATOM 0 HG21 VAL A 28 8.462 -18.023 81.284 1.00 0.00 H new ATOM 0 HG22 VAL A 28 7.179 -18.247 80.072 1.00 0.00 H new ATOM 0 HG23 VAL A 28 8.291 -16.864 79.945 1.00 0.00 H new ATOM 440 N ASN A 29 5.770 -14.252 78.876 1.00 0.00 N ATOM 441 CA ASN A 29 6.363 -13.227 77.989 1.00 0.00 C ATOM 442 C ASN A 29 5.228 -12.540 77.234 1.00 0.00 C ATOM 443 O ASN A 29 5.348 -12.199 76.074 1.00 0.00 O ATOM 444 CB ASN A 29 7.330 -13.886 77.006 1.00 0.00 C ATOM 445 CG ASN A 29 6.750 -15.210 76.519 1.00 0.00 C ATOM 446 OD1 ASN A 29 6.853 -16.269 77.271 1.00 0.00 O flip ATOM 447 ND2 ASN A 29 6.198 -15.285 75.440 1.00 0.00 N flip ATOM 0 H ASN A 29 4.762 -14.373 78.777 1.00 0.00 H new ATOM 0 HA ASN A 29 6.919 -12.494 78.574 1.00 0.00 H new ATOM 0 HB2 ASN A 29 7.509 -13.224 76.159 1.00 0.00 H new ATOM 0 HB3 ASN A 29 8.293 -14.056 77.488 1.00 0.00 H new ATOM 0 HD21 ASN A 29 6.117 -14.457 74.850 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.816 -16.176 75.124 1.00 0.00 H new ATOM 454 N ARG A 30 4.122 -12.332 77.900 1.00 0.00 N ATOM 455 CA ARG A 30 2.957 -11.664 77.260 1.00 0.00 C ATOM 456 C ARG A 30 2.832 -10.250 77.820 1.00 0.00 C ATOM 457 O ARG A 30 3.100 -10.008 78.979 1.00 0.00 O ATOM 458 CB ARG A 30 1.674 -12.439 77.580 1.00 0.00 C ATOM 459 CG ARG A 30 1.904 -13.941 77.375 1.00 0.00 C ATOM 460 CD ARG A 30 0.579 -14.627 77.028 1.00 0.00 C ATOM 461 NE ARG A 30 -0.547 -13.992 77.789 1.00 0.00 N ATOM 462 CZ ARG A 30 -0.518 -13.887 79.090 1.00 0.00 C ATOM 463 NH1 ARG A 30 0.448 -14.432 79.775 1.00 0.00 N ATOM 464 NH2 ARG A 30 -1.476 -13.252 79.709 1.00 0.00 N ATOM 0 H ARG A 30 3.978 -12.601 78.873 1.00 0.00 H new ATOM 0 HA ARG A 30 3.103 -11.634 76.180 1.00 0.00 H new ATOM 0 HB2 ARG A 30 1.370 -12.246 78.609 1.00 0.00 H new ATOM 0 HB3 ARG A 30 0.862 -12.096 76.938 1.00 0.00 H new ATOM 0 HG2 ARG A 30 2.627 -14.102 76.576 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.326 -14.380 78.279 1.00 0.00 H new ATOM 0 HD2 ARG A 30 0.392 -14.552 75.957 1.00 0.00 H new ATOM 0 HD3 ARG A 30 0.637 -15.689 77.268 1.00 0.00 H new ATOM 0 HE ARG A 30 -1.354 -13.634 77.278 1.00 0.00 H new ATOM 0 HH11 ARG A 30 1.188 -14.945 79.295 1.00 0.00 H new ATOM 0 HH12 ARG A 30 0.464 -14.346 80.791 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -2.243 -12.841 79.176 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -1.458 -13.167 80.725 1.00 0.00 H new ATOM 478 N THR A 31 2.422 -9.315 77.017 1.00 0.00 N ATOM 479 CA THR A 31 2.275 -7.926 77.528 1.00 0.00 C ATOM 480 C THR A 31 1.330 -7.950 78.731 1.00 0.00 C ATOM 481 O THR A 31 0.269 -8.541 78.692 1.00 0.00 O ATOM 482 CB THR A 31 1.713 -7.019 76.431 1.00 0.00 C ATOM 483 OG1 THR A 31 2.324 -7.352 75.191 1.00 0.00 O ATOM 484 CG2 THR A 31 2.018 -5.561 76.777 1.00 0.00 C ATOM 0 H THR A 31 2.183 -9.449 76.034 1.00 0.00 H new ATOM 0 HA THR A 31 3.247 -7.535 77.829 1.00 0.00 H new ATOM 0 HB THR A 31 0.634 -7.156 76.354 1.00 0.00 H new ATOM 0 HG1 THR A 31 1.966 -6.775 74.485 1.00 0.00 H new ATOM 0 HG21 THR A 31 1.619 -4.911 75.998 1.00 0.00 H new ATOM 0 HG22 THR A 31 1.556 -5.309 77.731 1.00 0.00 H new ATOM 0 HG23 THR A 31 3.097 -5.422 76.849 1.00 0.00 H new ATOM 492 N LEU A 32 1.730 -7.341 79.810 1.00 0.00 N ATOM 493 CA LEU A 32 0.890 -7.349 81.037 1.00 0.00 C ATOM 494 C LEU A 32 -0.300 -6.383 80.903 1.00 0.00 C ATOM 495 O LEU A 32 -1.379 -6.779 80.507 1.00 0.00 O ATOM 496 CB LEU A 32 1.770 -6.957 82.230 1.00 0.00 C ATOM 497 CG LEU A 32 1.201 -7.550 83.521 1.00 0.00 C ATOM 498 CD1 LEU A 32 2.180 -7.302 84.677 1.00 0.00 C ATOM 499 CD2 LEU A 32 -0.141 -6.883 83.839 1.00 0.00 C ATOM 0 H LEU A 32 2.611 -6.834 79.895 1.00 0.00 H new ATOM 0 HA LEU A 32 0.480 -8.347 81.188 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.788 -7.315 82.074 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.823 -5.871 82.312 1.00 0.00 H new ATOM 0 HG LEU A 32 1.055 -8.623 83.393 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.773 -7.725 85.595 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.136 -7.775 84.452 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.327 -6.230 84.805 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.548 -7.304 84.758 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.007 -5.810 83.965 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.838 -7.059 83.020 1.00 0.00 H new ATOM 511 N GLU A 33 -0.134 -5.130 81.251 1.00 0.00 N ATOM 512 CA GLU A 33 -1.283 -4.176 81.159 1.00 0.00 C ATOM 513 C GLU A 33 -1.452 -3.646 79.728 1.00 0.00 C ATOM 514 O GLU A 33 -2.526 -3.715 79.164 1.00 0.00 O ATOM 515 CB GLU A 33 -1.064 -3.007 82.124 1.00 0.00 C ATOM 516 CG GLU A 33 0.225 -2.266 81.767 1.00 0.00 C ATOM 517 CD GLU A 33 0.658 -1.398 82.951 1.00 0.00 C ATOM 518 OE1 GLU A 33 0.400 -1.794 84.075 1.00 0.00 O ATOM 519 OE2 GLU A 33 1.237 -0.352 82.711 1.00 0.00 O ATOM 0 H GLU A 33 0.740 -4.729 81.592 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.193 -4.711 81.432 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.911 -2.323 82.077 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.009 -3.376 83.148 1.00 0.00 H new ATOM 0 HG2 GLU A 33 1.011 -2.980 81.519 1.00 0.00 H new ATOM 0 HG3 GLU A 33 0.068 -1.645 80.885 1.00 0.00 H new ATOM 526 N GLY A 34 -0.420 -3.104 79.134 1.00 0.00 N ATOM 527 CA GLY A 34 -0.568 -2.569 77.746 1.00 0.00 C ATOM 528 C GLY A 34 0.781 -2.583 77.030 1.00 0.00 C ATOM 529 O GLY A 34 0.854 -2.656 75.820 1.00 0.00 O ATOM 0 H GLY A 34 0.509 -3.009 79.544 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -1.289 -3.170 77.191 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -0.960 -1.552 77.780 1.00 0.00 H new ATOM 533 N GLY A 35 1.846 -2.516 77.768 1.00 0.00 N ATOM 534 CA GLY A 35 3.199 -2.530 77.141 1.00 0.00 C ATOM 535 C GLY A 35 4.219 -2.997 78.176 1.00 0.00 C ATOM 536 O GLY A 35 5.408 -2.795 78.029 1.00 0.00 O ATOM 0 H GLY A 35 1.843 -2.452 78.786 1.00 0.00 H new ATOM 0 HA2 GLY A 35 3.207 -3.195 76.277 1.00 0.00 H new ATOM 0 HA3 GLY A 35 3.457 -1.535 76.780 1.00 0.00 H new ATOM 540 N ARG A 36 3.754 -3.614 79.229 1.00 0.00 N ATOM 541 CA ARG A 36 4.676 -4.093 80.298 1.00 0.00 C ATOM 542 C ARG A 36 4.683 -5.631 80.326 1.00 0.00 C ATOM 543 O ARG A 36 3.851 -6.274 79.717 1.00 0.00 O ATOM 544 CB ARG A 36 4.186 -3.547 81.647 1.00 0.00 C ATOM 545 CG ARG A 36 3.772 -2.074 81.493 1.00 0.00 C ATOM 546 CD ARG A 36 4.998 -1.229 81.138 1.00 0.00 C ATOM 547 NE ARG A 36 4.747 0.201 81.514 1.00 0.00 N ATOM 548 CZ ARG A 36 3.698 0.846 81.074 1.00 0.00 C ATOM 549 NH1 ARG A 36 2.928 0.313 80.168 1.00 0.00 N ATOM 550 NH2 ARG A 36 3.437 2.044 81.523 1.00 0.00 N ATOM 0 H ARG A 36 2.767 -3.808 79.395 1.00 0.00 H new ATOM 0 HA ARG A 36 5.689 -3.742 80.103 1.00 0.00 H new ATOM 0 HB2 ARG A 36 3.341 -4.136 82.003 1.00 0.00 H new ATOM 0 HB3 ARG A 36 4.975 -3.637 82.394 1.00 0.00 H new ATOM 0 HG2 ARG A 36 3.015 -1.978 80.715 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.325 -1.713 82.419 1.00 0.00 H new ATOM 0 HD2 ARG A 36 5.876 -1.605 81.663 1.00 0.00 H new ATOM 0 HD3 ARG A 36 5.208 -1.304 80.071 1.00 0.00 H new ATOM 0 HE ARG A 36 5.408 0.680 82.125 1.00 0.00 H new ATOM 0 HH11 ARG A 36 3.142 -0.613 79.798 1.00 0.00 H new ATOM 0 HH12 ARG A 36 2.111 0.822 79.829 1.00 0.00 H new ATOM 0 HH21 ARG A 36 4.051 2.474 82.215 1.00 0.00 H new ATOM 0 HH22 ARG A 36 2.620 2.550 81.182 1.00 0.00 H new ATOM 564 N LYS A 37 5.615 -6.226 81.030 1.00 0.00 N ATOM 565 CA LYS A 37 5.678 -7.723 81.108 1.00 0.00 C ATOM 566 C LYS A 37 5.429 -8.139 82.578 1.00 0.00 C ATOM 567 O LYS A 37 5.361 -7.283 83.436 1.00 0.00 O ATOM 568 CB LYS A 37 7.053 -8.184 80.603 1.00 0.00 C ATOM 569 CG LYS A 37 8.115 -7.972 81.681 1.00 0.00 C ATOM 570 CD LYS A 37 8.130 -6.501 82.113 1.00 0.00 C ATOM 571 CE LYS A 37 9.451 -6.180 82.817 1.00 0.00 C ATOM 572 NZ LYS A 37 9.744 -4.729 82.664 1.00 0.00 N ATOM 0 H LYS A 37 6.339 -5.738 81.557 1.00 0.00 H new ATOM 0 HA LYS A 37 4.918 -8.193 80.484 1.00 0.00 H new ATOM 0 HB2 LYS A 37 7.011 -9.238 80.327 1.00 0.00 H new ATOM 0 HB3 LYS A 37 7.322 -7.629 79.704 1.00 0.00 H new ATOM 0 HG2 LYS A 37 7.907 -8.611 82.540 1.00 0.00 H new ATOM 0 HG3 LYS A 37 9.095 -8.259 81.300 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.005 -5.856 81.243 1.00 0.00 H new ATOM 0 HD3 LYS A 37 7.293 -6.300 82.782 1.00 0.00 H new ATOM 0 HE2 LYS A 37 9.387 -6.441 83.873 1.00 0.00 H new ATOM 0 HE3 LYS A 37 10.259 -6.774 82.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 10.450 -4.441 83.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.117 -4.549 81.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 8.871 -4.182 82.803 1.00 0.00 H new ATOM 586 N PRO A 38 5.242 -9.418 82.837 1.00 0.00 N ATOM 587 CA PRO A 38 4.941 -9.900 84.207 1.00 0.00 C ATOM 588 C PRO A 38 6.204 -10.030 85.087 1.00 0.00 C ATOM 589 O PRO A 38 6.286 -10.919 85.917 1.00 0.00 O ATOM 590 CB PRO A 38 4.326 -11.292 83.976 1.00 0.00 C ATOM 591 CG PRO A 38 4.671 -11.713 82.522 1.00 0.00 C ATOM 592 CD PRO A 38 5.297 -10.490 81.820 1.00 0.00 C ATOM 0 HA PRO A 38 4.290 -9.204 84.736 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.726 -12.012 84.690 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.246 -11.264 84.122 1.00 0.00 H new ATOM 0 HG2 PRO A 38 5.366 -12.553 82.521 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.775 -12.040 81.995 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.322 -10.691 81.509 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.740 -10.217 80.924 1.00 0.00 H new ATOM 600 N LEU A 39 7.185 -9.174 84.924 1.00 0.00 N ATOM 601 CA LEU A 39 8.429 -9.287 85.764 1.00 0.00 C ATOM 602 C LEU A 39 8.686 -7.974 86.521 1.00 0.00 C ATOM 603 O LEU A 39 9.351 -7.957 87.536 1.00 0.00 O ATOM 604 CB LEU A 39 9.620 -9.592 84.836 1.00 0.00 C ATOM 605 CG LEU A 39 10.884 -10.082 85.600 1.00 0.00 C ATOM 606 CD1 LEU A 39 10.542 -10.750 86.938 1.00 0.00 C ATOM 607 CD2 LEU A 39 11.624 -11.099 84.717 1.00 0.00 C ATOM 0 H LEU A 39 7.183 -8.406 84.252 1.00 0.00 H new ATOM 0 HA LEU A 39 8.304 -10.086 86.494 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.323 -10.352 84.113 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.871 -8.694 84.271 1.00 0.00 H new ATOM 0 HG LEU A 39 11.501 -9.210 85.816 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.460 -11.073 87.429 1.00 0.00 H new ATOM 0 HD12 LEU A 39 10.020 -10.038 87.577 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.903 -11.615 86.760 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.514 -11.453 85.238 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.967 -11.943 84.505 1.00 0.00 H new ATOM 0 HD23 LEU A 39 11.917 -10.623 83.781 1.00 0.00 H new ATOM 619 N HIS A 40 8.171 -6.873 86.043 1.00 0.00 N ATOM 620 CA HIS A 40 8.411 -5.577 86.749 1.00 0.00 C ATOM 621 C HIS A 40 7.593 -5.550 88.039 1.00 0.00 C ATOM 622 O HIS A 40 8.090 -5.203 89.094 1.00 0.00 O ATOM 623 CB HIS A 40 7.977 -4.413 85.857 1.00 0.00 C ATOM 624 CG HIS A 40 8.223 -3.114 86.578 1.00 0.00 C ATOM 625 ND1 HIS A 40 9.204 -2.162 86.445 1.00 0.00 N flip ATOM 626 CD2 HIS A 40 7.393 -2.661 87.593 1.00 0.00 C flip ATOM 627 CE1 HIS A 40 8.989 -1.136 87.361 1.00 0.00 C flip ATOM 628 NE2 HIS A 40 7.886 -1.486 88.027 1.00 0.00 N flip ATOM 0 H HIS A 40 7.599 -6.812 85.201 1.00 0.00 H new ATOM 0 HA HIS A 40 9.472 -5.482 86.978 1.00 0.00 H new ATOM 0 HB2 HIS A 40 8.532 -4.432 84.919 1.00 0.00 H new ATOM 0 HB3 HIS A 40 6.921 -4.508 85.604 1.00 0.00 H new ATOM 0 HD2 HIS A 40 6.511 -3.160 87.967 1.00 0.00 H new ATOM 0 HE1 HIS A 40 9.586 -0.247 87.503 1.00 0.00 H new ATOM 0 HE2 HIS A 40 7.468 -0.931 88.774 1.00 0.00 H new ATOM 636 N TYR A 41 6.350 -5.929 87.966 1.00 0.00 N ATOM 637 CA TYR A 41 5.504 -5.944 89.189 1.00 0.00 C ATOM 638 C TYR A 41 6.028 -7.041 90.104 1.00 0.00 C ATOM 639 O TYR A 41 6.081 -6.894 91.310 1.00 0.00 O ATOM 640 CB TYR A 41 4.061 -6.224 88.790 1.00 0.00 C ATOM 641 CG TYR A 41 3.717 -5.324 87.634 1.00 0.00 C ATOM 642 CD1 TYR A 41 4.149 -5.648 86.341 1.00 0.00 C ATOM 643 CD2 TYR A 41 2.992 -4.151 87.857 1.00 0.00 C ATOM 644 CE1 TYR A 41 3.852 -4.796 85.274 1.00 0.00 C ATOM 645 CE2 TYR A 41 2.692 -3.302 86.789 1.00 0.00 C ATOM 646 CZ TYR A 41 3.123 -3.623 85.497 1.00 0.00 C ATOM 647 OH TYR A 41 2.831 -2.782 84.444 1.00 0.00 O ATOM 0 H TYR A 41 5.882 -6.230 87.111 1.00 0.00 H new ATOM 0 HA TYR A 41 5.541 -4.985 89.706 1.00 0.00 H new ATOM 0 HB2 TYR A 41 3.939 -7.270 88.508 1.00 0.00 H new ATOM 0 HB3 TYR A 41 3.391 -6.040 89.629 1.00 0.00 H new ATOM 0 HD1 TYR A 41 4.710 -6.554 86.169 1.00 0.00 H new ATOM 0 HD2 TYR A 41 2.663 -3.901 88.855 1.00 0.00 H new ATOM 0 HE1 TYR A 41 4.185 -5.043 84.277 1.00 0.00 H new ATOM 0 HE2 TYR A 41 2.127 -2.398 86.961 1.00 0.00 H new ATOM 0 HH TYR A 41 2.066 -2.216 84.680 1.00 0.00 H new ATOM 657 N ALA A 42 6.461 -8.128 89.533 1.00 0.00 N ATOM 658 CA ALA A 42 7.029 -9.216 90.363 1.00 0.00 C ATOM 659 C ALA A 42 8.330 -8.689 90.948 1.00 0.00 C ATOM 660 O ALA A 42 8.499 -8.586 92.145 1.00 0.00 O ATOM 661 CB ALA A 42 7.327 -10.428 89.480 1.00 0.00 C ATOM 0 H ALA A 42 6.445 -8.307 88.529 1.00 0.00 H new ATOM 0 HA ALA A 42 6.334 -9.516 91.147 1.00 0.00 H new ATOM 0 HB1 ALA A 42 7.745 -11.229 90.090 1.00 0.00 H new ATOM 0 HB2 ALA A 42 6.405 -10.772 89.011 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.044 -10.148 88.708 1.00 0.00 H new ATOM 667 N ALA A 43 9.243 -8.327 90.099 1.00 0.00 N ATOM 668 CA ALA A 43 10.531 -7.776 90.581 1.00 0.00 C ATOM 669 C ALA A 43 10.244 -6.617 91.543 1.00 0.00 C ATOM 670 O ALA A 43 10.613 -6.647 92.700 1.00 0.00 O ATOM 671 CB ALA A 43 11.315 -7.244 89.377 1.00 0.00 C ATOM 0 H ALA A 43 9.151 -8.390 89.085 1.00 0.00 H new ATOM 0 HA ALA A 43 11.106 -8.548 91.092 1.00 0.00 H new ATOM 0 HB1 ALA A 43 12.267 -6.834 89.715 1.00 0.00 H new ATOM 0 HB2 ALA A 43 11.499 -8.057 88.674 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.738 -6.462 88.884 1.00 0.00 H new ATOM 677 N ASP A 44 9.589 -5.596 91.061 1.00 0.00 N ATOM 678 CA ASP A 44 9.274 -4.411 91.914 1.00 0.00 C ATOM 679 C ASP A 44 8.612 -4.817 93.240 1.00 0.00 C ATOM 680 O ASP A 44 8.900 -4.247 94.273 1.00 0.00 O ATOM 681 CB ASP A 44 8.324 -3.488 91.149 1.00 0.00 C ATOM 682 CG ASP A 44 8.108 -2.203 91.948 1.00 0.00 C ATOM 683 OD1 ASP A 44 8.924 -1.306 91.821 1.00 0.00 O ATOM 684 OD2 ASP A 44 7.129 -2.138 92.673 1.00 0.00 O ATOM 0 H ASP A 44 9.254 -5.531 90.100 1.00 0.00 H new ATOM 0 HA ASP A 44 10.211 -3.905 92.146 1.00 0.00 H new ATOM 0 HB2 ASP A 44 8.739 -3.254 90.169 1.00 0.00 H new ATOM 0 HB3 ASP A 44 7.371 -3.989 90.981 1.00 0.00 H new ATOM 689 N CYS A 45 7.718 -5.771 93.229 1.00 0.00 N ATOM 690 CA CYS A 45 7.038 -6.155 94.506 1.00 0.00 C ATOM 691 C CYS A 45 6.440 -7.552 94.386 1.00 0.00 C ATOM 692 O CYS A 45 5.242 -7.729 94.478 1.00 0.00 O ATOM 693 CB CYS A 45 5.891 -5.180 94.778 1.00 0.00 C ATOM 694 SG CYS A 45 6.542 -3.519 95.078 1.00 0.00 S ATOM 0 H CYS A 45 7.430 -6.296 92.403 1.00 0.00 H new ATOM 0 HA CYS A 45 7.772 -6.131 95.311 1.00 0.00 H new ATOM 0 HB2 CYS A 45 5.209 -5.163 93.928 1.00 0.00 H new ATOM 0 HB3 CYS A 45 5.316 -5.515 95.641 1.00 0.00 H new ATOM 0 HG CYS A 45 7.834 -3.526 94.931 1.00 0.00 H new ATOM 700 N GLY A 46 7.254 -8.548 94.191 1.00 0.00 N ATOM 701 CA GLY A 46 6.706 -9.935 94.075 1.00 0.00 C ATOM 702 C GLY A 46 7.159 -10.772 95.268 1.00 0.00 C ATOM 703 O GLY A 46 7.350 -11.967 95.155 1.00 0.00 O ATOM 0 H GLY A 46 8.267 -8.469 94.107 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.617 -9.903 94.034 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.047 -10.394 93.147 1.00 0.00 H new ATOM 707 N GLN A 47 7.354 -10.163 96.405 1.00 0.00 N ATOM 708 CA GLN A 47 7.819 -10.946 97.578 1.00 0.00 C ATOM 709 C GLN A 47 9.082 -11.696 97.148 1.00 0.00 C ATOM 710 O GLN A 47 9.558 -12.601 97.801 1.00 0.00 O ATOM 711 CB GLN A 47 6.696 -11.883 98.032 1.00 0.00 C ATOM 712 CG GLN A 47 5.497 -11.005 98.397 1.00 0.00 C ATOM 713 CD GLN A 47 4.418 -11.817 99.107 1.00 0.00 C ATOM 714 OE1 GLN A 47 3.178 -11.433 98.994 1.00 0.00 O flip ATOM 715 NE2 GLN A 47 4.701 -12.794 99.769 1.00 0.00 N flip ATOM 0 H GLN A 47 7.212 -9.166 96.570 1.00 0.00 H new ATOM 0 HA GLN A 47 8.063 -10.313 98.431 1.00 0.00 H new ATOM 0 HB2 GLN A 47 6.434 -12.583 97.238 1.00 0.00 H new ATOM 0 HB3 GLN A 47 7.013 -12.477 98.889 1.00 0.00 H new ATOM 0 HG2 GLN A 47 5.823 -10.187 99.040 1.00 0.00 H new ATOM 0 HG3 GLN A 47 5.083 -10.555 97.494 1.00 0.00 H new ATOM 0 HE21 GLN A 47 5.674 -13.089 99.853 1.00 0.00 H new ATOM 0 HE22 GLN A 47 3.966 -13.320 100.241 1.00 0.00 H new ATOM 724 N LEU A 48 9.631 -11.250 96.046 1.00 0.00 N ATOM 725 CA LEU A 48 10.894 -11.813 95.489 1.00 0.00 C ATOM 726 C LEU A 48 10.766 -13.299 95.146 1.00 0.00 C ATOM 727 O LEU A 48 11.717 -13.937 94.741 1.00 0.00 O ATOM 728 CB LEU A 48 12.023 -11.604 96.486 1.00 0.00 C ATOM 729 CG LEU A 48 12.402 -10.104 96.594 1.00 0.00 C ATOM 730 CD1 LEU A 48 11.650 -9.241 95.568 1.00 0.00 C ATOM 731 CD2 LEU A 48 12.078 -9.593 98.000 1.00 0.00 C ATOM 0 H LEU A 48 9.238 -10.490 95.491 1.00 0.00 H new ATOM 0 HA LEU A 48 11.111 -11.287 94.560 1.00 0.00 H new ATOM 0 HB2 LEU A 48 11.722 -11.978 97.465 1.00 0.00 H new ATOM 0 HB3 LEU A 48 12.895 -12.181 96.179 1.00 0.00 H new ATOM 0 HG LEU A 48 13.469 -10.023 96.389 1.00 0.00 H new ATOM 0 HD11 LEU A 48 11.948 -8.199 95.682 1.00 0.00 H new ATOM 0 HD12 LEU A 48 11.892 -9.580 94.561 1.00 0.00 H new ATOM 0 HD13 LEU A 48 10.576 -9.332 95.733 1.00 0.00 H new ATOM 0 HD21 LEU A 48 12.345 -8.539 98.074 1.00 0.00 H new ATOM 0 HD22 LEU A 48 11.012 -9.712 98.194 1.00 0.00 H new ATOM 0 HD23 LEU A 48 12.646 -10.164 98.734 1.00 0.00 H new ATOM 743 N GLU A 49 9.602 -13.846 95.268 1.00 0.00 N ATOM 744 CA GLU A 49 9.400 -15.282 94.908 1.00 0.00 C ATOM 745 C GLU A 49 8.805 -15.346 93.505 1.00 0.00 C ATOM 746 O GLU A 49 9.091 -16.236 92.725 1.00 0.00 O ATOM 747 CB GLU A 49 8.429 -15.946 95.891 1.00 0.00 C ATOM 748 CG GLU A 49 7.450 -14.899 96.415 1.00 0.00 C ATOM 749 CD GLU A 49 6.396 -15.572 97.296 1.00 0.00 C ATOM 750 OE1 GLU A 49 6.780 -16.241 98.241 1.00 0.00 O ATOM 751 OE2 GLU A 49 5.221 -15.404 97.013 1.00 0.00 O ATOM 0 H GLU A 49 8.768 -13.364 95.604 1.00 0.00 H new ATOM 0 HA GLU A 49 10.356 -15.805 94.948 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.887 -16.752 95.397 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.980 -16.393 96.719 1.00 0.00 H new ATOM 0 HG2 GLU A 49 7.985 -14.141 96.987 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.968 -14.388 95.581 1.00 0.00 H new ATOM 758 N ILE A 50 7.958 -14.410 93.199 1.00 0.00 N ATOM 759 CA ILE A 50 7.297 -14.386 91.867 1.00 0.00 C ATOM 760 C ILE A 50 8.299 -14.120 90.747 1.00 0.00 C ATOM 761 O ILE A 50 8.216 -14.716 89.701 1.00 0.00 O ATOM 762 CB ILE A 50 6.224 -13.297 91.858 1.00 0.00 C ATOM 763 CG1 ILE A 50 5.301 -13.500 93.087 1.00 0.00 C ATOM 764 CG2 ILE A 50 5.446 -13.376 90.533 1.00 0.00 C ATOM 765 CD1 ILE A 50 3.822 -13.364 92.719 1.00 0.00 C ATOM 0 H ILE A 50 7.691 -13.649 93.823 1.00 0.00 H new ATOM 0 HA ILE A 50 6.849 -15.364 91.692 1.00 0.00 H new ATOM 0 HB ILE A 50 6.667 -12.304 91.927 1.00 0.00 H new ATOM 0 HG12 ILE A 50 5.479 -14.486 93.516 1.00 0.00 H new ATOM 0 HG13 ILE A 50 5.553 -12.768 93.855 1.00 0.00 H new ATOM 0 HG21 ILE A 50 4.677 -12.603 90.516 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.131 -13.225 89.699 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.977 -14.356 90.444 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.210 -13.513 93.609 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.638 -12.369 92.315 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.563 -14.113 91.971 1.00 0.00 H new ATOM 777 N LEU A 51 9.227 -13.226 90.931 1.00 0.00 N ATOM 778 CA LEU A 51 10.175 -12.951 89.818 1.00 0.00 C ATOM 779 C LEU A 51 10.895 -14.240 89.394 1.00 0.00 C ATOM 780 O LEU A 51 10.864 -14.605 88.241 1.00 0.00 O ATOM 781 CB LEU A 51 11.221 -11.851 90.146 1.00 0.00 C ATOM 782 CG LEU A 51 11.366 -11.552 91.644 1.00 0.00 C ATOM 783 CD1 LEU A 51 10.044 -11.052 92.243 1.00 0.00 C ATOM 784 CD2 LEU A 51 11.855 -12.798 92.377 1.00 0.00 C ATOM 0 H LEU A 51 9.370 -12.684 91.783 1.00 0.00 H new ATOM 0 HA LEU A 51 9.568 -12.571 88.996 1.00 0.00 H new ATOM 0 HB2 LEU A 51 12.190 -12.157 89.752 1.00 0.00 H new ATOM 0 HB3 LEU A 51 10.942 -10.933 89.628 1.00 0.00 H new ATOM 0 HG LEU A 51 12.102 -10.758 91.767 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.180 -10.849 93.305 1.00 0.00 H new ATOM 0 HD12 LEU A 51 9.737 -10.138 91.735 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.275 -11.814 92.114 1.00 0.00 H new ATOM 0 HD21 LEU A 51 11.956 -12.579 93.440 1.00 0.00 H new ATOM 0 HD22 LEU A 51 11.137 -13.606 92.240 1.00 0.00 H new ATOM 0 HD23 LEU A 51 12.822 -13.100 91.976 1.00 0.00 H new ATOM 796 N GLU A 52 11.561 -14.931 90.282 1.00 0.00 N ATOM 797 CA GLU A 52 12.272 -16.171 89.829 1.00 0.00 C ATOM 798 C GLU A 52 11.278 -17.186 89.233 1.00 0.00 C ATOM 799 O GLU A 52 11.664 -18.060 88.481 1.00 0.00 O ATOM 800 CB GLU A 52 13.110 -16.845 90.949 1.00 0.00 C ATOM 801 CG GLU A 52 12.605 -16.508 92.353 1.00 0.00 C ATOM 802 CD GLU A 52 11.407 -17.396 92.696 1.00 0.00 C ATOM 803 OE1 GLU A 52 10.662 -17.728 91.788 1.00 0.00 O ATOM 804 OE2 GLU A 52 11.255 -17.731 93.859 1.00 0.00 O ATOM 0 H GLU A 52 11.645 -14.703 91.273 1.00 0.00 H new ATOM 0 HA GLU A 52 12.973 -15.849 89.059 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.090 -17.926 90.811 1.00 0.00 H new ATOM 0 HB3 GLU A 52 14.150 -16.531 90.857 1.00 0.00 H new ATOM 0 HG2 GLU A 52 13.401 -16.657 93.082 1.00 0.00 H new ATOM 0 HG3 GLU A 52 12.318 -15.458 92.405 1.00 0.00 H new ATOM 811 N PHE A 53 10.010 -17.102 89.557 1.00 0.00 N ATOM 812 CA PHE A 53 9.032 -18.090 88.994 1.00 0.00 C ATOM 813 C PHE A 53 8.924 -17.966 87.469 1.00 0.00 C ATOM 814 O PHE A 53 9.540 -18.702 86.733 1.00 0.00 O ATOM 815 CB PHE A 53 7.644 -17.860 89.590 1.00 0.00 C ATOM 816 CG PHE A 53 6.620 -18.639 88.786 1.00 0.00 C ATOM 817 CD1 PHE A 53 6.740 -20.030 88.655 1.00 0.00 C ATOM 818 CD2 PHE A 53 5.561 -17.969 88.158 1.00 0.00 C ATOM 819 CE1 PHE A 53 5.800 -20.749 87.905 1.00 0.00 C ATOM 820 CE2 PHE A 53 4.621 -18.689 87.409 1.00 0.00 C ATOM 821 CZ PHE A 53 4.743 -20.079 87.281 1.00 0.00 C ATOM 0 H PHE A 53 9.611 -16.400 90.180 1.00 0.00 H new ATOM 0 HA PHE A 53 9.397 -19.085 89.250 1.00 0.00 H new ATOM 0 HB2 PHE A 53 7.625 -18.179 90.632 1.00 0.00 H new ATOM 0 HB3 PHE A 53 7.402 -16.797 89.578 1.00 0.00 H new ATOM 0 HD1 PHE A 53 7.558 -20.548 89.133 1.00 0.00 H new ATOM 0 HD2 PHE A 53 5.470 -16.897 88.252 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.892 -21.821 87.809 1.00 0.00 H new ATOM 0 HE2 PHE A 53 3.802 -18.173 86.930 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.020 -20.633 86.700 1.00 0.00 H new ATOM 831 N LEU A 54 8.099 -17.068 86.995 1.00 0.00 N ATOM 832 CA LEU A 54 7.903 -16.923 85.527 1.00 0.00 C ATOM 833 C LEU A 54 9.237 -16.736 84.807 1.00 0.00 C ATOM 834 O LEU A 54 9.304 -16.711 83.595 1.00 0.00 O ATOM 835 CB LEU A 54 6.946 -15.748 85.242 1.00 0.00 C ATOM 836 CG LEU A 54 7.524 -14.368 85.639 1.00 0.00 C ATOM 837 CD1 LEU A 54 8.381 -14.456 86.900 1.00 0.00 C ATOM 838 CD2 LEU A 54 8.359 -13.790 84.490 1.00 0.00 C ATOM 0 H LEU A 54 7.551 -16.426 87.568 1.00 0.00 H new ATOM 0 HA LEU A 54 7.455 -17.839 85.142 1.00 0.00 H new ATOM 0 HB2 LEU A 54 6.702 -15.738 84.180 1.00 0.00 H new ATOM 0 HB3 LEU A 54 6.013 -15.911 85.782 1.00 0.00 H new ATOM 0 HG LEU A 54 6.681 -13.709 85.846 1.00 0.00 H new ATOM 0 HD11 LEU A 54 8.769 -13.467 87.146 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.774 -14.824 87.727 1.00 0.00 H new ATOM 0 HD13 LEU A 54 9.213 -15.139 86.728 1.00 0.00 H new ATOM 0 HD21 LEU A 54 8.759 -12.819 84.783 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.182 -14.468 84.261 1.00 0.00 H new ATOM 0 HD23 LEU A 54 7.731 -13.672 83.607 1.00 0.00 H new ATOM 850 N LEU A 55 10.308 -16.633 85.535 1.00 0.00 N ATOM 851 CA LEU A 55 11.637 -16.478 84.883 1.00 0.00 C ATOM 852 C LEU A 55 12.250 -17.865 84.648 1.00 0.00 C ATOM 853 O LEU A 55 12.840 -18.126 83.617 1.00 0.00 O ATOM 854 CB LEU A 55 12.546 -15.652 85.797 1.00 0.00 C ATOM 855 CG LEU A 55 13.639 -14.953 84.985 1.00 0.00 C ATOM 856 CD1 LEU A 55 14.479 -14.097 85.934 1.00 0.00 C ATOM 857 CD2 LEU A 55 14.539 -15.996 84.310 1.00 0.00 C ATOM 0 H LEU A 55 10.323 -16.649 86.555 1.00 0.00 H new ATOM 0 HA LEU A 55 11.528 -15.969 83.925 1.00 0.00 H new ATOM 0 HB2 LEU A 55 11.954 -14.910 86.333 1.00 0.00 H new ATOM 0 HB3 LEU A 55 13.001 -16.299 86.547 1.00 0.00 H new ATOM 0 HG LEU A 55 13.183 -14.329 84.216 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.263 -13.592 85.370 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.842 -13.355 86.415 1.00 0.00 H new ATOM 0 HD13 LEU A 55 14.931 -14.734 86.694 1.00 0.00 H new ATOM 0 HD21 LEU A 55 15.314 -15.490 83.734 1.00 0.00 H new ATOM 0 HD22 LEU A 55 15.003 -16.623 85.071 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.940 -16.617 83.644 1.00 0.00 H new ATOM 869 N LEU A 56 12.103 -18.763 85.593 1.00 0.00 N ATOM 870 CA LEU A 56 12.673 -20.132 85.414 1.00 0.00 C ATOM 871 C LEU A 56 12.008 -20.787 84.206 1.00 0.00 C ATOM 872 O LEU A 56 12.641 -21.489 83.439 1.00 0.00 O ATOM 873 CB LEU A 56 12.487 -20.972 86.692 1.00 0.00 C ATOM 874 CG LEU A 56 11.050 -21.501 86.809 1.00 0.00 C ATOM 875 CD1 LEU A 56 10.966 -22.908 86.203 1.00 0.00 C ATOM 876 CD2 LEU A 56 10.659 -21.580 88.289 1.00 0.00 C ATOM 0 H LEU A 56 11.615 -18.607 86.475 1.00 0.00 H new ATOM 0 HA LEU A 56 13.746 -20.066 85.233 1.00 0.00 H new ATOM 0 HB2 LEU A 56 13.185 -21.809 86.684 1.00 0.00 H new ATOM 0 HB3 LEU A 56 12.726 -20.366 87.566 1.00 0.00 H new ATOM 0 HG LEU A 56 10.376 -20.829 86.277 1.00 0.00 H new ATOM 0 HD11 LEU A 56 9.945 -23.280 86.288 1.00 0.00 H new ATOM 0 HD12 LEU A 56 11.252 -22.869 85.152 1.00 0.00 H new ATOM 0 HD13 LEU A 56 11.641 -23.576 86.738 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.639 -21.955 88.376 1.00 0.00 H new ATOM 0 HD22 LEU A 56 11.339 -22.254 88.810 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.720 -20.587 88.735 1.00 0.00 H new ATOM 888 N LYS A 57 10.746 -20.528 83.996 1.00 0.00 N ATOM 889 CA LYS A 57 10.069 -21.094 82.802 1.00 0.00 C ATOM 890 C LYS A 57 10.757 -20.466 81.589 1.00 0.00 C ATOM 891 O LYS A 57 11.894 -20.774 81.286 1.00 0.00 O ATOM 892 CB LYS A 57 8.577 -20.720 82.826 1.00 0.00 C ATOM 893 CG LYS A 57 7.816 -21.519 81.751 1.00 0.00 C ATOM 894 CD LYS A 57 6.965 -22.609 82.412 1.00 0.00 C ATOM 895 CE LYS A 57 7.873 -23.653 83.068 1.00 0.00 C ATOM 896 NZ LYS A 57 8.857 -24.158 82.069 1.00 0.00 N ATOM 0 H LYS A 57 10.159 -19.951 84.599 1.00 0.00 H new ATOM 0 HA LYS A 57 10.136 -22.182 82.774 1.00 0.00 H new ATOM 0 HB2 LYS A 57 8.157 -20.928 83.810 1.00 0.00 H new ATOM 0 HB3 LYS A 57 8.459 -19.651 82.648 1.00 0.00 H new ATOM 0 HG2 LYS A 57 7.179 -20.850 81.172 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.522 -21.970 81.054 1.00 0.00 H new ATOM 0 HD2 LYS A 57 6.307 -22.166 83.159 1.00 0.00 H new ATOM 0 HD3 LYS A 57 6.327 -23.086 81.668 1.00 0.00 H new ATOM 0 HE2 LYS A 57 8.395 -23.213 83.918 1.00 0.00 H new ATOM 0 HE3 LYS A 57 7.275 -24.479 83.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 8.842 -25.198 82.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 8.606 -23.802 81.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 9.810 -23.827 82.322 1.00 0.00 H new ATOM 910 N GLY A 58 10.119 -19.543 80.923 1.00 0.00 N ATOM 911 CA GLY A 58 10.794 -18.866 79.786 1.00 0.00 C ATOM 912 C GLY A 58 11.851 -17.941 80.390 1.00 0.00 C ATOM 913 O GLY A 58 12.666 -18.371 81.178 1.00 0.00 O ATOM 0 H GLY A 58 9.167 -19.232 81.117 1.00 0.00 H new ATOM 0 HA2 GLY A 58 11.254 -19.595 79.119 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.077 -18.299 79.192 1.00 0.00 H new ATOM 917 N ALA A 59 11.833 -16.673 80.075 1.00 0.00 N ATOM 918 CA ALA A 59 12.834 -15.757 80.695 1.00 0.00 C ATOM 919 C ALA A 59 12.714 -14.348 80.112 1.00 0.00 C ATOM 920 O ALA A 59 13.486 -13.947 79.262 1.00 0.00 O ATOM 921 CB ALA A 59 14.258 -16.293 80.478 1.00 0.00 C ATOM 0 H ALA A 59 11.179 -16.237 79.425 1.00 0.00 H new ATOM 0 HA ALA A 59 12.632 -15.710 81.765 1.00 0.00 H new ATOM 0 HB1 ALA A 59 14.976 -15.613 80.936 1.00 0.00 H new ATOM 0 HB2 ALA A 59 14.349 -17.279 80.934 1.00 0.00 H new ATOM 0 HB3 ALA A 59 14.460 -16.368 79.409 1.00 0.00 H new ATOM 927 N ASP A 60 11.776 -13.580 80.593 1.00 0.00 N ATOM 928 CA ASP A 60 11.634 -12.182 80.109 1.00 0.00 C ATOM 929 C ASP A 60 12.754 -11.376 80.765 1.00 0.00 C ATOM 930 O ASP A 60 12.862 -10.173 80.625 1.00 0.00 O ATOM 931 CB ASP A 60 10.271 -11.639 80.532 1.00 0.00 C ATOM 932 CG ASP A 60 9.998 -10.326 79.806 1.00 0.00 C ATOM 933 OD1 ASP A 60 10.685 -9.363 80.094 1.00 0.00 O ATOM 934 OD2 ASP A 60 9.103 -10.306 78.976 1.00 0.00 O ATOM 0 H ASP A 60 11.100 -13.863 81.303 1.00 0.00 H new ATOM 0 HA ASP A 60 11.701 -12.121 79.023 1.00 0.00 H new ATOM 0 HB2 ASP A 60 9.491 -12.364 80.300 1.00 0.00 H new ATOM 0 HB3 ASP A 60 10.249 -11.482 81.610 1.00 0.00 H new ATOM 939 N ILE A 61 13.580 -12.073 81.494 1.00 0.00 N ATOM 940 CA ILE A 61 14.722 -11.449 82.214 1.00 0.00 C ATOM 941 C ILE A 61 15.528 -10.566 81.268 1.00 0.00 C ATOM 942 O ILE A 61 16.226 -9.665 81.686 1.00 0.00 O ATOM 943 CB ILE A 61 15.620 -12.578 82.713 1.00 0.00 C ATOM 944 CG1 ILE A 61 16.672 -12.028 83.676 1.00 0.00 C ATOM 945 CG2 ILE A 61 16.316 -13.226 81.513 1.00 0.00 C ATOM 946 CD1 ILE A 61 17.741 -13.096 83.928 1.00 0.00 C ATOM 0 H ILE A 61 13.507 -13.082 81.623 1.00 0.00 H new ATOM 0 HA ILE A 61 14.353 -10.836 83.036 1.00 0.00 H new ATOM 0 HB ILE A 61 15.014 -13.317 83.238 1.00 0.00 H new ATOM 0 HG12 ILE A 61 17.130 -11.131 83.258 1.00 0.00 H new ATOM 0 HG13 ILE A 61 16.203 -11.738 84.616 1.00 0.00 H new ATOM 0 HG21 ILE A 61 16.960 -14.034 81.859 1.00 0.00 H new ATOM 0 HG22 ILE A 61 15.567 -13.626 80.830 1.00 0.00 H new ATOM 0 HG23 ILE A 61 16.917 -12.479 80.994 1.00 0.00 H new ATOM 0 HD11 ILE A 61 18.492 -12.705 84.615 1.00 0.00 H new ATOM 0 HD12 ILE A 61 17.276 -13.980 84.364 1.00 0.00 H new ATOM 0 HD13 ILE A 61 18.217 -13.364 82.985 1.00 0.00 H new ATOM 958 N ASN A 62 15.463 -10.841 80.001 1.00 0.00 N ATOM 959 CA ASN A 62 16.257 -10.045 79.023 1.00 0.00 C ATOM 960 C ASN A 62 15.382 -9.614 77.834 1.00 0.00 C ATOM 961 O ASN A 62 15.596 -8.578 77.240 1.00 0.00 O ATOM 962 CB ASN A 62 17.425 -10.912 78.533 1.00 0.00 C ATOM 963 CG ASN A 62 16.915 -12.317 78.192 1.00 0.00 C ATOM 964 OD1 ASN A 62 15.643 -12.581 78.300 1.00 0.00 O flip ATOM 965 ND2 ASN A 62 17.686 -13.184 77.828 1.00 0.00 N flip ATOM 0 H ASN A 62 14.894 -11.584 79.595 1.00 0.00 H new ATOM 0 HA ASN A 62 16.633 -9.142 79.504 1.00 0.00 H new ATOM 0 HB2 ASN A 62 17.885 -10.458 77.655 1.00 0.00 H new ATOM 0 HB3 ASN A 62 18.195 -10.970 79.302 1.00 0.00 H new ATOM 0 HD21 ASN A 62 18.681 -12.978 77.743 1.00 0.00 H new ATOM 0 HD22 ASN A 62 17.337 -14.117 77.607 1.00 0.00 H new ATOM 972 N ALA A 63 14.402 -10.405 77.500 1.00 0.00 N ATOM 973 CA ALA A 63 13.480 -10.096 76.347 1.00 0.00 C ATOM 974 C ALA A 63 13.413 -8.591 75.975 1.00 0.00 C ATOM 975 O ALA A 63 13.652 -8.250 74.839 1.00 0.00 O ATOM 976 CB ALA A 63 12.082 -10.590 76.693 1.00 0.00 C ATOM 0 H ALA A 63 14.188 -11.277 77.984 1.00 0.00 H new ATOM 0 HA ALA A 63 13.886 -10.607 75.474 1.00 0.00 H new ATOM 0 HB1 ALA A 63 11.405 -10.373 75.867 1.00 0.00 H new ATOM 0 HB2 ALA A 63 12.109 -11.666 76.867 1.00 0.00 H new ATOM 0 HB3 ALA A 63 11.730 -10.086 77.593 1.00 0.00 H new ATOM 982 N PRO A 64 13.066 -7.740 76.922 1.00 0.00 N ATOM 983 CA PRO A 64 12.944 -6.294 76.711 1.00 0.00 C ATOM 984 C PRO A 64 13.625 -5.783 75.439 1.00 0.00 C ATOM 985 O PRO A 64 14.742 -6.135 75.111 1.00 0.00 O ATOM 986 CB PRO A 64 13.556 -5.745 77.993 1.00 0.00 C ATOM 987 CG PRO A 64 13.320 -6.846 79.073 1.00 0.00 C ATOM 988 CD PRO A 64 12.817 -8.096 78.325 1.00 0.00 C ATOM 0 HA PRO A 64 11.917 -5.972 76.540 1.00 0.00 H new ATOM 0 HB2 PRO A 64 14.619 -5.543 77.865 1.00 0.00 H new ATOM 0 HB3 PRO A 64 13.085 -4.805 78.281 1.00 0.00 H new ATOM 0 HG2 PRO A 64 14.242 -7.063 79.613 1.00 0.00 H new ATOM 0 HG3 PRO A 64 12.588 -6.515 79.810 1.00 0.00 H new ATOM 0 HD2 PRO A 64 13.361 -8.993 78.620 1.00 0.00 H new ATOM 0 HD3 PRO A 64 11.761 -8.287 78.515 1.00 0.00 H new ATOM 996 N ASP A 65 12.912 -4.942 74.723 1.00 0.00 N ATOM 997 CA ASP A 65 13.414 -4.345 73.449 1.00 0.00 C ATOM 998 C ASP A 65 12.966 -2.875 73.396 1.00 0.00 C ATOM 999 O ASP A 65 13.750 -1.984 73.120 1.00 0.00 O ATOM 1000 CB ASP A 65 12.807 -5.101 72.262 1.00 0.00 C ATOM 1001 CG ASP A 65 13.583 -6.399 72.033 1.00 0.00 C ATOM 1002 OD1 ASP A 65 14.775 -6.406 72.292 1.00 0.00 O ATOM 1003 OD2 ASP A 65 12.972 -7.362 71.604 1.00 0.00 O ATOM 0 H ASP A 65 11.973 -4.638 74.982 1.00 0.00 H new ATOM 0 HA ASP A 65 14.501 -4.412 73.402 1.00 0.00 H new ATOM 0 HB2 ASP A 65 11.757 -5.322 72.456 1.00 0.00 H new ATOM 0 HB3 ASP A 65 12.842 -4.481 71.366 1.00 0.00 H new ATOM 1008 N LYS A 66 11.711 -2.621 73.669 1.00 0.00 N ATOM 1009 CA LYS A 66 11.191 -1.227 73.656 1.00 0.00 C ATOM 1010 C LYS A 66 11.407 -0.619 75.042 1.00 0.00 C ATOM 1011 O LYS A 66 11.569 0.572 75.206 1.00 0.00 O ATOM 1012 CB LYS A 66 9.694 -1.276 73.348 1.00 0.00 C ATOM 1013 CG LYS A 66 9.233 0.057 72.761 1.00 0.00 C ATOM 1014 CD LYS A 66 9.345 1.176 73.807 1.00 0.00 C ATOM 1015 CE LYS A 66 8.310 2.268 73.511 1.00 0.00 C ATOM 1016 NZ LYS A 66 6.979 1.853 74.038 1.00 0.00 N ATOM 0 H LYS A 66 11.019 -3.332 73.903 1.00 0.00 H new ATOM 0 HA LYS A 66 11.704 -0.626 72.905 1.00 0.00 H new ATOM 0 HB2 LYS A 66 9.486 -2.083 72.645 1.00 0.00 H new ATOM 0 HB3 LYS A 66 9.135 -1.494 74.258 1.00 0.00 H new ATOM 0 HG2 LYS A 66 9.838 0.305 71.889 1.00 0.00 H new ATOM 0 HG3 LYS A 66 8.201 -0.027 72.420 1.00 0.00 H new ATOM 0 HD2 LYS A 66 9.184 0.770 74.806 1.00 0.00 H new ATOM 0 HD3 LYS A 66 10.349 1.600 73.793 1.00 0.00 H new ATOM 0 HE2 LYS A 66 8.617 3.208 73.970 1.00 0.00 H new ATOM 0 HE3 LYS A 66 8.248 2.443 72.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.237 2.445 73.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 6.806 0.856 73.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 6.963 1.969 75.071 1.00 0.00 H new ATOM 1030 N HIS A 67 11.421 -1.456 76.040 1.00 0.00 N ATOM 1031 CA HIS A 67 11.631 -0.986 77.433 1.00 0.00 C ATOM 1032 C HIS A 67 13.111 -0.677 77.633 1.00 0.00 C ATOM 1033 O HIS A 67 13.532 -0.236 78.683 1.00 0.00 O ATOM 1034 CB HIS A 67 11.200 -2.108 78.382 1.00 0.00 C ATOM 1035 CG HIS A 67 9.970 -2.783 77.834 1.00 0.00 C ATOM 1036 ND1 HIS A 67 9.188 -2.206 76.844 1.00 0.00 N ATOM 1037 CD2 HIS A 67 9.375 -3.986 78.126 1.00 0.00 C ATOM 1038 CE1 HIS A 67 8.177 -3.054 76.579 1.00 0.00 C ATOM 1039 NE2 HIS A 67 8.243 -4.154 77.332 1.00 0.00 N ATOM 0 H HIS A 67 11.293 -2.464 75.945 1.00 0.00 H new ATOM 0 HA HIS A 67 11.049 -0.086 77.632 1.00 0.00 H new ATOM 0 HB2 HIS A 67 12.006 -2.833 78.495 1.00 0.00 H new ATOM 0 HB3 HIS A 67 10.995 -1.702 79.373 1.00 0.00 H new ATOM 0 HD2 HIS A 67 9.731 -4.694 78.860 1.00 0.00 H new ATOM 0 HE1 HIS A 67 7.406 -2.867 75.846 1.00 0.00 H new ATOM 0 HE2 HIS A 67 7.602 -4.947 77.327 1.00 0.00 H new ATOM 1047 N HIS A 68 13.899 -0.897 76.615 1.00 0.00 N ATOM 1048 CA HIS A 68 15.362 -0.619 76.704 1.00 0.00 C ATOM 1049 C HIS A 68 15.888 -0.940 78.099 1.00 0.00 C ATOM 1050 O HIS A 68 16.859 -0.367 78.547 1.00 0.00 O ATOM 1051 CB HIS A 68 15.621 0.857 76.401 1.00 0.00 C ATOM 1052 CG HIS A 68 17.103 1.084 76.273 1.00 0.00 C ATOM 1053 ND1 HIS A 68 17.851 0.522 75.251 1.00 0.00 N ATOM 1054 CD2 HIS A 68 17.991 1.805 77.034 1.00 0.00 C ATOM 1055 CE1 HIS A 68 19.128 0.909 75.422 1.00 0.00 C ATOM 1056 NE2 HIS A 68 19.269 1.692 76.494 1.00 0.00 N ATOM 0 H HIS A 68 13.588 -1.262 75.715 1.00 0.00 H new ATOM 0 HA HIS A 68 15.878 -1.248 75.978 1.00 0.00 H new ATOM 0 HB2 HIS A 68 15.116 1.145 75.479 1.00 0.00 H new ATOM 0 HB3 HIS A 68 15.213 1.481 77.196 1.00 0.00 H new ATOM 0 HD1 HIS A 68 17.498 -0.077 74.504 1.00 0.00 H new ATOM 0 HD2 HIS A 68 17.736 2.373 77.917 1.00 0.00 H new ATOM 0 HE1 HIS A 68 19.940 0.621 74.771 1.00 0.00 H new ATOM 1064 N ILE A 69 15.273 -1.853 78.796 1.00 0.00 N ATOM 1065 CA ILE A 69 15.784 -2.180 80.145 1.00 0.00 C ATOM 1066 C ILE A 69 15.348 -3.577 80.563 1.00 0.00 C ATOM 1067 O ILE A 69 14.331 -4.094 80.148 1.00 0.00 O ATOM 1068 CB ILE A 69 15.284 -1.148 81.169 1.00 0.00 C ATOM 1069 CG1 ILE A 69 16.475 -0.601 81.961 1.00 0.00 C ATOM 1070 CG2 ILE A 69 14.278 -1.787 82.137 1.00 0.00 C ATOM 1071 CD1 ILE A 69 17.197 -1.733 82.702 1.00 0.00 C ATOM 0 H ILE A 69 14.452 -2.377 78.493 1.00 0.00 H new ATOM 0 HA ILE A 69 16.873 -2.151 80.112 1.00 0.00 H new ATOM 0 HB ILE A 69 14.787 -0.338 80.635 1.00 0.00 H new ATOM 0 HG12 ILE A 69 17.169 -0.101 81.285 1.00 0.00 H new ATOM 0 HG13 ILE A 69 16.131 0.147 82.675 1.00 0.00 H new ATOM 0 HG21 ILE A 69 13.937 -1.039 82.853 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.425 -2.168 81.576 1.00 0.00 H new ATOM 0 HG23 ILE A 69 14.757 -2.608 82.670 1.00 0.00 H new ATOM 0 HD11 ILE A 69 18.040 -1.324 83.259 1.00 0.00 H new ATOM 0 HD12 ILE A 69 16.505 -2.215 83.393 1.00 0.00 H new ATOM 0 HD13 ILE A 69 17.560 -2.466 81.982 1.00 0.00 H new ATOM 1083 N THR A 70 16.130 -4.169 81.415 1.00 0.00 N ATOM 1084 CA THR A 70 15.819 -5.510 81.941 1.00 0.00 C ATOM 1085 C THR A 70 15.351 -5.305 83.391 1.00 0.00 C ATOM 1086 O THR A 70 15.588 -4.260 83.960 1.00 0.00 O ATOM 1087 CB THR A 70 17.077 -6.368 81.836 1.00 0.00 C ATOM 1088 OG1 THR A 70 17.090 -7.348 82.851 1.00 0.00 O ATOM 1089 CG2 THR A 70 18.305 -5.459 81.946 1.00 0.00 C ATOM 0 H THR A 70 16.994 -3.763 81.775 1.00 0.00 H new ATOM 0 HA THR A 70 15.035 -6.026 81.386 1.00 0.00 H new ATOM 0 HB THR A 70 17.092 -6.883 80.875 1.00 0.00 H new ATOM 0 HG1 THR A 70 16.925 -8.230 82.457 1.00 0.00 H new ATOM 0 HG21 THR A 70 19.211 -6.061 81.872 1.00 0.00 H new ATOM 0 HG22 THR A 70 18.289 -4.727 81.139 1.00 0.00 H new ATOM 0 HG23 THR A 70 18.290 -4.942 82.905 1.00 0.00 H new ATOM 1097 N PRO A 71 14.628 -6.243 83.926 1.00 0.00 N ATOM 1098 CA PRO A 71 14.048 -6.098 85.275 1.00 0.00 C ATOM 1099 C PRO A 71 15.079 -6.121 86.425 1.00 0.00 C ATOM 1100 O PRO A 71 14.749 -5.725 87.522 1.00 0.00 O ATOM 1101 CB PRO A 71 13.065 -7.280 85.382 1.00 0.00 C ATOM 1102 CG PRO A 71 13.035 -7.961 83.990 1.00 0.00 C ATOM 1103 CD PRO A 71 14.305 -7.520 83.270 1.00 0.00 C ATOM 0 HA PRO A 71 13.579 -5.121 85.386 1.00 0.00 H new ATOM 0 HB2 PRO A 71 13.387 -7.983 86.150 1.00 0.00 H new ATOM 0 HB3 PRO A 71 12.071 -6.933 85.665 1.00 0.00 H new ATOM 0 HG2 PRO A 71 13.001 -9.046 84.089 1.00 0.00 H new ATOM 0 HG3 PRO A 71 12.148 -7.664 83.431 1.00 0.00 H new ATOM 0 HD2 PRO A 71 15.108 -8.248 83.385 1.00 0.00 H new ATOM 0 HD3 PRO A 71 14.140 -7.394 82.200 1.00 0.00 H new ATOM 1111 N LEU A 72 16.298 -6.567 86.248 1.00 0.00 N ATOM 1112 CA LEU A 72 17.208 -6.553 87.435 1.00 0.00 C ATOM 1113 C LEU A 72 17.309 -5.125 87.966 1.00 0.00 C ATOM 1114 O LEU A 72 17.313 -4.912 89.156 1.00 0.00 O ATOM 1115 CB LEU A 72 18.637 -7.077 87.132 1.00 0.00 C ATOM 1116 CG LEU A 72 18.720 -7.936 85.860 1.00 0.00 C ATOM 1117 CD1 LEU A 72 17.479 -8.827 85.695 1.00 0.00 C ATOM 1118 CD2 LEU A 72 18.896 -7.027 84.643 1.00 0.00 C ATOM 0 H LEU A 72 16.690 -6.925 85.377 1.00 0.00 H new ATOM 0 HA LEU A 72 16.773 -7.229 88.171 1.00 0.00 H new ATOM 0 HB2 LEU A 72 19.313 -6.228 87.032 1.00 0.00 H new ATOM 0 HB3 LEU A 72 18.987 -7.664 87.981 1.00 0.00 H new ATOM 0 HG LEU A 72 19.582 -8.598 85.947 1.00 0.00 H new ATOM 0 HD11 LEU A 72 17.575 -9.419 84.785 1.00 0.00 H new ATOM 0 HD12 LEU A 72 17.392 -9.493 86.554 1.00 0.00 H new ATOM 0 HD13 LEU A 72 16.588 -8.202 85.629 1.00 0.00 H new ATOM 0 HD21 LEU A 72 18.955 -7.635 83.740 1.00 0.00 H new ATOM 0 HD22 LEU A 72 18.046 -6.349 84.569 1.00 0.00 H new ATOM 0 HD23 LEU A 72 19.813 -6.448 84.751 1.00 0.00 H new ATOM 1130 N LEU A 73 17.378 -4.147 87.100 1.00 0.00 N ATOM 1131 CA LEU A 73 17.471 -2.741 87.595 1.00 0.00 C ATOM 1132 C LEU A 73 16.129 -2.330 88.194 1.00 0.00 C ATOM 1133 O LEU A 73 16.054 -1.476 89.049 1.00 0.00 O ATOM 1134 CB LEU A 73 17.851 -1.801 86.456 1.00 0.00 C ATOM 1135 CG LEU A 73 19.161 -2.287 85.825 1.00 0.00 C ATOM 1136 CD1 LEU A 73 18.868 -3.324 84.733 1.00 0.00 C ATOM 1137 CD2 LEU A 73 19.905 -1.103 85.214 1.00 0.00 C ATOM 0 H LEU A 73 17.374 -4.258 86.086 1.00 0.00 H new ATOM 0 HA LEU A 73 18.244 -2.679 88.361 1.00 0.00 H new ATOM 0 HB2 LEU A 73 17.059 -1.777 85.708 1.00 0.00 H new ATOM 0 HB3 LEU A 73 17.968 -0.784 86.830 1.00 0.00 H new ATOM 0 HG LEU A 73 19.777 -2.747 86.598 1.00 0.00 H new ATOM 0 HD11 LEU A 73 19.805 -3.662 84.292 1.00 0.00 H new ATOM 0 HD12 LEU A 73 18.345 -4.175 85.170 1.00 0.00 H new ATOM 0 HD13 LEU A 73 18.245 -2.873 83.961 1.00 0.00 H new ATOM 0 HD21 LEU A 73 20.836 -1.450 84.766 1.00 0.00 H new ATOM 0 HD22 LEU A 73 19.284 -0.639 84.447 1.00 0.00 H new ATOM 0 HD23 LEU A 73 20.127 -0.372 85.992 1.00 0.00 H new ATOM 1149 N SER A 74 15.064 -2.941 87.765 1.00 0.00 N ATOM 1150 CA SER A 74 13.747 -2.582 88.336 1.00 0.00 C ATOM 1151 C SER A 74 13.798 -2.751 89.863 1.00 0.00 C ATOM 1152 O SER A 74 13.382 -1.887 90.616 1.00 0.00 O ATOM 1153 CB SER A 74 12.674 -3.487 87.736 1.00 0.00 C ATOM 1154 OG SER A 74 11.399 -3.109 88.237 1.00 0.00 O ATOM 0 H SER A 74 15.051 -3.668 87.049 1.00 0.00 H new ATOM 0 HA SER A 74 13.505 -1.545 88.101 1.00 0.00 H new ATOM 0 HB2 SER A 74 12.686 -3.411 86.649 1.00 0.00 H new ATOM 0 HB3 SER A 74 12.880 -4.528 87.985 1.00 0.00 H new ATOM 0 HG SER A 74 10.778 -2.983 87.489 1.00 0.00 H new ATOM 1160 N ALA A 75 14.313 -3.856 90.328 1.00 0.00 N ATOM 1161 CA ALA A 75 14.392 -4.078 91.806 1.00 0.00 C ATOM 1162 C ALA A 75 15.452 -3.162 92.424 1.00 0.00 C ATOM 1163 O ALA A 75 15.306 -2.683 93.531 1.00 0.00 O ATOM 1164 CB ALA A 75 14.756 -5.534 92.084 1.00 0.00 C ATOM 0 H ALA A 75 14.682 -4.614 89.754 1.00 0.00 H new ATOM 0 HA ALA A 75 13.423 -3.849 92.249 1.00 0.00 H new ATOM 0 HB1 ALA A 75 14.814 -5.696 93.160 1.00 0.00 H new ATOM 0 HB2 ALA A 75 13.994 -6.187 91.659 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.721 -5.761 91.631 1.00 0.00 H new ATOM 1170 N VAL A 76 16.524 -2.928 91.723 1.00 0.00 N ATOM 1171 CA VAL A 76 17.606 -2.063 92.267 1.00 0.00 C ATOM 1172 C VAL A 76 17.009 -0.825 92.944 1.00 0.00 C ATOM 1173 O VAL A 76 17.113 -0.654 94.142 1.00 0.00 O ATOM 1174 CB VAL A 76 18.531 -1.655 91.120 1.00 0.00 C ATOM 1175 CG1 VAL A 76 19.502 -0.569 91.591 1.00 0.00 C ATOM 1176 CG2 VAL A 76 19.310 -2.892 90.659 1.00 0.00 C ATOM 0 H VAL A 76 16.699 -3.301 90.790 1.00 0.00 H new ATOM 0 HA VAL A 76 18.175 -2.612 93.017 1.00 0.00 H new ATOM 0 HB VAL A 76 17.944 -1.257 90.293 1.00 0.00 H new ATOM 0 HG11 VAL A 76 20.157 -0.285 90.768 1.00 0.00 H new ATOM 0 HG12 VAL A 76 18.939 0.303 91.925 1.00 0.00 H new ATOM 0 HG13 VAL A 76 20.102 -0.951 92.417 1.00 0.00 H new ATOM 0 HG21 VAL A 76 19.975 -2.619 89.840 1.00 0.00 H new ATOM 0 HG22 VAL A 76 19.898 -3.282 91.490 1.00 0.00 H new ATOM 0 HG23 VAL A 76 18.611 -3.656 90.319 1.00 0.00 H new ATOM 1186 N TYR A 77 16.384 0.041 92.197 1.00 0.00 N ATOM 1187 CA TYR A 77 15.787 1.253 92.821 1.00 0.00 C ATOM 1188 C TYR A 77 14.559 0.843 93.639 1.00 0.00 C ATOM 1189 O TYR A 77 13.555 1.526 93.655 1.00 0.00 O ATOM 1190 CB TYR A 77 15.367 2.248 91.731 1.00 0.00 C ATOM 1191 CG TYR A 77 16.194 2.043 90.477 1.00 0.00 C ATOM 1192 CD1 TYR A 77 17.399 2.739 90.306 1.00 0.00 C ATOM 1193 CD2 TYR A 77 15.742 1.174 89.474 1.00 0.00 C ATOM 1194 CE1 TYR A 77 18.150 2.563 89.136 1.00 0.00 C ATOM 1195 CE2 TYR A 77 16.494 1.003 88.304 1.00 0.00 C ATOM 1196 CZ TYR A 77 17.698 1.697 88.137 1.00 0.00 C ATOM 1197 OH TYR A 77 18.438 1.526 86.987 1.00 0.00 O ATOM 0 H TYR A 77 16.261 -0.037 91.187 1.00 0.00 H new ATOM 0 HA TYR A 77 16.523 1.726 93.471 1.00 0.00 H new ATOM 0 HB2 TYR A 77 14.309 2.119 91.501 1.00 0.00 H new ATOM 0 HB3 TYR A 77 15.493 3.268 92.094 1.00 0.00 H new ATOM 0 HD1 TYR A 77 17.748 3.411 91.076 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.814 0.636 89.603 1.00 0.00 H new ATOM 0 HE1 TYR A 77 19.079 3.097 89.006 1.00 0.00 H new ATOM 0 HE2 TYR A 77 16.144 0.335 87.531 1.00 0.00 H new ATOM 0 HH TYR A 77 17.836 1.477 86.215 1.00 0.00 H new ATOM 1207 N GLU A 78 14.635 -0.273 94.318 1.00 0.00 N ATOM 1208 CA GLU A 78 13.476 -0.738 95.140 1.00 0.00 C ATOM 1209 C GLU A 78 13.935 -0.994 96.574 1.00 0.00 C ATOM 1210 O GLU A 78 13.159 -0.941 97.505 1.00 0.00 O ATOM 1211 CB GLU A 78 12.934 -2.050 94.561 1.00 0.00 C ATOM 1212 CG GLU A 78 11.475 -2.237 94.984 1.00 0.00 C ATOM 1213 CD GLU A 78 10.575 -1.421 94.058 1.00 0.00 C ATOM 1214 OE1 GLU A 78 10.979 -1.188 92.932 1.00 0.00 O ATOM 1215 OE2 GLU A 78 9.501 -1.040 94.491 1.00 0.00 O ATOM 0 H GLU A 78 15.451 -0.884 94.339 1.00 0.00 H new ATOM 0 HA GLU A 78 12.700 0.027 95.128 1.00 0.00 H new ATOM 0 HB2 GLU A 78 13.009 -2.037 93.474 1.00 0.00 H new ATOM 0 HB3 GLU A 78 13.535 -2.889 94.912 1.00 0.00 H new ATOM 0 HG2 GLU A 78 11.203 -3.292 94.939 1.00 0.00 H new ATOM 0 HG3 GLU A 78 11.340 -1.917 96.017 1.00 0.00 H new ATOM 1222 N GLY A 79 15.188 -1.307 96.758 1.00 0.00 N ATOM 1223 CA GLY A 79 15.678 -1.609 98.128 1.00 0.00 C ATOM 1224 C GLY A 79 15.375 -3.078 98.408 1.00 0.00 C ATOM 1225 O GLY A 79 15.699 -3.612 99.448 1.00 0.00 O ATOM 0 H GLY A 79 15.890 -1.366 96.020 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.748 -1.417 98.204 1.00 0.00 H new ATOM 0 HA3 GLY A 79 15.187 -0.969 98.861 1.00 0.00 H new ATOM 1229 N HIS A 80 14.764 -3.737 97.457 1.00 0.00 N ATOM 1230 CA HIS A 80 14.442 -5.174 97.630 1.00 0.00 C ATOM 1231 C HIS A 80 15.712 -5.964 97.347 1.00 0.00 C ATOM 1232 O HIS A 80 16.236 -6.651 98.197 1.00 0.00 O ATOM 1233 CB HIS A 80 13.364 -5.578 96.612 1.00 0.00 C ATOM 1234 CG HIS A 80 11.994 -5.398 97.204 1.00 0.00 C ATOM 1235 ND1 HIS A 80 11.080 -6.437 97.289 1.00 0.00 N ATOM 1236 CD2 HIS A 80 11.361 -4.300 97.726 1.00 0.00 C ATOM 1237 CE1 HIS A 80 9.957 -5.949 97.835 1.00 0.00 C ATOM 1238 NE2 HIS A 80 10.072 -4.649 98.125 1.00 0.00 N ATOM 0 H HIS A 80 14.475 -3.334 96.566 1.00 0.00 H new ATOM 0 HA HIS A 80 14.076 -5.370 98.638 1.00 0.00 H new ATOM 0 HB2 HIS A 80 13.460 -4.973 95.711 1.00 0.00 H new ATOM 0 HB3 HIS A 80 13.506 -6.617 96.315 1.00 0.00 H new ATOM 0 HD2 HIS A 80 11.795 -3.315 97.815 1.00 0.00 H new ATOM 0 HE1 HIS A 80 9.068 -6.534 98.018 1.00 0.00 H new ATOM 0 HE2 HIS A 80 9.368 -4.043 98.547 1.00 0.00 H new ATOM 1246 N VAL A 81 16.198 -5.838 96.146 1.00 0.00 N ATOM 1247 CA VAL A 81 17.437 -6.537 95.726 1.00 0.00 C ATOM 1248 C VAL A 81 17.559 -7.907 96.389 1.00 0.00 C ATOM 1249 O VAL A 81 18.607 -8.528 96.381 1.00 0.00 O ATOM 1250 CB VAL A 81 18.645 -5.636 95.999 1.00 0.00 C ATOM 1251 CG1 VAL A 81 18.804 -4.666 94.809 1.00 0.00 C ATOM 1252 CG2 VAL A 81 18.405 -4.823 97.278 1.00 0.00 C ATOM 0 H VAL A 81 15.774 -5.262 95.419 1.00 0.00 H new ATOM 0 HA VAL A 81 17.397 -6.731 94.654 1.00 0.00 H new ATOM 0 HB VAL A 81 19.542 -6.243 96.122 1.00 0.00 H new ATOM 0 HG11 VAL A 81 19.660 -4.014 94.983 1.00 0.00 H new ATOM 0 HG12 VAL A 81 18.962 -5.236 93.894 1.00 0.00 H new ATOM 0 HG13 VAL A 81 17.902 -4.062 94.709 1.00 0.00 H new ATOM 0 HG21 VAL A 81 19.266 -4.183 97.469 1.00 0.00 H new ATOM 0 HG22 VAL A 81 17.515 -4.206 97.155 1.00 0.00 H new ATOM 0 HG23 VAL A 81 18.263 -5.502 98.119 1.00 0.00 H new ATOM 1262 N SER A 82 16.468 -8.427 96.871 1.00 0.00 N ATOM 1263 CA SER A 82 16.492 -9.802 97.421 1.00 0.00 C ATOM 1264 C SER A 82 16.388 -10.695 96.188 1.00 0.00 C ATOM 1265 O SER A 82 16.751 -11.861 96.181 1.00 0.00 O ATOM 1266 CB SER A 82 15.297 -10.027 98.366 1.00 0.00 C ATOM 1267 OG SER A 82 15.772 -10.200 99.697 1.00 0.00 O ATOM 0 H SER A 82 15.563 -7.958 96.907 1.00 0.00 H new ATOM 0 HA SER A 82 17.387 -10.007 98.009 1.00 0.00 H new ATOM 0 HB2 SER A 82 14.617 -9.177 98.319 1.00 0.00 H new ATOM 0 HB3 SER A 82 14.732 -10.905 98.053 1.00 0.00 H new ATOM 0 HG SER A 82 15.012 -10.342 100.300 1.00 0.00 H new ATOM 1273 N CYS A 83 15.894 -10.097 95.125 1.00 0.00 N ATOM 1274 CA CYS A 83 15.736 -10.800 93.822 1.00 0.00 C ATOM 1275 C CYS A 83 17.064 -10.758 93.058 1.00 0.00 C ATOM 1276 O CYS A 83 17.588 -11.778 92.662 1.00 0.00 O ATOM 1277 CB CYS A 83 14.658 -10.093 92.995 1.00 0.00 C ATOM 1278 SG CYS A 83 15.070 -8.339 92.842 1.00 0.00 S ATOM 0 H CYS A 83 15.588 -9.124 95.114 1.00 0.00 H new ATOM 0 HA CYS A 83 15.446 -11.836 93.998 1.00 0.00 H new ATOM 0 HB2 CYS A 83 14.585 -10.548 92.007 1.00 0.00 H new ATOM 0 HB3 CYS A 83 13.685 -10.209 93.472 1.00 0.00 H new ATOM 0 HG CYS A 83 15.210 -8.034 91.586 1.00 0.00 H new ATOM 1284 N VAL A 84 17.619 -9.583 92.844 1.00 0.00 N ATOM 1285 CA VAL A 84 18.918 -9.504 92.103 1.00 0.00 C ATOM 1286 C VAL A 84 19.798 -10.672 92.537 1.00 0.00 C ATOM 1287 O VAL A 84 20.499 -11.269 91.751 1.00 0.00 O ATOM 1288 CB VAL A 84 19.660 -8.207 92.429 1.00 0.00 C ATOM 1289 CG1 VAL A 84 18.846 -6.992 91.973 1.00 0.00 C ATOM 1290 CG2 VAL A 84 19.904 -8.126 93.930 1.00 0.00 C ATOM 0 H VAL A 84 17.233 -8.689 93.147 1.00 0.00 H new ATOM 0 HA VAL A 84 18.708 -9.536 91.034 1.00 0.00 H new ATOM 0 HB VAL A 84 20.613 -8.205 91.900 1.00 0.00 H new ATOM 0 HG11 VAL A 84 19.390 -6.079 92.213 1.00 0.00 H new ATOM 0 HG12 VAL A 84 18.685 -7.045 90.896 1.00 0.00 H new ATOM 0 HG13 VAL A 84 17.883 -6.986 92.484 1.00 0.00 H new ATOM 0 HG21 VAL A 84 20.433 -7.202 94.163 1.00 0.00 H new ATOM 0 HG22 VAL A 84 18.949 -8.140 94.455 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.505 -8.978 94.247 1.00 0.00 H new ATOM 1300 N LYS A 85 19.768 -10.984 93.801 1.00 0.00 N ATOM 1301 CA LYS A 85 20.603 -12.096 94.319 1.00 0.00 C ATOM 1302 C LYS A 85 20.346 -13.391 93.511 1.00 0.00 C ATOM 1303 O LYS A 85 21.144 -13.768 92.671 1.00 0.00 O ATOM 1304 CB LYS A 85 20.269 -12.302 95.806 1.00 0.00 C ATOM 1305 CG LYS A 85 21.533 -12.134 96.663 1.00 0.00 C ATOM 1306 CD LYS A 85 21.880 -10.647 96.793 1.00 0.00 C ATOM 1307 CE LYS A 85 23.340 -10.494 97.229 1.00 0.00 C ATOM 1308 NZ LYS A 85 24.240 -10.930 96.123 1.00 0.00 N ATOM 0 H LYS A 85 19.196 -10.512 94.501 1.00 0.00 H new ATOM 0 HA LYS A 85 21.659 -11.849 94.212 1.00 0.00 H new ATOM 0 HB2 LYS A 85 19.511 -11.584 96.119 1.00 0.00 H new ATOM 0 HB3 LYS A 85 19.848 -13.296 95.957 1.00 0.00 H new ATOM 0 HG2 LYS A 85 21.374 -12.567 97.651 1.00 0.00 H new ATOM 0 HG3 LYS A 85 22.365 -12.672 96.209 1.00 0.00 H new ATOM 0 HD2 LYS A 85 21.720 -10.142 95.841 1.00 0.00 H new ATOM 0 HD3 LYS A 85 21.221 -10.172 97.520 1.00 0.00 H new ATOM 0 HE2 LYS A 85 23.545 -9.456 97.491 1.00 0.00 H new ATOM 0 HE3 LYS A 85 23.528 -11.091 98.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 25.144 -10.420 96.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 24.413 -11.953 96.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 23.792 -10.721 95.208 1.00 0.00 H new ATOM 1322 N LEU A 86 19.254 -14.084 93.753 1.00 0.00 N ATOM 1323 CA LEU A 86 19.004 -15.350 92.978 1.00 0.00 C ATOM 1324 C LEU A 86 18.850 -15.044 91.488 1.00 0.00 C ATOM 1325 O LEU A 86 18.596 -15.920 90.687 1.00 0.00 O ATOM 1326 CB LEU A 86 17.781 -16.133 93.504 1.00 0.00 C ATOM 1327 CG LEU A 86 16.472 -15.322 93.505 1.00 0.00 C ATOM 1328 CD1 LEU A 86 16.513 -14.220 94.563 1.00 0.00 C ATOM 1329 CD2 LEU A 86 16.192 -14.704 92.130 1.00 0.00 C ATOM 0 H LEU A 86 18.539 -13.837 94.437 1.00 0.00 H new ATOM 0 HA LEU A 86 19.875 -15.990 93.121 1.00 0.00 H new ATOM 0 HB2 LEU A 86 17.643 -17.025 92.893 1.00 0.00 H new ATOM 0 HB3 LEU A 86 17.988 -16.471 94.519 1.00 0.00 H new ATOM 0 HG LEU A 86 15.666 -16.016 93.743 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.577 -13.662 94.543 1.00 0.00 H new ATOM 0 HD12 LEU A 86 16.649 -14.666 95.548 1.00 0.00 H new ATOM 0 HD13 LEU A 86 17.343 -13.545 94.353 1.00 0.00 H new ATOM 0 HD21 LEU A 86 15.261 -14.139 92.168 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.010 -14.037 91.857 1.00 0.00 H new ATOM 0 HD23 LEU A 86 16.106 -15.496 91.386 1.00 0.00 H new ATOM 1341 N LEU A 87 18.987 -13.803 91.104 1.00 0.00 N ATOM 1342 CA LEU A 87 18.825 -13.451 89.662 1.00 0.00 C ATOM 1343 C LEU A 87 20.077 -13.835 88.866 1.00 0.00 C ATOM 1344 O LEU A 87 20.055 -14.783 88.104 1.00 0.00 O ATOM 1345 CB LEU A 87 18.577 -11.947 89.536 1.00 0.00 C ATOM 1346 CG LEU A 87 17.281 -11.698 88.767 1.00 0.00 C ATOM 1347 CD1 LEU A 87 16.893 -10.226 88.889 1.00 0.00 C ATOM 1348 CD2 LEU A 87 17.493 -12.053 87.295 1.00 0.00 C ATOM 0 H LEU A 87 19.203 -13.021 91.722 1.00 0.00 H new ATOM 0 HA LEU A 87 17.977 -14.003 89.258 1.00 0.00 H new ATOM 0 HB2 LEU A 87 18.515 -11.495 90.526 1.00 0.00 H new ATOM 0 HB3 LEU A 87 19.413 -11.473 89.021 1.00 0.00 H new ATOM 0 HG LEU A 87 16.484 -12.316 89.180 1.00 0.00 H new ATOM 0 HD11 LEU A 87 15.968 -10.047 88.341 1.00 0.00 H new ATOM 0 HD12 LEU A 87 16.747 -9.974 89.939 1.00 0.00 H new ATOM 0 HD13 LEU A 87 17.687 -9.605 88.474 1.00 0.00 H new ATOM 0 HD21 LEU A 87 16.570 -11.877 86.742 1.00 0.00 H new ATOM 0 HD22 LEU A 87 18.288 -11.432 86.882 1.00 0.00 H new ATOM 0 HD23 LEU A 87 17.772 -13.103 87.211 1.00 0.00 H new ATOM 1360 N LEU A 88 21.170 -13.114 89.001 1.00 0.00 N ATOM 1361 CA LEU A 88 22.372 -13.488 88.201 1.00 0.00 C ATOM 1362 C LEU A 88 22.636 -14.977 88.365 1.00 0.00 C ATOM 1363 O LEU A 88 23.362 -15.581 87.602 1.00 0.00 O ATOM 1364 CB LEU A 88 23.617 -12.660 88.573 1.00 0.00 C ATOM 1365 CG LEU A 88 24.148 -12.982 89.979 1.00 0.00 C ATOM 1366 CD1 LEU A 88 23.003 -12.999 90.986 1.00 0.00 C ATOM 1367 CD2 LEU A 88 24.866 -14.342 89.981 1.00 0.00 C ATOM 0 H LEU A 88 21.276 -12.306 89.614 1.00 0.00 H new ATOM 0 HA LEU A 88 22.164 -13.263 87.155 1.00 0.00 H new ATOM 0 HB2 LEU A 88 24.403 -12.846 87.841 1.00 0.00 H new ATOM 0 HB3 LEU A 88 23.373 -11.599 88.516 1.00 0.00 H new ATOM 0 HG LEU A 88 24.859 -12.207 90.265 1.00 0.00 H new ATOM 0 HD11 LEU A 88 23.394 -13.228 91.977 1.00 0.00 H new ATOM 0 HD12 LEU A 88 22.519 -12.022 91.004 1.00 0.00 H new ATOM 0 HD13 LEU A 88 22.276 -13.759 90.698 1.00 0.00 H new ATOM 0 HD21 LEU A 88 25.237 -14.556 90.983 1.00 0.00 H new ATOM 0 HD22 LEU A 88 24.168 -15.122 89.678 1.00 0.00 H new ATOM 0 HD23 LEU A 88 25.703 -14.313 89.283 1.00 0.00 H new ATOM 1379 N SER A 89 22.005 -15.591 89.323 1.00 0.00 N ATOM 1380 CA SER A 89 22.176 -17.055 89.483 1.00 0.00 C ATOM 1381 C SER A 89 21.733 -17.693 88.166 1.00 0.00 C ATOM 1382 O SER A 89 22.075 -18.815 87.842 1.00 0.00 O ATOM 1383 CB SER A 89 21.286 -17.555 90.622 1.00 0.00 C ATOM 1384 OG SER A 89 21.718 -18.847 91.028 1.00 0.00 O ATOM 0 H SER A 89 21.383 -15.145 89.997 1.00 0.00 H new ATOM 0 HA SER A 89 23.209 -17.310 89.718 1.00 0.00 H new ATOM 0 HB2 SER A 89 21.331 -16.864 91.463 1.00 0.00 H new ATOM 0 HB3 SER A 89 20.247 -17.593 90.296 1.00 0.00 H new ATOM 0 HG SER A 89 21.149 -19.167 91.759 1.00 0.00 H new ATOM 1390 N LYS A 90 20.967 -16.953 87.405 1.00 0.00 N ATOM 1391 CA LYS A 90 20.469 -17.443 86.094 1.00 0.00 C ATOM 1392 C LYS A 90 21.247 -16.752 84.971 1.00 0.00 C ATOM 1393 O LYS A 90 21.211 -17.168 83.831 1.00 0.00 O ATOM 1394 CB LYS A 90 18.984 -17.086 85.979 1.00 0.00 C ATOM 1395 CG LYS A 90 18.152 -18.119 86.740 1.00 0.00 C ATOM 1396 CD LYS A 90 16.756 -17.553 87.039 1.00 0.00 C ATOM 1397 CE LYS A 90 16.770 -16.830 88.388 1.00 0.00 C ATOM 1398 NZ LYS A 90 17.032 -17.812 89.481 1.00 0.00 N ATOM 0 H LYS A 90 20.662 -16.010 87.647 1.00 0.00 H new ATOM 0 HA LYS A 90 20.603 -18.522 86.015 1.00 0.00 H new ATOM 0 HB2 LYS A 90 18.806 -16.090 86.384 1.00 0.00 H new ATOM 0 HB3 LYS A 90 18.685 -17.062 84.931 1.00 0.00 H new ATOM 0 HG2 LYS A 90 18.065 -19.032 86.152 1.00 0.00 H new ATOM 0 HG3 LYS A 90 18.652 -18.386 87.671 1.00 0.00 H new ATOM 0 HD2 LYS A 90 16.456 -16.864 86.249 1.00 0.00 H new ATOM 0 HD3 LYS A 90 16.022 -18.359 87.055 1.00 0.00 H new ATOM 0 HE2 LYS A 90 17.538 -16.056 88.389 1.00 0.00 H new ATOM 0 HE3 LYS A 90 15.815 -16.332 88.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 16.198 -17.875 90.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 17.229 -18.746 89.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 17.853 -17.500 90.039 1.00 0.00 H new ATOM 1412 N GLY A 91 21.956 -15.700 85.291 1.00 0.00 N ATOM 1413 CA GLY A 91 22.747 -14.971 84.256 1.00 0.00 C ATOM 1414 C GLY A 91 22.390 -13.479 84.273 1.00 0.00 C ATOM 1415 O GLY A 91 22.931 -12.711 85.044 1.00 0.00 O ATOM 0 H GLY A 91 22.021 -15.312 86.232 1.00 0.00 H new ATOM 0 HA2 GLY A 91 23.813 -15.100 84.444 1.00 0.00 H new ATOM 0 HA3 GLY A 91 22.544 -15.390 83.270 1.00 0.00 H new ATOM 1419 N ALA A 92 21.480 -13.068 83.430 1.00 0.00 N ATOM 1420 CA ALA A 92 21.078 -11.631 83.391 1.00 0.00 C ATOM 1421 C ALA A 92 22.308 -10.721 83.395 1.00 0.00 C ATOM 1422 O ALA A 92 22.186 -9.524 83.558 1.00 0.00 O ATOM 1423 CB ALA A 92 20.231 -11.315 84.629 1.00 0.00 C ATOM 0 H ALA A 92 20.995 -13.669 82.763 1.00 0.00 H new ATOM 0 HA ALA A 92 20.510 -11.454 82.478 1.00 0.00 H new ATOM 0 HB1 ALA A 92 19.933 -10.267 84.608 1.00 0.00 H new ATOM 0 HB2 ALA A 92 19.342 -11.945 84.632 1.00 0.00 H new ATOM 0 HB3 ALA A 92 20.815 -11.508 85.529 1.00 0.00 H new ATOM 1429 N ASP A 93 23.482 -11.263 83.229 1.00 0.00 N ATOM 1430 CA ASP A 93 24.708 -10.403 83.251 1.00 0.00 C ATOM 1431 C ASP A 93 24.473 -9.217 84.185 1.00 0.00 C ATOM 1432 O ASP A 93 24.317 -9.381 85.378 1.00 0.00 O ATOM 1433 CB ASP A 93 25.036 -9.907 81.838 1.00 0.00 C ATOM 1434 CG ASP A 93 26.381 -9.177 81.858 1.00 0.00 C ATOM 1435 OD1 ASP A 93 27.193 -9.498 82.710 1.00 0.00 O ATOM 1436 OD2 ASP A 93 26.575 -8.308 81.023 1.00 0.00 O ATOM 0 H ASP A 93 23.650 -12.258 83.080 1.00 0.00 H new ATOM 0 HA ASP A 93 25.553 -10.989 83.613 1.00 0.00 H new ATOM 0 HB2 ASP A 93 25.076 -10.748 81.145 1.00 0.00 H new ATOM 0 HB3 ASP A 93 24.251 -9.238 81.484 1.00 0.00 H new ATOM 1441 N LYS A 94 24.436 -8.029 83.664 1.00 0.00 N ATOM 1442 CA LYS A 94 24.196 -6.856 84.539 1.00 0.00 C ATOM 1443 C LYS A 94 23.802 -5.665 83.676 1.00 0.00 C ATOM 1444 O LYS A 94 22.998 -4.842 84.058 1.00 0.00 O ATOM 1445 CB LYS A 94 25.467 -6.537 85.329 1.00 0.00 C ATOM 1446 CG LYS A 94 25.276 -5.234 86.108 1.00 0.00 C ATOM 1447 CD LYS A 94 24.169 -5.401 87.171 1.00 0.00 C ATOM 1448 CE LYS A 94 22.871 -4.717 86.711 1.00 0.00 C ATOM 1449 NZ LYS A 94 22.089 -4.281 87.900 1.00 0.00 N ATOM 0 H LYS A 94 24.561 -7.819 82.674 1.00 0.00 H new ATOM 0 HA LYS A 94 23.392 -7.075 85.241 1.00 0.00 H new ATOM 0 HB2 LYS A 94 25.694 -7.353 86.016 1.00 0.00 H new ATOM 0 HB3 LYS A 94 26.315 -6.446 84.651 1.00 0.00 H new ATOM 0 HG2 LYS A 94 26.212 -4.950 86.589 1.00 0.00 H new ATOM 0 HG3 LYS A 94 25.013 -4.428 85.423 1.00 0.00 H new ATOM 0 HD2 LYS A 94 23.985 -6.460 87.349 1.00 0.00 H new ATOM 0 HD3 LYS A 94 24.498 -4.971 88.117 1.00 0.00 H new ATOM 0 HE2 LYS A 94 23.104 -3.858 86.081 1.00 0.00 H new ATOM 0 HE3 LYS A 94 22.280 -5.405 86.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 21.096 -4.136 87.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 22.143 -5.012 88.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 22.481 -3.390 88.266 1.00 0.00 H new ATOM 1463 N THR A 95 24.362 -5.569 82.508 1.00 0.00 N ATOM 1464 CA THR A 95 24.019 -4.437 81.608 1.00 0.00 C ATOM 1465 C THR A 95 23.521 -5.012 80.282 1.00 0.00 C ATOM 1466 O THR A 95 24.013 -4.687 79.221 1.00 0.00 O ATOM 1467 CB THR A 95 25.269 -3.573 81.386 1.00 0.00 C ATOM 1468 OG1 THR A 95 26.293 -4.000 82.270 1.00 0.00 O ATOM 1469 CG2 THR A 95 24.941 -2.106 81.663 1.00 0.00 C ATOM 0 H THR A 95 25.046 -6.228 82.135 1.00 0.00 H new ATOM 0 HA THR A 95 23.240 -3.814 82.048 1.00 0.00 H new ATOM 0 HB THR A 95 25.603 -3.678 80.354 1.00 0.00 H new ATOM 0 HG1 THR A 95 27.094 -3.453 82.131 1.00 0.00 H new ATOM 0 HG21 THR A 95 25.831 -1.498 81.504 1.00 0.00 H new ATOM 0 HG22 THR A 95 24.151 -1.776 80.988 1.00 0.00 H new ATOM 0 HG23 THR A 95 24.606 -1.996 82.695 1.00 0.00 H new ATOM 1477 N VAL A 96 22.556 -5.892 80.346 1.00 0.00 N ATOM 1478 CA VAL A 96 22.032 -6.527 79.105 1.00 0.00 C ATOM 1479 C VAL A 96 21.171 -5.544 78.307 1.00 0.00 C ATOM 1480 O VAL A 96 20.932 -5.748 77.133 1.00 0.00 O ATOM 1481 CB VAL A 96 21.153 -7.725 79.480 1.00 0.00 C ATOM 1482 CG1 VAL A 96 20.646 -8.405 78.207 1.00 0.00 C ATOM 1483 CG2 VAL A 96 21.959 -8.727 80.308 1.00 0.00 C ATOM 0 H VAL A 96 22.108 -6.198 81.210 1.00 0.00 H new ATOM 0 HA VAL A 96 22.884 -6.838 78.500 1.00 0.00 H new ATOM 0 HB VAL A 96 20.306 -7.375 80.070 1.00 0.00 H new ATOM 0 HG11 VAL A 96 20.021 -9.257 78.474 1.00 0.00 H new ATOM 0 HG12 VAL A 96 20.061 -7.694 77.623 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.495 -8.749 77.615 1.00 0.00 H new ATOM 0 HG21 VAL A 96 21.326 -9.575 80.570 1.00 0.00 H new ATOM 0 HG22 VAL A 96 22.812 -9.077 79.726 1.00 0.00 H new ATOM 0 HG23 VAL A 96 22.314 -8.244 81.219 1.00 0.00 H new ATOM 1493 N LYS A 97 20.683 -4.490 78.908 1.00 0.00 N ATOM 1494 CA LYS A 97 19.829 -3.559 78.113 1.00 0.00 C ATOM 1495 C LYS A 97 19.717 -2.172 78.772 1.00 0.00 C ATOM 1496 O LYS A 97 19.026 -1.309 78.269 1.00 0.00 O ATOM 1497 CB LYS A 97 18.438 -4.188 77.962 1.00 0.00 C ATOM 1498 CG LYS A 97 17.968 -4.086 76.504 1.00 0.00 C ATOM 1499 CD LYS A 97 18.712 -5.105 75.629 1.00 0.00 C ATOM 1500 CE LYS A 97 17.981 -5.270 74.289 1.00 0.00 C ATOM 1501 NZ LYS A 97 17.009 -6.397 74.379 1.00 0.00 N ATOM 0 H LYS A 97 20.832 -4.238 79.885 1.00 0.00 H new ATOM 0 HA LYS A 97 20.290 -3.409 77.137 1.00 0.00 H new ATOM 0 HB2 LYS A 97 18.468 -5.233 78.270 1.00 0.00 H new ATOM 0 HB3 LYS A 97 17.729 -3.682 78.617 1.00 0.00 H new ATOM 0 HG2 LYS A 97 16.894 -4.265 76.448 1.00 0.00 H new ATOM 0 HG3 LYS A 97 18.143 -3.078 76.128 1.00 0.00 H new ATOM 0 HD2 LYS A 97 19.736 -4.772 75.457 1.00 0.00 H new ATOM 0 HD3 LYS A 97 18.771 -6.065 76.142 1.00 0.00 H new ATOM 0 HE2 LYS A 97 17.460 -4.348 74.033 1.00 0.00 H new ATOM 0 HE3 LYS A 97 18.701 -5.461 73.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 16.719 -6.682 73.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 17.456 -7.204 74.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 16.173 -6.093 74.918 1.00 0.00 H new ATOM 1515 N GLY A 98 20.392 -1.922 79.867 1.00 0.00 N ATOM 1516 CA GLY A 98 20.302 -0.564 80.483 1.00 0.00 C ATOM 1517 C GLY A 98 21.109 0.402 79.617 1.00 0.00 C ATOM 1518 O GLY A 98 21.824 -0.029 78.736 1.00 0.00 O ATOM 0 H GLY A 98 20.992 -2.588 80.354 1.00 0.00 H new ATOM 0 HA2 GLY A 98 19.262 -0.242 80.546 1.00 0.00 H new ATOM 0 HA3 GLY A 98 20.692 -0.581 81.501 1.00 0.00 H new ATOM 1522 N PRO A 99 20.998 1.676 79.890 1.00 0.00 N ATOM 1523 CA PRO A 99 21.741 2.690 79.128 1.00 0.00 C ATOM 1524 C PRO A 99 23.185 2.236 78.969 1.00 0.00 C ATOM 1525 O PRO A 99 23.598 1.792 77.917 1.00 0.00 O ATOM 1526 CB PRO A 99 21.637 3.965 79.978 1.00 0.00 C ATOM 1527 CG PRO A 99 20.618 3.677 81.116 1.00 0.00 C ATOM 1528 CD PRO A 99 20.153 2.212 80.969 1.00 0.00 C ATOM 0 HA PRO A 99 21.351 2.854 78.123 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.610 4.232 80.391 1.00 0.00 H new ATOM 0 HB3 PRO A 99 21.307 4.807 79.370 1.00 0.00 H new ATOM 0 HG2 PRO A 99 21.078 3.836 82.091 1.00 0.00 H new ATOM 0 HG3 PRO A 99 19.768 4.357 81.050 1.00 0.00 H new ATOM 0 HD2 PRO A 99 20.289 1.655 81.896 1.00 0.00 H new ATOM 0 HD3 PRO A 99 19.095 2.153 80.714 1.00 0.00 H new ATOM 1536 N ASP A 100 23.947 2.330 80.010 1.00 0.00 N ATOM 1537 CA ASP A 100 25.359 1.888 79.935 1.00 0.00 C ATOM 1538 C ASP A 100 25.832 1.507 81.337 1.00 0.00 C ATOM 1539 O ASP A 100 25.263 0.653 81.991 1.00 0.00 O ATOM 1540 CB ASP A 100 26.227 3.021 79.374 1.00 0.00 C ATOM 1541 CG ASP A 100 27.670 2.531 79.216 1.00 0.00 C ATOM 1542 OD1 ASP A 100 27.932 1.819 78.259 1.00 0.00 O ATOM 1543 OD2 ASP A 100 28.488 2.877 80.051 1.00 0.00 O ATOM 0 H ASP A 100 23.653 2.696 80.916 1.00 0.00 H new ATOM 0 HA ASP A 100 25.444 1.025 79.275 1.00 0.00 H new ATOM 0 HB2 ASP A 100 25.836 3.350 78.411 1.00 0.00 H new ATOM 0 HB3 ASP A 100 26.195 3.882 80.042 1.00 0.00 H new ATOM 1548 N GLY A 101 26.867 2.133 81.803 1.00 0.00 N ATOM 1549 CA GLY A 101 27.387 1.807 83.158 1.00 0.00 C ATOM 1550 C GLY A 101 26.312 2.072 84.219 1.00 0.00 C ATOM 1551 O GLY A 101 26.531 1.863 85.405 1.00 0.00 O ATOM 0 H GLY A 101 27.380 2.860 81.305 1.00 0.00 H new ATOM 0 HA2 GLY A 101 27.694 0.762 83.195 1.00 0.00 H new ATOM 0 HA3 GLY A 101 28.272 2.407 83.369 1.00 0.00 H new ATOM 1555 N LEU A 102 25.138 2.510 83.826 1.00 0.00 N ATOM 1556 CA LEU A 102 24.090 2.761 84.852 1.00 0.00 C ATOM 1557 C LEU A 102 24.006 1.558 85.745 1.00 0.00 C ATOM 1558 O LEU A 102 24.367 1.622 86.903 1.00 0.00 O ATOM 1559 CB LEU A 102 22.717 2.989 84.209 1.00 0.00 C ATOM 1560 CG LEU A 102 21.679 3.464 85.256 1.00 0.00 C ATOM 1561 CD1 LEU A 102 20.318 3.629 84.584 1.00 0.00 C ATOM 1562 CD2 LEU A 102 21.527 2.446 86.396 1.00 0.00 C ATOM 0 H LEU A 102 24.869 2.699 82.860 1.00 0.00 H new ATOM 0 HA LEU A 102 24.359 3.657 85.412 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.803 3.732 83.416 1.00 0.00 H new ATOM 0 HB3 LEU A 102 22.372 2.065 83.745 1.00 0.00 H new ATOM 0 HG LEU A 102 22.031 4.410 85.667 1.00 0.00 H new ATOM 0 HD11 LEU A 102 19.587 3.963 85.320 1.00 0.00 H new ATOM 0 HD12 LEU A 102 20.393 4.368 83.786 1.00 0.00 H new ATOM 0 HD13 LEU A 102 20.001 2.674 84.165 1.00 0.00 H new ATOM 0 HD21 LEU A 102 20.791 2.810 87.113 1.00 0.00 H new ATOM 0 HD22 LEU A 102 21.195 1.491 85.989 1.00 0.00 H new ATOM 0 HD23 LEU A 102 22.486 2.314 86.896 1.00 0.00 H new ATOM 1574 N THR A 103 23.505 0.467 85.238 1.00 0.00 N ATOM 1575 CA THR A 103 23.368 -0.730 86.100 1.00 0.00 C ATOM 1576 C THR A 103 23.337 -0.260 87.557 1.00 0.00 C ATOM 1577 O THR A 103 22.421 0.422 87.993 1.00 0.00 O ATOM 1578 CB THR A 103 24.552 -1.681 85.888 1.00 0.00 C ATOM 1579 OG1 THR A 103 24.667 -2.540 87.016 1.00 0.00 O ATOM 1580 CG2 THR A 103 25.849 -0.888 85.727 1.00 0.00 C ATOM 0 H THR A 103 23.189 0.356 84.275 1.00 0.00 H new ATOM 0 HA THR A 103 22.453 -1.266 85.849 1.00 0.00 H new ATOM 0 HB THR A 103 24.380 -2.266 84.985 1.00 0.00 H new ATOM 0 HG1 THR A 103 25.606 -2.792 87.141 1.00 0.00 H new ATOM 0 HG21 THR A 103 26.680 -1.577 85.577 1.00 0.00 H new ATOM 0 HG22 THR A 103 25.766 -0.226 84.865 1.00 0.00 H new ATOM 0 HG23 THR A 103 26.026 -0.295 86.624 1.00 0.00 H new ATOM 1588 N ALA A 104 24.330 -0.605 88.308 1.00 0.00 N ATOM 1589 CA ALA A 104 24.367 -0.184 89.738 1.00 0.00 C ATOM 1590 C ALA A 104 25.144 1.137 89.907 1.00 0.00 C ATOM 1591 O ALA A 104 24.955 1.845 90.872 1.00 0.00 O ATOM 1592 CB ALA A 104 25.034 -1.289 90.566 1.00 0.00 C ATOM 0 H ALA A 104 25.126 -1.163 88.000 1.00 0.00 H new ATOM 0 HA ALA A 104 23.346 -0.021 90.084 1.00 0.00 H new ATOM 0 HB1 ALA A 104 25.066 -0.990 91.614 1.00 0.00 H new ATOM 0 HB2 ALA A 104 24.462 -2.212 90.469 1.00 0.00 H new ATOM 0 HB3 ALA A 104 26.049 -1.452 90.204 1.00 0.00 H new ATOM 1598 N LEU A 105 26.041 1.456 89.006 1.00 0.00 N ATOM 1599 CA LEU A 105 26.856 2.694 89.166 1.00 0.00 C ATOM 1600 C LEU A 105 25.997 3.947 89.337 1.00 0.00 C ATOM 1601 O LEU A 105 26.007 4.576 90.381 1.00 0.00 O ATOM 1602 CB LEU A 105 27.720 2.902 87.931 1.00 0.00 C ATOM 1603 CG LEU A 105 28.460 1.619 87.561 1.00 0.00 C ATOM 1604 CD1 LEU A 105 29.485 1.946 86.476 1.00 0.00 C ATOM 1605 CD2 LEU A 105 29.180 1.053 88.791 1.00 0.00 C ATOM 0 H LEU A 105 26.242 0.911 88.168 1.00 0.00 H new ATOM 0 HA LEU A 105 27.458 2.554 90.064 1.00 0.00 H new ATOM 0 HB2 LEU A 105 27.097 3.221 87.096 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.439 3.701 88.115 1.00 0.00 H new ATOM 0 HG LEU A 105 27.749 0.876 87.199 1.00 0.00 H new ATOM 0 HD11 LEU A 105 30.024 1.040 86.199 1.00 0.00 H new ATOM 0 HD12 LEU A 105 28.973 2.346 85.601 1.00 0.00 H new ATOM 0 HD13 LEU A 105 30.190 2.686 86.853 1.00 0.00 H new ATOM 0 HD21 LEU A 105 29.705 0.138 88.516 1.00 0.00 H new ATOM 0 HD22 LEU A 105 29.897 1.785 89.162 1.00 0.00 H new ATOM 0 HD23 LEU A 105 28.450 0.833 89.570 1.00 0.00 H new ATOM 1617 N GLU A 106 25.299 4.347 88.313 1.00 0.00 N ATOM 1618 CA GLU A 106 24.497 5.588 88.402 1.00 0.00 C ATOM 1619 C GLU A 106 23.193 5.323 89.149 1.00 0.00 C ATOM 1620 O GLU A 106 22.437 6.235 89.435 1.00 0.00 O ATOM 1621 CB GLU A 106 24.180 6.069 86.985 1.00 0.00 C ATOM 1622 CG GLU A 106 25.471 6.176 86.173 1.00 0.00 C ATOM 1623 CD GLU A 106 26.384 7.228 86.805 1.00 0.00 C ATOM 1624 OE1 GLU A 106 25.872 8.078 87.515 1.00 0.00 O ATOM 1625 OE2 GLU A 106 27.580 7.167 86.569 1.00 0.00 O ATOM 0 H GLU A 106 25.252 3.863 87.416 1.00 0.00 H new ATOM 0 HA GLU A 106 25.063 6.347 88.943 1.00 0.00 H new ATOM 0 HB2 GLU A 106 23.492 5.376 86.501 1.00 0.00 H new ATOM 0 HB3 GLU A 106 23.682 7.038 87.023 1.00 0.00 H new ATOM 0 HG2 GLU A 106 25.976 5.211 86.144 1.00 0.00 H new ATOM 0 HG3 GLU A 106 25.244 6.448 85.142 1.00 0.00 H new ATOM 1632 N ALA A 107 22.912 4.093 89.468 1.00 0.00 N ATOM 1633 CA ALA A 107 21.643 3.810 90.191 1.00 0.00 C ATOM 1634 C ALA A 107 21.748 4.146 91.680 1.00 0.00 C ATOM 1635 O ALA A 107 20.797 4.618 92.268 1.00 0.00 O ATOM 1636 CB ALA A 107 21.299 2.331 90.076 1.00 0.00 C ATOM 0 H ALA A 107 23.496 3.282 89.264 1.00 0.00 H new ATOM 0 HA ALA A 107 20.872 4.432 89.735 1.00 0.00 H new ATOM 0 HB1 ALA A 107 20.369 2.131 90.608 1.00 0.00 H new ATOM 0 HB2 ALA A 107 21.181 2.066 89.025 1.00 0.00 H new ATOM 0 HB3 ALA A 107 22.101 1.736 90.512 1.00 0.00 H new ATOM 1642 N THR A 108 22.839 3.849 92.332 1.00 0.00 N ATOM 1643 CA THR A 108 22.857 4.112 93.793 1.00 0.00 C ATOM 1644 C THR A 108 24.265 4.189 94.389 1.00 0.00 C ATOM 1645 O THR A 108 25.257 4.409 93.723 1.00 0.00 O ATOM 1646 CB THR A 108 22.165 2.922 94.436 1.00 0.00 C ATOM 1647 OG1 THR A 108 22.147 3.071 95.848 1.00 0.00 O ATOM 1648 CG2 THR A 108 22.951 1.657 94.060 1.00 0.00 C ATOM 0 H THR A 108 23.688 3.450 91.932 1.00 0.00 H new ATOM 0 HA THR A 108 22.379 5.075 93.974 1.00 0.00 H new ATOM 0 HB THR A 108 21.136 2.852 94.084 1.00 0.00 H new ATOM 0 HG1 THR A 108 21.779 3.949 96.080 1.00 0.00 H new ATOM 0 HG21 THR A 108 22.475 0.786 94.510 1.00 0.00 H new ATOM 0 HG22 THR A 108 22.963 1.545 92.976 1.00 0.00 H new ATOM 0 HG23 THR A 108 23.974 1.741 94.427 1.00 0.00 H new ATOM 1656 N ASP A 109 24.310 3.954 95.675 1.00 0.00 N ATOM 1657 CA ASP A 109 25.575 3.936 96.443 1.00 0.00 C ATOM 1658 C ASP A 109 25.432 2.882 97.548 1.00 0.00 C ATOM 1659 O ASP A 109 26.340 2.659 98.324 1.00 0.00 O ATOM 1660 CB ASP A 109 25.846 5.306 97.072 1.00 0.00 C ATOM 1661 CG ASP A 109 27.146 5.244 97.880 1.00 0.00 C ATOM 1662 OD1 ASP A 109 28.087 4.631 97.405 1.00 0.00 O ATOM 1663 OD2 ASP A 109 27.176 5.810 98.961 1.00 0.00 O ATOM 0 H ASP A 109 23.482 3.767 96.240 1.00 0.00 H new ATOM 0 HA ASP A 109 26.408 3.699 95.781 1.00 0.00 H new ATOM 0 HB2 ASP A 109 25.923 6.067 96.295 1.00 0.00 H new ATOM 0 HB3 ASP A 109 25.016 5.593 97.718 1.00 0.00 H new ATOM 1668 N ASN A 110 24.300 2.206 97.607 1.00 0.00 N ATOM 1669 CA ASN A 110 24.123 1.147 98.643 1.00 0.00 C ATOM 1670 C ASN A 110 24.936 -0.057 98.184 1.00 0.00 C ATOM 1671 O ASN A 110 24.930 -0.413 97.024 1.00 0.00 O ATOM 1672 CB ASN A 110 22.640 0.770 98.795 1.00 0.00 C ATOM 1673 CG ASN A 110 22.027 0.550 97.423 1.00 0.00 C ATOM 1674 OD1 ASN A 110 22.636 -0.227 96.591 1.00 0.00 O flip ATOM 1675 ND2 ASN A 110 20.984 1.089 97.110 1.00 0.00 N flip ATOM 0 H ASN A 110 23.503 2.346 96.986 1.00 0.00 H new ATOM 0 HA ASN A 110 24.462 1.501 99.617 1.00 0.00 H new ATOM 0 HB2 ASN A 110 22.544 -0.134 99.397 1.00 0.00 H new ATOM 0 HB3 ASN A 110 22.105 1.561 99.321 1.00 0.00 H new ATOM 0 HD21 ASN A 110 20.508 1.702 97.772 1.00 0.00 H new ATOM 0 HD22 ASN A 110 20.585 0.929 96.185 1.00 0.00 H new ATOM 1682 N GLN A 111 25.681 -0.645 99.066 1.00 0.00 N ATOM 1683 CA GLN A 111 26.558 -1.780 98.668 1.00 0.00 C ATOM 1684 C GLN A 111 25.759 -3.064 98.371 1.00 0.00 C ATOM 1685 O GLN A 111 26.328 -4.105 98.118 1.00 0.00 O ATOM 1686 CB GLN A 111 27.573 -2.010 99.787 1.00 0.00 C ATOM 1687 CG GLN A 111 28.279 -3.349 99.595 1.00 0.00 C ATOM 1688 CD GLN A 111 29.561 -3.351 100.425 1.00 0.00 C ATOM 1689 OE1 GLN A 111 30.313 -2.399 100.397 1.00 0.00 O ATOM 1690 NE2 GLN A 111 29.837 -4.381 101.171 1.00 0.00 N ATOM 0 H GLN A 111 25.724 -0.390 100.053 1.00 0.00 H new ATOM 0 HA GLN A 111 27.068 -1.525 97.739 1.00 0.00 H new ATOM 0 HB2 GLN A 111 28.305 -1.203 99.794 1.00 0.00 H new ATOM 0 HB3 GLN A 111 27.069 -1.992 100.753 1.00 0.00 H new ATOM 0 HG2 GLN A 111 27.628 -4.167 99.904 1.00 0.00 H new ATOM 0 HG3 GLN A 111 28.511 -3.506 98.542 1.00 0.00 H new ATOM 0 HE21 GLN A 111 29.203 -5.180 101.192 1.00 0.00 H new ATOM 0 HE22 GLN A 111 30.687 -4.390 101.734 1.00 0.00 H new ATOM 1699 N ALA A 112 24.456 -3.011 98.357 1.00 0.00 N ATOM 1700 CA ALA A 112 23.678 -4.248 98.042 1.00 0.00 C ATOM 1701 C ALA A 112 23.660 -4.420 96.530 1.00 0.00 C ATOM 1702 O ALA A 112 24.021 -5.447 95.967 1.00 0.00 O ATOM 1703 CB ALA A 112 22.236 -4.090 98.532 1.00 0.00 C ATOM 0 H ALA A 112 23.899 -2.178 98.547 1.00 0.00 H new ATOM 0 HA ALA A 112 24.134 -5.109 98.530 1.00 0.00 H new ATOM 0 HB1 ALA A 112 21.672 -4.994 98.301 1.00 0.00 H new ATOM 0 HB2 ALA A 112 22.234 -3.927 99.610 1.00 0.00 H new ATOM 0 HB3 ALA A 112 21.774 -3.237 98.035 1.00 0.00 H new ATOM 1709 N ILE A 113 23.252 -3.392 95.881 1.00 0.00 N ATOM 1710 CA ILE A 113 23.183 -3.390 94.405 1.00 0.00 C ATOM 1711 C ILE A 113 24.587 -3.321 93.838 1.00 0.00 C ATOM 1712 O ILE A 113 24.926 -4.019 92.900 1.00 0.00 O ATOM 1713 CB ILE A 113 22.387 -2.166 93.995 1.00 0.00 C ATOM 1714 CG1 ILE A 113 20.948 -2.387 94.457 1.00 0.00 C ATOM 1715 CG2 ILE A 113 22.431 -1.983 92.471 1.00 0.00 C ATOM 1716 CD1 ILE A 113 20.364 -1.109 95.066 1.00 0.00 C ATOM 0 H ILE A 113 22.952 -2.521 96.320 1.00 0.00 H new ATOM 0 HA ILE A 113 22.707 -4.295 94.028 1.00 0.00 H new ATOM 0 HB ILE A 113 22.806 -1.268 94.448 1.00 0.00 H new ATOM 0 HG12 ILE A 113 20.336 -2.704 93.613 1.00 0.00 H new ATOM 0 HG13 ILE A 113 20.918 -3.191 95.192 1.00 0.00 H new ATOM 0 HG21 ILE A 113 21.855 -1.100 92.194 1.00 0.00 H new ATOM 0 HG22 ILE A 113 23.465 -1.857 92.149 1.00 0.00 H new ATOM 0 HG23 ILE A 113 22.005 -2.861 91.987 1.00 0.00 H new ATOM 0 HD11 ILE A 113 19.339 -1.294 95.387 1.00 0.00 H new ATOM 0 HD12 ILE A 113 20.964 -0.808 95.925 1.00 0.00 H new ATOM 0 HD13 ILE A 113 20.373 -0.314 94.321 1.00 0.00 H new ATOM 1728 N LYS A 114 25.417 -2.497 94.400 1.00 0.00 N ATOM 1729 CA LYS A 114 26.795 -2.421 93.883 1.00 0.00 C ATOM 1730 C LYS A 114 27.367 -3.842 93.923 1.00 0.00 C ATOM 1731 O LYS A 114 28.379 -4.140 93.324 1.00 0.00 O ATOM 1732 CB LYS A 114 27.635 -1.453 94.737 1.00 0.00 C ATOM 1733 CG LYS A 114 26.824 -0.167 95.010 1.00 0.00 C ATOM 1734 CD LYS A 114 27.383 1.009 94.195 1.00 0.00 C ATOM 1735 CE LYS A 114 27.303 0.714 92.694 1.00 0.00 C ATOM 1736 NZ LYS A 114 28.544 0.012 92.261 1.00 0.00 N ATOM 0 H LYS A 114 25.202 -1.882 95.185 1.00 0.00 H new ATOM 0 HA LYS A 114 26.813 -2.037 92.863 1.00 0.00 H new ATOM 0 HB2 LYS A 114 27.911 -1.928 95.678 1.00 0.00 H new ATOM 0 HB3 LYS A 114 28.563 -1.207 94.220 1.00 0.00 H new ATOM 0 HG2 LYS A 114 25.777 -0.329 94.753 1.00 0.00 H new ATOM 0 HG3 LYS A 114 26.858 0.072 96.073 1.00 0.00 H new ATOM 0 HD2 LYS A 114 26.822 1.915 94.423 1.00 0.00 H new ATOM 0 HD3 LYS A 114 28.419 1.195 94.479 1.00 0.00 H new ATOM 0 HE2 LYS A 114 26.430 0.098 92.479 1.00 0.00 H new ATOM 0 HE3 LYS A 114 27.183 1.642 92.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 28.973 0.525 91.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 29.217 -0.024 93.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 28.309 -0.956 91.962 1.00 0.00 H new ATOM 1750 N ALA A 115 26.690 -4.728 94.620 1.00 0.00 N ATOM 1751 CA ALA A 115 27.146 -6.144 94.695 1.00 0.00 C ATOM 1752 C ALA A 115 27.013 -6.788 93.316 1.00 0.00 C ATOM 1753 O ALA A 115 27.881 -7.517 92.881 1.00 0.00 O ATOM 1754 CB ALA A 115 26.298 -6.918 95.707 1.00 0.00 C ATOM 0 H ALA A 115 25.837 -4.523 95.141 1.00 0.00 H new ATOM 0 HA ALA A 115 28.187 -6.170 95.016 1.00 0.00 H new ATOM 0 HB1 ALA A 115 26.640 -7.952 95.753 1.00 0.00 H new ATOM 0 HB2 ALA A 115 26.396 -6.459 96.691 1.00 0.00 H new ATOM 0 HB3 ALA A 115 25.253 -6.895 95.399 1.00 0.00 H new ATOM 1760 N LEU A 116 25.939 -6.520 92.609 1.00 0.00 N ATOM 1761 CA LEU A 116 25.805 -7.122 91.253 1.00 0.00 C ATOM 1762 C LEU A 116 26.914 -6.544 90.379 1.00 0.00 C ATOM 1763 O LEU A 116 27.206 -7.047 89.312 1.00 0.00 O ATOM 1764 CB LEU A 116 24.449 -6.770 90.626 1.00 0.00 C ATOM 1765 CG LEU A 116 23.400 -7.866 90.878 1.00 0.00 C ATOM 1766 CD1 LEU A 116 22.187 -7.598 89.985 1.00 0.00 C ATOM 1767 CD2 LEU A 116 23.958 -9.257 90.537 1.00 0.00 C ATOM 0 H LEU A 116 25.168 -5.923 92.908 1.00 0.00 H new ATOM 0 HA LEU A 116 25.876 -8.207 91.329 1.00 0.00 H new ATOM 0 HB2 LEU A 116 24.093 -5.825 91.037 1.00 0.00 H new ATOM 0 HB3 LEU A 116 24.572 -6.625 89.553 1.00 0.00 H new ATOM 0 HG LEU A 116 23.126 -7.847 91.933 1.00 0.00 H new ATOM 0 HD11 LEU A 116 21.434 -8.368 90.153 1.00 0.00 H new ATOM 0 HD12 LEU A 116 21.767 -6.621 90.225 1.00 0.00 H new ATOM 0 HD13 LEU A 116 22.494 -7.613 88.939 1.00 0.00 H new ATOM 0 HD21 LEU A 116 23.194 -10.012 90.725 1.00 0.00 H new ATOM 0 HD22 LEU A 116 24.246 -9.286 89.486 1.00 0.00 H new ATOM 0 HD23 LEU A 116 24.830 -9.461 91.158 1.00 0.00 H new ATOM 1779 N LEU A 117 27.554 -5.508 90.848 1.00 0.00 N ATOM 1780 CA LEU A 117 28.676 -4.910 90.078 1.00 0.00 C ATOM 1781 C LEU A 117 29.882 -5.813 90.316 1.00 0.00 C ATOM 1782 O LEU A 117 30.550 -6.235 89.393 1.00 0.00 O ATOM 1783 CB LEU A 117 28.970 -3.495 90.611 1.00 0.00 C ATOM 1784 CG LEU A 117 29.119 -2.494 89.458 1.00 0.00 C ATOM 1785 CD1 LEU A 117 30.318 -2.882 88.587 1.00 0.00 C ATOM 1786 CD2 LEU A 117 27.841 -2.476 88.603 1.00 0.00 C ATOM 0 H LEU A 117 27.346 -5.050 91.735 1.00 0.00 H new ATOM 0 HA LEU A 117 28.440 -4.831 89.017 1.00 0.00 H new ATOM 0 HB2 LEU A 117 28.164 -3.177 91.272 1.00 0.00 H new ATOM 0 HB3 LEU A 117 29.883 -3.509 91.206 1.00 0.00 H new ATOM 0 HG LEU A 117 29.281 -1.499 89.873 1.00 0.00 H new ATOM 0 HD11 LEU A 117 30.420 -2.168 87.769 1.00 0.00 H new ATOM 0 HD12 LEU A 117 31.225 -2.873 89.192 1.00 0.00 H new ATOM 0 HD13 LEU A 117 30.163 -3.881 88.179 1.00 0.00 H new ATOM 0 HD21 LEU A 117 27.959 -1.762 87.788 1.00 0.00 H new ATOM 0 HD22 LEU A 117 27.664 -3.470 88.192 1.00 0.00 H new ATOM 0 HD23 LEU A 117 26.993 -2.183 89.222 1.00 0.00 H new ATOM 1798 N GLN A 118 30.122 -6.134 91.568 1.00 0.00 N ATOM 1799 CA GLN A 118 31.235 -7.041 91.959 1.00 0.00 C ATOM 1800 C GLN A 118 32.297 -7.129 90.857 1.00 0.00 C ATOM 1801 O GLN A 118 32.616 -6.102 90.282 1.00 0.00 O ATOM 1802 CB GLN A 118 30.658 -8.428 92.265 1.00 0.00 C ATOM 1803 CG GLN A 118 29.750 -8.908 91.124 1.00 0.00 C ATOM 1804 CD GLN A 118 30.600 -9.346 89.928 1.00 0.00 C ATOM 1805 OE1 GLN A 118 31.392 -10.261 90.035 1.00 0.00 O ATOM 1806 NE2 GLN A 118 30.464 -8.730 88.785 1.00 0.00 N ATOM 1807 OXT GLN A 118 32.779 -8.224 90.615 1.00 0.00 O ATOM 0 H GLN A 118 29.571 -5.790 92.354 1.00 0.00 H new ATOM 0 HA GLN A 118 31.725 -6.641 92.847 1.00 0.00 H new ATOM 0 HB2 GLN A 118 31.470 -9.140 92.412 1.00 0.00 H new ATOM 0 HB3 GLN A 118 30.092 -8.393 93.196 1.00 0.00 H new ATOM 0 HG2 GLN A 118 29.132 -9.738 91.465 1.00 0.00 H new ATOM 0 HG3 GLN A 118 29.073 -8.108 90.826 1.00 0.00 H new ATOM 0 HE21 GLN A 118 29.799 -7.962 88.696 1.00 0.00 H new ATOM 0 HE22 GLN A 118 31.023 -9.017 87.981 1.00 0.00 H new TER 1816 GLN A 118