USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 933 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 Single : A 5 MET CE :methyl 140:sc= -0.499 (180deg=-2.22!) USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 170:sc= -0.0389 (180deg=-0.241) USER MOD Single : A 27 TYR OH : rot 30:sc= -0.857 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 176:sc= -0.47 USER MOD Single : A 46 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.272) USER MOD Single : A 48 LYS NZ :NH3+ -116:sc= -2.29 (180deg=-7.09!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot -15:sc= -0.0763 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl 145:sc= -5.61! (180deg=-10.8!) USER MOD Single : A 66 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.0129) USER MOD Single : A 71 ASN : amide:sc= 0.234 K(o=0.23,f=-1.9) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 14:sc= 1.25 USER MOD Single : A 84 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.14) USER MOD Single : A 86 TYR OH : rot -104:sc= -2.3 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 172:sc= 1.52 (180deg=1.46) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 17 N GLU A 2 -15.952 1.367 8.239 1.00 0.00 N ATOM 18 CA GLU A 2 -15.468 0.476 7.199 1.00 0.00 C ATOM 19 C GLU A 2 -14.976 1.283 5.995 1.00 0.00 C ATOM 20 O GLU A 2 -15.395 2.422 5.795 1.00 0.00 O ATOM 21 CB GLU A 2 -16.549 -0.524 6.785 1.00 0.00 C ATOM 22 CG GLU A 2 -15.940 -1.890 6.464 1.00 0.00 C ATOM 23 CD GLU A 2 -17.004 -2.855 5.938 1.00 0.00 C ATOM 24 OE1 GLU A 2 -17.414 -2.667 4.772 1.00 0.00 O ATOM 25 OE2 GLU A 2 -17.384 -3.759 6.713 1.00 0.00 O ATOM 0 HA GLU A 2 -14.628 -0.093 7.598 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -17.280 -0.627 7.587 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -17.084 -0.147 5.913 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -15.150 -1.775 5.722 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -15.478 -2.306 7.359 1.00 0.00 H new ATOM 32 N TRP A 3 -14.096 0.660 5.225 1.00 0.00 N ATOM 33 CA TRP A 3 -13.544 1.306 4.047 1.00 0.00 C ATOM 34 C TRP A 3 -13.448 0.259 2.935 1.00 0.00 C ATOM 35 O TRP A 3 -13.214 -0.918 3.205 1.00 0.00 O ATOM 36 CB TRP A 3 -12.201 1.967 4.363 1.00 0.00 C ATOM 37 CG TRP A 3 -12.095 2.511 5.789 1.00 0.00 C ATOM 38 CD1 TRP A 3 -11.552 1.916 6.861 1.00 0.00 C ATOM 39 CD2 TRP A 3 -12.569 3.791 6.259 1.00 0.00 C ATOM 40 NE1 TRP A 3 -11.641 2.716 7.982 1.00 0.00 N ATOM 41 CE2 TRP A 3 -12.279 3.892 7.604 1.00 0.00 C ATOM 42 CE3 TRP A 3 -13.220 4.829 5.570 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -12.604 5.014 8.376 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -13.538 5.943 6.355 1.00 0.00 C ATOM 45 CH2 TRP A 3 -13.253 6.060 7.711 1.00 0.00 C ATOM 0 H TRP A 3 -13.752 -0.285 5.394 1.00 0.00 H new ATOM 0 HA TRP A 3 -14.194 2.114 3.710 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.404 1.241 4.202 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -12.035 2.784 3.660 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -11.102 0.934 6.849 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -11.301 2.487 8.916 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -13.456 4.771 4.518 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -12.367 5.069 9.428 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -14.040 6.770 5.874 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -13.531 6.954 8.249 1.00 0.00 H new ATOM 56 N GLU A 4 -13.633 0.726 1.709 1.00 0.00 N ATOM 57 CA GLU A 4 -13.570 -0.156 0.556 1.00 0.00 C ATOM 58 C GLU A 4 -12.688 0.458 -0.534 1.00 0.00 C ATOM 59 O GLU A 4 -12.309 1.625 -0.446 1.00 0.00 O ATOM 60 CB GLU A 4 -14.971 -0.459 0.021 1.00 0.00 C ATOM 61 CG GLU A 4 -15.018 -1.836 -0.644 1.00 0.00 C ATOM 62 CD GLU A 4 -16.330 -2.555 -0.324 1.00 0.00 C ATOM 63 OE1 GLU A 4 -16.381 -3.192 0.751 1.00 0.00 O ATOM 64 OE2 GLU A 4 -17.252 -2.452 -1.162 1.00 0.00 O ATOM 0 H GLU A 4 -13.826 1.703 1.489 1.00 0.00 H new ATOM 0 HA GLU A 4 -13.124 -1.100 0.869 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -15.692 -0.421 0.838 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -15.263 0.306 -0.698 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -14.913 -1.726 -1.723 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -14.176 -2.438 -0.302 1.00 0.00 H new ATOM 71 N MET A 5 -12.387 -0.356 -1.535 1.00 0.00 N ATOM 72 CA MET A 5 -11.557 0.092 -2.640 1.00 0.00 C ATOM 73 C MET A 5 -11.886 -0.678 -3.920 1.00 0.00 C ATOM 74 O MET A 5 -12.697 -1.602 -3.902 1.00 0.00 O ATOM 75 CB MET A 5 -10.082 -0.112 -2.286 1.00 0.00 C ATOM 76 CG MET A 5 -9.685 0.742 -1.080 1.00 0.00 C ATOM 77 SD MET A 5 -9.842 2.474 -1.479 1.00 0.00 S ATOM 78 CE MET A 5 -9.686 3.184 0.151 1.00 0.00 C ATOM 0 H MET A 5 -12.703 -1.323 -1.604 1.00 0.00 H new ATOM 0 HA MET A 5 -11.755 1.150 -2.814 1.00 0.00 H new ATOM 0 HB2 MET A 5 -9.899 -1.164 -2.067 1.00 0.00 H new ATOM 0 HB3 MET A 5 -9.459 0.149 -3.142 1.00 0.00 H new ATOM 0 HG2 MET A 5 -10.319 0.498 -0.227 1.00 0.00 H new ATOM 0 HG3 MET A 5 -8.659 0.519 -0.789 1.00 0.00 H new ATOM 0 HE1 MET A 5 -9.082 4.090 0.097 1.00 0.00 H new ATOM 0 HE2 MET A 5 -10.675 3.429 0.537 1.00 0.00 H new ATOM 0 HE3 MET A 5 -9.205 2.467 0.816 1.00 0.00 H new ATOM 88 N GLY A 6 -11.240 -0.268 -5.002 1.00 0.00 N ATOM 89 CA GLY A 6 -11.454 -0.907 -6.289 1.00 0.00 C ATOM 90 C GLY A 6 -10.137 -1.054 -7.054 1.00 0.00 C ATOM 91 O GLY A 6 -9.398 -0.084 -7.216 1.00 0.00 O ATOM 0 H GLY A 6 -10.568 0.499 -5.013 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -11.904 -1.889 -6.141 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -12.157 -0.319 -6.879 1.00 0.00 H new ATOM 95 N LEU A 7 -9.883 -2.274 -7.503 1.00 0.00 N ATOM 96 CA LEU A 7 -8.668 -2.560 -8.248 1.00 0.00 C ATOM 97 C LEU A 7 -8.820 -3.902 -8.967 1.00 0.00 C ATOM 98 O LEU A 7 -9.842 -4.572 -8.830 1.00 0.00 O ATOM 99 CB LEU A 7 -7.447 -2.489 -7.328 1.00 0.00 C ATOM 100 CG LEU A 7 -7.440 -3.463 -6.147 1.00 0.00 C ATOM 101 CD1 LEU A 7 -6.009 -3.832 -5.750 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.236 -2.901 -4.968 1.00 0.00 C ATOM 0 H LEU A 7 -10.498 -3.076 -7.365 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.504 -1.804 -9.016 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.554 -2.669 -7.927 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.370 -1.474 -6.937 1.00 0.00 H new ATOM 0 HG LEU A 7 -7.935 -4.383 -6.459 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.032 -4.525 -4.909 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -5.507 -4.303 -6.595 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.467 -2.931 -5.463 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.215 -3.613 -4.143 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.793 -1.959 -4.646 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.268 -2.731 -5.274 1.00 0.00 H new ATOM 114 N GLN A 8 -7.787 -4.254 -9.718 1.00 0.00 N ATOM 115 CA GLN A 8 -7.792 -5.504 -10.459 1.00 0.00 C ATOM 116 C GLN A 8 -7.556 -6.683 -9.513 1.00 0.00 C ATOM 117 O GLN A 8 -7.156 -6.492 -8.365 1.00 0.00 O ATOM 118 CB GLN A 8 -6.750 -5.482 -11.579 1.00 0.00 C ATOM 119 CG GLN A 8 -7.370 -5.013 -12.896 1.00 0.00 C ATOM 120 CD GLN A 8 -6.754 -3.689 -13.352 1.00 0.00 C ATOM 121 OE1 GLN A 8 -7.369 -2.637 -13.296 1.00 0.00 O ATOM 122 NE2 GLN A 8 -5.509 -3.800 -13.805 1.00 0.00 N ATOM 0 H GLN A 8 -6.941 -3.695 -9.829 1.00 0.00 H new ATOM 0 HA GLN A 8 -8.771 -5.625 -10.922 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.929 -4.820 -11.304 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -6.327 -6.478 -11.707 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -7.219 -5.772 -13.664 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -8.446 -4.894 -12.773 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -5.053 -4.712 -13.824 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -5.010 -2.973 -14.133 1.00 0.00 H new ATOM 131 N GLU A 9 -7.812 -7.876 -10.029 1.00 0.00 N ATOM 132 CA GLU A 9 -7.632 -9.086 -9.245 1.00 0.00 C ATOM 133 C GLU A 9 -6.143 -9.387 -9.068 1.00 0.00 C ATOM 134 O GLU A 9 -5.711 -9.793 -7.990 1.00 0.00 O ATOM 135 CB GLU A 9 -8.358 -10.269 -9.888 1.00 0.00 C ATOM 136 CG GLU A 9 -8.173 -11.542 -9.059 1.00 0.00 C ATOM 137 CD GLU A 9 -7.543 -12.656 -9.899 1.00 0.00 C ATOM 138 OE1 GLU A 9 -8.243 -13.143 -10.812 1.00 0.00 O ATOM 139 OE2 GLU A 9 -6.376 -12.994 -9.608 1.00 0.00 O ATOM 0 H GLU A 9 -8.143 -8.031 -10.981 1.00 0.00 H new ATOM 0 HA GLU A 9 -8.070 -8.926 -8.260 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -9.420 -10.042 -9.980 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -7.977 -10.429 -10.897 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -7.541 -11.330 -8.197 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.137 -11.873 -8.674 1.00 0.00 H new ATOM 146 N GLU A 10 -5.397 -9.176 -10.143 1.00 0.00 N ATOM 147 CA GLU A 10 -3.965 -9.420 -10.120 1.00 0.00 C ATOM 148 C GLU A 10 -3.296 -8.555 -9.050 1.00 0.00 C ATOM 149 O GLU A 10 -2.338 -8.983 -8.409 1.00 0.00 O ATOM 150 CB GLU A 10 -3.344 -9.168 -11.495 1.00 0.00 C ATOM 151 CG GLU A 10 -2.586 -10.403 -11.989 1.00 0.00 C ATOM 152 CD GLU A 10 -1.670 -10.051 -13.163 1.00 0.00 C ATOM 153 OE1 GLU A 10 -2.219 -9.825 -14.263 1.00 0.00 O ATOM 154 OE2 GLU A 10 -0.442 -10.015 -12.933 1.00 0.00 O ATOM 0 H GLU A 10 -5.758 -8.839 -11.035 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.799 -10.468 -9.869 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.125 -8.907 -12.209 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.665 -8.317 -11.441 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -1.995 -10.821 -11.174 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.296 -11.172 -12.295 1.00 0.00 H new ATOM 161 N PHE A 11 -3.828 -7.352 -8.889 1.00 0.00 N ATOM 162 CA PHE A 11 -3.295 -6.423 -7.908 1.00 0.00 C ATOM 163 C PHE A 11 -3.699 -6.831 -6.490 1.00 0.00 C ATOM 164 O PHE A 11 -2.996 -6.525 -5.528 1.00 0.00 O ATOM 165 CB PHE A 11 -3.894 -5.050 -8.220 1.00 0.00 C ATOM 166 CG PHE A 11 -2.870 -3.913 -8.235 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.211 -3.606 -9.385 1.00 0.00 C ATOM 168 CD2 PHE A 11 -2.618 -3.209 -7.099 1.00 0.00 C ATOM 169 CE1 PHE A 11 -1.261 -2.551 -9.399 1.00 0.00 C ATOM 170 CE2 PHE A 11 -1.668 -2.154 -7.113 1.00 0.00 C ATOM 171 CZ PHE A 11 -1.009 -1.848 -8.263 1.00 0.00 C ATOM 0 H PHE A 11 -4.623 -7.000 -9.422 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.206 -6.413 -7.959 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.388 -5.093 -9.190 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -4.662 -4.824 -7.481 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.411 -4.165 -10.287 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.141 -3.453 -6.186 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -0.739 -2.307 -10.312 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -1.469 -1.595 -6.211 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.285 -1.046 -8.274 1.00 0.00 H new ATOM 181 N LEU A 12 -4.830 -7.516 -6.405 1.00 0.00 N ATOM 182 CA LEU A 12 -5.335 -7.970 -5.121 1.00 0.00 C ATOM 183 C LEU A 12 -4.338 -8.952 -4.503 1.00 0.00 C ATOM 184 O LEU A 12 -4.048 -8.880 -3.310 1.00 0.00 O ATOM 185 CB LEU A 12 -6.747 -8.541 -5.272 1.00 0.00 C ATOM 186 CG LEU A 12 -7.885 -7.518 -5.290 1.00 0.00 C ATOM 187 CD1 LEU A 12 -9.180 -8.149 -5.806 1.00 0.00 C ATOM 188 CD2 LEU A 12 -8.069 -6.877 -3.913 1.00 0.00 C ATOM 0 H LEU A 12 -5.411 -7.768 -7.205 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.427 -7.132 -4.430 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -6.788 -9.117 -6.197 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.925 -9.239 -4.454 1.00 0.00 H new ATOM 0 HG LEU A 12 -7.616 -6.720 -5.982 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.973 -7.401 -5.809 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.026 -8.519 -6.820 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.465 -8.977 -5.157 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -8.884 -6.154 -3.954 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -8.305 -7.649 -3.181 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.149 -6.370 -3.622 1.00 0.00 H new ATOM 200 N GLU A 13 -3.840 -9.848 -5.343 1.00 0.00 N ATOM 201 CA GLU A 13 -2.881 -10.843 -4.894 1.00 0.00 C ATOM 202 C GLU A 13 -1.659 -10.162 -4.276 1.00 0.00 C ATOM 203 O GLU A 13 -1.086 -10.664 -3.310 1.00 0.00 O ATOM 204 CB GLU A 13 -2.471 -11.766 -6.043 1.00 0.00 C ATOM 205 CG GLU A 13 -1.175 -11.285 -6.698 1.00 0.00 C ATOM 206 CD GLU A 13 -0.922 -12.016 -8.018 1.00 0.00 C ATOM 207 OE1 GLU A 13 -0.913 -13.265 -7.981 1.00 0.00 O ATOM 208 OE2 GLU A 13 -0.745 -11.309 -9.033 1.00 0.00 O ATOM 0 H GLU A 13 -4.083 -9.905 -6.332 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.356 -11.457 -4.129 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -2.338 -12.781 -5.669 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.267 -11.802 -6.787 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.231 -10.211 -6.878 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -0.338 -11.451 -6.020 1.00 0.00 H new ATOM 215 N LEU A 14 -1.296 -9.028 -4.857 1.00 0.00 N ATOM 216 CA LEU A 14 -0.152 -8.272 -4.375 1.00 0.00 C ATOM 217 C LEU A 14 -0.343 -7.960 -2.889 1.00 0.00 C ATOM 218 O LEU A 14 0.579 -8.130 -2.092 1.00 0.00 O ATOM 219 CB LEU A 14 0.073 -7.031 -5.240 1.00 0.00 C ATOM 220 CG LEU A 14 0.455 -7.291 -6.699 1.00 0.00 C ATOM 221 CD1 LEU A 14 0.948 -6.009 -7.373 1.00 0.00 C ATOM 222 CD2 LEU A 14 1.478 -8.424 -6.804 1.00 0.00 C ATOM 0 H LEU A 14 -1.774 -8.614 -5.657 1.00 0.00 H new ATOM 0 HA LEU A 14 0.760 -8.863 -4.463 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.837 -6.432 -5.225 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.858 -6.430 -4.781 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.438 -7.613 -7.234 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.213 -6.221 -8.409 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.159 -5.258 -7.347 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.824 -5.634 -6.844 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.732 -8.589 -7.851 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.377 -8.155 -6.250 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.054 -9.337 -6.386 1.00 0.00 H new ATOM 234 N ILE A 15 -1.544 -7.508 -2.561 1.00 0.00 N ATOM 235 CA ILE A 15 -1.867 -7.170 -1.185 1.00 0.00 C ATOM 236 C ILE A 15 -1.667 -8.403 -0.302 1.00 0.00 C ATOM 237 O ILE A 15 -1.109 -8.305 0.790 1.00 0.00 O ATOM 238 CB ILE A 15 -3.272 -6.571 -1.097 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.325 -5.195 -1.765 1.00 0.00 C ATOM 240 CG2 ILE A 15 -3.757 -6.522 0.354 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.461 -5.328 -3.283 1.00 0.00 C ATOM 0 H ILE A 15 -2.306 -7.368 -3.225 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.193 -6.398 -0.813 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.955 -7.221 -1.644 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.167 -4.627 -1.369 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.421 -4.635 -1.525 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -4.758 -6.092 0.389 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.781 -7.532 0.764 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.077 -5.907 0.944 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.496 -4.336 -3.733 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.606 -5.876 -3.678 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.378 -5.867 -3.520 1.00 0.00 H new ATOM 253 N LYS A 16 -2.134 -9.535 -0.807 1.00 0.00 N ATOM 254 CA LYS A 16 -2.014 -10.786 -0.077 1.00 0.00 C ATOM 255 C LYS A 16 -0.541 -11.043 0.247 1.00 0.00 C ATOM 256 O LYS A 16 -0.223 -11.652 1.267 1.00 0.00 O ATOM 257 CB LYS A 16 -2.681 -11.925 -0.852 1.00 0.00 C ATOM 258 CG LYS A 16 -3.947 -12.405 -0.139 1.00 0.00 C ATOM 259 CD LYS A 16 -4.521 -13.649 -0.820 1.00 0.00 C ATOM 260 CE LYS A 16 -5.257 -13.278 -2.109 1.00 0.00 C ATOM 261 NZ LYS A 16 -5.277 -14.426 -3.043 1.00 0.00 N ATOM 0 H LYS A 16 -2.596 -9.612 -1.713 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.544 -10.725 0.873 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -2.931 -11.588 -1.858 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.983 -12.755 -0.959 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.719 -12.629 0.903 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.692 -11.610 -0.139 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.716 -14.349 -1.045 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -5.205 -14.157 -0.140 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.277 -12.972 -1.877 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -4.768 -12.426 -2.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -5.780 -14.157 -3.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.301 -14.699 -3.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.763 -15.229 -2.596 1.00 0.00 H new ATOM 275 N LEU A 17 0.319 -10.565 -0.640 1.00 0.00 N ATOM 276 CA LEU A 17 1.751 -10.735 -0.461 1.00 0.00 C ATOM 277 C LEU A 17 2.289 -9.603 0.416 1.00 0.00 C ATOM 278 O LEU A 17 3.329 -9.750 1.057 1.00 0.00 O ATOM 279 CB LEU A 17 2.451 -10.848 -1.817 1.00 0.00 C ATOM 280 CG LEU A 17 2.461 -12.240 -2.453 1.00 0.00 C ATOM 281 CD1 LEU A 17 2.217 -12.155 -3.961 1.00 0.00 C ATOM 282 CD2 LEU A 17 3.756 -12.984 -2.123 1.00 0.00 C ATOM 0 H LEU A 17 0.052 -10.060 -1.485 1.00 0.00 H new ATOM 0 HA LEU A 17 1.961 -11.669 0.059 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.971 -10.157 -2.510 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.483 -10.516 -1.700 1.00 0.00 H new ATOM 0 HG LEU A 17 1.641 -12.817 -2.026 1.00 0.00 H new ATOM 0 HD11 LEU A 17 2.229 -13.158 -4.389 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.248 -11.693 -4.147 1.00 0.00 H new ATOM 0 HD13 LEU A 17 3.000 -11.554 -4.423 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.737 -13.970 -2.587 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.607 -12.420 -2.504 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.848 -13.093 -1.042 1.00 0.00 H new ATOM 294 N ARG A 18 1.556 -8.499 0.417 1.00 0.00 N ATOM 295 CA ARG A 18 1.947 -7.342 1.205 1.00 0.00 C ATOM 296 C ARG A 18 1.662 -7.589 2.688 1.00 0.00 C ATOM 297 O ARG A 18 1.899 -6.718 3.523 1.00 0.00 O ATOM 298 CB ARG A 18 1.198 -6.088 0.751 1.00 0.00 C ATOM 299 CG ARG A 18 1.644 -5.659 -0.648 1.00 0.00 C ATOM 300 CD ARG A 18 0.573 -4.804 -1.328 1.00 0.00 C ATOM 301 NE ARG A 18 1.199 -3.634 -1.983 1.00 0.00 N ATOM 302 CZ ARG A 18 0.554 -2.492 -2.256 1.00 0.00 C ATOM 303 NH1 ARG A 18 -0.739 -2.358 -1.931 1.00 0.00 N ATOM 304 NH2 ARG A 18 1.203 -1.483 -2.853 1.00 0.00 N ATOM 0 H ARG A 18 0.694 -8.381 -0.115 1.00 0.00 H new ATOM 0 HA ARG A 18 3.016 -7.186 1.058 1.00 0.00 H new ATOM 0 HB2 ARG A 18 0.125 -6.281 0.751 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.376 -5.278 1.458 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.575 -5.096 -0.580 1.00 0.00 H new ATOM 0 HG3 ARG A 18 1.849 -6.541 -1.254 1.00 0.00 H new ATOM 0 HD2 ARG A 18 0.035 -5.399 -2.066 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -0.159 -4.471 -0.592 1.00 0.00 H new ATOM 0 HE ARG A 18 2.183 -3.701 -2.243 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -1.233 -3.126 -1.476 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -1.230 -1.488 -2.139 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.188 -1.585 -3.099 1.00 0.00 H new ATOM 0 HH22 ARG A 18 0.712 -0.613 -3.061 1.00 0.00 H new ATOM 318 N LYS A 19 1.157 -8.781 2.970 1.00 0.00 N ATOM 319 CA LYS A 19 0.837 -9.154 4.337 1.00 0.00 C ATOM 320 C LYS A 19 2.133 -9.393 5.113 1.00 0.00 C ATOM 321 O LYS A 19 2.174 -9.218 6.330 1.00 0.00 O ATOM 322 CB LYS A 19 -0.120 -10.348 4.357 1.00 0.00 C ATOM 323 CG LYS A 19 0.647 -11.667 4.243 1.00 0.00 C ATOM 324 CD LYS A 19 0.797 -12.334 5.612 1.00 0.00 C ATOM 325 CE LYS A 19 0.990 -13.845 5.467 1.00 0.00 C ATOM 326 NZ LYS A 19 0.380 -14.558 6.611 1.00 0.00 N ATOM 0 H LYS A 19 0.962 -9.501 2.275 1.00 0.00 H new ATOM 0 HA LYS A 19 0.309 -8.343 4.839 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.700 -10.339 5.280 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -0.830 -10.264 3.534 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.123 -12.339 3.563 1.00 0.00 H new ATOM 0 HG3 LYS A 19 1.632 -11.483 3.814 1.00 0.00 H new ATOM 0 HD2 LYS A 19 1.649 -11.904 6.139 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -0.087 -12.133 6.217 1.00 0.00 H new ATOM 0 HE2 LYS A 19 0.539 -14.187 4.535 1.00 0.00 H new ATOM 0 HE3 LYS A 19 2.053 -14.078 5.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 0.520 -15.582 6.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 0.829 -14.244 7.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -0.638 -14.350 6.647 1.00 0.00 H new ATOM 340 N LYS A 20 3.162 -9.788 4.377 1.00 0.00 N ATOM 341 CA LYS A 20 4.457 -10.052 4.981 1.00 0.00 C ATOM 342 C LYS A 20 5.445 -8.964 4.555 1.00 0.00 C ATOM 343 O LYS A 20 6.602 -8.973 4.973 1.00 0.00 O ATOM 344 CB LYS A 20 4.924 -11.470 4.649 1.00 0.00 C ATOM 345 CG LYS A 20 4.687 -12.416 5.828 1.00 0.00 C ATOM 346 CD LYS A 20 4.924 -13.871 5.421 1.00 0.00 C ATOM 347 CE LYS A 20 4.991 -14.781 6.649 1.00 0.00 C ATOM 348 NZ LYS A 20 5.236 -16.183 6.243 1.00 0.00 N ATOM 0 H LYS A 20 3.125 -9.932 3.368 1.00 0.00 H new ATOM 0 HA LYS A 20 4.386 -10.011 6.068 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.391 -11.836 3.772 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.984 -11.458 4.396 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.352 -12.152 6.650 1.00 0.00 H new ATOM 0 HG3 LYS A 20 3.667 -12.299 6.193 1.00 0.00 H new ATOM 0 HD2 LYS A 20 4.122 -14.203 4.762 1.00 0.00 H new ATOM 0 HD3 LYS A 20 5.853 -13.947 4.856 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.786 -14.445 7.315 1.00 0.00 H new ATOM 0 HE3 LYS A 20 4.058 -14.716 7.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 5.279 -16.787 7.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 4.464 -16.506 5.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 6.138 -16.243 5.729 1.00 0.00 H new ATOM 362 N LYS A 21 4.952 -8.053 3.728 1.00 0.00 N ATOM 363 CA LYS A 21 5.777 -6.960 3.241 1.00 0.00 C ATOM 364 C LYS A 21 5.203 -5.632 3.738 1.00 0.00 C ATOM 365 O LYS A 21 5.168 -5.379 4.942 1.00 0.00 O ATOM 366 CB LYS A 21 5.923 -7.036 1.720 1.00 0.00 C ATOM 367 CG LYS A 21 6.681 -8.299 1.304 1.00 0.00 C ATOM 368 CD LYS A 21 6.331 -8.701 -0.130 1.00 0.00 C ATOM 369 CE LYS A 21 6.174 -10.218 -0.252 1.00 0.00 C ATOM 370 NZ LYS A 21 6.400 -10.652 -1.649 1.00 0.00 N ATOM 0 H LYS A 21 3.992 -8.049 3.383 1.00 0.00 H new ATOM 0 HA LYS A 21 6.788 -7.039 3.640 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.937 -7.030 1.256 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.451 -6.154 1.357 1.00 0.00 H new ATOM 0 HG2 LYS A 21 7.754 -8.127 1.386 1.00 0.00 H new ATOM 0 HG3 LYS A 21 6.436 -9.115 1.984 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.406 -8.211 -0.433 1.00 0.00 H new ATOM 0 HD3 LYS A 21 7.112 -8.357 -0.809 1.00 0.00 H new ATOM 0 HE2 LYS A 21 6.882 -10.717 0.409 1.00 0.00 H new ATOM 0 HE3 LYS A 21 5.175 -10.513 0.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 6.458 -11.690 -1.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.612 -10.328 -2.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 7.290 -10.243 -2.000 1.00 0.00 H new ATOM 384 N ILE A 22 4.767 -4.820 2.787 1.00 0.00 N ATOM 385 CA ILE A 22 4.196 -3.524 3.113 1.00 0.00 C ATOM 386 C ILE A 22 3.531 -2.936 1.867 1.00 0.00 C ATOM 387 O ILE A 22 3.555 -3.547 0.800 1.00 0.00 O ATOM 388 CB ILE A 22 5.257 -2.612 3.732 1.00 0.00 C ATOM 389 CG1 ILE A 22 4.859 -2.191 5.149 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.535 -1.406 2.833 1.00 0.00 C ATOM 391 CD1 ILE A 22 3.545 -1.407 5.140 1.00 0.00 C ATOM 0 H ILE A 22 4.797 -5.034 1.790 1.00 0.00 H new ATOM 0 HA ILE A 22 3.418 -3.630 3.870 1.00 0.00 H new ATOM 0 HB ILE A 22 6.187 -3.175 3.812 1.00 0.00 H new ATOM 0 HG12 ILE A 22 4.755 -3.074 5.779 1.00 0.00 H new ATOM 0 HG13 ILE A 22 5.648 -1.579 5.586 1.00 0.00 H new ATOM 0 HG21 ILE A 22 6.293 -0.774 3.296 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.893 -1.750 1.863 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.617 -0.833 2.699 1.00 0.00 H new ATOM 0 HD11 ILE A 22 3.285 -1.120 6.159 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.660 -0.512 4.529 1.00 0.00 H new ATOM 0 HD13 ILE A 22 2.752 -2.030 4.725 1.00 0.00 H new ATOM 403 N GLU A 23 2.951 -1.758 2.045 1.00 0.00 N ATOM 404 CA GLU A 23 2.281 -1.081 0.948 1.00 0.00 C ATOM 405 C GLU A 23 2.473 0.433 1.062 1.00 0.00 C ATOM 406 O GLU A 23 2.229 1.016 2.117 1.00 0.00 O ATOM 407 CB GLU A 23 0.795 -1.443 0.907 1.00 0.00 C ATOM 408 CG GLU A 23 -0.032 -0.465 1.744 1.00 0.00 C ATOM 409 CD GLU A 23 -1.526 -0.774 1.633 1.00 0.00 C ATOM 410 OE1 GLU A 23 -1.844 -1.833 1.050 1.00 0.00 O ATOM 411 OE2 GLU A 23 -2.316 0.055 2.133 1.00 0.00 O ATOM 0 H GLU A 23 2.931 -1.255 2.932 1.00 0.00 H new ATOM 0 HA GLU A 23 2.729 -1.415 0.012 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.443 -1.432 -0.125 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.654 -2.457 1.281 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.278 -0.522 2.787 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.158 0.555 1.410 1.00 0.00 H new ATOM 418 N GLY A 24 2.909 1.026 -0.040 1.00 0.00 N ATOM 419 CA GLY A 24 3.136 2.460 -0.078 1.00 0.00 C ATOM 420 C GLY A 24 1.956 3.186 -0.726 1.00 0.00 C ATOM 421 O GLY A 24 1.176 2.580 -1.458 1.00 0.00 O ATOM 0 H GLY A 24 3.111 0.539 -0.913 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.286 2.835 0.934 1.00 0.00 H new ATOM 0 HA3 GLY A 24 4.048 2.672 -0.635 1.00 0.00 H new ATOM 425 N ARG A 25 1.862 4.475 -0.433 1.00 0.00 N ATOM 426 CA ARG A 25 0.789 5.290 -0.978 1.00 0.00 C ATOM 427 C ARG A 25 0.760 6.657 -0.291 1.00 0.00 C ATOM 428 O ARG A 25 0.544 6.744 0.917 1.00 0.00 O ATOM 429 CB ARG A 25 -0.568 4.607 -0.798 1.00 0.00 C ATOM 430 CG ARG A 25 -0.755 4.131 0.645 1.00 0.00 C ATOM 431 CD ARG A 25 -2.070 4.651 1.227 1.00 0.00 C ATOM 432 NE ARG A 25 -3.215 3.976 0.576 1.00 0.00 N ATOM 433 CZ ARG A 25 -3.803 2.870 1.051 1.00 0.00 C ATOM 434 NH1 ARG A 25 -3.359 2.308 2.183 1.00 0.00 N ATOM 435 NH2 ARG A 25 -4.836 2.326 0.393 1.00 0.00 N ATOM 0 H ARG A 25 2.511 4.975 0.175 1.00 0.00 H new ATOM 0 HA ARG A 25 0.979 5.419 -2.044 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.366 5.301 -1.062 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.645 3.758 -1.478 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.745 3.042 0.677 1.00 0.00 H new ATOM 0 HG3 ARG A 25 0.079 4.476 1.256 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.096 4.474 2.302 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -2.141 5.729 1.080 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.579 4.378 -0.288 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -2.573 2.722 2.684 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -3.807 1.466 2.544 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -5.174 2.754 -0.469 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -5.284 1.484 0.754 1.00 0.00 H new ATOM 449 N LEU A 26 0.980 7.690 -1.091 1.00 0.00 N ATOM 450 CA LEU A 26 0.981 9.049 -0.575 1.00 0.00 C ATOM 451 C LEU A 26 -0.141 9.200 0.454 1.00 0.00 C ATOM 452 O LEU A 26 -1.206 8.602 0.309 1.00 0.00 O ATOM 453 CB LEU A 26 0.904 10.057 -1.722 1.00 0.00 C ATOM 454 CG LEU A 26 0.046 11.299 -1.467 1.00 0.00 C ATOM 455 CD1 LEU A 26 0.767 12.284 -0.545 1.00 0.00 C ATOM 456 CD2 LEU A 26 -0.378 11.952 -2.784 1.00 0.00 C ATOM 0 H LEU A 26 1.159 7.614 -2.092 1.00 0.00 H new ATOM 0 HA LEU A 26 1.917 9.260 -0.059 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.916 10.382 -1.962 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.516 9.546 -2.603 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.864 10.986 -0.955 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.136 13.157 -0.380 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.976 11.802 0.410 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.704 12.596 -1.007 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.986 12.832 -2.575 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.508 12.249 -3.345 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.958 11.241 -3.372 1.00 0.00 H new ATOM 468 N TYR A 27 0.136 10.003 1.471 1.00 0.00 N ATOM 469 CA TYR A 27 -0.836 10.241 2.524 1.00 0.00 C ATOM 470 C TYR A 27 -1.944 11.182 2.045 1.00 0.00 C ATOM 471 O TYR A 27 -1.665 12.267 1.539 1.00 0.00 O ATOM 472 CB TYR A 27 -0.069 10.914 3.663 1.00 0.00 C ATOM 473 CG TYR A 27 -0.592 10.564 5.058 1.00 0.00 C ATOM 474 CD1 TYR A 27 -1.949 10.439 5.274 1.00 0.00 C ATOM 475 CD2 TYR A 27 0.293 10.375 6.099 1.00 0.00 C ATOM 476 CE1 TYR A 27 -2.442 10.110 6.587 1.00 0.00 C ATOM 477 CE2 TYR A 27 -0.200 10.046 7.412 1.00 0.00 C ATOM 478 CZ TYR A 27 -1.543 9.930 7.591 1.00 0.00 C ATOM 479 OH TYR A 27 -2.008 9.619 8.830 1.00 0.00 O ATOM 0 H TYR A 27 1.021 10.497 1.588 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.305 9.306 2.831 1.00 0.00 H new ATOM 0 HB2 TYR A 27 0.981 10.629 3.598 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -0.115 11.995 3.530 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -2.642 10.588 4.459 1.00 0.00 H new ATOM 0 HD2 TYR A 27 1.355 10.474 5.930 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -3.502 10.009 6.770 1.00 0.00 H new ATOM 0 HE2 TYR A 27 0.482 9.895 8.236 1.00 0.00 H new ATOM 0 HH TYR A 27 -2.846 9.117 8.749 1.00 0.00 H new ATOM 489 N ASP A 28 -3.177 10.731 2.222 1.00 0.00 N ATOM 490 CA ASP A 28 -4.328 11.519 1.815 1.00 0.00 C ATOM 491 C ASP A 28 -5.158 11.876 3.049 1.00 0.00 C ATOM 492 O ASP A 28 -4.820 11.483 4.164 1.00 0.00 O ATOM 493 CB ASP A 28 -5.222 10.732 0.854 1.00 0.00 C ATOM 494 CG ASP A 28 -4.527 10.235 -0.415 1.00 0.00 C ATOM 495 OD1 ASP A 28 -4.455 11.035 -1.373 1.00 0.00 O ATOM 496 OD2 ASP A 28 -4.085 9.066 -0.399 1.00 0.00 O ATOM 0 H ASP A 28 -3.404 9.830 2.642 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.963 12.416 1.315 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.633 9.873 1.385 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -6.064 11.362 0.566 1.00 0.00 H new ATOM 501 N GLU A 29 -6.230 12.617 2.807 1.00 0.00 N ATOM 502 CA GLU A 29 -7.112 13.032 3.885 1.00 0.00 C ATOM 503 C GLU A 29 -7.891 11.831 4.425 1.00 0.00 C ATOM 504 O GLU A 29 -8.165 11.753 5.621 1.00 0.00 O ATOM 505 CB GLU A 29 -8.061 14.138 3.421 1.00 0.00 C ATOM 506 CG GLU A 29 -7.309 15.454 3.208 1.00 0.00 C ATOM 507 CD GLU A 29 -7.596 16.439 4.344 1.00 0.00 C ATOM 508 OE1 GLU A 29 -7.408 16.030 5.510 1.00 0.00 O ATOM 509 OE2 GLU A 29 -7.996 17.578 4.019 1.00 0.00 O ATOM 0 H GLU A 29 -6.508 12.941 1.880 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.502 13.437 4.692 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.547 13.839 2.492 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.848 14.281 4.161 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.238 15.260 3.152 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.603 15.895 2.256 1.00 0.00 H new ATOM 516 N LYS A 30 -8.224 10.926 3.517 1.00 0.00 N ATOM 517 CA LYS A 30 -8.966 9.733 3.888 1.00 0.00 C ATOM 518 C LYS A 30 -8.121 8.888 4.842 1.00 0.00 C ATOM 519 O LYS A 30 -8.624 8.390 5.848 1.00 0.00 O ATOM 520 CB LYS A 30 -9.424 8.977 2.639 1.00 0.00 C ATOM 521 CG LYS A 30 -10.778 9.496 2.149 1.00 0.00 C ATOM 522 CD LYS A 30 -11.394 8.540 1.125 1.00 0.00 C ATOM 523 CE LYS A 30 -12.857 8.245 1.461 1.00 0.00 C ATOM 524 NZ LYS A 30 -13.726 8.543 0.301 1.00 0.00 N ATOM 0 H LYS A 30 -7.994 10.995 2.526 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.877 10.002 4.422 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.681 9.088 1.849 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.497 7.912 2.861 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.455 9.613 2.996 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.653 10.482 1.702 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -11.327 8.976 0.128 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -10.827 7.609 1.104 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -12.967 7.199 1.746 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -13.167 8.843 2.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -14.715 8.337 0.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -13.634 9.547 0.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -13.440 7.954 -0.507 1.00 0.00 H new ATOM 538 N ARG A 31 -6.850 8.752 4.494 1.00 0.00 N ATOM 539 CA ARG A 31 -5.930 7.975 5.307 1.00 0.00 C ATOM 540 C ARG A 31 -5.874 8.538 6.729 1.00 0.00 C ATOM 541 O ARG A 31 -5.858 7.782 7.699 1.00 0.00 O ATOM 542 CB ARG A 31 -4.522 7.984 4.707 1.00 0.00 C ATOM 543 CG ARG A 31 -4.499 7.270 3.354 1.00 0.00 C ATOM 544 CD ARG A 31 -4.599 5.754 3.532 1.00 0.00 C ATOM 545 NE ARG A 31 -5.758 5.231 2.775 1.00 0.00 N ATOM 546 CZ ARG A 31 -6.263 3.999 2.930 1.00 0.00 C ATOM 547 NH1 ARG A 31 -5.713 3.157 3.816 1.00 0.00 N ATOM 548 NH2 ARG A 31 -7.317 3.610 2.200 1.00 0.00 N ATOM 0 H ARG A 31 -6.435 9.167 3.660 1.00 0.00 H new ATOM 0 HA ARG A 31 -6.295 6.948 5.332 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -4.181 9.012 4.586 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.828 7.497 5.392 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.327 7.623 2.739 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.579 7.518 2.824 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.682 5.278 3.185 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.704 5.510 4.589 1.00 0.00 H new ATOM 0 HE ARG A 31 -6.200 5.847 2.092 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -4.911 3.454 4.372 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.097 2.219 3.935 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -7.735 4.251 1.526 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -7.701 2.672 2.318 1.00 0.00 H new ATOM 562 N ARG A 32 -5.845 9.860 6.807 1.00 0.00 N ATOM 563 CA ARG A 32 -5.791 10.532 8.094 1.00 0.00 C ATOM 564 C ARG A 32 -6.885 9.996 9.019 1.00 0.00 C ATOM 565 O ARG A 32 -6.657 9.811 10.214 1.00 0.00 O ATOM 566 CB ARG A 32 -5.964 12.044 7.933 1.00 0.00 C ATOM 567 CG ARG A 32 -4.704 12.681 7.343 1.00 0.00 C ATOM 568 CD ARG A 32 -4.428 14.044 7.982 1.00 0.00 C ATOM 569 NE ARG A 32 -3.779 13.863 9.300 1.00 0.00 N ATOM 570 CZ ARG A 32 -3.314 14.869 10.052 1.00 0.00 C ATOM 571 NH1 ARG A 32 -3.422 16.134 9.621 1.00 0.00 N ATOM 572 NH2 ARG A 32 -2.739 14.611 11.235 1.00 0.00 N ATOM 0 H ARG A 32 -5.858 10.484 6.000 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.812 10.334 8.531 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -6.817 12.249 7.286 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -6.184 12.494 8.901 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -3.851 12.022 7.501 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -4.821 12.797 6.266 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -3.787 14.637 7.330 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -5.361 14.595 8.099 1.00 0.00 H new ATOM 0 HE ARG A 32 -3.680 12.913 9.658 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -3.858 16.330 8.720 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -3.068 16.900 10.194 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -2.656 13.649 11.562 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -2.385 15.377 11.808 1.00 0.00 H new ATOM 586 N GLN A 33 -8.049 9.761 8.432 1.00 0.00 N ATOM 587 CA GLN A 33 -9.179 9.250 9.189 1.00 0.00 C ATOM 588 C GLN A 33 -8.987 7.762 9.489 1.00 0.00 C ATOM 589 O GLN A 33 -9.475 7.261 10.501 1.00 0.00 O ATOM 590 CB GLN A 33 -10.493 9.494 8.445 1.00 0.00 C ATOM 591 CG GLN A 33 -11.414 10.418 9.246 1.00 0.00 C ATOM 592 CD GLN A 33 -12.778 10.556 8.567 1.00 0.00 C ATOM 593 OE1 GLN A 33 -13.003 11.422 7.739 1.00 0.00 O ATOM 594 NE2 GLN A 33 -13.673 9.655 8.963 1.00 0.00 N ATOM 0 H GLN A 33 -8.234 9.915 7.441 1.00 0.00 H new ATOM 0 HA GLN A 33 -9.231 9.788 10.135 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -10.286 9.936 7.470 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -10.994 8.543 8.264 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -11.544 10.023 10.254 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.952 11.400 9.345 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -13.419 8.956 9.661 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -14.614 9.663 8.568 1.00 0.00 H new ATOM 603 N ILE A 34 -8.276 7.097 8.591 1.00 0.00 N ATOM 604 CA ILE A 34 -8.014 5.676 8.746 1.00 0.00 C ATOM 605 C ILE A 34 -7.056 5.464 9.920 1.00 0.00 C ATOM 606 O ILE A 34 -6.230 6.326 10.215 1.00 0.00 O ATOM 607 CB ILE A 34 -7.515 5.076 7.430 1.00 0.00 C ATOM 608 CG1 ILE A 34 -8.544 5.271 6.314 1.00 0.00 C ATOM 609 CG2 ILE A 34 -7.135 3.605 7.608 1.00 0.00 C ATOM 610 CD1 ILE A 34 -7.921 5.007 4.942 1.00 0.00 C ATOM 0 H ILE A 34 -7.873 7.516 7.753 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.935 5.143 8.984 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.612 5.608 7.132 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.387 4.598 6.470 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.936 6.287 6.350 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -6.784 3.202 6.658 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -6.343 3.521 8.353 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.007 3.042 7.940 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.673 5.152 4.167 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -7.094 5.698 4.779 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.551 3.982 4.901 1.00 0.00 H new ATOM 622 N LYS A 35 -7.198 4.312 10.558 1.00 0.00 N ATOM 623 CA LYS A 35 -6.356 3.976 11.694 1.00 0.00 C ATOM 624 C LYS A 35 -6.099 2.468 11.704 1.00 0.00 C ATOM 625 O LYS A 35 -6.808 1.709 11.044 1.00 0.00 O ATOM 626 CB LYS A 35 -6.971 4.504 12.991 1.00 0.00 C ATOM 627 CG LYS A 35 -8.103 3.593 13.472 1.00 0.00 C ATOM 628 CD LYS A 35 -9.466 4.252 13.253 1.00 0.00 C ATOM 629 CE LYS A 35 -9.791 5.229 14.385 1.00 0.00 C ATOM 630 NZ LYS A 35 -10.351 4.507 15.549 1.00 0.00 N ATOM 0 H LYS A 35 -7.884 3.599 10.310 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.385 4.464 11.607 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -6.202 4.572 13.761 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -7.353 5.512 12.832 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -8.063 2.644 12.937 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -7.969 3.368 14.530 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -9.469 4.780 12.300 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -10.239 3.486 13.196 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -8.889 5.764 14.681 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -10.504 5.975 14.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -10.566 5.185 16.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -11.223 4.016 15.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -9.658 3.812 15.892 1.00 0.00 H new ATOM 644 N PRO A 36 -5.056 2.067 12.480 1.00 0.00 N ATOM 645 CA PRO A 36 -4.697 0.663 12.585 1.00 0.00 C ATOM 646 C PRO A 36 -5.691 -0.092 13.469 1.00 0.00 C ATOM 647 O PRO A 36 -5.556 -0.102 14.692 1.00 0.00 O ATOM 648 CB PRO A 36 -3.283 0.660 13.142 1.00 0.00 C ATOM 649 CG PRO A 36 -3.076 2.032 13.763 1.00 0.00 C ATOM 650 CD PRO A 36 -4.195 2.938 13.275 1.00 0.00 C ATOM 0 HA PRO A 36 -4.734 0.146 11.626 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.158 -0.128 13.885 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.553 0.474 12.354 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -3.087 1.964 14.851 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.105 2.437 13.478 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.740 3.379 14.110 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.805 3.762 12.678 1.00 0.00 H new ATOM 658 N GLY A 37 -6.666 -0.708 12.817 1.00 0.00 N ATOM 659 CA GLY A 37 -7.681 -1.464 13.528 1.00 0.00 C ATOM 660 C GLY A 37 -8.914 -1.690 12.650 1.00 0.00 C ATOM 661 O GLY A 37 -9.623 -2.682 12.812 1.00 0.00 O ATOM 0 H GLY A 37 -6.774 -0.698 11.803 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.272 -2.425 13.840 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -7.968 -0.931 14.434 1.00 0.00 H new ATOM 665 N ASP A 38 -9.130 -0.754 11.738 1.00 0.00 N ATOM 666 CA ASP A 38 -10.264 -0.838 10.833 1.00 0.00 C ATOM 667 C ASP A 38 -9.976 -1.888 9.758 1.00 0.00 C ATOM 668 O ASP A 38 -8.979 -2.603 9.835 1.00 0.00 O ATOM 669 CB ASP A 38 -10.511 0.500 10.134 1.00 0.00 C ATOM 670 CG ASP A 38 -10.479 1.725 11.050 1.00 0.00 C ATOM 671 OD1 ASP A 38 -10.979 1.595 12.189 1.00 0.00 O ATOM 672 OD2 ASP A 38 -9.956 2.763 10.592 1.00 0.00 O ATOM 0 H ASP A 38 -8.539 0.067 11.606 1.00 0.00 H new ATOM 0 HA ASP A 38 -11.144 -1.106 11.418 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -9.761 0.629 9.354 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -11.482 0.460 9.639 1.00 0.00 H new ATOM 677 N VAL A 39 -10.868 -1.946 8.780 1.00 0.00 N ATOM 678 CA VAL A 39 -10.722 -2.896 7.690 1.00 0.00 C ATOM 679 C VAL A 39 -11.020 -2.194 6.364 1.00 0.00 C ATOM 680 O VAL A 39 -11.941 -1.383 6.280 1.00 0.00 O ATOM 681 CB VAL A 39 -11.615 -4.115 7.935 1.00 0.00 C ATOM 682 CG1 VAL A 39 -11.553 -5.086 6.755 1.00 0.00 C ATOM 683 CG2 VAL A 39 -11.239 -4.815 9.243 1.00 0.00 C ATOM 0 H VAL A 39 -11.694 -1.351 8.720 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.698 -3.265 7.640 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.643 -3.765 8.026 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.196 -5.943 6.955 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.892 -4.581 5.850 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.527 -5.427 6.618 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.888 -5.678 9.394 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.202 -5.146 9.193 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.359 -4.121 10.075 1.00 0.00 H new ATOM 693 N ILE A 40 -10.223 -2.532 5.360 1.00 0.00 N ATOM 694 CA ILE A 40 -10.389 -1.944 4.042 1.00 0.00 C ATOM 695 C ILE A 40 -10.752 -3.042 3.041 1.00 0.00 C ATOM 696 O ILE A 40 -9.960 -3.952 2.798 1.00 0.00 O ATOM 697 CB ILE A 40 -9.146 -1.142 3.652 1.00 0.00 C ATOM 698 CG1 ILE A 40 -8.654 -0.290 4.824 1.00 0.00 C ATOM 699 CG2 ILE A 40 -9.406 -0.301 2.401 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.192 0.117 4.630 1.00 0.00 C ATOM 0 H ILE A 40 -9.461 -3.206 5.433 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.212 -1.230 4.045 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.349 -1.844 3.407 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.274 0.602 4.916 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -8.759 -0.849 5.754 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -8.506 0.259 2.146 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -9.674 -0.956 1.572 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.224 0.394 2.593 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -6.867 0.722 5.477 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -6.571 -0.777 4.563 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.094 0.696 3.712 1.00 0.00 H new ATOM 712 N SER A 41 -11.949 -2.922 2.486 1.00 0.00 N ATOM 713 CA SER A 41 -12.426 -3.894 1.517 1.00 0.00 C ATOM 714 C SER A 41 -11.906 -3.539 0.122 1.00 0.00 C ATOM 715 O SER A 41 -11.766 -2.363 -0.212 1.00 0.00 O ATOM 716 CB SER A 41 -13.954 -3.963 1.512 1.00 0.00 C ATOM 717 OG SER A 41 -14.459 -4.538 0.310 1.00 0.00 O ATOM 0 H SER A 41 -12.603 -2.166 2.689 1.00 0.00 H new ATOM 0 HA SER A 41 -12.046 -4.875 1.801 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.293 -4.551 2.365 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.363 -2.960 1.633 1.00 0.00 H new ATOM 0 HG SER A 41 -15.433 -4.625 0.373 1.00 0.00 H new ATOM 723 N PHE A 42 -11.634 -4.577 -0.655 1.00 0.00 N ATOM 724 CA PHE A 42 -11.133 -4.390 -2.006 1.00 0.00 C ATOM 725 C PHE A 42 -12.013 -5.120 -3.023 1.00 0.00 C ATOM 726 O PHE A 42 -12.334 -6.294 -2.842 1.00 0.00 O ATOM 727 CB PHE A 42 -9.725 -4.986 -2.047 1.00 0.00 C ATOM 728 CG PHE A 42 -8.692 -4.199 -1.237 1.00 0.00 C ATOM 729 CD1 PHE A 42 -8.871 -4.017 0.098 1.00 0.00 C ATOM 730 CD2 PHE A 42 -7.596 -3.682 -1.853 1.00 0.00 C ATOM 731 CE1 PHE A 42 -7.913 -3.287 0.850 1.00 0.00 C ATOM 732 CE2 PHE A 42 -6.637 -2.952 -1.101 1.00 0.00 C ATOM 733 CZ PHE A 42 -6.816 -2.770 0.235 1.00 0.00 C ATOM 0 H PHE A 42 -11.751 -5.551 -0.375 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.134 -3.330 -2.260 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -9.763 -6.009 -1.672 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -9.394 -5.039 -3.084 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -9.742 -4.428 0.587 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -7.454 -3.826 -2.914 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.056 -3.142 1.911 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -5.766 -2.542 -1.590 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.087 -2.215 0.807 1.00 0.00 H new ATOM 743 N GLU A 43 -12.377 -4.395 -4.071 1.00 0.00 N ATOM 744 CA GLU A 43 -13.214 -4.959 -5.117 1.00 0.00 C ATOM 745 C GLU A 43 -14.540 -5.448 -4.530 1.00 0.00 C ATOM 746 O GLU A 43 -15.013 -6.530 -4.873 1.00 0.00 O ATOM 747 CB GLU A 43 -12.488 -6.090 -5.849 1.00 0.00 C ATOM 748 CG GLU A 43 -12.013 -5.633 -7.229 1.00 0.00 C ATOM 749 CD GLU A 43 -13.195 -5.210 -8.104 1.00 0.00 C ATOM 750 OE1 GLU A 43 -14.151 -6.011 -8.192 1.00 0.00 O ATOM 751 OE2 GLU A 43 -13.116 -4.095 -8.664 1.00 0.00 O ATOM 0 H GLU A 43 -12.108 -3.422 -4.218 1.00 0.00 H new ATOM 0 HA GLU A 43 -13.428 -4.177 -5.846 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -11.634 -6.422 -5.258 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.154 -6.946 -5.955 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.319 -4.799 -7.121 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.467 -6.441 -7.715 1.00 0.00 H new ATOM 758 N GLY A 44 -15.102 -4.626 -3.656 1.00 0.00 N ATOM 759 CA GLY A 44 -16.364 -4.961 -3.019 1.00 0.00 C ATOM 760 C GLY A 44 -16.135 -5.760 -1.734 1.00 0.00 C ATOM 761 O GLY A 44 -16.507 -5.317 -0.649 1.00 0.00 O ATOM 0 H GLY A 44 -14.707 -3.729 -3.374 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -16.914 -4.048 -2.791 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -16.980 -5.540 -3.707 1.00 0.00 H new ATOM 765 N GLY A 45 -15.524 -6.924 -1.900 1.00 0.00 N ATOM 766 CA GLY A 45 -15.240 -7.789 -0.767 1.00 0.00 C ATOM 767 C GLY A 45 -14.436 -9.015 -1.202 1.00 0.00 C ATOM 768 O GLY A 45 -14.526 -10.073 -0.580 1.00 0.00 O ATOM 0 H GLY A 45 -15.218 -7.288 -2.802 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.684 -7.234 -0.012 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.174 -8.108 -0.305 1.00 0.00 H new ATOM 772 N LYS A 46 -13.667 -8.833 -2.265 1.00 0.00 N ATOM 773 CA LYS A 46 -12.847 -9.912 -2.790 1.00 0.00 C ATOM 774 C LYS A 46 -11.603 -10.072 -1.915 1.00 0.00 C ATOM 775 O LYS A 46 -11.168 -11.191 -1.647 1.00 0.00 O ATOM 776 CB LYS A 46 -12.533 -9.675 -4.269 1.00 0.00 C ATOM 777 CG LYS A 46 -12.359 -11.002 -5.011 1.00 0.00 C ATOM 778 CD LYS A 46 -10.886 -11.257 -5.340 1.00 0.00 C ATOM 779 CE LYS A 46 -10.744 -12.030 -6.653 1.00 0.00 C ATOM 780 NZ LYS A 46 -11.581 -13.250 -6.629 1.00 0.00 N ATOM 0 H LYS A 46 -13.594 -7.954 -2.777 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.389 -10.857 -2.751 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.337 -9.100 -4.728 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.624 -9.081 -4.361 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.745 -11.818 -4.400 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.944 -10.988 -5.931 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.356 -10.307 -5.414 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.421 -11.819 -4.530 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.039 -11.396 -7.489 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -9.700 -12.301 -6.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -11.312 -13.871 -7.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -11.437 -13.752 -5.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -12.583 -12.986 -6.722 1.00 0.00 H new ATOM 794 N LEU A 47 -11.063 -8.937 -1.494 1.00 0.00 N ATOM 795 CA LEU A 47 -9.877 -8.938 -0.655 1.00 0.00 C ATOM 796 C LEU A 47 -10.093 -7.991 0.527 1.00 0.00 C ATOM 797 O LEU A 47 -10.253 -6.786 0.340 1.00 0.00 O ATOM 798 CB LEU A 47 -8.634 -8.612 -1.485 1.00 0.00 C ATOM 799 CG LEU A 47 -7.328 -9.258 -1.018 1.00 0.00 C ATOM 800 CD1 LEU A 47 -6.633 -8.391 0.034 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.569 -10.683 -0.516 1.00 0.00 C ATOM 0 H LEU A 47 -11.426 -8.010 -1.719 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.704 -9.931 -0.241 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -8.819 -8.917 -2.515 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.499 -7.530 -1.492 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.657 -9.327 -1.874 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.707 -8.873 0.349 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.406 -7.414 -0.392 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.289 -8.268 0.895 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.624 -11.119 -0.190 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.266 -10.661 0.322 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -7.988 -11.286 -1.321 1.00 0.00 H new ATOM 813 N LYS A 48 -10.092 -8.572 1.717 1.00 0.00 N ATOM 814 CA LYS A 48 -10.286 -7.795 2.930 1.00 0.00 C ATOM 815 C LYS A 48 -8.953 -7.673 3.671 1.00 0.00 C ATOM 816 O LYS A 48 -8.196 -8.639 3.758 1.00 0.00 O ATOM 817 CB LYS A 48 -11.408 -8.396 3.778 1.00 0.00 C ATOM 818 CG LYS A 48 -12.661 -8.642 2.935 1.00 0.00 C ATOM 819 CD LYS A 48 -13.409 -7.333 2.670 1.00 0.00 C ATOM 820 CE LYS A 48 -14.896 -7.475 3.000 1.00 0.00 C ATOM 821 NZ LYS A 48 -15.543 -8.431 2.074 1.00 0.00 N ATOM 0 H LYS A 48 -9.960 -9.572 1.868 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.610 -6.783 2.686 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.072 -9.334 4.219 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.646 -7.723 4.602 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.382 -9.104 1.988 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.318 -9.343 3.450 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.974 -6.534 3.270 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.290 -7.047 1.625 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -15.015 -7.818 4.028 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.385 -6.503 2.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.256 -7.933 1.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.825 -8.846 1.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -16.003 -9.187 2.621 1.00 0.00 H new ATOM 835 N VAL A 49 -8.706 -6.477 4.186 1.00 0.00 N ATOM 836 CA VAL A 49 -7.477 -6.217 4.917 1.00 0.00 C ATOM 837 C VAL A 49 -7.787 -5.337 6.129 1.00 0.00 C ATOM 838 O VAL A 49 -8.831 -4.688 6.179 1.00 0.00 O ATOM 839 CB VAL A 49 -6.433 -5.601 3.983 1.00 0.00 C ATOM 840 CG1 VAL A 49 -6.479 -6.257 2.601 1.00 0.00 C ATOM 841 CG2 VAL A 49 -6.618 -4.086 3.877 1.00 0.00 C ATOM 0 H VAL A 49 -9.336 -5.678 4.112 1.00 0.00 H new ATOM 0 HA VAL A 49 -7.051 -7.148 5.291 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.448 -5.789 4.411 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.727 -5.801 1.957 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -6.276 -7.323 2.698 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.467 -6.114 2.163 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -5.863 -3.673 3.207 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.611 -3.867 3.484 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.512 -3.637 4.864 1.00 0.00 H new ATOM 851 N ARG A 50 -6.861 -5.344 7.077 1.00 0.00 N ATOM 852 CA ARG A 50 -7.023 -4.555 8.287 1.00 0.00 C ATOM 853 C ARG A 50 -5.707 -3.863 8.648 1.00 0.00 C ATOM 854 O ARG A 50 -4.705 -4.525 8.913 1.00 0.00 O ATOM 855 CB ARG A 50 -7.471 -5.429 9.459 1.00 0.00 C ATOM 856 CG ARG A 50 -7.068 -4.802 10.796 1.00 0.00 C ATOM 857 CD ARG A 50 -7.629 -5.607 11.970 1.00 0.00 C ATOM 858 NE ARG A 50 -6.837 -5.340 13.191 1.00 0.00 N ATOM 859 CZ ARG A 50 -7.262 -5.601 14.435 1.00 0.00 C ATOM 860 NH1 ARG A 50 -8.475 -6.136 14.629 1.00 0.00 N ATOM 861 NH2 ARG A 50 -6.475 -5.326 15.484 1.00 0.00 N ATOM 0 H ARG A 50 -5.996 -5.883 7.032 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.791 -3.806 8.095 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.552 -5.561 9.426 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -7.026 -6.420 9.369 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -5.981 -4.757 10.868 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -7.434 -3.776 10.846 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -8.673 -5.341 12.138 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -7.605 -6.671 11.736 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.909 -4.932 13.079 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -9.074 -6.344 13.830 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -8.799 -6.335 15.575 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.552 -4.918 15.336 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -6.799 -5.525 16.431 1.00 0.00 H new ATOM 875 N VAL A 51 -5.752 -2.538 8.648 1.00 0.00 N ATOM 876 CA VAL A 51 -4.576 -1.749 8.973 1.00 0.00 C ATOM 877 C VAL A 51 -3.945 -2.288 10.258 1.00 0.00 C ATOM 878 O VAL A 51 -4.651 -2.739 11.159 1.00 0.00 O ATOM 879 CB VAL A 51 -4.949 -0.268 9.065 1.00 0.00 C ATOM 880 CG1 VAL A 51 -3.706 0.597 9.282 1.00 0.00 C ATOM 881 CG2 VAL A 51 -5.720 0.181 7.822 1.00 0.00 C ATOM 0 H VAL A 51 -6.585 -1.992 8.428 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.829 -1.834 8.184 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.602 -0.139 9.928 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.998 1.645 9.344 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.215 0.302 10.209 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.018 0.461 8.448 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -5.973 1.237 7.913 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -5.102 0.031 6.937 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.635 -0.405 7.730 1.00 0.00 H new ATOM 891 N LYS A 52 -2.623 -2.224 10.303 1.00 0.00 N ATOM 892 CA LYS A 52 -1.889 -2.699 11.463 1.00 0.00 C ATOM 893 C LYS A 52 -1.222 -1.512 12.162 1.00 0.00 C ATOM 894 O LYS A 52 -1.222 -1.430 13.389 1.00 0.00 O ATOM 895 CB LYS A 52 -0.910 -3.805 11.062 1.00 0.00 C ATOM 896 CG LYS A 52 -1.546 -5.187 11.226 1.00 0.00 C ATOM 897 CD LYS A 52 -1.091 -5.848 12.528 1.00 0.00 C ATOM 898 CE LYS A 52 -2.160 -5.713 13.615 1.00 0.00 C ATOM 899 NZ LYS A 52 -2.278 -6.971 14.385 1.00 0.00 N ATOM 0 H LYS A 52 -2.040 -1.850 9.554 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.569 -3.152 12.184 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.601 -3.664 10.026 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.011 -3.740 11.675 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.632 -5.094 11.221 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.276 -5.818 10.380 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.880 -6.902 12.350 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -0.162 -5.389 12.867 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -1.904 -4.892 14.285 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -3.120 -5.466 13.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -3.007 -6.862 15.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -2.544 -7.746 13.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -1.366 -7.190 14.834 1.00 0.00 H new ATOM 913 N ALA A 53 -0.671 -0.622 11.350 1.00 0.00 N ATOM 914 CA ALA A 53 -0.003 0.557 11.874 1.00 0.00 C ATOM 915 C ALA A 53 0.272 1.534 10.730 1.00 0.00 C ATOM 916 O ALA A 53 0.363 1.129 9.572 1.00 0.00 O ATOM 917 CB ALA A 53 1.275 0.137 12.603 1.00 0.00 C ATOM 0 H ALA A 53 -0.674 -0.694 10.333 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.638 1.068 12.597 1.00 0.00 H new ATOM 0 HB1 ALA A 53 1.777 1.021 12.996 1.00 0.00 H new ATOM 0 HB2 ALA A 53 1.022 -0.532 13.425 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.938 -0.377 11.908 1.00 0.00 H new ATOM 923 N ILE A 54 0.398 2.801 11.093 1.00 0.00 N ATOM 924 CA ILE A 54 0.661 3.839 10.111 1.00 0.00 C ATOM 925 C ILE A 54 2.102 4.329 10.267 1.00 0.00 C ATOM 926 O ILE A 54 2.621 4.399 11.380 1.00 0.00 O ATOM 927 CB ILE A 54 -0.382 4.953 10.216 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.795 5.451 8.829 1.00 0.00 C ATOM 929 CG2 ILE A 54 0.119 6.091 11.107 1.00 0.00 C ATOM 930 CD1 ILE A 54 -1.138 6.941 8.860 1.00 0.00 C ATOM 0 H ILE A 54 0.323 3.133 12.054 1.00 0.00 H new ATOM 0 HA ILE A 54 0.567 3.440 9.101 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.274 4.542 10.689 1.00 0.00 H new ATOM 0 HG12 ILE A 54 0.014 5.275 8.120 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -1.656 4.883 8.477 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.641 6.870 11.165 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.322 5.708 12.107 1.00 0.00 H new ATOM 0 HG23 ILE A 54 1.034 6.508 10.685 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -1.428 7.268 7.862 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -1.964 7.110 9.551 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -0.267 7.508 9.189 1.00 0.00 H new ATOM 942 N ARG A 55 2.708 4.657 9.135 1.00 0.00 N ATOM 943 CA ARG A 55 4.079 5.139 9.132 1.00 0.00 C ATOM 944 C ARG A 55 4.269 6.191 8.038 1.00 0.00 C ATOM 945 O ARG A 55 3.639 6.117 6.985 1.00 0.00 O ATOM 946 CB ARG A 55 5.065 3.992 8.905 1.00 0.00 C ATOM 947 CG ARG A 55 5.284 3.193 10.191 1.00 0.00 C ATOM 948 CD ARG A 55 6.644 3.516 10.813 1.00 0.00 C ATOM 949 NE ARG A 55 6.494 3.748 12.267 1.00 0.00 N ATOM 950 CZ ARG A 55 6.157 4.926 12.809 1.00 0.00 C ATOM 951 NH1 ARG A 55 5.933 5.986 12.020 1.00 0.00 N ATOM 952 NH2 ARG A 55 6.043 5.044 14.139 1.00 0.00 N ATOM 0 H ARG A 55 2.275 4.598 8.214 1.00 0.00 H new ATOM 0 HA ARG A 55 4.276 5.585 10.107 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.687 3.333 8.123 1.00 0.00 H new ATOM 0 HB3 ARG A 55 6.017 4.390 8.554 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.491 3.420 10.904 1.00 0.00 H new ATOM 0 HG3 ARG A 55 5.223 2.126 9.975 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.338 2.694 10.637 1.00 0.00 H new ATOM 0 HD3 ARG A 55 7.070 4.400 10.338 1.00 0.00 H new ATOM 0 HE ARG A 55 6.657 2.962 12.896 1.00 0.00 H new ATOM 0 HH11 ARG A 55 6.019 5.896 11.008 1.00 0.00 H new ATOM 0 HH12 ARG A 55 5.676 6.883 12.432 1.00 0.00 H new ATOM 0 HH21 ARG A 55 6.213 4.237 14.739 1.00 0.00 H new ATOM 0 HH22 ARG A 55 5.786 5.941 14.551 1.00 0.00 H new ATOM 966 N VAL A 56 5.141 7.146 8.326 1.00 0.00 N ATOM 967 CA VAL A 56 5.423 8.212 7.379 1.00 0.00 C ATOM 968 C VAL A 56 6.920 8.228 7.065 1.00 0.00 C ATOM 969 O VAL A 56 7.743 7.934 7.931 1.00 0.00 O ATOM 970 CB VAL A 56 4.913 9.547 7.927 1.00 0.00 C ATOM 971 CG1 VAL A 56 5.075 10.662 6.892 1.00 0.00 C ATOM 972 CG2 VAL A 56 3.458 9.432 8.385 1.00 0.00 C ATOM 0 H VAL A 56 5.662 7.204 9.201 1.00 0.00 H new ATOM 0 HA VAL A 56 4.896 8.038 6.441 1.00 0.00 H new ATOM 0 HB VAL A 56 5.518 9.805 8.796 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.705 11.600 7.307 1.00 0.00 H new ATOM 0 HG12 VAL A 56 6.129 10.770 6.635 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.507 10.412 5.996 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.121 10.394 8.770 1.00 0.00 H new ATOM 0 HG22 VAL A 56 2.833 9.139 7.541 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.382 8.680 9.171 1.00 0.00 H new ATOM 982 N TYR A 57 7.229 8.573 5.824 1.00 0.00 N ATOM 983 CA TYR A 57 8.612 8.630 5.385 1.00 0.00 C ATOM 984 C TYR A 57 8.896 9.933 4.633 1.00 0.00 C ATOM 985 O TYR A 57 8.004 10.762 4.464 1.00 0.00 O ATOM 986 CB TYR A 57 8.800 7.452 4.427 1.00 0.00 C ATOM 987 CG TYR A 57 8.568 6.084 5.072 1.00 0.00 C ATOM 988 CD1 TYR A 57 7.295 5.708 5.452 1.00 0.00 C ATOM 989 CD2 TYR A 57 9.630 5.226 5.272 1.00 0.00 C ATOM 990 CE1 TYR A 57 7.076 4.420 6.058 1.00 0.00 C ATOM 991 CE2 TYR A 57 9.410 3.938 5.878 1.00 0.00 C ATOM 992 CZ TYR A 57 8.145 3.599 6.241 1.00 0.00 C ATOM 993 OH TYR A 57 7.937 2.382 6.814 1.00 0.00 O ATOM 0 H TYR A 57 6.544 8.816 5.108 1.00 0.00 H new ATOM 0 HA TYR A 57 9.287 8.586 6.240 1.00 0.00 H new ATOM 0 HB2 TYR A 57 8.115 7.567 3.587 1.00 0.00 H new ATOM 0 HB3 TYR A 57 9.811 7.484 4.021 1.00 0.00 H new ATOM 0 HD1 TYR A 57 6.464 6.379 5.295 1.00 0.00 H new ATOM 0 HD2 TYR A 57 10.626 5.520 4.974 1.00 0.00 H new ATOM 0 HE1 TYR A 57 6.086 4.113 6.360 1.00 0.00 H new ATOM 0 HE2 TYR A 57 10.232 3.257 6.040 1.00 0.00 H new ATOM 0 HH TYR A 57 7.053 2.366 7.236 1.00 0.00 H new ATOM 1003 N ASN A 58 10.141 10.071 4.203 1.00 0.00 N ATOM 1004 CA ASN A 58 10.553 11.258 3.473 1.00 0.00 C ATOM 1005 C ASN A 58 10.036 11.174 2.036 1.00 0.00 C ATOM 1006 O ASN A 58 9.485 12.141 1.513 1.00 0.00 O ATOM 1007 CB ASN A 58 12.078 11.371 3.421 1.00 0.00 C ATOM 1008 CG ASN A 58 12.579 12.468 4.362 1.00 0.00 C ATOM 1009 OD1 ASN A 58 12.804 13.602 3.972 1.00 0.00 O ATOM 1010 ND2 ASN A 58 12.741 12.069 5.620 1.00 0.00 N ATOM 0 H ASN A 58 10.878 9.381 4.346 1.00 0.00 H new ATOM 0 HA ASN A 58 10.144 12.128 3.987 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.527 10.417 3.698 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.396 11.589 2.401 1.00 0.00 H new ATOM 0 HD21 ASN A 58 13.072 12.727 6.325 1.00 0.00 H new ATOM 0 HD22 ASN A 58 12.534 11.105 5.880 1.00 0.00 H new ATOM 1017 N SER A 59 10.232 10.007 1.438 1.00 0.00 N ATOM 1018 CA SER A 59 9.792 9.784 0.071 1.00 0.00 C ATOM 1019 C SER A 59 9.657 8.284 -0.196 1.00 0.00 C ATOM 1020 O SER A 59 9.832 7.470 0.709 1.00 0.00 O ATOM 1021 CB SER A 59 10.760 10.417 -0.930 1.00 0.00 C ATOM 1022 OG SER A 59 10.125 11.408 -1.733 1.00 0.00 O ATOM 0 H SER A 59 10.689 9.207 1.875 1.00 0.00 H new ATOM 0 HA SER A 59 8.819 10.259 -0.057 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.595 10.866 -0.392 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.175 9.641 -1.573 1.00 0.00 H new ATOM 0 HG SER A 59 10.776 11.789 -2.358 1.00 0.00 H new ATOM 1028 N PHE A 60 9.348 7.963 -1.444 1.00 0.00 N ATOM 1029 CA PHE A 60 9.189 6.575 -1.842 1.00 0.00 C ATOM 1030 C PHE A 60 10.535 5.848 -1.849 1.00 0.00 C ATOM 1031 O PHE A 60 10.623 4.693 -1.433 1.00 0.00 O ATOM 1032 CB PHE A 60 8.619 6.579 -3.262 1.00 0.00 C ATOM 1033 CG PHE A 60 7.127 6.913 -3.333 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.235 6.200 -2.595 1.00 0.00 C ATOM 1035 CD2 PHE A 60 6.693 7.923 -4.134 1.00 0.00 C ATOM 1036 CE1 PHE A 60 4.851 6.510 -2.660 1.00 0.00 C ATOM 1037 CE2 PHE A 60 5.309 8.233 -4.200 1.00 0.00 C ATOM 1038 CZ PHE A 60 4.417 7.520 -3.461 1.00 0.00 C ATOM 0 H PHE A 60 9.204 8.641 -2.193 1.00 0.00 H new ATOM 0 HA PHE A 60 8.532 6.061 -1.141 1.00 0.00 H new ATOM 0 HB2 PHE A 60 9.172 7.302 -3.862 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.783 5.600 -3.711 1.00 0.00 H new ATOM 0 HD1 PHE A 60 6.579 5.398 -1.959 1.00 0.00 H new ATOM 0 HD2 PHE A 60 7.402 8.489 -4.720 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.143 5.944 -2.073 1.00 0.00 H new ATOM 0 HE2 PHE A 60 4.965 9.035 -4.837 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.364 7.756 -3.510 1.00 0.00 H new ATOM 1048 N ARG A 61 11.550 6.554 -2.324 1.00 0.00 N ATOM 1049 CA ARG A 61 12.888 5.990 -2.390 1.00 0.00 C ATOM 1050 C ARG A 61 13.325 5.499 -1.008 1.00 0.00 C ATOM 1051 O ARG A 61 13.863 4.400 -0.878 1.00 0.00 O ATOM 1052 CB ARG A 61 13.896 7.022 -2.899 1.00 0.00 C ATOM 1053 CG ARG A 61 15.233 6.360 -3.241 1.00 0.00 C ATOM 1054 CD ARG A 61 15.208 5.773 -4.654 1.00 0.00 C ATOM 1055 NE ARG A 61 15.402 6.848 -5.652 1.00 0.00 N ATOM 1056 CZ ARG A 61 16.600 7.319 -6.025 1.00 0.00 C ATOM 1057 NH1 ARG A 61 17.717 6.814 -5.485 1.00 0.00 N ATOM 1058 NH2 ARG A 61 16.680 8.297 -6.939 1.00 0.00 N ATOM 0 H ARG A 61 11.473 7.512 -2.667 1.00 0.00 H new ATOM 0 HA ARG A 61 12.861 5.152 -3.086 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.497 7.521 -3.782 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.050 7.790 -2.141 1.00 0.00 H new ATOM 0 HG2 ARG A 61 16.036 7.092 -3.162 1.00 0.00 H new ATOM 0 HG3 ARG A 61 15.448 5.572 -2.519 1.00 0.00 H new ATOM 0 HD2 ARG A 61 15.991 5.022 -4.759 1.00 0.00 H new ATOM 0 HD3 ARG A 61 14.258 5.269 -4.830 1.00 0.00 H new ATOM 0 HE ARG A 61 14.572 7.256 -6.083 1.00 0.00 H new ATOM 0 HH11 ARG A 61 17.656 6.070 -4.789 1.00 0.00 H new ATOM 0 HH12 ARG A 61 18.628 7.173 -5.769 1.00 0.00 H new ATOM 0 HH21 ARG A 61 15.829 8.682 -7.350 1.00 0.00 H new ATOM 0 HH22 ARG A 61 17.591 8.656 -7.223 1.00 0.00 H new ATOM 1072 N GLU A 62 13.078 6.336 -0.012 1.00 0.00 N ATOM 1073 CA GLU A 62 13.440 6.001 1.355 1.00 0.00 C ATOM 1074 C GLU A 62 12.600 4.823 1.852 1.00 0.00 C ATOM 1075 O GLU A 62 13.114 3.927 2.520 1.00 0.00 O ATOM 1076 CB GLU A 62 13.285 7.213 2.276 1.00 0.00 C ATOM 1077 CG GLU A 62 14.581 8.023 2.338 1.00 0.00 C ATOM 1078 CD GLU A 62 14.432 9.355 1.599 1.00 0.00 C ATOM 1079 OE1 GLU A 62 14.000 9.307 0.427 1.00 0.00 O ATOM 1080 OE2 GLU A 62 14.752 10.389 2.223 1.00 0.00 O ATOM 0 H GLU A 62 12.631 7.246 -0.124 1.00 0.00 H new ATOM 0 HA GLU A 62 14.489 5.706 1.371 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.473 7.846 1.917 1.00 0.00 H new ATOM 0 HB3 GLU A 62 13.011 6.881 3.277 1.00 0.00 H new ATOM 0 HG2 GLU A 62 14.849 8.208 3.378 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.395 7.448 1.897 1.00 0.00 H new ATOM 1087 N MET A 63 11.321 4.863 1.508 1.00 0.00 N ATOM 1088 CA MET A 63 10.405 3.810 1.912 1.00 0.00 C ATOM 1089 C MET A 63 10.834 2.459 1.335 1.00 0.00 C ATOM 1090 O MET A 63 10.942 1.475 2.066 1.00 0.00 O ATOM 1091 CB MET A 63 8.993 4.147 1.426 1.00 0.00 C ATOM 1092 CG MET A 63 8.191 4.853 2.520 1.00 0.00 C ATOM 1093 SD MET A 63 6.477 4.975 2.038 1.00 0.00 S ATOM 1094 CE MET A 63 6.159 3.277 1.588 1.00 0.00 C ATOM 0 H MET A 63 10.898 5.608 0.954 1.00 0.00 H new ATOM 0 HA MET A 63 10.418 3.741 3.000 1.00 0.00 H new ATOM 0 HB2 MET A 63 9.051 4.784 0.544 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.480 3.233 1.126 1.00 0.00 H new ATOM 0 HG2 MET A 63 8.276 4.303 3.457 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.599 5.848 2.697 1.00 0.00 H new ATOM 0 HE1 MET A 63 5.136 3.015 1.857 1.00 0.00 H new ATOM 0 HE2 MET A 63 6.295 3.154 0.514 1.00 0.00 H new ATOM 0 HE3 MET A 63 6.852 2.624 2.118 1.00 0.00 H new ATOM 1104 N LEU A 64 11.066 2.455 0.031 1.00 0.00 N ATOM 1105 CA LEU A 64 11.481 1.241 -0.651 1.00 0.00 C ATOM 1106 C LEU A 64 12.862 0.822 -0.143 1.00 0.00 C ATOM 1107 O LEU A 64 13.179 -0.366 -0.106 1.00 0.00 O ATOM 1108 CB LEU A 64 11.415 1.430 -2.168 1.00 0.00 C ATOM 1109 CG LEU A 64 10.167 2.134 -2.703 1.00 0.00 C ATOM 1110 CD1 LEU A 64 10.539 3.202 -3.734 1.00 0.00 C ATOM 1111 CD2 LEU A 64 9.164 1.123 -3.262 1.00 0.00 C ATOM 0 H LEU A 64 10.975 3.273 -0.572 1.00 0.00 H new ATOM 0 HA LEU A 64 10.796 0.424 -0.424 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.291 1.998 -2.482 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.485 0.450 -2.640 1.00 0.00 H new ATOM 0 HG LEU A 64 9.680 2.644 -1.872 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.633 3.687 -4.098 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.187 3.945 -3.270 1.00 0.00 H new ATOM 0 HD13 LEU A 64 11.062 2.735 -4.569 1.00 0.00 H new ATOM 0 HD21 LEU A 64 8.286 1.650 -3.636 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.626 0.564 -4.076 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.864 0.433 -2.473 1.00 0.00 H new ATOM 1123 N GLU A 65 13.646 1.820 0.237 1.00 0.00 N ATOM 1124 CA GLU A 65 14.985 1.570 0.741 1.00 0.00 C ATOM 1125 C GLU A 65 14.922 1.052 2.179 1.00 0.00 C ATOM 1126 O GLU A 65 15.697 0.176 2.562 1.00 0.00 O ATOM 1127 CB GLU A 65 15.850 2.829 0.649 1.00 0.00 C ATOM 1128 CG GLU A 65 16.470 2.968 -0.742 1.00 0.00 C ATOM 1129 CD GLU A 65 17.944 3.367 -0.648 1.00 0.00 C ATOM 1130 OE1 GLU A 65 18.240 4.254 0.181 1.00 0.00 O ATOM 1131 OE2 GLU A 65 18.741 2.775 -1.408 1.00 0.00 O ATOM 0 H GLU A 65 13.379 2.804 0.206 1.00 0.00 H new ATOM 0 HA GLU A 65 15.449 0.804 0.119 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.244 3.708 0.870 1.00 0.00 H new ATOM 0 HB3 GLU A 65 16.639 2.788 1.400 1.00 0.00 H new ATOM 0 HG2 GLU A 65 16.379 2.025 -1.281 1.00 0.00 H new ATOM 0 HG3 GLU A 65 15.923 3.717 -1.315 1.00 0.00 H new ATOM 1138 N LYS A 66 13.993 1.614 2.937 1.00 0.00 N ATOM 1139 CA LYS A 66 13.819 1.220 4.325 1.00 0.00 C ATOM 1140 C LYS A 66 12.942 -0.032 4.388 1.00 0.00 C ATOM 1141 O LYS A 66 13.412 -1.105 4.764 1.00 0.00 O ATOM 1142 CB LYS A 66 13.280 2.390 5.151 1.00 0.00 C ATOM 1143 CG LYS A 66 14.107 2.589 6.423 1.00 0.00 C ATOM 1144 CD LYS A 66 15.353 3.431 6.141 1.00 0.00 C ATOM 1145 CE LYS A 66 15.104 4.905 6.472 1.00 0.00 C ATOM 1146 NZ LYS A 66 15.162 5.125 7.934 1.00 0.00 N ATOM 0 H LYS A 66 13.352 2.340 2.616 1.00 0.00 H new ATOM 0 HA LYS A 66 14.779 0.961 4.771 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.300 3.301 4.554 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.239 2.205 5.415 1.00 0.00 H new ATOM 0 HG2 LYS A 66 13.498 3.077 7.184 1.00 0.00 H new ATOM 0 HG3 LYS A 66 14.402 1.620 6.825 1.00 0.00 H new ATOM 0 HD2 LYS A 66 16.190 3.058 6.732 1.00 0.00 H new ATOM 0 HD3 LYS A 66 15.634 3.332 5.092 1.00 0.00 H new ATOM 0 HE2 LYS A 66 15.849 5.526 5.975 1.00 0.00 H new ATOM 0 HE3 LYS A 66 14.129 5.210 6.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 14.574 5.945 8.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 14.807 4.281 8.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 16.146 5.304 8.219 1.00 0.00 H new ATOM 1160 N GLU A 67 11.683 0.146 4.016 1.00 0.00 N ATOM 1161 CA GLU A 67 10.736 -0.956 4.026 1.00 0.00 C ATOM 1162 C GLU A 67 11.195 -2.058 3.069 1.00 0.00 C ATOM 1163 O GLU A 67 11.328 -3.215 3.466 1.00 0.00 O ATOM 1164 CB GLU A 67 9.328 -0.473 3.672 1.00 0.00 C ATOM 1165 CG GLU A 67 8.457 -0.359 4.924 1.00 0.00 C ATOM 1166 CD GLU A 67 8.447 -1.673 5.708 1.00 0.00 C ATOM 1167 OE1 GLU A 67 7.610 -2.534 5.361 1.00 0.00 O ATOM 1168 OE2 GLU A 67 9.277 -1.787 6.635 1.00 0.00 O ATOM 0 H GLU A 67 11.296 1.037 3.706 1.00 0.00 H new ATOM 0 HA GLU A 67 10.699 -1.369 5.034 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.386 0.496 3.176 1.00 0.00 H new ATOM 0 HB3 GLU A 67 8.869 -1.166 2.967 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.830 0.444 5.559 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.439 -0.093 4.640 1.00 0.00 H new ATOM 1175 N GLY A 68 11.422 -1.661 1.825 1.00 0.00 N ATOM 1176 CA GLY A 68 11.863 -2.600 0.808 1.00 0.00 C ATOM 1177 C GLY A 68 11.025 -2.463 -0.465 1.00 0.00 C ATOM 1178 O GLY A 68 9.797 -2.514 -0.412 1.00 0.00 O ATOM 0 H GLY A 68 11.309 -0.701 1.499 1.00 0.00 H new ATOM 0 HA2 GLY A 68 12.914 -2.424 0.577 1.00 0.00 H new ATOM 0 HA3 GLY A 68 11.787 -3.618 1.190 1.00 0.00 H new ATOM 1182 N LEU A 69 11.722 -2.292 -1.578 1.00 0.00 N ATOM 1183 CA LEU A 69 11.058 -2.147 -2.862 1.00 0.00 C ATOM 1184 C LEU A 69 10.073 -3.302 -3.055 1.00 0.00 C ATOM 1185 O LEU A 69 8.869 -3.082 -3.180 1.00 0.00 O ATOM 1186 CB LEU A 69 12.087 -2.023 -3.987 1.00 0.00 C ATOM 1187 CG LEU A 69 11.540 -2.128 -5.412 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.572 -0.983 -5.714 1.00 0.00 C ATOM 1189 CD2 LEU A 69 12.678 -2.201 -6.432 1.00 0.00 C ATOM 0 H LEU A 69 12.740 -2.251 -1.617 1.00 0.00 H new ATOM 0 HA LEU A 69 10.478 -1.224 -2.889 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.595 -1.064 -3.884 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.840 -2.799 -3.850 1.00 0.00 H new ATOM 0 HG LEU A 69 10.975 -3.056 -5.493 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.198 -1.082 -6.733 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.736 -1.020 -5.016 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.091 -0.030 -5.609 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.262 -2.275 -7.437 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.291 -1.303 -6.358 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.293 -3.077 -6.229 1.00 0.00 H new ATOM 1201 N GLU A 70 10.621 -4.508 -3.074 1.00 0.00 N ATOM 1202 CA GLU A 70 9.806 -5.698 -3.250 1.00 0.00 C ATOM 1203 C GLU A 70 8.928 -5.927 -2.017 1.00 0.00 C ATOM 1204 O GLU A 70 8.006 -6.740 -2.050 1.00 0.00 O ATOM 1205 CB GLU A 70 10.677 -6.922 -3.538 1.00 0.00 C ATOM 1206 CG GLU A 70 10.794 -7.170 -5.043 1.00 0.00 C ATOM 1207 CD GLU A 70 11.705 -8.365 -5.333 1.00 0.00 C ATOM 1208 OE1 GLU A 70 12.879 -8.299 -4.909 1.00 0.00 O ATOM 1209 OE2 GLU A 70 11.206 -9.317 -5.971 1.00 0.00 O ATOM 0 H GLU A 70 11.620 -4.687 -2.970 1.00 0.00 H new ATOM 0 HA GLU A 70 9.156 -5.545 -4.112 1.00 0.00 H new ATOM 0 HB2 GLU A 70 11.669 -6.775 -3.112 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.249 -7.800 -3.053 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.805 -7.352 -5.463 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.189 -6.280 -5.532 1.00 0.00 H new ATOM 1216 N ASN A 71 9.247 -5.196 -0.959 1.00 0.00 N ATOM 1217 CA ASN A 71 8.500 -5.309 0.282 1.00 0.00 C ATOM 1218 C ASN A 71 7.418 -4.229 0.320 1.00 0.00 C ATOM 1219 O ASN A 71 6.765 -4.035 1.345 1.00 0.00 O ATOM 1220 CB ASN A 71 9.411 -5.109 1.494 1.00 0.00 C ATOM 1221 CG ASN A 71 10.501 -6.182 1.543 1.00 0.00 C ATOM 1222 OD1 ASN A 71 10.581 -7.062 0.702 1.00 0.00 O ATOM 1223 ND2 ASN A 71 11.334 -6.060 2.573 1.00 0.00 N ATOM 0 H ASN A 71 10.013 -4.523 -0.936 1.00 0.00 H new ATOM 0 HA ASN A 71 8.062 -6.306 0.322 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.870 -4.121 1.450 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.819 -5.145 2.408 1.00 0.00 H new ATOM 0 HD21 ASN A 71 12.096 -6.727 2.694 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.211 -5.299 3.241 1.00 0.00 H new ATOM 1230 N VAL A 72 7.260 -3.553 -0.808 1.00 0.00 N ATOM 1231 CA VAL A 72 6.269 -2.496 -0.916 1.00 0.00 C ATOM 1232 C VAL A 72 5.554 -2.610 -2.264 1.00 0.00 C ATOM 1233 O VAL A 72 4.325 -2.589 -2.323 1.00 0.00 O ATOM 1234 CB VAL A 72 6.930 -1.133 -0.703 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.919 0.001 -0.880 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.603 -1.059 0.669 1.00 0.00 C ATOM 0 H VAL A 72 7.802 -3.717 -1.656 1.00 0.00 H new ATOM 0 HA VAL A 72 5.514 -2.600 -0.137 1.00 0.00 H new ATOM 0 HB VAL A 72 7.703 -1.013 -1.462 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.415 0.959 -0.723 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.507 -0.033 -1.888 1.00 0.00 H new ATOM 0 HG13 VAL A 72 5.113 -0.113 -0.155 1.00 0.00 H new ATOM 0 HG21 VAL A 72 8.065 -0.080 0.795 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.857 -1.211 1.449 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.367 -1.833 0.742 1.00 0.00 H new ATOM 1246 N LEU A 73 6.353 -2.727 -3.314 1.00 0.00 N ATOM 1247 CA LEU A 73 5.812 -2.844 -4.657 1.00 0.00 C ATOM 1248 C LEU A 73 6.384 -4.095 -5.326 1.00 0.00 C ATOM 1249 O LEU A 73 7.472 -4.055 -5.899 1.00 0.00 O ATOM 1250 CB LEU A 73 6.059 -1.557 -5.448 1.00 0.00 C ATOM 1251 CG LEU A 73 5.128 -1.312 -6.638 1.00 0.00 C ATOM 1252 CD1 LEU A 73 4.025 -0.316 -6.276 1.00 0.00 C ATOM 1253 CD2 LEU A 73 5.920 -0.868 -7.870 1.00 0.00 C ATOM 0 H LEU A 73 7.372 -2.743 -3.262 1.00 0.00 H new ATOM 0 HA LEU A 73 4.730 -2.967 -4.622 1.00 0.00 H new ATOM 0 HB2 LEU A 73 5.973 -0.712 -4.765 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.086 -1.569 -5.812 1.00 0.00 H new ATOM 0 HG LEU A 73 4.640 -2.254 -6.890 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.378 -0.160 -7.139 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.436 -0.710 -5.448 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.474 0.633 -5.983 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.236 -0.700 -8.702 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.453 0.056 -7.646 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.637 -1.643 -8.141 1.00 0.00 H new ATOM 1265 N PRO A 74 5.605 -5.206 -5.228 1.00 0.00 N ATOM 1266 CA PRO A 74 6.023 -6.467 -5.817 1.00 0.00 C ATOM 1267 C PRO A 74 5.859 -6.443 -7.338 1.00 0.00 C ATOM 1268 O PRO A 74 4.786 -6.119 -7.845 1.00 0.00 O ATOM 1269 CB PRO A 74 5.160 -7.521 -5.143 1.00 0.00 C ATOM 1270 CG PRO A 74 3.978 -6.773 -4.548 1.00 0.00 C ATOM 1271 CD PRO A 74 4.311 -5.290 -4.558 1.00 0.00 C ATOM 0 HA PRO A 74 7.081 -6.676 -5.657 1.00 0.00 H new ATOM 0 HB2 PRO A 74 4.827 -8.270 -5.861 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.719 -8.047 -4.369 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.074 -6.965 -5.127 1.00 0.00 H new ATOM 0 HG3 PRO A 74 3.784 -7.114 -3.531 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.552 -4.717 -5.090 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.362 -4.889 -3.546 1.00 0.00 H new ATOM 1279 N GLY A 75 6.939 -6.791 -8.023 1.00 0.00 N ATOM 1280 CA GLY A 75 6.928 -6.814 -9.476 1.00 0.00 C ATOM 1281 C GLY A 75 7.790 -5.687 -10.048 1.00 0.00 C ATOM 1282 O GLY A 75 8.374 -5.831 -11.121 1.00 0.00 O ATOM 0 H GLY A 75 7.827 -7.059 -7.599 1.00 0.00 H new ATOM 0 HA2 GLY A 75 7.298 -7.776 -9.831 1.00 0.00 H new ATOM 0 HA3 GLY A 75 5.905 -6.713 -9.837 1.00 0.00 H new ATOM 1286 N VAL A 76 7.841 -4.590 -9.307 1.00 0.00 N ATOM 1287 CA VAL A 76 8.622 -3.439 -9.728 1.00 0.00 C ATOM 1288 C VAL A 76 9.921 -3.919 -10.378 1.00 0.00 C ATOM 1289 O VAL A 76 10.420 -4.995 -10.054 1.00 0.00 O ATOM 1290 CB VAL A 76 8.858 -2.504 -8.539 1.00 0.00 C ATOM 1291 CG1 VAL A 76 9.587 -3.230 -7.407 1.00 0.00 C ATOM 1292 CG2 VAL A 76 9.624 -1.252 -8.971 1.00 0.00 C ATOM 0 H VAL A 76 7.355 -4.474 -8.418 1.00 0.00 H new ATOM 0 HA VAL A 76 8.079 -2.862 -10.476 1.00 0.00 H new ATOM 0 HB VAL A 76 7.885 -2.188 -8.162 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.742 -2.543 -6.575 1.00 0.00 H new ATOM 0 HG12 VAL A 76 8.987 -4.076 -7.072 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.552 -3.588 -7.766 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.779 -0.604 -8.108 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.590 -1.541 -9.385 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.050 -0.717 -9.728 1.00 0.00 H new ATOM 1302 N LYS A 77 10.431 -3.097 -11.283 1.00 0.00 N ATOM 1303 CA LYS A 77 11.662 -3.425 -11.982 1.00 0.00 C ATOM 1304 C LYS A 77 12.857 -2.964 -11.144 1.00 0.00 C ATOM 1305 O LYS A 77 13.896 -3.622 -11.123 1.00 0.00 O ATOM 1306 CB LYS A 77 11.645 -2.846 -13.398 1.00 0.00 C ATOM 1307 CG LYS A 77 10.728 -3.661 -14.312 1.00 0.00 C ATOM 1308 CD LYS A 77 11.230 -3.636 -15.757 1.00 0.00 C ATOM 1309 CE LYS A 77 11.726 -5.018 -16.189 1.00 0.00 C ATOM 1310 NZ LYS A 77 12.848 -4.891 -17.145 1.00 0.00 N ATOM 0 H LYS A 77 10.014 -2.205 -11.548 1.00 0.00 H new ATOM 0 HA LYS A 77 11.754 -4.504 -12.105 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.307 -1.810 -13.367 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.656 -2.839 -13.804 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.678 -4.691 -13.958 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.715 -3.260 -14.268 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.428 -3.310 -16.419 1.00 0.00 H new ATOM 0 HD3 LYS A 77 12.037 -2.910 -15.853 1.00 0.00 H new ATOM 0 HE2 LYS A 77 12.048 -5.585 -15.315 1.00 0.00 H new ATOM 0 HE3 LYS A 77 10.910 -5.576 -16.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 13.172 -5.838 -17.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 12.530 -4.369 -17.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 13.632 -4.377 -16.694 1.00 0.00 H new ATOM 1324 N SER A 78 12.669 -1.836 -10.474 1.00 0.00 N ATOM 1325 CA SER A 78 13.718 -1.280 -9.636 1.00 0.00 C ATOM 1326 C SER A 78 13.154 -0.149 -8.774 1.00 0.00 C ATOM 1327 O SER A 78 12.033 0.307 -8.996 1.00 0.00 O ATOM 1328 CB SER A 78 14.886 -0.771 -10.483 1.00 0.00 C ATOM 1329 OG SER A 78 15.761 -1.825 -10.874 1.00 0.00 O ATOM 0 H SER A 78 11.806 -1.292 -10.495 1.00 0.00 H new ATOM 0 HA SER A 78 14.093 -2.071 -8.986 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.499 -0.273 -11.372 1.00 0.00 H new ATOM 0 HB3 SER A 78 15.446 -0.026 -9.918 1.00 0.00 H new ATOM 0 HG SER A 78 15.329 -2.688 -10.705 1.00 0.00 H new ATOM 1335 N ILE A 79 13.957 0.272 -7.808 1.00 0.00 N ATOM 1336 CA ILE A 79 13.553 1.342 -6.911 1.00 0.00 C ATOM 1337 C ILE A 79 13.176 2.576 -7.733 1.00 0.00 C ATOM 1338 O ILE A 79 12.204 3.261 -7.420 1.00 0.00 O ATOM 1339 CB ILE A 79 14.641 1.606 -5.868 1.00 0.00 C ATOM 1340 CG1 ILE A 79 14.998 0.326 -5.111 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.229 2.736 -4.922 1.00 0.00 C ATOM 1342 CD1 ILE A 79 15.981 0.616 -3.975 1.00 0.00 C ATOM 0 H ILE A 79 14.886 -0.109 -7.627 1.00 0.00 H new ATOM 0 HA ILE A 79 12.667 1.052 -6.347 1.00 0.00 H new ATOM 0 HB ILE A 79 15.541 1.933 -6.388 1.00 0.00 H new ATOM 0 HG12 ILE A 79 14.092 -0.126 -4.706 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.435 -0.398 -5.799 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.019 2.904 -4.190 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.065 3.649 -5.495 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.309 2.461 -4.406 1.00 0.00 H new ATOM 0 HD11 ILE A 79 16.218 -0.311 -3.453 1.00 0.00 H new ATOM 0 HD12 ILE A 79 16.895 1.045 -4.385 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.531 1.321 -3.276 1.00 0.00 H new ATOM 1354 N GLU A 80 13.964 2.821 -8.769 1.00 0.00 N ATOM 1355 CA GLU A 80 13.725 3.960 -9.639 1.00 0.00 C ATOM 1356 C GLU A 80 12.386 3.804 -10.362 1.00 0.00 C ATOM 1357 O GLU A 80 11.587 4.737 -10.404 1.00 0.00 O ATOM 1358 CB GLU A 80 14.871 4.137 -10.638 1.00 0.00 C ATOM 1359 CG GLU A 80 15.695 5.384 -10.311 1.00 0.00 C ATOM 1360 CD GLU A 80 15.754 6.332 -11.511 1.00 0.00 C ATOM 1361 OE1 GLU A 80 16.314 5.906 -12.544 1.00 0.00 O ATOM 1362 OE2 GLU A 80 15.238 7.462 -11.368 1.00 0.00 O ATOM 0 H GLU A 80 14.769 2.250 -9.026 1.00 0.00 H new ATOM 0 HA GLU A 80 13.681 4.859 -9.024 1.00 0.00 H new ATOM 0 HB2 GLU A 80 15.514 3.257 -10.619 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.469 4.217 -11.648 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.257 5.900 -9.457 1.00 0.00 H new ATOM 0 HG3 GLU A 80 16.705 5.092 -10.024 1.00 0.00 H new ATOM 1369 N GLU A 81 12.183 2.617 -10.915 1.00 0.00 N ATOM 1370 CA GLU A 81 10.955 2.326 -11.634 1.00 0.00 C ATOM 1371 C GLU A 81 9.750 2.449 -10.699 1.00 0.00 C ATOM 1372 O GLU A 81 8.700 2.952 -11.096 1.00 0.00 O ATOM 1373 CB GLU A 81 11.011 0.939 -12.277 1.00 0.00 C ATOM 1374 CG GLU A 81 11.725 0.990 -13.629 1.00 0.00 C ATOM 1375 CD GLU A 81 10.796 1.526 -14.720 1.00 0.00 C ATOM 1376 OE1 GLU A 81 9.887 0.765 -15.116 1.00 0.00 O ATOM 1377 OE2 GLU A 81 11.016 2.685 -15.134 1.00 0.00 O ATOM 0 H GLU A 81 12.849 1.845 -10.879 1.00 0.00 H new ATOM 0 HA GLU A 81 10.845 3.057 -12.435 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.530 0.247 -11.613 1.00 0.00 H new ATOM 0 HB3 GLU A 81 10.000 0.555 -12.410 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.608 1.625 -13.554 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.071 -0.008 -13.899 1.00 0.00 H new ATOM 1384 N GLY A 82 9.942 1.981 -9.475 1.00 0.00 N ATOM 1385 CA GLY A 82 8.884 2.032 -8.480 1.00 0.00 C ATOM 1386 C GLY A 82 8.326 3.450 -8.345 1.00 0.00 C ATOM 1387 O GLY A 82 7.112 3.641 -8.291 1.00 0.00 O ATOM 0 H GLY A 82 10.814 1.565 -9.149 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.083 1.347 -8.760 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.269 1.696 -7.517 1.00 0.00 H new ATOM 1391 N ILE A 83 9.240 4.408 -8.294 1.00 0.00 N ATOM 1392 CA ILE A 83 8.855 5.803 -8.166 1.00 0.00 C ATOM 1393 C ILE A 83 8.002 6.205 -9.372 1.00 0.00 C ATOM 1394 O ILE A 83 7.002 6.905 -9.223 1.00 0.00 O ATOM 1395 CB ILE A 83 10.090 6.684 -7.966 1.00 0.00 C ATOM 1396 CG1 ILE A 83 10.571 6.631 -6.514 1.00 0.00 C ATOM 1397 CG2 ILE A 83 9.822 8.118 -8.428 1.00 0.00 C ATOM 1398 CD1 ILE A 83 12.036 6.195 -6.438 1.00 0.00 C ATOM 0 H ILE A 83 10.246 4.245 -8.339 1.00 0.00 H new ATOM 0 HA ILE A 83 8.241 5.948 -7.277 1.00 0.00 H new ATOM 0 HB ILE A 83 10.894 6.291 -8.587 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.455 7.612 -6.053 1.00 0.00 H new ATOM 0 HG13 ILE A 83 9.951 5.937 -5.947 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.716 8.723 -8.275 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.562 8.117 -9.487 1.00 0.00 H new ATOM 0 HG23 ILE A 83 8.997 8.538 -7.852 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.353 6.165 -5.396 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.144 5.204 -6.878 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.656 6.905 -6.986 1.00 0.00 H new ATOM 1410 N GLN A 84 8.430 5.745 -10.538 1.00 0.00 N ATOM 1411 CA GLN A 84 7.719 6.048 -11.769 1.00 0.00 C ATOM 1412 C GLN A 84 6.253 5.626 -11.651 1.00 0.00 C ATOM 1413 O GLN A 84 5.365 6.305 -12.166 1.00 0.00 O ATOM 1414 CB GLN A 84 8.388 5.376 -12.969 1.00 0.00 C ATOM 1415 CG GLN A 84 9.210 6.384 -13.774 1.00 0.00 C ATOM 1416 CD GLN A 84 10.327 6.988 -12.920 1.00 0.00 C ATOM 1417 OE1 GLN A 84 11.370 6.393 -12.706 1.00 0.00 O ATOM 1418 NE2 GLN A 84 10.051 8.200 -12.447 1.00 0.00 N ATOM 0 H GLN A 84 9.260 5.165 -10.657 1.00 0.00 H new ATOM 0 HA GLN A 84 7.756 7.125 -11.932 1.00 0.00 H new ATOM 0 HB2 GLN A 84 9.033 4.568 -12.625 1.00 0.00 H new ATOM 0 HB3 GLN A 84 7.628 4.927 -13.609 1.00 0.00 H new ATOM 0 HG2 GLN A 84 9.640 5.893 -14.647 1.00 0.00 H new ATOM 0 HG3 GLN A 84 8.560 7.177 -14.142 1.00 0.00 H new ATOM 0 HE21 GLN A 84 9.157 8.641 -12.665 1.00 0.00 H new ATOM 0 HE22 GLN A 84 10.733 8.688 -11.867 1.00 0.00 H new ATOM 1427 N VAL A 85 6.044 4.508 -10.971 1.00 0.00 N ATOM 1428 CA VAL A 85 4.701 3.988 -10.780 1.00 0.00 C ATOM 1429 C VAL A 85 3.897 4.967 -9.922 1.00 0.00 C ATOM 1430 O VAL A 85 2.767 5.314 -10.264 1.00 0.00 O ATOM 1431 CB VAL A 85 4.765 2.582 -10.182 1.00 0.00 C ATOM 1432 CG1 VAL A 85 3.627 2.359 -9.183 1.00 0.00 C ATOM 1433 CG2 VAL A 85 4.747 1.517 -11.280 1.00 0.00 C ATOM 0 H VAL A 85 6.783 3.948 -10.546 1.00 0.00 H new ATOM 0 HA VAL A 85 4.187 3.897 -11.737 1.00 0.00 H new ATOM 0 HB VAL A 85 5.708 2.490 -9.643 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.695 1.352 -8.772 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.705 3.086 -8.375 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.669 2.480 -9.689 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.793 0.527 -10.827 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.829 1.608 -11.860 1.00 0.00 H new ATOM 0 HG23 VAL A 85 5.606 1.656 -11.936 1.00 0.00 H new ATOM 1443 N TYR A 86 4.511 5.385 -8.825 1.00 0.00 N ATOM 1444 CA TYR A 86 3.867 6.318 -7.916 1.00 0.00 C ATOM 1445 C TYR A 86 3.701 7.692 -8.567 1.00 0.00 C ATOM 1446 O TYR A 86 2.850 8.479 -8.155 1.00 0.00 O ATOM 1447 CB TYR A 86 4.801 6.446 -6.712 1.00 0.00 C ATOM 1448 CG TYR A 86 5.196 5.108 -6.085 1.00 0.00 C ATOM 1449 CD1 TYR A 86 4.302 4.056 -6.083 1.00 0.00 C ATOM 1450 CD2 TYR A 86 6.446 4.952 -5.520 1.00 0.00 C ATOM 1451 CE1 TYR A 86 4.674 2.796 -5.493 1.00 0.00 C ATOM 1452 CE2 TYR A 86 6.817 3.692 -4.930 1.00 0.00 C ATOM 1453 CZ TYR A 86 5.913 2.676 -4.945 1.00 0.00 C ATOM 1454 OH TYR A 86 6.264 1.487 -4.388 1.00 0.00 O ATOM 0 H TYR A 86 5.448 5.095 -8.545 1.00 0.00 H new ATOM 0 HA TYR A 86 2.875 5.961 -7.639 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.705 6.972 -7.021 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.317 7.062 -5.954 1.00 0.00 H new ATOM 0 HD1 TYR A 86 3.324 4.178 -6.524 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.145 5.775 -5.521 1.00 0.00 H new ATOM 0 HE1 TYR A 86 3.984 1.965 -5.486 1.00 0.00 H new ATOM 0 HE2 TYR A 86 7.792 3.557 -4.485 1.00 0.00 H new ATOM 0 HH TYR A 86 6.227 1.560 -3.411 1.00 0.00 H new ATOM 1464 N ARG A 87 4.527 7.939 -9.573 1.00 0.00 N ATOM 1465 CA ARG A 87 4.483 9.205 -10.285 1.00 0.00 C ATOM 1466 C ARG A 87 3.268 9.249 -11.213 1.00 0.00 C ATOM 1467 O ARG A 87 2.528 10.232 -11.228 1.00 0.00 O ATOM 1468 CB ARG A 87 5.754 9.418 -11.109 1.00 0.00 C ATOM 1469 CG ARG A 87 6.454 10.719 -10.710 1.00 0.00 C ATOM 1470 CD ARG A 87 6.442 11.724 -11.863 1.00 0.00 C ATOM 1471 NE ARG A 87 7.757 12.397 -11.962 1.00 0.00 N ATOM 1472 CZ ARG A 87 8.175 13.073 -13.041 1.00 0.00 C ATOM 1473 NH1 ARG A 87 7.384 13.172 -14.118 1.00 0.00 N ATOM 1474 NH2 ARG A 87 9.384 13.651 -13.042 1.00 0.00 N ATOM 0 H ARG A 87 5.231 7.283 -9.912 1.00 0.00 H new ATOM 0 HA ARG A 87 4.407 10.000 -9.544 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.432 8.577 -10.963 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.504 9.446 -12.170 1.00 0.00 H new ATOM 0 HG2 ARG A 87 5.958 11.151 -9.841 1.00 0.00 H new ATOM 0 HG3 ARG A 87 7.483 10.508 -10.418 1.00 0.00 H new ATOM 0 HD2 ARG A 87 6.214 11.214 -12.799 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.657 12.463 -11.704 1.00 0.00 H new ATOM 0 HE ARG A 87 8.384 12.343 -11.159 1.00 0.00 H new ATOM 0 HH11 ARG A 87 6.463 12.733 -14.117 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.702 13.687 -14.939 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.986 13.576 -12.222 1.00 0.00 H new ATOM 0 HH22 ARG A 87 9.703 14.166 -13.863 1.00 0.00 H new ATOM 1488 N ARG A 88 3.099 8.172 -11.966 1.00 0.00 N ATOM 1489 CA ARG A 88 1.986 8.076 -12.895 1.00 0.00 C ATOM 1490 C ARG A 88 0.667 7.940 -12.132 1.00 0.00 C ATOM 1491 O ARG A 88 -0.360 8.462 -12.562 1.00 0.00 O ATOM 1492 CB ARG A 88 2.151 6.876 -13.831 1.00 0.00 C ATOM 1493 CG ARG A 88 2.241 5.571 -13.038 1.00 0.00 C ATOM 1494 CD ARG A 88 2.287 4.362 -13.975 1.00 0.00 C ATOM 1495 NE ARG A 88 0.915 3.985 -14.382 1.00 0.00 N ATOM 1496 CZ ARG A 88 0.287 4.482 -15.456 1.00 0.00 C ATOM 1497 NH1 ARG A 88 0.903 5.379 -16.238 1.00 0.00 N ATOM 1498 NH2 ARG A 88 -0.958 4.082 -15.749 1.00 0.00 N ATOM 0 H ARG A 88 3.714 7.358 -11.952 1.00 0.00 H new ATOM 0 HA ARG A 88 1.973 8.989 -13.491 1.00 0.00 H new ATOM 0 HB2 ARG A 88 1.308 6.829 -14.520 1.00 0.00 H new ATOM 0 HB3 ARG A 88 3.050 7.002 -14.435 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.132 5.583 -12.410 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.383 5.486 -12.371 1.00 0.00 H new ATOM 0 HD2 ARG A 88 2.885 4.597 -14.856 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.771 3.523 -13.476 1.00 0.00 H new ATOM 0 HE ARG A 88 0.416 3.304 -13.809 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.851 5.684 -16.016 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.424 5.757 -17.056 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -1.428 3.399 -15.154 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -1.436 4.460 -16.567 1.00 0.00 H new ATOM 1512 N PHE A 89 0.738 7.236 -11.012 1.00 0.00 N ATOM 1513 CA PHE A 89 -0.437 7.025 -10.184 1.00 0.00 C ATOM 1514 C PHE A 89 -0.778 8.284 -9.384 1.00 0.00 C ATOM 1515 O PHE A 89 -1.896 8.791 -9.465 1.00 0.00 O ATOM 1516 CB PHE A 89 -0.103 5.892 -9.212 1.00 0.00 C ATOM 1517 CG PHE A 89 -0.646 4.526 -9.637 1.00 0.00 C ATOM 1518 CD1 PHE A 89 0.080 3.736 -10.473 1.00 0.00 C ATOM 1519 CD2 PHE A 89 -1.854 4.102 -9.178 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -0.424 2.469 -10.867 1.00 0.00 C ATOM 1521 CE2 PHE A 89 -2.358 2.835 -9.572 1.00 0.00 C ATOM 1522 CZ PHE A 89 -1.632 2.045 -10.409 1.00 0.00 C ATOM 0 H PHE A 89 1.592 6.804 -10.658 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.295 6.783 -10.811 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.980 5.824 -9.107 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.503 6.141 -8.229 1.00 0.00 H new ATOM 0 HD1 PHE A 89 1.040 4.073 -10.837 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.430 4.729 -8.514 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.152 1.841 -11.531 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.317 2.498 -9.208 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.015 1.081 -10.710 1.00 0.00 H new ATOM 1532 N TYR A 90 0.206 8.751 -8.630 1.00 0.00 N ATOM 1533 CA TYR A 90 0.025 9.941 -7.817 1.00 0.00 C ATOM 1534 C TYR A 90 0.858 11.106 -8.355 1.00 0.00 C ATOM 1535 O TYR A 90 1.888 10.894 -8.993 1.00 0.00 O ATOM 1536 CB TYR A 90 0.524 9.576 -6.418 1.00 0.00 C ATOM 1537 CG TYR A 90 0.348 8.098 -6.060 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.919 7.561 -5.955 1.00 0.00 C ATOM 1539 CD2 TYR A 90 1.455 7.304 -5.843 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -1.085 6.170 -5.619 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.289 5.914 -5.506 1.00 0.00 C ATOM 1542 CZ TYR A 90 0.027 5.415 -5.411 1.00 0.00 C ATOM 1543 OH TYR A 90 -0.130 4.102 -5.093 1.00 0.00 O ATOM 0 H TYR A 90 1.131 8.327 -8.565 1.00 0.00 H new ATOM 0 HA TYR A 90 -1.020 10.252 -7.820 1.00 0.00 H new ATOM 0 HB2 TYR A 90 1.580 9.835 -6.341 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -0.007 10.183 -5.684 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.785 8.183 -6.125 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.446 7.725 -5.926 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -2.070 5.736 -5.534 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.147 5.282 -5.333 1.00 0.00 H new ATOM 0 HH TYR A 90 0.750 3.687 -4.974 1.00 0.00 H new ATOM 1553 N ASP A 91 0.382 12.311 -8.077 1.00 0.00 N ATOM 1554 CA ASP A 91 1.070 13.509 -8.525 1.00 0.00 C ATOM 1555 C ASP A 91 2.355 13.687 -7.714 1.00 0.00 C ATOM 1556 O ASP A 91 2.412 13.312 -6.544 1.00 0.00 O ATOM 1557 CB ASP A 91 0.203 14.753 -8.317 1.00 0.00 C ATOM 1558 CG ASP A 91 -1.302 14.524 -8.467 1.00 0.00 C ATOM 1559 OD1 ASP A 91 -1.704 14.098 -9.571 1.00 0.00 O ATOM 1560 OD2 ASP A 91 -2.017 14.781 -7.475 1.00 0.00 O ATOM 0 H ASP A 91 -0.472 12.483 -7.547 1.00 0.00 H new ATOM 0 HA ASP A 91 1.288 13.395 -9.587 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.397 15.151 -7.321 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.512 15.517 -9.031 1.00 0.00 H new ATOM 1565 N GLU A 92 3.355 14.261 -8.368 1.00 0.00 N ATOM 1566 CA GLU A 92 4.636 14.493 -7.722 1.00 0.00 C ATOM 1567 C GLU A 92 4.535 15.673 -6.753 1.00 0.00 C ATOM 1568 O GLU A 92 5.139 15.654 -5.682 1.00 0.00 O ATOM 1569 CB GLU A 92 5.737 14.727 -8.758 1.00 0.00 C ATOM 1570 CG GLU A 92 7.047 14.066 -8.323 1.00 0.00 C ATOM 1571 CD GLU A 92 7.981 15.083 -7.663 1.00 0.00 C ATOM 1572 OE1 GLU A 92 8.332 16.064 -8.355 1.00 0.00 O ATOM 1573 OE2 GLU A 92 8.324 14.857 -6.483 1.00 0.00 O ATOM 0 H GLU A 92 3.304 14.572 -9.338 1.00 0.00 H new ATOM 0 HA GLU A 92 4.901 13.602 -7.153 1.00 0.00 H new ATOM 0 HB2 GLU A 92 5.425 14.326 -9.722 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.893 15.797 -8.893 1.00 0.00 H new ATOM 0 HG2 GLU A 92 6.836 13.255 -7.626 1.00 0.00 H new ATOM 0 HG3 GLU A 92 7.540 13.622 -9.188 1.00 0.00 H new ATOM 1580 N GLU A 93 3.766 16.671 -7.164 1.00 0.00 N ATOM 1581 CA GLU A 93 3.579 17.857 -6.345 1.00 0.00 C ATOM 1582 C GLU A 93 2.946 17.481 -5.004 1.00 0.00 C ATOM 1583 O GLU A 93 3.481 17.812 -3.947 1.00 0.00 O ATOM 1584 CB GLU A 93 2.732 18.900 -7.077 1.00 0.00 C ATOM 1585 CG GLU A 93 3.420 20.267 -7.069 1.00 0.00 C ATOM 1586 CD GLU A 93 3.178 21.010 -8.385 1.00 0.00 C ATOM 1587 OE1 GLU A 93 3.523 20.430 -9.436 1.00 0.00 O ATOM 1588 OE2 GLU A 93 2.653 22.142 -8.309 1.00 0.00 O ATOM 0 H GLU A 93 3.266 16.683 -8.053 1.00 0.00 H new ATOM 0 HA GLU A 93 4.556 18.300 -6.152 1.00 0.00 H new ATOM 0 HB2 GLU A 93 2.563 18.580 -8.105 1.00 0.00 H new ATOM 0 HB3 GLU A 93 1.754 18.978 -6.602 1.00 0.00 H new ATOM 0 HG2 GLU A 93 3.045 20.862 -6.237 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.491 20.138 -6.911 1.00 0.00 H new ATOM 1595 N LYS A 94 1.816 16.795 -5.090 1.00 0.00 N ATOM 1596 CA LYS A 94 1.105 16.371 -3.896 1.00 0.00 C ATOM 1597 C LYS A 94 2.012 15.463 -3.063 1.00 0.00 C ATOM 1598 O LYS A 94 1.980 15.506 -1.834 1.00 0.00 O ATOM 1599 CB LYS A 94 -0.232 15.728 -4.269 1.00 0.00 C ATOM 1600 CG LYS A 94 -1.405 16.593 -3.803 1.00 0.00 C ATOM 1601 CD LYS A 94 -2.042 16.018 -2.536 1.00 0.00 C ATOM 1602 CE LYS A 94 -1.169 16.293 -1.310 1.00 0.00 C ATOM 1603 NZ LYS A 94 -1.922 17.072 -0.302 1.00 0.00 N ATOM 0 H LYS A 94 1.375 16.522 -5.968 1.00 0.00 H new ATOM 0 HA LYS A 94 0.857 17.232 -3.275 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.284 15.589 -5.349 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.303 14.739 -3.817 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.059 17.609 -3.611 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.152 16.655 -4.594 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.029 16.457 -2.390 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.185 14.944 -2.652 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.835 15.351 -0.875 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.275 16.841 -1.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -1.366 17.134 0.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.102 18.029 -0.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.828 16.601 -0.105 1.00 0.00 H new ATOM 1617 N GLU A 95 2.801 14.662 -3.765 1.00 0.00 N ATOM 1618 CA GLU A 95 3.715 13.746 -3.106 1.00 0.00 C ATOM 1619 C GLU A 95 4.784 14.525 -2.336 1.00 0.00 C ATOM 1620 O GLU A 95 4.974 14.307 -1.140 1.00 0.00 O ATOM 1621 CB GLU A 95 4.354 12.789 -4.114 1.00 0.00 C ATOM 1622 CG GLU A 95 4.955 11.571 -3.409 1.00 0.00 C ATOM 1623 CD GLU A 95 3.912 10.464 -3.241 1.00 0.00 C ATOM 1624 OE1 GLU A 95 3.047 10.359 -4.138 1.00 0.00 O ATOM 1625 OE2 GLU A 95 4.003 9.749 -2.220 1.00 0.00 O ATOM 0 H GLU A 95 2.826 14.629 -4.784 1.00 0.00 H new ATOM 0 HA GLU A 95 3.147 13.146 -2.395 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.606 12.463 -4.836 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.131 13.310 -4.673 1.00 0.00 H new ATOM 0 HG2 GLU A 95 5.801 11.194 -3.984 1.00 0.00 H new ATOM 0 HG3 GLU A 95 5.339 11.865 -2.432 1.00 0.00 H new ATOM 1632 N LYS A 96 5.452 15.416 -3.052 1.00 0.00 N ATOM 1633 CA LYS A 96 6.497 16.228 -2.452 1.00 0.00 C ATOM 1634 C LYS A 96 5.876 17.159 -1.408 1.00 0.00 C ATOM 1635 O LYS A 96 6.584 17.727 -0.579 1.00 0.00 O ATOM 1636 CB LYS A 96 7.295 16.960 -3.532 1.00 0.00 C ATOM 1637 CG LYS A 96 6.513 18.159 -4.074 1.00 0.00 C ATOM 1638 CD LYS A 96 7.341 19.442 -3.979 1.00 0.00 C ATOM 1639 CE LYS A 96 6.501 20.666 -4.348 1.00 0.00 C ATOM 1640 NZ LYS A 96 7.224 21.912 -4.011 1.00 0.00 N ATOM 0 H LYS A 96 5.290 15.594 -4.043 1.00 0.00 H new ATOM 0 HA LYS A 96 7.217 15.598 -1.930 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.246 17.298 -3.120 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.526 16.274 -4.347 1.00 0.00 H new ATOM 0 HG2 LYS A 96 6.235 17.977 -5.112 1.00 0.00 H new ATOM 0 HG3 LYS A 96 5.586 18.277 -3.512 1.00 0.00 H new ATOM 0 HD2 LYS A 96 7.729 19.555 -2.967 1.00 0.00 H new ATOM 0 HD3 LYS A 96 8.202 19.373 -4.644 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.271 20.649 -5.413 1.00 0.00 H new ATOM 0 HE3 LYS A 96 5.550 20.635 -3.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 6.639 22.733 -4.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 7.421 21.934 -2.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 8.120 21.947 -4.538 1.00 0.00 H new ATOM 1654 N LYS A 97 4.559 17.287 -1.485 1.00 0.00 N ATOM 1655 CA LYS A 97 3.835 18.140 -0.558 1.00 0.00 C ATOM 1656 C LYS A 97 3.842 17.497 0.831 1.00 0.00 C ATOM 1657 O LYS A 97 4.327 18.093 1.792 1.00 0.00 O ATOM 1658 CB LYS A 97 2.432 18.440 -1.089 1.00 0.00 C ATOM 1659 CG LYS A 97 2.297 19.913 -1.478 1.00 0.00 C ATOM 1660 CD LYS A 97 0.881 20.424 -1.204 1.00 0.00 C ATOM 1661 CE LYS A 97 0.033 20.397 -2.478 1.00 0.00 C ATOM 1662 NZ LYS A 97 -0.687 21.679 -2.649 1.00 0.00 N ATOM 0 H LYS A 97 3.975 16.814 -2.175 1.00 0.00 H new ATOM 0 HA LYS A 97 4.329 19.107 -0.465 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.225 17.811 -1.955 1.00 0.00 H new ATOM 0 HB3 LYS A 97 1.691 18.191 -0.329 1.00 0.00 H new ATOM 0 HG2 LYS A 97 3.017 20.509 -0.917 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.534 20.037 -2.535 1.00 0.00 H new ATOM 0 HD2 LYS A 97 0.411 19.809 -0.437 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.926 21.441 -0.814 1.00 0.00 H new ATOM 0 HE2 LYS A 97 0.671 20.213 -3.343 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -0.682 19.575 -2.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.257 21.644 -3.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -1.310 21.839 -1.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 0.000 22.457 -2.717 1.00 0.00 H new ATOM 1676 N TYR A 98 3.299 16.291 0.892 1.00 0.00 N ATOM 1677 CA TYR A 98 3.236 15.561 2.147 1.00 0.00 C ATOM 1678 C TYR A 98 4.382 14.552 2.253 1.00 0.00 C ATOM 1679 O TYR A 98 5.124 14.551 3.234 1.00 0.00 O ATOM 1680 CB TYR A 98 1.906 14.804 2.130 1.00 0.00 C ATOM 1681 CG TYR A 98 0.724 15.613 2.667 1.00 0.00 C ATOM 1682 CD1 TYR A 98 0.392 16.820 2.087 1.00 0.00 C ATOM 1683 CD2 TYR A 98 -0.011 15.134 3.733 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -0.721 17.580 2.593 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -1.125 15.895 4.239 1.00 0.00 C ATOM 1686 CZ TYR A 98 -1.424 17.080 3.644 1.00 0.00 C ATOM 1687 OH TYR A 98 -2.476 17.798 4.122 1.00 0.00 O ATOM 0 H TYR A 98 2.898 15.800 0.093 1.00 0.00 H new ATOM 0 HA TYR A 98 3.317 16.245 2.992 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.688 14.496 1.107 1.00 0.00 H new ATOM 0 HB3 TYR A 98 2.010 13.894 2.722 1.00 0.00 H new ATOM 0 HD1 TYR A 98 0.967 17.195 1.253 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.249 14.189 4.187 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.992 18.526 2.148 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.709 15.532 5.072 1.00 0.00 H new ATOM 0 HH TYR A 98 -2.885 17.319 4.872 1.00 0.00 H new ATOM 1697 N GLY A 99 4.490 13.718 1.229 1.00 0.00 N ATOM 1698 CA GLY A 99 5.532 12.707 1.194 1.00 0.00 C ATOM 1699 C GLY A 99 4.945 11.324 0.904 1.00 0.00 C ATOM 1700 O GLY A 99 4.254 11.136 -0.096 1.00 0.00 O ATOM 0 H GLY A 99 3.872 13.722 0.417 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.266 12.962 0.429 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.059 12.690 2.148 1.00 0.00 H new ATOM 1704 N VAL A 100 5.241 10.392 1.797 1.00 0.00 N ATOM 1705 CA VAL A 100 4.751 9.031 1.650 1.00 0.00 C ATOM 1706 C VAL A 100 4.449 8.450 3.033 1.00 0.00 C ATOM 1707 O VAL A 100 5.078 8.828 4.020 1.00 0.00 O ATOM 1708 CB VAL A 100 5.758 8.196 0.857 1.00 0.00 C ATOM 1709 CG1 VAL A 100 5.081 6.978 0.224 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.462 9.045 -0.203 1.00 0.00 C ATOM 0 H VAL A 100 5.814 10.552 2.626 1.00 0.00 H new ATOM 0 HA VAL A 100 3.820 9.019 1.083 1.00 0.00 H new ATOM 0 HB VAL A 100 6.516 7.835 1.553 1.00 0.00 H new ATOM 0 HG11 VAL A 100 5.818 6.401 -0.334 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.649 6.354 1.007 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.293 7.310 -0.452 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.172 8.426 -0.752 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.723 9.450 -0.895 1.00 0.00 H new ATOM 0 HG23 VAL A 100 6.993 9.865 0.281 1.00 0.00 H new ATOM 1720 N VAL A 101 3.486 7.541 3.060 1.00 0.00 N ATOM 1721 CA VAL A 101 3.092 6.904 4.305 1.00 0.00 C ATOM 1722 C VAL A 101 2.913 5.402 4.070 1.00 0.00 C ATOM 1723 O VAL A 101 1.945 4.981 3.439 1.00 0.00 O ATOM 1724 CB VAL A 101 1.836 7.576 4.863 1.00 0.00 C ATOM 1725 CG1 VAL A 101 0.749 7.681 3.791 1.00 0.00 C ATOM 1726 CG2 VAL A 101 1.319 6.834 6.097 1.00 0.00 C ATOM 0 H VAL A 101 2.967 7.230 2.239 1.00 0.00 H new ATOM 0 HA VAL A 101 3.870 7.025 5.059 1.00 0.00 H new ATOM 0 HB VAL A 101 2.105 8.587 5.169 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -0.133 8.162 4.213 1.00 0.00 H new ATOM 0 HG12 VAL A 101 1.119 8.273 2.954 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.485 6.683 3.441 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.426 7.332 6.474 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.075 5.806 5.828 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.088 6.834 6.870 1.00 0.00 H new ATOM 1736 N ALA A 102 3.861 4.637 4.591 1.00 0.00 N ATOM 1737 CA ALA A 102 3.820 3.192 4.446 1.00 0.00 C ATOM 1738 C ALA A 102 2.916 2.601 5.529 1.00 0.00 C ATOM 1739 O ALA A 102 3.347 2.407 6.665 1.00 0.00 O ATOM 1740 CB ALA A 102 5.242 2.632 4.504 1.00 0.00 C ATOM 0 H ALA A 102 4.662 4.991 5.114 1.00 0.00 H new ATOM 0 HA ALA A 102 3.400 2.915 3.479 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.211 1.548 4.395 1.00 0.00 H new ATOM 0 HB2 ALA A 102 5.835 3.061 3.696 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.695 2.888 5.462 1.00 0.00 H new ATOM 1746 N ILE A 103 1.678 2.331 5.140 1.00 0.00 N ATOM 1747 CA ILE A 103 0.710 1.765 6.064 1.00 0.00 C ATOM 1748 C ILE A 103 0.784 0.238 6.003 1.00 0.00 C ATOM 1749 O ILE A 103 0.670 -0.350 4.929 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.687 2.325 5.785 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -0.686 3.854 5.837 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -1.720 1.720 6.737 1.00 0.00 C ATOM 1753 CD1 ILE A 103 -1.169 4.448 4.512 1.00 0.00 C ATOM 0 H ILE A 103 1.323 2.494 4.198 1.00 0.00 H new ATOM 0 HA ILE A 103 0.946 2.055 7.088 1.00 0.00 H new ATOM 0 HB ILE A 103 -0.974 2.038 4.773 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -1.330 4.194 6.648 1.00 0.00 H new ATOM 0 HG13 ILE A 103 0.320 4.213 6.056 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -2.704 2.135 6.518 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -1.745 0.638 6.607 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -1.448 1.956 7.766 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -1.159 5.536 4.576 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -0.509 4.125 3.707 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -2.184 4.106 4.308 1.00 0.00 H new ATOM 1765 N GLU A 104 0.976 -0.360 7.170 1.00 0.00 N ATOM 1766 CA GLU A 104 1.067 -1.807 7.263 1.00 0.00 C ATOM 1767 C GLU A 104 -0.332 -2.424 7.324 1.00 0.00 C ATOM 1768 O GLU A 104 -1.011 -2.332 8.346 1.00 0.00 O ATOM 1769 CB GLU A 104 1.905 -2.227 8.472 1.00 0.00 C ATOM 1770 CG GLU A 104 2.815 -3.407 8.125 1.00 0.00 C ATOM 1771 CD GLU A 104 2.569 -4.586 9.069 1.00 0.00 C ATOM 1772 OE1 GLU A 104 1.378 -4.883 9.306 1.00 0.00 O ATOM 1773 OE2 GLU A 104 3.576 -5.162 9.532 1.00 0.00 O ATOM 0 H GLU A 104 1.071 0.131 8.059 1.00 0.00 H new ATOM 0 HA GLU A 104 1.568 -2.178 6.369 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.509 -1.385 8.811 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.248 -2.500 9.297 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.637 -3.718 7.096 1.00 0.00 H new ATOM 0 HG3 GLU A 104 3.858 -3.097 8.189 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.721 -3.039 6.217 1.00 0.00 N ATOM 1781 CA ILE A 105 -2.027 -3.671 6.132 1.00 0.00 C ATOM 1782 C ILE A 105 -1.875 -5.178 6.352 1.00 0.00 C ATOM 1783 O ILE A 105 -0.775 -5.717 6.237 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.713 -3.308 4.814 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -2.266 -4.242 3.688 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.484 -1.837 4.463 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -0.789 -4.027 3.350 1.00 0.00 C ATOM 0 H ILE A 105 -0.155 -3.113 5.372 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.683 -3.298 6.919 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.787 -3.445 4.939 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -2.428 -5.278 3.985 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.875 -4.066 2.801 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.982 -1.606 3.522 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.891 -1.207 5.254 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.415 -1.649 4.363 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.497 -4.703 2.547 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.635 -2.996 3.030 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -0.181 -4.228 4.232 1.00 0.00 H new ATOM 1799 N GLU A 106 -2.994 -5.814 6.663 1.00 0.00 N ATOM 1800 CA GLU A 106 -2.999 -7.248 6.899 1.00 0.00 C ATOM 1801 C GLU A 106 -4.224 -7.890 6.245 1.00 0.00 C ATOM 1802 O GLU A 106 -5.296 -7.945 6.846 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.953 -7.557 8.397 1.00 0.00 C ATOM 1804 CG GLU A 106 -3.018 -9.065 8.648 1.00 0.00 C ATOM 1805 CD GLU A 106 -4.468 -9.540 8.756 1.00 0.00 C ATOM 1806 OE1 GLU A 106 -5.197 -8.955 9.585 1.00 0.00 O ATOM 1807 OE2 GLU A 106 -4.814 -10.479 8.007 1.00 0.00 O ATOM 0 H GLU A 106 -3.904 -5.363 6.757 1.00 0.00 H new ATOM 0 HA GLU A 106 -2.104 -7.674 6.445 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -2.037 -7.152 8.827 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -3.786 -7.065 8.899 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -2.518 -9.594 7.837 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -2.482 -9.308 9.566 1.00 0.00 H new ATOM 1814 N PRO A 107 -4.020 -8.371 4.990 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.095 -9.006 4.247 1.00 0.00 C ATOM 1816 C PRO A 107 -5.371 -10.414 4.779 1.00 0.00 C ATOM 1817 O PRO A 107 -4.658 -11.359 4.444 1.00 0.00 O ATOM 1818 CB PRO A 107 -4.631 -8.998 2.800 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.127 -8.784 2.844 1.00 0.00 C ATOM 1820 CD PRO A 107 -2.764 -8.322 4.246 1.00 0.00 C ATOM 0 HA PRO A 107 -6.045 -8.481 4.349 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -4.877 -9.938 2.306 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.122 -8.204 2.237 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -2.602 -9.707 2.598 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -2.825 -8.040 2.107 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.012 -8.972 4.695 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.349 -7.314 4.236 1.00 0.00 H new ATOM 1828 N LEU A 108 -6.407 -10.510 5.599 1.00 0.00 N ATOM 1829 CA LEU A 108 -6.786 -11.787 6.180 1.00 0.00 C ATOM 1830 C LEU A 108 -7.158 -12.761 5.061 1.00 0.00 C ATOM 1831 O LEU A 108 -8.323 -12.855 4.677 1.00 0.00 O ATOM 1832 CB LEU A 108 -7.890 -11.595 7.221 1.00 0.00 C ATOM 1833 CG LEU A 108 -7.919 -10.237 7.926 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -8.936 -9.300 7.271 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -8.175 -10.403 9.425 1.00 0.00 C ATOM 0 H LEU A 108 -6.996 -9.724 5.875 1.00 0.00 H new ATOM 0 HA LEU A 108 -5.946 -12.225 6.718 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -8.853 -11.749 6.733 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -7.788 -12.373 7.978 1.00 0.00 H new ATOM 0 HG LEU A 108 -6.938 -9.774 7.816 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -8.936 -8.342 7.791 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -8.668 -9.145 6.226 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.930 -9.744 7.328 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.191 -9.423 9.902 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -9.135 -10.896 9.578 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -7.382 -11.008 9.865 1.00 0.00 H new