USER MOD reduce.3.24.130724 H: found=0, std=0, add=681, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 679 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 33 LYS NZ :NH3+ -128:sc= 0.81 (180deg=-3.74!) USER MOD Set 1.2: A 81 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 36 THR OG1 : rot -131:sc= -0.947 USER MOD Set 2.2: A 43 GLN : amide:sc= -4.8! C(o=-9.5!,f=-11!) USER MOD Set 2.3: A 74 MET CE :methyl 158:sc= -3.72 (180deg=-2.47) USER MOD Set 3.1: A 12 GLN : amide:sc= 0.144 X(o=0.28,f=-0.039) USER MOD Set 3.2: A 14 TYR OH : rot 0:sc= 0.135 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 164:sc=0.000916 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ -152:sc= -0.269 (180deg=-0.983) USER MOD Single : A 15 SER OG : rot 180:sc= 0.0119 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -126:sc= 0.0106 USER MOD Single : A 24 THR OG1 : rot 180:sc= -1.61 USER MOD Single : A 29 LYS NZ :NH3+ 142:sc= -3.32! (180deg=-4.71!) USER MOD Single : A 30 GLN : amide:sc= -0.433 K(o=-0.43,f=-1.8) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -165:sc= -0.0327 (180deg=-0.3) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 167:sc=-0.00265 (180deg=-0.147) USER MOD Single : A 53 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0307) USER MOD Single : A 57 ASN : amide:sc= -2.36 K(o=-2.4,f=-5.6!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 154:sc= 0.0379 (180deg=-1.34!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= 0.415 K(o=0.42,f=-4.3!) USER MOD Single : A 70 THR OG1 : rot -170:sc= -0.0249 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 160:sc= 0 (180deg=-0.736) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.532 -0.033 0.101 1.00 0.00 N ATOM 2 CA MET A 1 1.923 -0.087 -1.303 1.00 0.00 C ATOM 3 C MET A 1 2.249 -1.517 -1.722 1.00 0.00 C ATOM 4 O MET A 1 2.332 -2.415 -0.885 1.00 0.00 O ATOM 5 CB MET A 1 3.130 0.818 -1.554 1.00 0.00 C ATOM 6 CG MET A 1 2.945 1.768 -2.726 1.00 0.00 C ATOM 7 SD MET A 1 4.190 3.071 -2.767 1.00 0.00 S ATOM 8 CE MET A 1 3.391 4.334 -1.779 1.00 0.00 C ATOM 0 H1 MET A 1 1.578 0.950 0.437 1.00 0.00 H new ATOM 0 H2 MET A 1 0.560 -0.389 0.205 1.00 0.00 H new ATOM 0 H3 MET A 1 2.179 -0.621 0.664 1.00 0.00 H new ATOM 0 HA MET A 1 1.083 0.266 -1.902 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.331 1.399 -0.654 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.008 0.197 -1.735 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.986 1.203 -3.657 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.954 2.219 -2.670 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.040 5.207 -1.711 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.448 4.618 -2.245 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.199 3.946 -0.779 1.00 0.00 H new ATOM 18 N ALA A 2 2.432 -1.721 -3.023 1.00 0.00 N ATOM 19 CA ALA A 2 2.750 -3.041 -3.551 1.00 0.00 C ATOM 20 C ALA A 2 4.209 -3.119 -3.991 1.00 0.00 C ATOM 21 O ALA A 2 4.740 -2.180 -4.583 1.00 0.00 O ATOM 22 CB ALA A 2 1.828 -3.381 -4.713 1.00 0.00 C ATOM 0 H ALA A 2 2.365 -0.989 -3.730 1.00 0.00 H new ATOM 0 HA ALA A 2 2.598 -3.770 -2.755 1.00 0.00 H new ATOM 0 HB1 ALA A 2 2.077 -4.370 -5.098 1.00 0.00 H new ATOM 0 HB2 ALA A 2 0.793 -3.375 -4.370 1.00 0.00 H new ATOM 0 HB3 ALA A 2 1.952 -2.642 -5.504 1.00 0.00 H new ATOM 28 N LEU A 3 4.851 -4.244 -3.696 1.00 0.00 N ATOM 29 CA LEU A 3 6.249 -4.445 -4.060 1.00 0.00 C ATOM 30 C LEU A 3 6.383 -5.521 -5.133 1.00 0.00 C ATOM 31 O LEU A 3 5.987 -6.672 -4.945 1.00 0.00 O ATOM 32 CB LEU A 3 7.067 -4.833 -2.827 1.00 0.00 C ATOM 33 CG LEU A 3 7.571 -3.675 -1.965 1.00 0.00 C ATOM 34 CD1 LEU A 3 8.715 -2.951 -2.659 1.00 0.00 C ATOM 35 CD2 LEU A 3 6.438 -2.709 -1.653 1.00 0.00 C ATOM 0 H LEU A 3 4.426 -5.031 -3.206 1.00 0.00 H new ATOM 0 HA LEU A 3 6.633 -3.507 -4.462 1.00 0.00 H new ATOM 0 HB2 LEU A 3 6.458 -5.486 -2.202 1.00 0.00 H new ATOM 0 HB3 LEU A 3 7.927 -5.417 -3.155 1.00 0.00 H new ATOM 0 HG LEU A 3 7.943 -4.083 -1.025 1.00 0.00 H new ATOM 0 HD11 LEU A 3 9.061 -2.130 -2.031 1.00 0.00 H new ATOM 0 HD12 LEU A 3 9.536 -3.647 -2.830 1.00 0.00 H new ATOM 0 HD13 LEU A 3 8.369 -2.556 -3.614 1.00 0.00 H new ATOM 0 HD21 LEU A 3 6.816 -1.892 -1.039 1.00 0.00 H new ATOM 0 HD22 LEU A 3 6.035 -2.308 -2.583 1.00 0.00 H new ATOM 0 HD23 LEU A 3 5.650 -3.234 -1.113 1.00 0.00 H new ATOM 47 N PRO A 4 6.957 -5.142 -6.284 1.00 0.00 N ATOM 48 CA PRO A 4 7.160 -6.060 -7.408 1.00 0.00 C ATOM 49 C PRO A 4 8.222 -7.114 -7.112 1.00 0.00 C ATOM 50 O PRO A 4 9.094 -6.909 -6.266 1.00 0.00 O ATOM 51 CB PRO A 4 7.622 -5.139 -8.540 1.00 0.00 C ATOM 52 CG PRO A 4 8.231 -3.968 -7.851 1.00 0.00 C ATOM 53 CD PRO A 4 7.454 -3.786 -6.576 1.00 0.00 C ATOM 0 HA PRO A 4 6.257 -6.624 -7.641 1.00 0.00 H new ATOM 0 HB2 PRO A 4 8.344 -5.638 -9.186 1.00 0.00 H new ATOM 0 HB3 PRO A 4 6.786 -4.837 -9.170 1.00 0.00 H new ATOM 0 HG2 PRO A 4 9.286 -4.143 -7.643 1.00 0.00 H new ATOM 0 HG3 PRO A 4 8.173 -3.075 -8.474 1.00 0.00 H new ATOM 0 HD2 PRO A 4 8.084 -3.407 -5.772 1.00 0.00 H new ATOM 0 HD3 PRO A 4 6.636 -3.076 -6.701 1.00 0.00 H new ATOM 61 N ILE A 5 8.144 -8.239 -7.813 1.00 0.00 N ATOM 62 CA ILE A 5 9.100 -9.324 -7.626 1.00 0.00 C ATOM 63 C ILE A 5 9.333 -10.083 -8.927 1.00 0.00 C ATOM 64 O ILE A 5 8.384 -10.500 -9.592 1.00 0.00 O ATOM 65 CB ILE A 5 8.625 -10.313 -6.545 1.00 0.00 C ATOM 66 CG1 ILE A 5 9.015 -9.809 -5.154 1.00 0.00 C ATOM 67 CG2 ILE A 5 9.211 -11.694 -6.797 1.00 0.00 C ATOM 68 CD1 ILE A 5 9.862 -10.788 -4.372 1.00 0.00 C ATOM 0 H ILE A 5 7.429 -8.424 -8.516 1.00 0.00 H new ATOM 0 HA ILE A 5 10.036 -8.867 -7.303 1.00 0.00 H new ATOM 0 HB ILE A 5 7.538 -10.386 -6.593 1.00 0.00 H new ATOM 0 HG12 ILE A 5 9.560 -8.870 -5.256 1.00 0.00 H new ATOM 0 HG13 ILE A 5 8.109 -9.592 -4.588 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.866 -12.382 -6.025 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.888 -12.054 -7.774 1.00 0.00 H new ATOM 0 HG23 ILE A 5 10.299 -11.637 -6.773 1.00 0.00 H new ATOM 0 HD11 ILE A 5 10.101 -10.364 -3.396 1.00 0.00 H new ATOM 0 HD12 ILE A 5 9.312 -11.719 -4.238 1.00 0.00 H new ATOM 0 HD13 ILE A 5 10.785 -10.987 -4.917 1.00 0.00 H new ATOM 80 N ILE A 6 10.600 -10.260 -9.284 1.00 0.00 N ATOM 81 CA ILE A 6 10.957 -10.972 -10.505 1.00 0.00 C ATOM 82 C ILE A 6 11.278 -12.434 -10.215 1.00 0.00 C ATOM 83 O ILE A 6 11.981 -12.748 -9.254 1.00 0.00 O ATOM 84 CB ILE A 6 12.166 -10.322 -11.203 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.777 -8.960 -11.781 1.00 0.00 C ATOM 86 CG2 ILE A 6 12.701 -11.235 -12.297 1.00 0.00 C ATOM 87 CD1 ILE A 6 12.905 -7.952 -11.766 1.00 0.00 C ATOM 0 H ILE A 6 11.397 -9.920 -8.745 1.00 0.00 H new ATOM 0 HA ILE A 6 10.092 -10.916 -11.167 1.00 0.00 H new ATOM 0 HB ILE A 6 12.954 -10.171 -10.466 1.00 0.00 H new ATOM 0 HG12 ILE A 6 11.434 -9.094 -12.807 1.00 0.00 H new ATOM 0 HG13 ILE A 6 10.936 -8.561 -11.214 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.555 -10.761 -12.781 1.00 0.00 H new ATOM 0 HG22 ILE A 6 13.012 -12.184 -11.859 1.00 0.00 H new ATOM 0 HG23 ILE A 6 11.920 -11.415 -13.035 1.00 0.00 H new ATOM 0 HD11 ILE A 6 12.557 -7.010 -12.190 1.00 0.00 H new ATOM 0 HD12 ILE A 6 13.233 -7.788 -10.739 1.00 0.00 H new ATOM 0 HD13 ILE A 6 13.739 -8.330 -12.357 1.00 0.00 H new ATOM 99 N VAL A 7 10.760 -13.326 -11.053 1.00 0.00 N ATOM 100 CA VAL A 7 10.993 -14.756 -10.889 1.00 0.00 C ATOM 101 C VAL A 7 11.686 -15.344 -12.113 1.00 0.00 C ATOM 102 O VAL A 7 11.396 -14.963 -13.247 1.00 0.00 O ATOM 103 CB VAL A 7 9.675 -15.515 -10.644 1.00 0.00 C ATOM 104 CG1 VAL A 7 8.970 -15.799 -11.961 1.00 0.00 C ATOM 105 CG2 VAL A 7 9.938 -16.805 -9.881 1.00 0.00 C ATOM 0 H VAL A 7 10.176 -13.083 -11.853 1.00 0.00 H new ATOM 0 HA VAL A 7 11.638 -14.874 -10.019 1.00 0.00 H new ATOM 0 HB VAL A 7 9.021 -14.888 -10.038 1.00 0.00 H new ATOM 0 HG11 VAL A 7 8.041 -16.336 -11.768 1.00 0.00 H new ATOM 0 HG12 VAL A 7 8.748 -14.858 -12.465 1.00 0.00 H new ATOM 0 HG13 VAL A 7 9.615 -16.407 -12.595 1.00 0.00 H new ATOM 0 HG21 VAL A 7 8.996 -17.329 -9.716 1.00 0.00 H new ATOM 0 HG22 VAL A 7 10.610 -17.439 -10.459 1.00 0.00 H new ATOM 0 HG23 VAL A 7 10.397 -16.572 -8.920 1.00 0.00 H new ATOM 115 N LYS A 8 12.603 -16.276 -11.876 1.00 0.00 N ATOM 116 CA LYS A 8 13.338 -16.919 -12.958 1.00 0.00 C ATOM 117 C LYS A 8 13.115 -18.428 -12.945 1.00 0.00 C ATOM 118 O LYS A 8 13.415 -19.100 -11.958 1.00 0.00 O ATOM 119 CB LYS A 8 14.832 -16.613 -12.841 1.00 0.00 C ATOM 120 CG LYS A 8 15.516 -16.395 -14.180 1.00 0.00 C ATOM 121 CD LYS A 8 16.754 -15.525 -14.039 1.00 0.00 C ATOM 122 CE LYS A 8 16.472 -14.085 -14.438 1.00 0.00 C ATOM 123 NZ LYS A 8 16.853 -13.816 -15.852 1.00 0.00 N ATOM 0 H LYS A 8 12.855 -16.603 -10.943 1.00 0.00 H new ATOM 0 HA LYS A 8 12.966 -16.522 -13.902 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.965 -15.723 -12.226 1.00 0.00 H new ATOM 0 HB3 LYS A 8 15.323 -17.436 -12.322 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.794 -17.358 -14.609 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.818 -15.927 -14.874 1.00 0.00 H new ATOM 0 HD2 LYS A 8 17.106 -15.556 -13.008 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.554 -15.926 -14.661 1.00 0.00 H new ATOM 0 HE2 LYS A 8 15.412 -13.871 -14.301 1.00 0.00 H new ATOM 0 HE3 LYS A 8 17.021 -13.412 -13.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 17.102 -12.812 -15.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 17.670 -14.405 -16.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 16.053 -14.042 -16.476 1.00 0.00 H new ATOM 137 N TRP A 9 12.589 -18.954 -14.045 1.00 0.00 N ATOM 138 CA TRP A 9 12.328 -20.384 -14.160 1.00 0.00 C ATOM 139 C TRP A 9 12.529 -20.861 -15.594 1.00 0.00 C ATOM 140 O TRP A 9 11.914 -20.340 -16.523 1.00 0.00 O ATOM 141 CB TRP A 9 10.904 -20.702 -13.698 1.00 0.00 C ATOM 142 CG TRP A 9 10.499 -22.122 -13.956 1.00 0.00 C ATOM 143 CD1 TRP A 9 9.339 -22.550 -14.534 1.00 0.00 C ATOM 144 CD2 TRP A 9 11.253 -23.298 -13.644 1.00 0.00 C ATOM 145 NE1 TRP A 9 9.325 -23.923 -14.600 1.00 0.00 N ATOM 146 CE2 TRP A 9 10.488 -24.405 -14.061 1.00 0.00 C ATOM 147 CE3 TRP A 9 12.499 -23.524 -13.055 1.00 0.00 C ATOM 148 CZ2 TRP A 9 10.931 -25.716 -13.905 1.00 0.00 C ATOM 149 CZ3 TRP A 9 12.937 -24.826 -12.900 1.00 0.00 C ATOM 150 CH2 TRP A 9 12.155 -25.908 -13.325 1.00 0.00 C ATOM 0 H TRP A 9 12.335 -18.411 -14.870 1.00 0.00 H new ATOM 0 HA TRP A 9 13.036 -20.910 -13.520 1.00 0.00 H new ATOM 0 HB2 TRP A 9 10.822 -20.496 -12.631 1.00 0.00 H new ATOM 0 HB3 TRP A 9 10.207 -20.035 -14.206 1.00 0.00 H new ATOM 0 HD1 TRP A 9 8.548 -21.905 -14.888 1.00 0.00 H new ATOM 0 HE1 TRP A 9 8.571 -24.490 -14.987 1.00 0.00 H new ATOM 0 HE3 TRP A 9 13.110 -22.696 -12.726 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 10.329 -26.552 -14.230 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 13.898 -25.012 -12.444 1.00 0.00 H new ATOM 0 HH2 TRP A 9 12.526 -26.914 -13.192 1.00 0.00 H new ATOM 161 N GLY A 10 13.394 -21.856 -15.766 1.00 0.00 N ATOM 162 CA GLY A 10 13.660 -22.386 -17.091 1.00 0.00 C ATOM 163 C GLY A 10 14.098 -21.313 -18.068 1.00 0.00 C ATOM 164 O GLY A 10 13.759 -21.364 -19.249 1.00 0.00 O ATOM 0 H GLY A 10 13.915 -22.304 -15.012 1.00 0.00 H new ATOM 0 HA2 GLY A 10 14.434 -23.150 -17.024 1.00 0.00 H new ATOM 0 HA3 GLY A 10 12.762 -22.874 -17.471 1.00 0.00 H new ATOM 168 N GLY A 11 14.852 -20.337 -17.573 1.00 0.00 N ATOM 169 CA GLY A 11 15.323 -19.259 -18.424 1.00 0.00 C ATOM 170 C GLY A 11 14.255 -18.214 -18.680 1.00 0.00 C ATOM 171 O GLY A 11 14.493 -17.237 -19.389 1.00 0.00 O ATOM 0 H GLY A 11 15.145 -20.273 -16.598 1.00 0.00 H new ATOM 0 HA2 GLY A 11 16.187 -18.785 -17.959 1.00 0.00 H new ATOM 0 HA3 GLY A 11 15.659 -19.671 -19.375 1.00 0.00 H new ATOM 175 N GLN A 12 13.077 -18.421 -18.102 1.00 0.00 N ATOM 176 CA GLN A 12 11.968 -17.489 -18.274 1.00 0.00 C ATOM 177 C GLN A 12 12.010 -16.392 -17.215 1.00 0.00 C ATOM 178 O GLN A 12 12.632 -16.553 -16.166 1.00 0.00 O ATOM 179 CB GLN A 12 10.633 -18.232 -18.202 1.00 0.00 C ATOM 180 CG GLN A 12 10.550 -19.425 -19.141 1.00 0.00 C ATOM 181 CD GLN A 12 10.619 -19.023 -20.601 1.00 0.00 C ATOM 182 OE1 GLN A 12 11.618 -19.270 -21.278 1.00 0.00 O ATOM 183 NE2 GLN A 12 9.556 -18.400 -21.096 1.00 0.00 N ATOM 0 H GLN A 12 12.865 -19.225 -17.511 1.00 0.00 H new ATOM 0 HA GLN A 12 12.065 -17.026 -19.256 1.00 0.00 H new ATOM 0 HB2 GLN A 12 10.471 -18.573 -17.179 1.00 0.00 H new ATOM 0 HB3 GLN A 12 9.827 -17.537 -18.438 1.00 0.00 H new ATOM 0 HG2 GLN A 12 11.364 -20.115 -18.919 1.00 0.00 H new ATOM 0 HG3 GLN A 12 9.619 -19.962 -18.959 1.00 0.00 H new ATOM 0 HE21 GLN A 12 8.749 -18.215 -20.500 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.546 -18.106 -22.073 1.00 0.00 H new ATOM 192 N GLU A 13 11.345 -15.277 -17.499 1.00 0.00 N ATOM 193 CA GLU A 13 11.309 -14.153 -16.571 1.00 0.00 C ATOM 194 C GLU A 13 9.881 -13.644 -16.388 1.00 0.00 C ATOM 195 O GLU A 13 9.191 -13.338 -17.361 1.00 0.00 O ATOM 196 CB GLU A 13 12.205 -13.019 -17.072 1.00 0.00 C ATOM 197 CG GLU A 13 13.521 -12.905 -16.320 1.00 0.00 C ATOM 198 CD GLU A 13 14.575 -12.143 -17.100 1.00 0.00 C ATOM 199 OE1 GLU A 13 15.226 -12.756 -17.972 1.00 0.00 O ATOM 200 OE2 GLU A 13 14.749 -10.935 -16.838 1.00 0.00 O ATOM 0 H GLU A 13 10.824 -15.128 -18.363 1.00 0.00 H new ATOM 0 HA GLU A 13 11.680 -14.500 -15.607 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.413 -13.173 -18.131 1.00 0.00 H new ATOM 0 HB3 GLU A 13 11.665 -12.076 -16.987 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.348 -12.406 -15.367 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.893 -13.904 -16.094 1.00 0.00 H new ATOM 207 N TYR A 14 9.447 -13.557 -15.136 1.00 0.00 N ATOM 208 CA TYR A 14 8.101 -13.088 -14.825 1.00 0.00 C ATOM 209 C TYR A 14 8.106 -12.206 -13.581 1.00 0.00 C ATOM 210 O TYR A 14 8.553 -12.623 -12.512 1.00 0.00 O ATOM 211 CB TYR A 14 7.160 -14.276 -14.619 1.00 0.00 C ATOM 212 CG TYR A 14 7.232 -15.305 -15.725 1.00 0.00 C ATOM 213 CD1 TYR A 14 6.609 -15.085 -16.947 1.00 0.00 C ATOM 214 CD2 TYR A 14 7.923 -16.497 -15.547 1.00 0.00 C ATOM 215 CE1 TYR A 14 6.671 -16.022 -17.960 1.00 0.00 C ATOM 216 CE2 TYR A 14 7.992 -17.440 -16.555 1.00 0.00 C ATOM 217 CZ TYR A 14 7.364 -17.198 -17.759 1.00 0.00 C ATOM 218 OH TYR A 14 7.430 -18.134 -18.766 1.00 0.00 O ATOM 0 H TYR A 14 10.007 -13.805 -14.320 1.00 0.00 H new ATOM 0 HA TYR A 14 7.746 -12.494 -15.667 1.00 0.00 H new ATOM 0 HB2 TYR A 14 7.398 -14.757 -13.670 1.00 0.00 H new ATOM 0 HB3 TYR A 14 6.137 -13.909 -14.542 1.00 0.00 H new ATOM 0 HD1 TYR A 14 6.067 -14.165 -17.108 1.00 0.00 H new ATOM 0 HD2 TYR A 14 8.415 -16.690 -14.605 1.00 0.00 H new ATOM 0 HE1 TYR A 14 6.180 -15.835 -18.904 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.534 -18.361 -16.401 1.00 0.00 H new ATOM 0 HH TYR A 14 6.936 -17.809 -19.548 1.00 0.00 H new ATOM 228 N SER A 15 7.603 -10.985 -13.727 1.00 0.00 N ATOM 229 CA SER A 15 7.551 -10.041 -12.617 1.00 0.00 C ATOM 230 C SER A 15 6.156 -10.005 -11.999 1.00 0.00 C ATOM 231 O SER A 15 5.163 -10.305 -12.662 1.00 0.00 O ATOM 232 CB SER A 15 7.947 -8.641 -13.091 1.00 0.00 C ATOM 233 OG SER A 15 7.409 -8.366 -14.373 1.00 0.00 O ATOM 0 H SER A 15 7.225 -10.626 -14.604 1.00 0.00 H new ATOM 0 HA SER A 15 8.258 -10.373 -11.857 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.592 -7.898 -12.377 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.033 -8.558 -13.124 1.00 0.00 H new ATOM 0 HG SER A 15 7.675 -7.465 -14.653 1.00 0.00 H new ATOM 239 N VAL A 16 6.090 -9.637 -10.724 1.00 0.00 N ATOM 240 CA VAL A 16 4.819 -9.560 -10.015 1.00 0.00 C ATOM 241 C VAL A 16 4.420 -8.112 -9.756 1.00 0.00 C ATOM 242 O VAL A 16 5.274 -7.235 -9.621 1.00 0.00 O ATOM 243 CB VAL A 16 4.878 -10.313 -8.672 1.00 0.00 C ATOM 244 CG1 VAL A 16 4.897 -9.331 -7.510 1.00 0.00 C ATOM 245 CG2 VAL A 16 3.707 -11.275 -8.548 1.00 0.00 C ATOM 0 H VAL A 16 6.903 -9.387 -10.160 1.00 0.00 H new ATOM 0 HA VAL A 16 4.072 -10.031 -10.654 1.00 0.00 H new ATOM 0 HB VAL A 16 5.800 -10.894 -8.641 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.939 -9.881 -6.570 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.772 -8.686 -7.593 1.00 0.00 H new ATOM 0 HG13 VAL A 16 3.994 -8.721 -7.534 1.00 0.00 H new ATOM 0 HG21 VAL A 16 3.765 -11.798 -7.593 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.771 -10.718 -8.600 1.00 0.00 H new ATOM 0 HG23 VAL A 16 3.744 -12.000 -9.361 1.00 0.00 H new ATOM 255 N THR A 17 3.115 -7.866 -9.687 1.00 0.00 N ATOM 256 CA THR A 17 2.602 -6.524 -9.444 1.00 0.00 C ATOM 257 C THR A 17 1.197 -6.571 -8.854 1.00 0.00 C ATOM 258 O THR A 17 0.277 -5.928 -9.360 1.00 0.00 O ATOM 259 CB THR A 17 2.574 -5.691 -10.740 1.00 0.00 C ATOM 260 OG1 THR A 17 2.146 -6.505 -11.837 1.00 0.00 O ATOM 261 CG2 THR A 17 3.948 -5.109 -11.038 1.00 0.00 C ATOM 0 H THR A 17 2.394 -8.579 -9.796 1.00 0.00 H new ATOM 0 HA THR A 17 3.277 -6.052 -8.731 1.00 0.00 H new ATOM 0 HB THR A 17 1.871 -4.870 -10.603 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.129 -5.967 -12.656 1.00 0.00 H new ATOM 0 HG21 THR A 17 3.904 -4.525 -11.957 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.257 -4.466 -10.214 1.00 0.00 H new ATOM 0 HG23 THR A 17 4.668 -5.919 -11.157 1.00 0.00 H new ATOM 269 N THR A 18 1.037 -7.336 -7.778 1.00 0.00 N ATOM 270 CA THR A 18 -0.256 -7.467 -7.118 1.00 0.00 C ATOM 271 C THR A 18 -0.112 -7.371 -5.604 1.00 0.00 C ATOM 272 O THR A 18 -0.962 -6.793 -4.925 1.00 0.00 O ATOM 273 CB THR A 18 -0.936 -8.802 -7.475 1.00 0.00 C ATOM 274 OG1 THR A 18 -1.933 -9.120 -6.498 1.00 0.00 O ATOM 275 CG2 THR A 18 0.086 -9.927 -7.550 1.00 0.00 C ATOM 0 H THR A 18 1.788 -7.874 -7.345 1.00 0.00 H new ATOM 0 HA THR A 18 -0.878 -6.645 -7.474 1.00 0.00 H new ATOM 0 HB THR A 18 -1.407 -8.695 -8.452 1.00 0.00 H new ATOM 0 HG1 THR A 18 -2.362 -9.969 -6.733 1.00 0.00 H new ATOM 0 HG21 THR A 18 -0.418 -10.860 -7.803 1.00 0.00 H new ATOM 0 HG22 THR A 18 0.827 -9.695 -8.315 1.00 0.00 H new ATOM 0 HG23 THR A 18 0.582 -10.033 -6.585 1.00 0.00 H new ATOM 283 N LEU A 19 0.967 -7.941 -5.079 1.00 0.00 N ATOM 284 CA LEU A 19 1.223 -7.919 -3.643 1.00 0.00 C ATOM 285 C LEU A 19 2.611 -7.363 -3.345 1.00 0.00 C ATOM 286 O LEU A 19 3.274 -6.816 -4.227 1.00 0.00 O ATOM 287 CB LEU A 19 1.089 -9.327 -3.060 1.00 0.00 C ATOM 288 CG LEU A 19 2.164 -10.331 -3.477 1.00 0.00 C ATOM 289 CD1 LEU A 19 2.452 -11.305 -2.345 1.00 0.00 C ATOM 290 CD2 LEU A 19 1.738 -11.079 -4.731 1.00 0.00 C ATOM 0 H LEU A 19 1.679 -8.424 -5.627 1.00 0.00 H new ATOM 0 HA LEU A 19 0.484 -7.267 -3.177 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.094 -9.250 -1.973 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.116 -9.726 -3.347 1.00 0.00 H new ATOM 0 HG LEU A 19 3.079 -9.783 -3.699 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.219 -12.012 -2.660 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.802 -10.755 -1.472 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.541 -11.847 -2.091 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.515 -11.789 -5.013 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.809 -11.616 -4.537 1.00 0.00 H new ATOM 0 HD23 LEU A 19 1.583 -10.369 -5.543 1.00 0.00 H new ATOM 302 N SER A 20 3.046 -7.509 -2.098 1.00 0.00 N ATOM 303 CA SER A 20 4.356 -7.020 -1.683 1.00 0.00 C ATOM 304 C SER A 20 5.191 -8.146 -1.081 1.00 0.00 C ATOM 305 O SER A 20 4.652 -9.132 -0.580 1.00 0.00 O ATOM 306 CB SER A 20 4.203 -5.886 -0.668 1.00 0.00 C ATOM 307 OG SER A 20 2.838 -5.658 -0.361 1.00 0.00 O ATOM 0 H SER A 20 2.511 -7.962 -1.357 1.00 0.00 H new ATOM 0 HA SER A 20 4.871 -6.641 -2.566 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.748 -6.133 0.243 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.647 -4.974 -1.067 1.00 0.00 H new ATOM 0 HG SER A 20 2.622 -4.714 -0.511 1.00 0.00 H new ATOM 313 N GLU A 21 6.510 -7.991 -1.136 1.00 0.00 N ATOM 314 CA GLU A 21 7.420 -8.995 -0.597 1.00 0.00 C ATOM 315 C GLU A 21 7.158 -9.225 0.889 1.00 0.00 C ATOM 316 O GLU A 21 7.501 -10.274 1.436 1.00 0.00 O ATOM 317 CB GLU A 21 8.873 -8.566 -0.810 1.00 0.00 C ATOM 318 CG GLU A 21 9.285 -7.373 0.036 1.00 0.00 C ATOM 319 CD GLU A 21 10.790 -7.251 0.178 1.00 0.00 C ATOM 320 OE1 GLU A 21 11.513 -7.999 -0.513 1.00 0.00 O ATOM 321 OE2 GLU A 21 11.244 -6.409 0.980 1.00 0.00 O ATOM 0 H GLU A 21 6.972 -7.180 -1.548 1.00 0.00 H new ATOM 0 HA GLU A 21 7.244 -9.930 -1.128 1.00 0.00 H new ATOM 0 HB2 GLU A 21 9.528 -9.406 -0.582 1.00 0.00 H new ATOM 0 HB3 GLU A 21 9.021 -8.323 -1.862 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.891 -6.461 -0.412 1.00 0.00 H new ATOM 0 HG3 GLU A 21 8.836 -7.462 1.025 1.00 0.00 H new ATOM 328 N ASP A 22 6.549 -8.237 1.536 1.00 0.00 N ATOM 329 CA ASP A 22 6.241 -8.331 2.958 1.00 0.00 C ATOM 330 C ASP A 22 4.897 -9.018 3.179 1.00 0.00 C ATOM 331 O ASP A 22 4.399 -9.083 4.302 1.00 0.00 O ATOM 332 CB ASP A 22 6.225 -6.938 3.591 1.00 0.00 C ATOM 333 CG ASP A 22 6.606 -6.965 5.058 1.00 0.00 C ATOM 334 OD1 ASP A 22 7.611 -7.624 5.399 1.00 0.00 O ATOM 335 OD2 ASP A 22 5.900 -6.326 5.866 1.00 0.00 O ATOM 0 H ASP A 22 6.259 -7.362 1.098 1.00 0.00 H new ATOM 0 HA ASP A 22 7.018 -8.930 3.434 1.00 0.00 H new ATOM 0 HB2 ASP A 22 6.915 -6.289 3.051 1.00 0.00 H new ATOM 0 HB3 ASP A 22 5.230 -6.505 3.485 1.00 0.00 H new ATOM 340 N ASP A 23 4.316 -9.530 2.099 1.00 0.00 N ATOM 341 CA ASP A 23 3.030 -10.213 2.174 1.00 0.00 C ATOM 342 C ASP A 23 3.208 -11.661 2.619 1.00 0.00 C ATOM 343 O ASP A 23 2.917 -12.011 3.763 1.00 0.00 O ATOM 344 CB ASP A 23 2.324 -10.166 0.818 1.00 0.00 C ATOM 345 CG ASP A 23 0.844 -10.479 0.925 1.00 0.00 C ATOM 346 OD1 ASP A 23 0.480 -11.360 1.732 1.00 0.00 O ATOM 347 OD2 ASP A 23 0.050 -9.843 0.201 1.00 0.00 O ATOM 0 H ASP A 23 4.715 -9.485 1.162 1.00 0.00 H new ATOM 0 HA ASP A 23 2.416 -9.698 2.913 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.452 -9.177 0.379 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.795 -10.879 0.141 1.00 0.00 H new ATOM 352 N THR A 24 3.688 -12.500 1.707 1.00 0.00 N ATOM 353 CA THR A 24 3.904 -13.911 2.004 1.00 0.00 C ATOM 354 C THR A 24 4.375 -14.667 0.768 1.00 0.00 C ATOM 355 O THR A 24 4.008 -14.329 -0.357 1.00 0.00 O ATOM 356 CB THR A 24 2.621 -14.574 2.540 1.00 0.00 C ATOM 357 OG1 THR A 24 1.488 -13.742 2.265 1.00 0.00 O ATOM 358 CG2 THR A 24 2.724 -14.821 4.037 1.00 0.00 C ATOM 0 H THR A 24 3.935 -12.227 0.756 1.00 0.00 H new ATOM 0 HA THR A 24 4.677 -13.958 2.771 1.00 0.00 H new ATOM 0 HB THR A 24 2.497 -15.533 2.038 1.00 0.00 H new ATOM 0 HG1 THR A 24 0.676 -14.171 2.608 1.00 0.00 H new ATOM 0 HG21 THR A 24 1.806 -15.290 4.392 1.00 0.00 H new ATOM 0 HG22 THR A 24 3.569 -15.478 4.240 1.00 0.00 H new ATOM 0 HG23 THR A 24 2.870 -13.872 4.553 1.00 0.00 H new ATOM 366 N VAL A 25 5.191 -15.694 0.984 1.00 0.00 N ATOM 367 CA VAL A 25 5.712 -16.501 -0.114 1.00 0.00 C ATOM 368 C VAL A 25 4.580 -17.120 -0.926 1.00 0.00 C ATOM 369 O VAL A 25 4.532 -16.985 -2.149 1.00 0.00 O ATOM 370 CB VAL A 25 6.632 -17.623 0.402 1.00 0.00 C ATOM 371 CG1 VAL A 25 6.459 -18.882 -0.433 1.00 0.00 C ATOM 372 CG2 VAL A 25 8.083 -17.166 0.397 1.00 0.00 C ATOM 0 H VAL A 25 5.506 -15.987 1.909 1.00 0.00 H new ATOM 0 HA VAL A 25 6.290 -15.832 -0.752 1.00 0.00 H new ATOM 0 HB VAL A 25 6.351 -17.856 1.429 1.00 0.00 H new ATOM 0 HG11 VAL A 25 7.117 -19.664 -0.053 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.424 -19.219 -0.374 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.712 -18.668 -1.471 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.719 -17.971 0.765 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.379 -16.905 -0.619 1.00 0.00 H new ATOM 0 HG23 VAL A 25 8.192 -16.294 1.042 1.00 0.00 H new ATOM 382 N LEU A 26 3.669 -17.799 -0.238 1.00 0.00 N ATOM 383 CA LEU A 26 2.535 -18.440 -0.895 1.00 0.00 C ATOM 384 C LEU A 26 1.686 -17.414 -1.640 1.00 0.00 C ATOM 385 O LEU A 26 0.956 -17.756 -2.571 1.00 0.00 O ATOM 386 CB LEU A 26 1.676 -19.180 0.132 1.00 0.00 C ATOM 387 CG LEU A 26 0.297 -18.582 0.409 1.00 0.00 C ATOM 388 CD1 LEU A 26 -0.710 -19.059 -0.626 1.00 0.00 C ATOM 389 CD2 LEU A 26 -0.168 -18.941 1.813 1.00 0.00 C ATOM 0 H LEU A 26 3.693 -17.920 0.775 1.00 0.00 H new ATOM 0 HA LEU A 26 2.924 -19.157 -1.618 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.543 -20.207 -0.208 1.00 0.00 H new ATOM 0 HB3 LEU A 26 2.226 -19.224 1.072 1.00 0.00 H new ATOM 0 HG LEU A 26 0.372 -17.497 0.339 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.686 -18.623 -0.412 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.384 -18.751 -1.619 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.783 -20.146 -0.589 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.152 -18.507 1.993 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.226 -20.025 1.911 1.00 0.00 H new ATOM 0 HD23 LEU A 26 0.541 -18.549 2.542 1.00 0.00 H new ATOM 401 N ASP A 27 1.789 -16.156 -1.225 1.00 0.00 N ATOM 402 CA ASP A 27 1.033 -15.080 -1.855 1.00 0.00 C ATOM 403 C ASP A 27 1.642 -14.705 -3.202 1.00 0.00 C ATOM 404 O ASP A 27 0.928 -14.530 -4.191 1.00 0.00 O ATOM 405 CB ASP A 27 0.993 -13.854 -0.941 1.00 0.00 C ATOM 406 CG ASP A 27 -0.045 -12.839 -1.378 1.00 0.00 C ATOM 407 OD1 ASP A 27 -0.138 -12.574 -2.595 1.00 0.00 O ATOM 408 OD2 ASP A 27 -0.763 -12.310 -0.504 1.00 0.00 O ATOM 0 H ASP A 27 2.388 -15.857 -0.456 1.00 0.00 H new ATOM 0 HA ASP A 27 0.015 -15.433 -2.022 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.779 -14.172 0.079 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.975 -13.382 -0.928 1.00 0.00 H new ATOM 413 N LEU A 28 2.964 -14.581 -3.235 1.00 0.00 N ATOM 414 CA LEU A 28 3.670 -14.226 -4.461 1.00 0.00 C ATOM 415 C LEU A 28 3.895 -15.455 -5.335 1.00 0.00 C ATOM 416 O LEU A 28 3.569 -15.455 -6.523 1.00 0.00 O ATOM 417 CB LEU A 28 5.011 -13.569 -4.129 1.00 0.00 C ATOM 418 CG LEU A 28 5.530 -12.553 -5.147 1.00 0.00 C ATOM 419 CD1 LEU A 28 6.260 -11.419 -4.445 1.00 0.00 C ATOM 420 CD2 LEU A 28 6.442 -13.230 -6.159 1.00 0.00 C ATOM 0 H LEU A 28 3.569 -14.721 -2.426 1.00 0.00 H new ATOM 0 HA LEU A 28 3.053 -13.518 -5.014 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.920 -13.072 -3.163 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.759 -14.354 -4.015 1.00 0.00 H new ATOM 0 HG LEU A 28 4.677 -12.134 -5.680 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.622 -10.706 -5.186 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.577 -10.916 -3.760 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.104 -11.821 -3.885 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.802 -12.492 -6.876 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.291 -13.677 -5.642 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.888 -14.007 -6.686 1.00 0.00 H new ATOM 432 N LYS A 29 4.455 -16.503 -4.740 1.00 0.00 N ATOM 433 CA LYS A 29 4.721 -17.742 -5.462 1.00 0.00 C ATOM 434 C LYS A 29 3.480 -18.210 -6.216 1.00 0.00 C ATOM 435 O LYS A 29 3.560 -18.593 -7.383 1.00 0.00 O ATOM 436 CB LYS A 29 5.184 -18.832 -4.493 1.00 0.00 C ATOM 437 CG LYS A 29 6.695 -18.937 -4.373 1.00 0.00 C ATOM 438 CD LYS A 29 7.287 -17.713 -3.696 1.00 0.00 C ATOM 439 CE LYS A 29 7.612 -16.621 -4.704 1.00 0.00 C ATOM 440 NZ LYS A 29 8.902 -15.945 -4.393 1.00 0.00 N ATOM 0 H LYS A 29 4.734 -16.519 -3.759 1.00 0.00 H new ATOM 0 HA LYS A 29 5.512 -17.548 -6.186 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.763 -18.633 -3.508 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.786 -19.792 -4.822 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.954 -19.830 -3.804 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.132 -19.053 -5.365 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.584 -17.329 -2.956 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.193 -17.995 -3.159 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.660 -17.052 -5.704 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.809 -15.884 -4.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.405 -15.733 -5.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.715 -15.060 -3.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.488 -16.570 -3.803 1.00 0.00 H new ATOM 454 N GLN A 30 2.336 -18.175 -5.542 1.00 0.00 N ATOM 455 CA GLN A 30 1.079 -18.595 -6.149 1.00 0.00 C ATOM 456 C GLN A 30 0.802 -17.811 -7.427 1.00 0.00 C ATOM 457 O GLN A 30 0.280 -18.354 -8.401 1.00 0.00 O ATOM 458 CB GLN A 30 -0.076 -18.410 -5.163 1.00 0.00 C ATOM 459 CG GLN A 30 -0.431 -16.953 -4.909 1.00 0.00 C ATOM 460 CD GLN A 30 -1.592 -16.479 -5.760 1.00 0.00 C ATOM 461 OE1 GLN A 30 -1.461 -15.532 -6.537 1.00 0.00 O ATOM 462 NE2 GLN A 30 -2.738 -17.136 -5.618 1.00 0.00 N ATOM 0 H GLN A 30 2.253 -17.860 -4.575 1.00 0.00 H new ATOM 0 HA GLN A 30 1.164 -19.651 -6.404 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -0.955 -18.928 -5.545 1.00 0.00 H new ATOM 0 HB3 GLN A 30 0.186 -18.882 -4.216 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -0.680 -16.822 -3.856 1.00 0.00 H new ATOM 0 HG3 GLN A 30 0.440 -16.330 -5.111 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -2.802 -17.915 -4.962 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -3.554 -16.862 -6.165 1.00 0.00 H new ATOM 471 N PHE A 31 1.155 -16.530 -7.417 1.00 0.00 N ATOM 472 CA PHE A 31 0.944 -15.669 -8.576 1.00 0.00 C ATOM 473 C PHE A 31 1.821 -16.107 -9.745 1.00 0.00 C ATOM 474 O PHE A 31 1.323 -16.414 -10.829 1.00 0.00 O ATOM 475 CB PHE A 31 1.243 -14.212 -8.217 1.00 0.00 C ATOM 476 CG PHE A 31 0.663 -13.225 -9.189 1.00 0.00 C ATOM 477 CD1 PHE A 31 -0.653 -12.808 -9.072 1.00 0.00 C ATOM 478 CD2 PHE A 31 1.435 -12.713 -10.219 1.00 0.00 C ATOM 479 CE1 PHE A 31 -1.188 -11.900 -9.965 1.00 0.00 C ATOM 480 CE2 PHE A 31 0.905 -11.804 -11.116 1.00 0.00 C ATOM 481 CZ PHE A 31 -0.408 -11.396 -10.988 1.00 0.00 C ATOM 0 H PHE A 31 1.588 -16.065 -6.619 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.100 -15.755 -8.876 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.851 -14.003 -7.222 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.323 -14.072 -8.170 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.267 -13.197 -8.274 1.00 0.00 H new ATOM 0 HD2 PHE A 31 2.463 -13.028 -10.323 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -2.216 -11.584 -9.864 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.517 -11.414 -11.916 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.824 -10.685 -11.686 1.00 0.00 H new ATOM 491 N LEU A 32 3.130 -16.132 -9.518 1.00 0.00 N ATOM 492 CA LEU A 32 4.078 -16.532 -10.553 1.00 0.00 C ATOM 493 C LEU A 32 3.857 -17.984 -10.963 1.00 0.00 C ATOM 494 O LEU A 32 4.152 -18.374 -12.092 1.00 0.00 O ATOM 495 CB LEU A 32 5.513 -16.342 -10.057 1.00 0.00 C ATOM 496 CG LEU A 32 5.835 -16.944 -8.689 1.00 0.00 C ATOM 497 CD1 LEU A 32 6.236 -18.404 -8.829 1.00 0.00 C ATOM 498 CD2 LEU A 32 6.937 -16.149 -8.003 1.00 0.00 C ATOM 0 H LEU A 32 3.559 -15.880 -8.627 1.00 0.00 H new ATOM 0 HA LEU A 32 3.914 -15.900 -11.426 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.191 -16.777 -10.792 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.725 -15.273 -10.021 1.00 0.00 H new ATOM 0 HG LEU A 32 4.939 -16.893 -8.071 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.461 -18.815 -7.845 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.416 -18.965 -9.278 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.118 -18.480 -9.465 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.153 -16.591 -7.031 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.836 -16.168 -8.619 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.611 -15.118 -7.868 1.00 0.00 H new ATOM 510 N LYS A 33 3.333 -18.781 -10.038 1.00 0.00 N ATOM 511 CA LYS A 33 3.068 -20.190 -10.302 1.00 0.00 C ATOM 512 C LYS A 33 2.119 -20.353 -11.486 1.00 0.00 C ATOM 513 O LYS A 33 2.237 -21.299 -12.265 1.00 0.00 O ATOM 514 CB LYS A 33 2.472 -20.860 -9.062 1.00 0.00 C ATOM 515 CG LYS A 33 1.198 -21.637 -9.343 1.00 0.00 C ATOM 516 CD LYS A 33 1.491 -22.959 -10.032 1.00 0.00 C ATOM 517 CE LYS A 33 0.250 -23.522 -10.709 1.00 0.00 C ATOM 518 NZ LYS A 33 0.250 -23.259 -12.174 1.00 0.00 N ATOM 0 H LYS A 33 3.083 -18.474 -9.098 1.00 0.00 H new ATOM 0 HA LYS A 33 4.015 -20.671 -10.548 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.212 -21.535 -8.633 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.264 -20.097 -8.312 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.670 -21.822 -8.408 1.00 0.00 H new ATOM 0 HG3 LYS A 33 0.536 -21.038 -9.969 1.00 0.00 H new ATOM 0 HD2 LYS A 33 2.278 -22.818 -10.772 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.865 -23.676 -9.301 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.196 -24.596 -10.533 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.640 -23.080 -10.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -0.649 -22.813 -12.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.038 -22.624 -12.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.361 -24.156 -12.688 1.00 0.00 H new ATOM 532 N THR A 34 1.179 -19.422 -11.617 1.00 0.00 N ATOM 533 CA THR A 34 0.211 -19.462 -12.705 1.00 0.00 C ATOM 534 C THR A 34 0.882 -19.200 -14.049 1.00 0.00 C ATOM 535 O THR A 34 0.392 -19.629 -15.094 1.00 0.00 O ATOM 536 CB THR A 34 -0.912 -18.429 -12.496 1.00 0.00 C ATOM 537 OG1 THR A 34 -2.091 -18.837 -13.200 1.00 0.00 O ATOM 538 CG2 THR A 34 -0.479 -17.052 -12.978 1.00 0.00 C ATOM 0 H THR A 34 1.068 -18.631 -10.983 1.00 0.00 H new ATOM 0 HA THR A 34 -0.221 -20.463 -12.706 1.00 0.00 H new ATOM 0 HB THR A 34 -1.128 -18.372 -11.429 1.00 0.00 H new ATOM 0 HG1 THR A 34 -2.801 -18.176 -13.061 1.00 0.00 H new ATOM 0 HG21 THR A 34 -1.289 -16.340 -12.820 1.00 0.00 H new ATOM 0 HG22 THR A 34 0.401 -16.731 -12.420 1.00 0.00 H new ATOM 0 HG23 THR A 34 -0.238 -17.097 -14.040 1.00 0.00 H new ATOM 546 N LEU A 35 2.007 -18.494 -14.015 1.00 0.00 N ATOM 547 CA LEU A 35 2.748 -18.175 -15.231 1.00 0.00 C ATOM 548 C LEU A 35 3.876 -19.176 -15.459 1.00 0.00 C ATOM 549 O LEU A 35 4.376 -19.321 -16.575 1.00 0.00 O ATOM 550 CB LEU A 35 3.317 -16.758 -15.148 1.00 0.00 C ATOM 551 CG LEU A 35 2.315 -15.650 -14.821 1.00 0.00 C ATOM 552 CD1 LEU A 35 2.983 -14.286 -14.898 1.00 0.00 C ATOM 553 CD2 LEU A 35 1.122 -15.715 -15.763 1.00 0.00 C ATOM 0 H LEU A 35 2.426 -18.131 -13.159 1.00 0.00 H new ATOM 0 HA LEU A 35 2.059 -18.234 -16.073 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.101 -16.747 -14.391 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.791 -16.522 -16.101 1.00 0.00 H new ATOM 0 HG LEU A 35 1.957 -15.799 -13.802 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.254 -13.510 -14.662 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.804 -14.242 -14.183 1.00 0.00 H new ATOM 0 HD13 LEU A 35 3.370 -14.127 -15.905 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.419 -14.919 -15.516 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.463 -15.592 -16.791 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.628 -16.681 -15.658 1.00 0.00 H new ATOM 565 N THR A 36 4.271 -19.868 -14.395 1.00 0.00 N ATOM 566 CA THR A 36 5.339 -20.856 -14.479 1.00 0.00 C ATOM 567 C THR A 36 4.775 -22.271 -14.539 1.00 0.00 C ATOM 568 O THR A 36 5.430 -23.190 -15.028 1.00 0.00 O ATOM 569 CB THR A 36 6.300 -20.749 -13.280 1.00 0.00 C ATOM 570 OG1 THR A 36 5.660 -21.233 -12.094 1.00 0.00 O ATOM 571 CG2 THR A 36 6.745 -19.309 -13.070 1.00 0.00 C ATOM 0 H THR A 36 3.867 -19.762 -13.464 1.00 0.00 H new ATOM 0 HA THR A 36 5.890 -20.648 -15.396 1.00 0.00 H new ATOM 0 HB THR A 36 7.179 -21.358 -13.492 1.00 0.00 H new ATOM 0 HG1 THR A 36 5.778 -20.583 -11.370 1.00 0.00 H new ATOM 0 HG21 THR A 36 7.423 -19.258 -12.218 1.00 0.00 H new ATOM 0 HG22 THR A 36 7.258 -18.953 -13.963 1.00 0.00 H new ATOM 0 HG23 THR A 36 5.873 -18.683 -12.878 1.00 0.00 H new ATOM 579 N GLY A 37 3.555 -22.439 -14.038 1.00 0.00 N ATOM 580 CA GLY A 37 2.923 -23.745 -14.044 1.00 0.00 C ATOM 581 C GLY A 37 3.267 -24.562 -12.815 1.00 0.00 C ATOM 582 O GLY A 37 2.606 -25.556 -12.516 1.00 0.00 O ATOM 0 H GLY A 37 2.993 -21.693 -13.628 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.842 -23.621 -14.103 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.231 -24.290 -14.936 1.00 0.00 H new ATOM 586 N VAL A 38 4.307 -24.143 -12.099 1.00 0.00 N ATOM 587 CA VAL A 38 4.738 -24.843 -10.895 1.00 0.00 C ATOM 588 C VAL A 38 4.367 -24.059 -9.641 1.00 0.00 C ATOM 589 O VAL A 38 4.542 -22.841 -9.583 1.00 0.00 O ATOM 590 CB VAL A 38 6.259 -25.088 -10.903 1.00 0.00 C ATOM 591 CG1 VAL A 38 7.006 -23.799 -11.209 1.00 0.00 C ATOM 592 CG2 VAL A 38 6.710 -25.674 -9.574 1.00 0.00 C ATOM 0 H VAL A 38 4.866 -23.322 -12.333 1.00 0.00 H new ATOM 0 HA VAL A 38 4.223 -25.803 -10.885 1.00 0.00 H new ATOM 0 HB VAL A 38 6.490 -25.808 -11.688 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.079 -23.992 -11.210 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.703 -23.426 -12.188 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.772 -23.054 -10.449 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.787 -25.841 -9.597 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.467 -24.980 -8.769 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.200 -26.622 -9.402 1.00 0.00 H new ATOM 602 N LEU A 39 3.855 -24.765 -8.639 1.00 0.00 N ATOM 603 CA LEU A 39 3.460 -24.136 -7.384 1.00 0.00 C ATOM 604 C LEU A 39 4.563 -24.265 -6.339 1.00 0.00 C ATOM 605 O LEU A 39 5.455 -25.107 -6.443 1.00 0.00 O ATOM 606 CB LEU A 39 2.168 -24.765 -6.860 1.00 0.00 C ATOM 607 CG LEU A 39 1.984 -26.256 -7.146 1.00 0.00 C ATOM 608 CD1 LEU A 39 1.609 -26.478 -8.603 1.00 0.00 C ATOM 609 CD2 LEU A 39 3.248 -27.027 -6.795 1.00 0.00 C ATOM 0 H LEU A 39 3.704 -25.773 -8.671 1.00 0.00 H new ATOM 0 HA LEU A 39 3.289 -23.077 -7.575 1.00 0.00 H new ATOM 0 HB2 LEU A 39 2.125 -24.614 -5.781 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.324 -24.226 -7.291 1.00 0.00 H new ATOM 0 HG LEU A 39 1.171 -26.628 -6.522 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.482 -27.545 -8.788 1.00 0.00 H new ATOM 0 HD12 LEU A 39 0.676 -25.959 -8.822 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.400 -26.090 -9.245 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.098 -28.086 -7.005 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.080 -26.653 -7.392 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.472 -26.895 -5.737 1.00 0.00 H new ATOM 621 N PRO A 40 4.501 -23.414 -5.304 1.00 0.00 N ATOM 622 CA PRO A 40 5.485 -23.415 -4.218 1.00 0.00 C ATOM 623 C PRO A 40 5.371 -24.652 -3.333 1.00 0.00 C ATOM 624 O PRO A 40 6.340 -25.061 -2.695 1.00 0.00 O ATOM 625 CB PRO A 40 5.138 -22.155 -3.422 1.00 0.00 C ATOM 626 CG PRO A 40 3.695 -21.914 -3.705 1.00 0.00 C ATOM 627 CD PRO A 40 3.465 -22.384 -5.115 1.00 0.00 C ATOM 0 HA PRO A 40 6.507 -23.429 -4.596 1.00 0.00 H new ATOM 0 HB2 PRO A 40 5.314 -22.299 -2.356 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.750 -21.308 -3.734 1.00 0.00 H new ATOM 0 HG2 PRO A 40 3.063 -22.460 -3.004 1.00 0.00 H new ATOM 0 HG3 PRO A 40 3.448 -20.857 -3.601 1.00 0.00 H new ATOM 0 HD2 PRO A 40 2.463 -22.793 -5.244 1.00 0.00 H new ATOM 0 HD3 PRO A 40 3.572 -21.570 -5.832 1.00 0.00 H new ATOM 635 N GLU A 41 4.180 -25.243 -3.301 1.00 0.00 N ATOM 636 CA GLU A 41 3.940 -26.433 -2.494 1.00 0.00 C ATOM 637 C GLU A 41 4.831 -27.586 -2.947 1.00 0.00 C ATOM 638 O GLU A 41 5.033 -28.554 -2.213 1.00 0.00 O ATOM 639 CB GLU A 41 2.469 -26.846 -2.579 1.00 0.00 C ATOM 640 CG GLU A 41 2.050 -27.321 -3.960 1.00 0.00 C ATOM 641 CD GLU A 41 0.793 -28.170 -3.928 1.00 0.00 C ATOM 642 OE1 GLU A 41 -0.314 -27.594 -3.964 1.00 0.00 O ATOM 643 OE2 GLU A 41 0.918 -29.411 -3.868 1.00 0.00 O ATOM 0 H GLU A 41 3.367 -24.917 -3.824 1.00 0.00 H new ATOM 0 HA GLU A 41 4.183 -26.194 -1.459 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.281 -27.641 -1.858 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.845 -26.000 -2.290 1.00 0.00 H new ATOM 0 HG2 GLU A 41 1.884 -26.456 -4.603 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.862 -27.897 -4.404 1.00 0.00 H new ATOM 650 N ARG A 42 5.361 -27.476 -4.160 1.00 0.00 N ATOM 651 CA ARG A 42 6.228 -28.509 -4.713 1.00 0.00 C ATOM 652 C ARG A 42 7.692 -28.084 -4.644 1.00 0.00 C ATOM 653 O ARG A 42 8.569 -28.893 -4.343 1.00 0.00 O ATOM 654 CB ARG A 42 5.841 -28.810 -6.162 1.00 0.00 C ATOM 655 CG ARG A 42 4.714 -29.821 -6.293 1.00 0.00 C ATOM 656 CD ARG A 42 5.241 -31.248 -6.279 1.00 0.00 C ATOM 657 NE ARG A 42 4.197 -32.220 -6.590 1.00 0.00 N ATOM 658 CZ ARG A 42 3.745 -32.445 -7.819 1.00 0.00 C ATOM 659 NH1 ARG A 42 4.243 -31.771 -8.846 1.00 0.00 N ATOM 660 NH2 ARG A 42 2.793 -33.347 -8.022 1.00 0.00 N ATOM 0 H ARG A 42 5.205 -26.681 -4.780 1.00 0.00 H new ATOM 0 HA ARG A 42 6.101 -29.412 -4.116 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.544 -27.882 -6.650 1.00 0.00 H new ATOM 0 HB3 ARG A 42 6.717 -29.183 -6.693 1.00 0.00 H new ATOM 0 HG2 ARG A 42 4.006 -29.686 -5.476 1.00 0.00 H new ATOM 0 HG3 ARG A 42 4.169 -29.642 -7.220 1.00 0.00 H new ATOM 0 HD2 ARG A 42 6.051 -31.342 -7.002 1.00 0.00 H new ATOM 0 HD3 ARG A 42 5.662 -31.469 -5.298 1.00 0.00 H new ATOM 0 HE ARG A 42 3.793 -32.756 -5.822 1.00 0.00 H new ATOM 0 HH11 ARG A 42 4.975 -31.077 -8.694 1.00 0.00 H new ATOM 0 HH12 ARG A 42 3.894 -31.946 -9.788 1.00 0.00 H new ATOM 0 HH21 ARG A 42 2.408 -33.868 -7.234 1.00 0.00 H new ATOM 0 HH22 ARG A 42 2.446 -33.519 -8.966 1.00 0.00 H new ATOM 674 N GLN A 43 7.947 -26.810 -4.926 1.00 0.00 N ATOM 675 CA GLN A 43 9.304 -26.278 -4.897 1.00 0.00 C ATOM 676 C GLN A 43 9.351 -24.943 -4.162 1.00 0.00 C ATOM 677 O GLN A 43 8.315 -24.388 -3.795 1.00 0.00 O ATOM 678 CB GLN A 43 9.838 -26.109 -6.321 1.00 0.00 C ATOM 679 CG GLN A 43 8.773 -25.696 -7.324 1.00 0.00 C ATOM 680 CD GLN A 43 9.228 -24.565 -8.226 1.00 0.00 C ATOM 681 OE1 GLN A 43 9.490 -24.768 -9.412 1.00 0.00 O ATOM 682 NE2 GLN A 43 9.324 -23.364 -7.667 1.00 0.00 N ATOM 0 H GLN A 43 7.232 -26.128 -5.177 1.00 0.00 H new ATOM 0 HA GLN A 43 9.934 -26.988 -4.361 1.00 0.00 H new ATOM 0 HB2 GLN A 43 10.631 -25.361 -6.317 1.00 0.00 H new ATOM 0 HB3 GLN A 43 10.287 -27.048 -6.646 1.00 0.00 H new ATOM 0 HG2 GLN A 43 8.502 -26.557 -7.935 1.00 0.00 H new ATOM 0 HG3 GLN A 43 7.874 -25.390 -6.789 1.00 0.00 H new ATOM 0 HE21 GLN A 43 9.097 -23.241 -6.680 1.00 0.00 H new ATOM 0 HE22 GLN A 43 9.625 -22.565 -8.224 1.00 0.00 H new ATOM 691 N LYS A 44 10.559 -24.433 -3.948 1.00 0.00 N ATOM 692 CA LYS A 44 10.742 -23.163 -3.256 1.00 0.00 C ATOM 693 C LYS A 44 11.688 -22.252 -4.032 1.00 0.00 C ATOM 694 O LYS A 44 12.542 -22.723 -4.784 1.00 0.00 O ATOM 695 CB LYS A 44 11.288 -23.400 -1.846 1.00 0.00 C ATOM 696 CG LYS A 44 12.635 -24.100 -1.826 1.00 0.00 C ATOM 697 CD LYS A 44 12.479 -25.606 -1.692 1.00 0.00 C ATOM 698 CE LYS A 44 13.824 -26.313 -1.755 1.00 0.00 C ATOM 699 NZ LYS A 44 14.508 -26.090 -3.059 1.00 0.00 N ATOM 0 H LYS A 44 11.427 -24.880 -4.244 1.00 0.00 H new ATOM 0 HA LYS A 44 9.771 -22.674 -3.185 1.00 0.00 H new ATOM 0 HB2 LYS A 44 11.378 -22.442 -1.334 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.570 -23.996 -1.283 1.00 0.00 H new ATOM 0 HG2 LYS A 44 13.179 -23.870 -2.742 1.00 0.00 H new ATOM 0 HG3 LYS A 44 13.231 -23.720 -0.997 1.00 0.00 H new ATOM 0 HD2 LYS A 44 11.988 -25.839 -0.747 1.00 0.00 H new ATOM 0 HD3 LYS A 44 11.833 -25.978 -2.487 1.00 0.00 H new ATOM 0 HE2 LYS A 44 14.460 -25.955 -0.945 1.00 0.00 H new ATOM 0 HE3 LYS A 44 13.680 -27.382 -1.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 15.282 -26.776 -3.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 13.826 -26.213 -3.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 14.894 -25.125 -3.088 1.00 0.00 H new ATOM 713 N LEU A 45 11.531 -20.946 -3.845 1.00 0.00 N ATOM 714 CA LEU A 45 12.372 -19.969 -4.527 1.00 0.00 C ATOM 715 C LEU A 45 13.724 -19.837 -3.834 1.00 0.00 C ATOM 716 O LEU A 45 13.801 -19.777 -2.606 1.00 0.00 O ATOM 717 CB LEU A 45 11.674 -18.609 -4.572 1.00 0.00 C ATOM 718 CG LEU A 45 10.814 -18.336 -5.807 1.00 0.00 C ATOM 719 CD1 LEU A 45 11.648 -18.450 -7.074 1.00 0.00 C ATOM 720 CD2 LEU A 45 9.633 -19.294 -5.856 1.00 0.00 C ATOM 0 H LEU A 45 10.829 -20.539 -3.227 1.00 0.00 H new ATOM 0 HA LEU A 45 12.539 -20.318 -5.546 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.044 -18.517 -3.688 1.00 0.00 H new ATOM 0 HB3 LEU A 45 12.434 -17.831 -4.504 1.00 0.00 H new ATOM 0 HG LEU A 45 10.429 -17.319 -5.741 1.00 0.00 H new ATOM 0 HD11 LEU A 45 11.019 -18.253 -7.942 1.00 0.00 H new ATOM 0 HD12 LEU A 45 12.460 -17.724 -7.041 1.00 0.00 H new ATOM 0 HD13 LEU A 45 12.063 -19.455 -7.147 1.00 0.00 H new ATOM 0 HD21 LEU A 45 9.032 -19.086 -6.741 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.998 -20.320 -5.899 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.022 -19.164 -4.963 1.00 0.00 H new ATOM 732 N LEU A 46 14.788 -19.789 -4.627 1.00 0.00 N ATOM 733 CA LEU A 46 16.139 -19.661 -4.090 1.00 0.00 C ATOM 734 C LEU A 46 16.218 -18.519 -3.082 1.00 0.00 C ATOM 735 O LEU A 46 15.978 -17.361 -3.420 1.00 0.00 O ATOM 736 CB LEU A 46 17.139 -19.426 -5.223 1.00 0.00 C ATOM 737 CG LEU A 46 18.138 -20.555 -5.481 1.00 0.00 C ATOM 738 CD1 LEU A 46 19.042 -20.210 -6.655 1.00 0.00 C ATOM 739 CD2 LEU A 46 18.964 -20.832 -4.233 1.00 0.00 C ATOM 0 H LEU A 46 14.742 -19.837 -5.645 1.00 0.00 H new ATOM 0 HA LEU A 46 16.390 -20.590 -3.579 1.00 0.00 H new ATOM 0 HB2 LEU A 46 16.581 -19.245 -6.142 1.00 0.00 H new ATOM 0 HB3 LEU A 46 17.698 -18.516 -5.005 1.00 0.00 H new ATOM 0 HG LEU A 46 17.580 -21.458 -5.731 1.00 0.00 H new ATOM 0 HD11 LEU A 46 19.746 -21.025 -6.824 1.00 0.00 H new ATOM 0 HD12 LEU A 46 18.437 -20.063 -7.549 1.00 0.00 H new ATOM 0 HD13 LEU A 46 19.592 -19.295 -6.434 1.00 0.00 H new ATOM 0 HD21 LEU A 46 19.669 -21.638 -4.435 1.00 0.00 H new ATOM 0 HD22 LEU A 46 19.512 -19.932 -3.952 1.00 0.00 H new ATOM 0 HD23 LEU A 46 18.303 -21.124 -3.417 1.00 0.00 H new ATOM 751 N GLY A 47 16.558 -18.855 -1.841 1.00 0.00 N ATOM 752 CA GLY A 47 16.664 -17.846 -0.803 1.00 0.00 C ATOM 753 C GLY A 47 17.299 -18.384 0.464 1.00 0.00 C ATOM 754 O GLY A 47 18.458 -18.801 0.458 1.00 0.00 O ATOM 0 H GLY A 47 16.762 -19.807 -1.536 1.00 0.00 H new ATOM 0 HA2 GLY A 47 17.254 -17.008 -1.174 1.00 0.00 H new ATOM 0 HA3 GLY A 47 15.671 -17.460 -0.573 1.00 0.00 H new ATOM 758 N LEU A 48 16.541 -18.372 1.555 1.00 0.00 N ATOM 759 CA LEU A 48 17.036 -18.861 2.837 1.00 0.00 C ATOM 760 C LEU A 48 15.963 -19.664 3.565 1.00 0.00 C ATOM 761 O LEU A 48 14.799 -19.671 3.165 1.00 0.00 O ATOM 762 CB LEU A 48 17.494 -17.690 3.709 1.00 0.00 C ATOM 763 CG LEU A 48 18.723 -17.944 4.581 1.00 0.00 C ATOM 764 CD1 LEU A 48 19.924 -18.305 3.720 1.00 0.00 C ATOM 765 CD2 LEU A 48 19.028 -16.725 5.440 1.00 0.00 C ATOM 0 H LEU A 48 15.581 -18.029 1.577 1.00 0.00 H new ATOM 0 HA LEU A 48 17.885 -19.517 2.645 1.00 0.00 H new ATOM 0 HB2 LEU A 48 17.703 -16.840 3.060 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.667 -17.400 4.357 1.00 0.00 H new ATOM 0 HG LEU A 48 18.509 -18.785 5.241 1.00 0.00 H new ATOM 0 HD11 LEU A 48 20.789 -18.482 4.359 1.00 0.00 H new ATOM 0 HD12 LEU A 48 19.704 -19.207 3.148 1.00 0.00 H new ATOM 0 HD13 LEU A 48 20.140 -17.485 3.035 1.00 0.00 H new ATOM 0 HD21 LEU A 48 19.906 -16.923 6.055 1.00 0.00 H new ATOM 0 HD22 LEU A 48 19.221 -15.866 4.797 1.00 0.00 H new ATOM 0 HD23 LEU A 48 18.175 -16.511 6.084 1.00 0.00 H new ATOM 777 N LYS A 49 16.362 -20.338 4.639 1.00 0.00 N ATOM 778 CA LYS A 49 15.435 -21.141 5.427 1.00 0.00 C ATOM 779 C LYS A 49 15.260 -20.556 6.824 1.00 0.00 C ATOM 780 O LYS A 49 16.235 -20.189 7.481 1.00 0.00 O ATOM 781 CB LYS A 49 15.936 -22.584 5.525 1.00 0.00 C ATOM 782 CG LYS A 49 16.517 -23.116 4.227 1.00 0.00 C ATOM 783 CD LYS A 49 16.437 -24.632 4.161 1.00 0.00 C ATOM 784 CE LYS A 49 17.554 -25.285 4.960 1.00 0.00 C ATOM 785 NZ LYS A 49 18.791 -25.457 4.148 1.00 0.00 N ATOM 0 H LYS A 49 17.322 -20.344 4.983 1.00 0.00 H new ATOM 0 HA LYS A 49 14.467 -21.132 4.925 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.696 -22.644 6.305 1.00 0.00 H new ATOM 0 HB3 LYS A 49 15.111 -23.226 5.834 1.00 0.00 H new ATOM 0 HG2 LYS A 49 15.979 -22.685 3.383 1.00 0.00 H new ATOM 0 HG3 LYS A 49 17.557 -22.801 4.136 1.00 0.00 H new ATOM 0 HD2 LYS A 49 15.472 -24.963 4.545 1.00 0.00 H new ATOM 0 HD3 LYS A 49 16.495 -24.955 3.122 1.00 0.00 H new ATOM 0 HE2 LYS A 49 17.777 -24.677 5.836 1.00 0.00 H new ATOM 0 HE3 LYS A 49 17.220 -26.257 5.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 19.528 -25.905 4.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 18.585 -26.059 3.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 19.125 -24.527 3.822 1.00 0.00 H new ATOM 799 N VAL A 50 14.012 -20.473 7.274 1.00 0.00 N ATOM 800 CA VAL A 50 13.710 -19.935 8.595 1.00 0.00 C ATOM 801 C VAL A 50 13.177 -21.022 9.522 1.00 0.00 C ATOM 802 O VAL A 50 12.332 -21.828 9.132 1.00 0.00 O ATOM 803 CB VAL A 50 12.679 -18.794 8.514 1.00 0.00 C ATOM 804 CG1 VAL A 50 11.346 -19.314 7.998 1.00 0.00 C ATOM 805 CG2 VAL A 50 12.512 -18.130 9.873 1.00 0.00 C ATOM 0 H VAL A 50 13.194 -20.771 6.743 1.00 0.00 H new ATOM 0 HA VAL A 50 14.644 -19.543 8.998 1.00 0.00 H new ATOM 0 HB VAL A 50 13.046 -18.045 7.812 1.00 0.00 H new ATOM 0 HG11 VAL A 50 10.630 -18.493 7.948 1.00 0.00 H new ATOM 0 HG12 VAL A 50 11.482 -19.739 7.003 1.00 0.00 H new ATOM 0 HG13 VAL A 50 10.970 -20.083 8.673 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.780 -17.326 9.798 1.00 0.00 H new ATOM 0 HG22 VAL A 50 12.168 -18.867 10.598 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.468 -17.720 10.198 1.00 0.00 H new ATOM 815 N LYS A 51 13.676 -21.038 10.754 1.00 0.00 N ATOM 816 CA LYS A 51 13.249 -22.024 11.740 1.00 0.00 C ATOM 817 C LYS A 51 13.569 -23.439 11.267 1.00 0.00 C ATOM 818 O LYS A 51 12.997 -24.411 11.757 1.00 0.00 O ATOM 819 CB LYS A 51 11.748 -21.892 12.008 1.00 0.00 C ATOM 820 CG LYS A 51 11.324 -20.490 12.411 1.00 0.00 C ATOM 821 CD LYS A 51 12.001 -20.051 13.698 1.00 0.00 C ATOM 822 CE LYS A 51 11.414 -18.749 14.221 1.00 0.00 C ATOM 823 NZ LYS A 51 10.030 -18.933 14.738 1.00 0.00 N ATOM 0 H LYS A 51 14.377 -20.379 11.093 1.00 0.00 H new ATOM 0 HA LYS A 51 13.794 -21.836 12.665 1.00 0.00 H new ATOM 0 HB2 LYS A 51 11.200 -22.185 11.112 1.00 0.00 H new ATOM 0 HB3 LYS A 51 11.465 -22.589 12.797 1.00 0.00 H new ATOM 0 HG2 LYS A 51 11.571 -19.791 11.612 1.00 0.00 H new ATOM 0 HG3 LYS A 51 10.242 -20.459 12.539 1.00 0.00 H new ATOM 0 HD2 LYS A 51 11.891 -20.830 14.452 1.00 0.00 H new ATOM 0 HD3 LYS A 51 13.070 -19.925 13.524 1.00 0.00 H new ATOM 0 HE2 LYS A 51 12.049 -18.357 15.015 1.00 0.00 H new ATOM 0 HE3 LYS A 51 11.408 -18.007 13.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 9.747 -18.092 15.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 9.376 -19.067 13.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 9.998 -19.769 15.356 1.00 0.00 H new ATOM 837 N GLY A 52 14.489 -23.546 10.313 1.00 0.00 N ATOM 838 CA GLY A 52 14.869 -24.846 9.792 1.00 0.00 C ATOM 839 C GLY A 52 13.978 -25.297 8.652 1.00 0.00 C ATOM 840 O GLY A 52 14.209 -26.346 8.051 1.00 0.00 O ATOM 0 H GLY A 52 14.978 -22.756 9.892 1.00 0.00 H new ATOM 0 HA2 GLY A 52 15.903 -24.808 9.448 1.00 0.00 H new ATOM 0 HA3 GLY A 52 14.827 -25.582 10.595 1.00 0.00 H new ATOM 844 N LYS A 53 12.954 -24.504 8.354 1.00 0.00 N ATOM 845 CA LYS A 53 12.024 -24.827 7.279 1.00 0.00 C ATOM 846 C LYS A 53 12.385 -24.075 6.002 1.00 0.00 C ATOM 847 O LYS A 53 12.846 -22.934 6.035 1.00 0.00 O ATOM 848 CB LYS A 53 10.592 -24.485 7.697 1.00 0.00 C ATOM 849 CG LYS A 53 9.999 -25.464 8.696 1.00 0.00 C ATOM 850 CD LYS A 53 8.908 -26.313 8.066 1.00 0.00 C ATOM 851 CE LYS A 53 8.296 -27.272 9.075 1.00 0.00 C ATOM 852 NZ LYS A 53 7.457 -26.560 10.079 1.00 0.00 N ATOM 0 H LYS A 53 12.747 -23.633 8.842 1.00 0.00 H new ATOM 0 HA LYS A 53 12.094 -25.897 7.081 1.00 0.00 H new ATOM 0 HB2 LYS A 53 10.578 -23.485 8.129 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.960 -24.457 6.809 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.786 -26.111 9.084 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.590 -24.916 9.545 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.131 -25.666 7.660 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.322 -26.878 7.230 1.00 0.00 H new ATOM 0 HE2 LYS A 53 7.688 -28.010 8.552 1.00 0.00 H new ATOM 0 HE3 LYS A 53 9.090 -27.817 9.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 6.964 -27.255 10.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 8.063 -25.961 10.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 6.758 -25.966 9.589 1.00 0.00 H new ATOM 866 N PRO A 54 12.171 -24.727 4.850 1.00 0.00 N ATOM 867 CA PRO A 54 12.467 -24.138 3.540 1.00 0.00 C ATOM 868 C PRO A 54 11.513 -23.001 3.188 1.00 0.00 C ATOM 869 O PRO A 54 10.744 -23.097 2.232 1.00 0.00 O ATOM 870 CB PRO A 54 12.281 -25.310 2.574 1.00 0.00 C ATOM 871 CG PRO A 54 11.333 -26.227 3.267 1.00 0.00 C ATOM 872 CD PRO A 54 11.625 -26.090 4.736 1.00 0.00 C ATOM 0 HA PRO A 54 13.462 -23.695 3.507 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.879 -24.975 1.618 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.229 -25.805 2.365 1.00 0.00 H new ATOM 0 HG2 PRO A 54 10.300 -25.959 3.048 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.472 -27.256 2.936 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.725 -26.214 5.338 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.341 -26.839 5.075 1.00 0.00 H new ATOM 880 N ALA A 55 11.569 -21.925 3.966 1.00 0.00 N ATOM 881 CA ALA A 55 10.712 -20.769 3.734 1.00 0.00 C ATOM 882 C ALA A 55 9.256 -21.190 3.565 1.00 0.00 C ATOM 883 O ALA A 55 8.755 -21.288 2.446 1.00 0.00 O ATOM 884 CB ALA A 55 11.186 -19.998 2.511 1.00 0.00 C ATOM 0 H ALA A 55 12.199 -21.830 4.763 1.00 0.00 H new ATOM 0 HA ALA A 55 10.776 -20.119 4.607 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.537 -19.137 2.349 1.00 0.00 H new ATOM 0 HB2 ALA A 55 12.209 -19.656 2.670 1.00 0.00 H new ATOM 0 HB3 ALA A 55 11.152 -20.647 1.636 1.00 0.00 H new ATOM 890 N GLU A 56 8.583 -21.439 4.684 1.00 0.00 N ATOM 891 CA GLU A 56 7.185 -21.851 4.658 1.00 0.00 C ATOM 892 C GLU A 56 6.355 -20.907 3.792 1.00 0.00 C ATOM 893 O GLU A 56 6.740 -19.762 3.561 1.00 0.00 O ATOM 894 CB GLU A 56 6.615 -21.891 6.078 1.00 0.00 C ATOM 895 CG GLU A 56 5.557 -22.962 6.279 1.00 0.00 C ATOM 896 CD GLU A 56 5.704 -23.687 7.603 1.00 0.00 C ATOM 897 OE1 GLU A 56 6.261 -23.090 8.548 1.00 0.00 O ATOM 898 OE2 GLU A 56 5.261 -24.851 7.694 1.00 0.00 O ATOM 0 H GLU A 56 8.983 -21.363 5.619 1.00 0.00 H new ATOM 0 HA GLU A 56 7.136 -22.851 4.226 1.00 0.00 H new ATOM 0 HB2 GLU A 56 7.429 -22.060 6.783 1.00 0.00 H new ATOM 0 HB3 GLU A 56 6.185 -20.918 6.315 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.569 -22.505 6.227 1.00 0.00 H new ATOM 0 HG3 GLU A 56 5.617 -23.684 5.465 1.00 0.00 H new ATOM 905 N ASN A 57 5.216 -21.398 3.316 1.00 0.00 N ATOM 906 CA ASN A 57 4.332 -20.600 2.474 1.00 0.00 C ATOM 907 C ASN A 57 3.900 -19.326 3.194 1.00 0.00 C ATOM 908 O ASN A 57 3.611 -18.310 2.560 1.00 0.00 O ATOM 909 CB ASN A 57 3.101 -21.415 2.074 1.00 0.00 C ATOM 910 CG ASN A 57 3.172 -21.903 0.639 1.00 0.00 C ATOM 911 OD1 ASN A 57 4.180 -21.717 -0.042 1.00 0.00 O ATOM 912 ND2 ASN A 57 2.097 -22.529 0.174 1.00 0.00 N ATOM 0 H ASN A 57 4.883 -22.345 3.499 1.00 0.00 H new ATOM 0 HA ASN A 57 4.882 -20.320 1.575 1.00 0.00 H new ATOM 0 HB2 ASN A 57 3.003 -22.271 2.742 1.00 0.00 H new ATOM 0 HB3 ASN A 57 2.207 -20.805 2.204 1.00 0.00 H new ATOM 0 HD21 ASN A 57 2.085 -22.878 -0.784 1.00 0.00 H new ATOM 0 HD22 ASN A 57 1.284 -22.661 0.775 1.00 0.00 H new ATOM 919 N ASP A 58 3.859 -19.387 4.520 1.00 0.00 N ATOM 920 CA ASP A 58 3.464 -18.238 5.327 1.00 0.00 C ATOM 921 C ASP A 58 4.634 -17.276 5.512 1.00 0.00 C ATOM 922 O ASP A 58 4.455 -16.144 5.961 1.00 0.00 O ATOM 923 CB ASP A 58 2.947 -18.699 6.690 1.00 0.00 C ATOM 924 CG ASP A 58 2.174 -17.613 7.413 1.00 0.00 C ATOM 925 OD1 ASP A 58 1.325 -16.961 6.770 1.00 0.00 O ATOM 926 OD2 ASP A 58 2.417 -17.417 8.622 1.00 0.00 O ATOM 0 H ASP A 58 4.094 -20.220 5.059 1.00 0.00 H new ATOM 0 HA ASP A 58 2.665 -17.714 4.802 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.306 -19.570 6.556 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.788 -19.014 7.307 1.00 0.00 H new ATOM 931 N VAL A 59 5.832 -17.735 5.163 1.00 0.00 N ATOM 932 CA VAL A 59 7.031 -16.916 5.291 1.00 0.00 C ATOM 933 C VAL A 59 7.051 -15.805 4.246 1.00 0.00 C ATOM 934 O VAL A 59 6.824 -16.048 3.061 1.00 0.00 O ATOM 935 CB VAL A 59 8.309 -17.765 5.146 1.00 0.00 C ATOM 936 CG1 VAL A 59 9.546 -16.882 5.212 1.00 0.00 C ATOM 937 CG2 VAL A 59 8.355 -18.843 6.218 1.00 0.00 C ATOM 0 H VAL A 59 5.998 -18.670 4.790 1.00 0.00 H new ATOM 0 HA VAL A 59 7.008 -16.474 6.287 1.00 0.00 H new ATOM 0 HB VAL A 59 8.293 -18.254 4.172 1.00 0.00 H new ATOM 0 HG11 VAL A 59 10.439 -17.498 5.108 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.514 -16.150 4.405 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.572 -16.364 6.171 1.00 0.00 H new ATOM 0 HG21 VAL A 59 9.264 -19.434 6.101 1.00 0.00 H new ATOM 0 HG22 VAL A 59 8.349 -18.377 7.203 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.485 -19.492 6.119 1.00 0.00 H new ATOM 947 N LYS A 60 7.326 -14.585 4.694 1.00 0.00 N ATOM 948 CA LYS A 60 7.378 -13.435 3.799 1.00 0.00 C ATOM 949 C LYS A 60 8.556 -13.547 2.837 1.00 0.00 C ATOM 950 O LYS A 60 9.510 -14.284 3.091 1.00 0.00 O ATOM 951 CB LYS A 60 7.487 -12.139 4.607 1.00 0.00 C ATOM 952 CG LYS A 60 6.777 -12.197 5.948 1.00 0.00 C ATOM 953 CD LYS A 60 6.124 -10.869 6.291 1.00 0.00 C ATOM 954 CE LYS A 60 4.635 -11.033 6.557 1.00 0.00 C ATOM 955 NZ LYS A 60 4.363 -11.414 7.971 1.00 0.00 N ATOM 0 H LYS A 60 7.516 -14.367 5.672 1.00 0.00 H new ATOM 0 HA LYS A 60 6.457 -13.417 3.217 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.540 -11.911 4.772 1.00 0.00 H new ATOM 0 HB3 LYS A 60 7.072 -11.319 4.021 1.00 0.00 H new ATOM 0 HG2 LYS A 60 6.020 -12.981 5.926 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.491 -12.465 6.727 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.607 -10.441 7.170 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.273 -10.166 5.471 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.120 -10.100 6.327 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.229 -11.794 5.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.338 -11.516 8.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.833 -12.317 8.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.728 -10.675 8.606 1.00 0.00 H new ATOM 969 N LEU A 61 8.485 -12.812 1.733 1.00 0.00 N ATOM 970 CA LEU A 61 9.547 -12.827 0.733 1.00 0.00 C ATOM 971 C LEU A 61 10.796 -12.123 1.254 1.00 0.00 C ATOM 972 O LEU A 61 11.838 -12.748 1.448 1.00 0.00 O ATOM 973 CB LEU A 61 9.070 -12.157 -0.556 1.00 0.00 C ATOM 974 CG LEU A 61 7.971 -12.889 -1.326 1.00 0.00 C ATOM 975 CD1 LEU A 61 8.314 -14.363 -1.475 1.00 0.00 C ATOM 976 CD2 LEU A 61 6.628 -12.720 -0.630 1.00 0.00 C ATOM 0 H LEU A 61 7.703 -12.198 1.507 1.00 0.00 H new ATOM 0 HA LEU A 61 9.800 -13.866 0.523 1.00 0.00 H new ATOM 0 HB2 LEU A 61 8.710 -11.158 -0.311 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.928 -12.033 -1.217 1.00 0.00 H new ATOM 0 HG LEU A 61 7.899 -12.451 -2.322 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.520 -14.867 -2.026 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.254 -14.465 -2.018 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.415 -14.815 -0.488 1.00 0.00 H new ATOM 0 HD21 LEU A 61 5.858 -13.248 -1.192 1.00 0.00 H new ATOM 0 HD22 LEU A 61 6.686 -13.130 0.378 1.00 0.00 H new ATOM 0 HD23 LEU A 61 6.377 -11.661 -0.577 1.00 0.00 H new ATOM 988 N GLY A 62 10.682 -10.818 1.481 1.00 0.00 N ATOM 989 CA GLY A 62 11.809 -10.051 1.980 1.00 0.00 C ATOM 990 C GLY A 62 12.381 -10.626 3.260 1.00 0.00 C ATOM 991 O GLY A 62 13.470 -10.245 3.688 1.00 0.00 O ATOM 0 H GLY A 62 9.830 -10.278 1.328 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.589 -10.020 1.219 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.495 -9.022 2.156 1.00 0.00 H new ATOM 995 N ALA A 63 11.644 -11.546 3.875 1.00 0.00 N ATOM 996 CA ALA A 63 12.085 -12.175 5.113 1.00 0.00 C ATOM 997 C ALA A 63 13.404 -12.914 4.915 1.00 0.00 C ATOM 998 O ALA A 63 14.413 -12.584 5.539 1.00 0.00 O ATOM 999 CB ALA A 63 11.017 -13.127 5.631 1.00 0.00 C ATOM 0 H ALA A 63 10.739 -11.872 3.535 1.00 0.00 H new ATOM 0 HA ALA A 63 12.246 -11.390 5.852 1.00 0.00 H new ATOM 0 HB1 ALA A 63 11.360 -13.590 6.556 1.00 0.00 H new ATOM 0 HB2 ALA A 63 10.097 -12.573 5.821 1.00 0.00 H new ATOM 0 HB3 ALA A 63 10.827 -13.901 4.887 1.00 0.00 H new ATOM 1005 N LEU A 64 13.390 -13.916 4.043 1.00 0.00 N ATOM 1006 CA LEU A 64 14.585 -14.703 3.762 1.00 0.00 C ATOM 1007 C LEU A 64 14.901 -14.701 2.269 1.00 0.00 C ATOM 1008 O LEU A 64 16.065 -14.705 1.870 1.00 0.00 O ATOM 1009 CB LEU A 64 14.401 -16.140 4.254 1.00 0.00 C ATOM 1010 CG LEU A 64 12.956 -16.606 4.440 1.00 0.00 C ATOM 1011 CD1 LEU A 64 12.264 -16.748 3.093 1.00 0.00 C ATOM 1012 CD2 LEU A 64 12.914 -17.921 5.205 1.00 0.00 C ATOM 0 H LEU A 64 12.564 -14.203 3.518 1.00 0.00 H new ATOM 0 HA LEU A 64 15.422 -14.248 4.292 1.00 0.00 H new ATOM 0 HB2 LEU A 64 14.890 -16.810 3.547 1.00 0.00 H new ATOM 0 HB3 LEU A 64 14.921 -16.246 5.206 1.00 0.00 H new ATOM 0 HG LEU A 64 12.423 -15.854 5.022 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.237 -17.080 3.245 1.00 0.00 H new ATOM 0 HD12 LEU A 64 12.262 -15.785 2.582 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.796 -17.480 2.486 1.00 0.00 H new ATOM 0 HD21 LEU A 64 11.878 -18.237 5.328 1.00 0.00 H new ATOM 0 HD22 LEU A 64 13.463 -18.682 4.650 1.00 0.00 H new ATOM 0 HD23 LEU A 64 13.371 -17.786 6.185 1.00 0.00 H new ATOM 1024 N LYS A 65 13.856 -14.692 1.449 1.00 0.00 N ATOM 1025 CA LYS A 65 14.019 -14.686 0.000 1.00 0.00 C ATOM 1026 C LYS A 65 15.009 -13.608 -0.430 1.00 0.00 C ATOM 1027 O LYS A 65 16.198 -13.877 -0.608 1.00 0.00 O ATOM 1028 CB LYS A 65 12.670 -14.457 -0.685 1.00 0.00 C ATOM 1029 CG LYS A 65 11.624 -15.499 -0.330 1.00 0.00 C ATOM 1030 CD LYS A 65 11.939 -16.845 -0.961 1.00 0.00 C ATOM 1031 CE LYS A 65 12.075 -17.935 0.091 1.00 0.00 C ATOM 1032 NZ LYS A 65 11.815 -19.287 -0.476 1.00 0.00 N ATOM 0 H LYS A 65 12.886 -14.689 1.764 1.00 0.00 H new ATOM 0 HA LYS A 65 14.412 -15.657 -0.301 1.00 0.00 H new ATOM 0 HB2 LYS A 65 12.296 -13.471 -0.411 1.00 0.00 H new ATOM 0 HB3 LYS A 65 12.816 -14.454 -1.765 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.571 -15.608 0.753 1.00 0.00 H new ATOM 0 HG3 LYS A 65 10.644 -15.160 -0.665 1.00 0.00 H new ATOM 0 HD2 LYS A 65 11.150 -17.112 -1.664 1.00 0.00 H new ATOM 0 HD3 LYS A 65 12.864 -16.772 -1.533 1.00 0.00 H new ATOM 0 HE2 LYS A 65 13.078 -17.906 0.517 1.00 0.00 H new ATOM 0 HE3 LYS A 65 11.377 -17.742 0.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 12.318 -20.002 0.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.794 -19.483 -0.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 12.151 -19.322 -1.460 1.00 0.00 H new ATOM 1046 N LEU A 66 14.513 -12.387 -0.594 1.00 0.00 N ATOM 1047 CA LEU A 66 15.354 -11.267 -1.003 1.00 0.00 C ATOM 1048 C LEU A 66 14.519 -10.009 -1.220 1.00 0.00 C ATOM 1049 O LEU A 66 13.324 -9.986 -0.925 1.00 0.00 O ATOM 1050 CB LEU A 66 16.115 -11.616 -2.283 1.00 0.00 C ATOM 1051 CG LEU A 66 15.339 -12.420 -3.327 1.00 0.00 C ATOM 1052 CD1 LEU A 66 14.186 -11.600 -3.885 1.00 0.00 C ATOM 1053 CD2 LEU A 66 16.264 -12.874 -4.446 1.00 0.00 C ATOM 0 H LEU A 66 13.532 -12.147 -0.450 1.00 0.00 H new ATOM 0 HA LEU A 66 16.070 -11.071 -0.204 1.00 0.00 H new ATOM 0 HB2 LEU A 66 16.453 -10.689 -2.745 1.00 0.00 H new ATOM 0 HB3 LEU A 66 17.007 -12.179 -2.009 1.00 0.00 H new ATOM 0 HG LEU A 66 14.926 -13.305 -2.842 1.00 0.00 H new ATOM 0 HD11 LEU A 66 13.646 -12.189 -4.626 1.00 0.00 H new ATOM 0 HD12 LEU A 66 13.509 -11.326 -3.076 1.00 0.00 H new ATOM 0 HD13 LEU A 66 14.576 -10.696 -4.354 1.00 0.00 H new ATOM 0 HD21 LEU A 66 15.695 -13.445 -5.180 1.00 0.00 H new ATOM 0 HD22 LEU A 66 16.707 -12.002 -4.928 1.00 0.00 H new ATOM 0 HD23 LEU A 66 17.054 -13.501 -4.033 1.00 0.00 H new ATOM 1065 N LYS A 67 15.156 -8.965 -1.739 1.00 0.00 N ATOM 1066 CA LYS A 67 14.472 -7.704 -2.000 1.00 0.00 C ATOM 1067 C LYS A 67 13.382 -7.883 -3.052 1.00 0.00 C ATOM 1068 O LYS A 67 13.329 -8.889 -3.760 1.00 0.00 O ATOM 1069 CB LYS A 67 15.474 -6.644 -2.464 1.00 0.00 C ATOM 1070 CG LYS A 67 15.874 -5.666 -1.372 1.00 0.00 C ATOM 1071 CD LYS A 67 16.858 -6.291 -0.397 1.00 0.00 C ATOM 1072 CE LYS A 67 17.424 -5.257 0.563 1.00 0.00 C ATOM 1073 NZ LYS A 67 18.503 -5.825 1.418 1.00 0.00 N ATOM 0 H LYS A 67 16.145 -8.967 -1.987 1.00 0.00 H new ATOM 0 HA LYS A 67 14.005 -7.374 -1.072 1.00 0.00 H new ATOM 0 HB2 LYS A 67 16.368 -7.141 -2.840 1.00 0.00 H new ATOM 0 HB3 LYS A 67 15.043 -6.089 -3.297 1.00 0.00 H new ATOM 0 HG2 LYS A 67 16.320 -4.779 -1.822 1.00 0.00 H new ATOM 0 HG3 LYS A 67 14.985 -5.337 -0.833 1.00 0.00 H new ATOM 0 HD2 LYS A 67 16.361 -7.080 0.168 1.00 0.00 H new ATOM 0 HD3 LYS A 67 17.672 -6.760 -0.950 1.00 0.00 H new ATOM 0 HE2 LYS A 67 17.816 -4.412 -0.003 1.00 0.00 H new ATOM 0 HE3 LYS A 67 16.624 -4.873 1.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 18.862 -5.089 2.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 18.123 -6.615 1.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 19.278 -6.169 0.816 1.00 0.00 H new ATOM 1087 N PRO A 68 12.493 -6.885 -3.159 1.00 0.00 N ATOM 1088 CA PRO A 68 11.389 -6.909 -4.124 1.00 0.00 C ATOM 1089 C PRO A 68 11.873 -6.763 -5.562 1.00 0.00 C ATOM 1090 O PRO A 68 11.657 -7.645 -6.392 1.00 0.00 O ATOM 1091 CB PRO A 68 10.539 -5.701 -3.721 1.00 0.00 C ATOM 1092 CG PRO A 68 11.491 -4.778 -3.041 1.00 0.00 C ATOM 1093 CD PRO A 68 12.496 -5.656 -2.348 1.00 0.00 C ATOM 0 HA PRO A 68 10.848 -7.855 -4.101 1.00 0.00 H new ATOM 0 HB2 PRO A 68 10.084 -5.229 -4.592 1.00 0.00 H new ATOM 0 HB3 PRO A 68 9.727 -5.993 -3.055 1.00 0.00 H new ATOM 0 HG2 PRO A 68 11.978 -4.120 -3.761 1.00 0.00 H new ATOM 0 HG3 PRO A 68 10.972 -4.139 -2.326 1.00 0.00 H new ATOM 0 HD2 PRO A 68 13.483 -5.194 -2.322 1.00 0.00 H new ATOM 0 HD3 PRO A 68 12.211 -5.856 -1.315 1.00 0.00 H new ATOM 1101 N ASN A 69 12.530 -5.644 -5.850 1.00 0.00 N ATOM 1102 CA ASN A 69 13.045 -5.383 -7.189 1.00 0.00 C ATOM 1103 C ASN A 69 13.997 -6.491 -7.632 1.00 0.00 C ATOM 1104 O ASN A 69 14.223 -6.691 -8.826 1.00 0.00 O ATOM 1105 CB ASN A 69 13.764 -4.033 -7.228 1.00 0.00 C ATOM 1106 CG ASN A 69 14.742 -3.866 -6.081 1.00 0.00 C ATOM 1107 OD1 ASN A 69 14.343 -3.739 -4.924 1.00 0.00 O ATOM 1108 ND2 ASN A 69 16.032 -3.865 -6.399 1.00 0.00 N ATOM 0 H ASN A 69 12.718 -4.904 -5.174 1.00 0.00 H new ATOM 0 HA ASN A 69 12.200 -5.357 -7.877 1.00 0.00 H new ATOM 0 HB2 ASN A 69 14.297 -3.935 -8.174 1.00 0.00 H new ATOM 0 HB3 ASN A 69 13.027 -3.231 -7.193 1.00 0.00 H new ATOM 0 HD21 ASN A 69 16.737 -3.756 -5.670 1.00 0.00 H new ATOM 0 HD22 ASN A 69 16.317 -3.973 -7.372 1.00 0.00 H new ATOM 1115 N THR A 70 14.551 -7.210 -6.661 1.00 0.00 N ATOM 1116 CA THR A 70 15.478 -8.297 -6.949 1.00 0.00 C ATOM 1117 C THR A 70 14.745 -9.509 -7.513 1.00 0.00 C ATOM 1118 O THR A 70 13.597 -9.775 -7.157 1.00 0.00 O ATOM 1119 CB THR A 70 16.255 -8.722 -5.689 1.00 0.00 C ATOM 1120 OG1 THR A 70 17.050 -7.630 -5.212 1.00 0.00 O ATOM 1121 CG2 THR A 70 17.150 -9.917 -5.982 1.00 0.00 C ATOM 0 H THR A 70 14.374 -7.059 -5.668 1.00 0.00 H new ATOM 0 HA THR A 70 16.182 -7.923 -7.692 1.00 0.00 H new ATOM 0 HB THR A 70 15.534 -9.008 -4.923 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.657 -7.949 -4.512 1.00 0.00 H new ATOM 0 HG21 THR A 70 17.689 -10.199 -5.077 1.00 0.00 H new ATOM 0 HG22 THR A 70 16.539 -10.756 -6.317 1.00 0.00 H new ATOM 0 HG23 THR A 70 17.864 -9.654 -6.762 1.00 0.00 H new ATOM 1129 N LYS A 71 15.416 -10.244 -8.394 1.00 0.00 N ATOM 1130 CA LYS A 71 14.830 -11.430 -9.006 1.00 0.00 C ATOM 1131 C LYS A 71 15.234 -12.690 -8.247 1.00 0.00 C ATOM 1132 O LYS A 71 16.336 -12.772 -7.703 1.00 0.00 O ATOM 1133 CB LYS A 71 15.266 -11.542 -10.469 1.00 0.00 C ATOM 1134 CG LYS A 71 16.772 -11.613 -10.652 1.00 0.00 C ATOM 1135 CD LYS A 71 17.365 -10.242 -10.930 1.00 0.00 C ATOM 1136 CE LYS A 71 17.540 -10.003 -12.422 1.00 0.00 C ATOM 1137 NZ LYS A 71 18.754 -10.682 -12.954 1.00 0.00 N ATOM 0 H LYS A 71 16.367 -10.038 -8.700 1.00 0.00 H new ATOM 0 HA LYS A 71 13.745 -11.333 -8.962 1.00 0.00 H new ATOM 0 HB2 LYS A 71 14.813 -12.431 -10.907 1.00 0.00 H new ATOM 0 HB3 LYS A 71 14.882 -10.684 -11.020 1.00 0.00 H new ATOM 0 HG2 LYS A 71 17.229 -12.033 -9.756 1.00 0.00 H new ATOM 0 HG3 LYS A 71 17.008 -12.286 -11.476 1.00 0.00 H new ATOM 0 HD2 LYS A 71 16.717 -9.472 -10.511 1.00 0.00 H new ATOM 0 HD3 LYS A 71 18.330 -10.154 -10.431 1.00 0.00 H new ATOM 0 HE2 LYS A 71 16.660 -10.364 -12.953 1.00 0.00 H new ATOM 0 HE3 LYS A 71 17.610 -8.932 -12.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 18.838 -10.495 -13.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 19.597 -10.319 -12.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 18.676 -11.707 -12.795 1.00 0.00 H new ATOM 1151 N ILE A 72 14.337 -13.669 -8.216 1.00 0.00 N ATOM 1152 CA ILE A 72 14.602 -14.926 -7.525 1.00 0.00 C ATOM 1153 C ILE A 72 14.634 -16.094 -8.504 1.00 0.00 C ATOM 1154 O ILE A 72 14.041 -16.032 -9.581 1.00 0.00 O ATOM 1155 CB ILE A 72 13.544 -15.207 -6.442 1.00 0.00 C ATOM 1156 CG1 ILE A 72 12.521 -14.070 -6.390 1.00 0.00 C ATOM 1157 CG2 ILE A 72 14.209 -15.390 -5.086 1.00 0.00 C ATOM 1158 CD1 ILE A 72 11.488 -14.236 -5.298 1.00 0.00 C ATOM 0 H ILE A 72 13.421 -13.617 -8.661 1.00 0.00 H new ATOM 0 HA ILE A 72 15.578 -14.826 -7.050 1.00 0.00 H new ATOM 0 HB ILE A 72 13.022 -16.129 -6.696 1.00 0.00 H new ATOM 0 HG12 ILE A 72 13.046 -13.126 -6.242 1.00 0.00 H new ATOM 0 HG13 ILE A 72 12.013 -14.005 -7.352 1.00 0.00 H new ATOM 0 HG21 ILE A 72 13.448 -15.588 -4.331 1.00 0.00 H new ATOM 0 HG22 ILE A 72 14.902 -16.230 -5.131 1.00 0.00 H new ATOM 0 HG23 ILE A 72 14.754 -14.483 -4.823 1.00 0.00 H new ATOM 0 HD11 ILE A 72 10.796 -13.394 -5.321 1.00 0.00 H new ATOM 0 HD12 ILE A 72 10.937 -15.163 -5.456 1.00 0.00 H new ATOM 0 HD13 ILE A 72 11.986 -14.271 -4.329 1.00 0.00 H new ATOM 1170 N MET A 73 15.329 -17.161 -8.122 1.00 0.00 N ATOM 1171 CA MET A 73 15.435 -18.346 -8.965 1.00 0.00 C ATOM 1172 C MET A 73 14.456 -19.425 -8.512 1.00 0.00 C ATOM 1173 O MET A 73 14.242 -19.619 -7.316 1.00 0.00 O ATOM 1174 CB MET A 73 16.864 -18.892 -8.935 1.00 0.00 C ATOM 1175 CG MET A 73 17.748 -18.341 -10.042 1.00 0.00 C ATOM 1176 SD MET A 73 19.258 -19.302 -10.268 1.00 0.00 S ATOM 1177 CE MET A 73 20.411 -18.359 -9.273 1.00 0.00 C ATOM 0 H MET A 73 15.827 -17.229 -7.234 1.00 0.00 H new ATOM 0 HA MET A 73 15.184 -18.059 -9.986 1.00 0.00 H new ATOM 0 HB2 MET A 73 17.314 -18.657 -7.971 1.00 0.00 H new ATOM 0 HB3 MET A 73 16.831 -19.979 -9.014 1.00 0.00 H new ATOM 0 HG2 MET A 73 17.187 -18.327 -10.977 1.00 0.00 H new ATOM 0 HG3 MET A 73 18.010 -17.308 -9.812 1.00 0.00 H new ATOM 0 HE1 MET A 73 21.266 -18.984 -9.017 1.00 0.00 H new ATOM 0 HE2 MET A 73 20.752 -17.490 -9.836 1.00 0.00 H new ATOM 0 HE3 MET A 73 19.917 -18.028 -8.360 1.00 0.00 H new ATOM 1187 N MET A 74 13.865 -20.123 -9.476 1.00 0.00 N ATOM 1188 CA MET A 74 12.909 -21.182 -9.176 1.00 0.00 C ATOM 1189 C MET A 74 13.551 -22.556 -9.342 1.00 0.00 C ATOM 1190 O MET A 74 13.966 -22.928 -10.439 1.00 0.00 O ATOM 1191 CB MET A 74 11.683 -21.066 -10.083 1.00 0.00 C ATOM 1192 CG MET A 74 10.576 -20.202 -9.501 1.00 0.00 C ATOM 1193 SD MET A 74 9.067 -20.251 -10.486 1.00 0.00 S ATOM 1194 CE MET A 74 7.944 -21.055 -9.345 1.00 0.00 C ATOM 0 H MET A 74 14.031 -19.974 -10.471 1.00 0.00 H new ATOM 0 HA MET A 74 12.595 -21.070 -8.138 1.00 0.00 H new ATOM 0 HB2 MET A 74 11.990 -20.651 -11.043 1.00 0.00 H new ATOM 0 HB3 MET A 74 11.290 -22.064 -10.278 1.00 0.00 H new ATOM 0 HG2 MET A 74 10.355 -20.536 -8.487 1.00 0.00 H new ATOM 0 HG3 MET A 74 10.925 -19.172 -9.428 1.00 0.00 H new ATOM 0 HE1 MET A 74 6.916 -20.819 -9.620 1.00 0.00 H new ATOM 0 HE2 MET A 74 8.093 -22.134 -9.388 1.00 0.00 H new ATOM 0 HE3 MET A 74 8.139 -20.702 -8.333 1.00 0.00 H new ATOM 1204 N MET A 75 13.629 -23.305 -8.247 1.00 0.00 N ATOM 1205 CA MET A 75 14.219 -24.638 -8.274 1.00 0.00 C ATOM 1206 C MET A 75 13.164 -25.706 -8.001 1.00 0.00 C ATOM 1207 O MET A 75 12.649 -25.813 -6.889 1.00 0.00 O ATOM 1208 CB MET A 75 15.344 -24.742 -7.242 1.00 0.00 C ATOM 1209 CG MET A 75 16.354 -23.608 -7.328 1.00 0.00 C ATOM 1210 SD MET A 75 18.044 -24.159 -7.024 1.00 0.00 S ATOM 1211 CE MET A 75 18.749 -24.011 -8.663 1.00 0.00 C ATOM 0 H MET A 75 13.291 -23.012 -7.330 1.00 0.00 H new ATOM 0 HA MET A 75 14.631 -24.805 -9.269 1.00 0.00 H new ATOM 0 HB2 MET A 75 14.909 -24.755 -6.243 1.00 0.00 H new ATOM 0 HB3 MET A 75 15.863 -25.691 -7.377 1.00 0.00 H new ATOM 0 HG2 MET A 75 16.297 -23.150 -8.316 1.00 0.00 H new ATOM 0 HG3 MET A 75 16.091 -22.837 -6.604 1.00 0.00 H new ATOM 0 HE1 MET A 75 19.795 -24.317 -8.638 1.00 0.00 H new ATOM 0 HE2 MET A 75 18.200 -24.650 -9.354 1.00 0.00 H new ATOM 0 HE3 MET A 75 18.682 -22.975 -8.996 1.00 0.00 H new ATOM 1221 N GLY A 76 12.847 -26.493 -9.025 1.00 0.00 N ATOM 1222 CA GLY A 76 11.854 -27.541 -8.874 1.00 0.00 C ATOM 1223 C GLY A 76 11.313 -28.023 -10.206 1.00 0.00 C ATOM 1224 O GLY A 76 12.000 -27.954 -11.226 1.00 0.00 O ATOM 0 H GLY A 76 13.260 -26.424 -9.955 1.00 0.00 H new ATOM 0 HA2 GLY A 76 12.296 -28.382 -8.339 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.030 -27.172 -8.263 1.00 0.00 H new ATOM 1228 N THR A 77 10.078 -28.514 -10.198 1.00 0.00 N ATOM 1229 CA THR A 77 9.446 -29.012 -11.414 1.00 0.00 C ATOM 1230 C THR A 77 8.000 -28.541 -11.514 1.00 0.00 C ATOM 1231 O THR A 77 7.348 -28.289 -10.500 1.00 0.00 O ATOM 1232 CB THR A 77 9.478 -30.551 -11.474 1.00 0.00 C ATOM 1233 OG1 THR A 77 9.276 -30.993 -12.821 1.00 0.00 O ATOM 1234 CG2 THR A 77 8.410 -31.150 -10.572 1.00 0.00 C ATOM 0 H THR A 77 9.495 -28.578 -9.363 1.00 0.00 H new ATOM 0 HA THR A 77 10.015 -28.611 -12.253 1.00 0.00 H new ATOM 0 HB THR A 77 10.455 -30.886 -11.125 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.299 -31.972 -12.851 1.00 0.00 H new ATOM 0 HG21 THR A 77 8.452 -32.238 -10.631 1.00 0.00 H new ATOM 0 HG22 THR A 77 8.584 -30.835 -9.543 1.00 0.00 H new ATOM 0 HG23 THR A 77 7.427 -30.807 -10.895 1.00 0.00 H new ATOM 1242 N ARG A 78 7.504 -28.426 -12.741 1.00 0.00 N ATOM 1243 CA ARG A 78 6.134 -27.984 -12.973 1.00 0.00 C ATOM 1244 C ARG A 78 5.262 -29.143 -13.447 1.00 0.00 C ATOM 1245 O ARG A 78 5.722 -30.018 -14.180 1.00 0.00 O ATOM 1246 CB ARG A 78 6.107 -26.856 -14.006 1.00 0.00 C ATOM 1247 CG ARG A 78 6.599 -27.277 -15.381 1.00 0.00 C ATOM 1248 CD ARG A 78 8.103 -27.097 -15.513 1.00 0.00 C ATOM 1249 NE ARG A 78 8.482 -26.606 -16.835 1.00 0.00 N ATOM 1250 CZ ARG A 78 9.692 -26.764 -17.359 1.00 0.00 C ATOM 1251 NH1 ARG A 78 10.636 -27.398 -16.677 1.00 0.00 N ATOM 1252 NH2 ARG A 78 9.960 -26.289 -18.569 1.00 0.00 N ATOM 0 H ARG A 78 8.030 -28.633 -13.590 1.00 0.00 H new ATOM 0 HA ARG A 78 5.734 -27.613 -12.029 1.00 0.00 H new ATOM 0 HB2 ARG A 78 5.088 -26.480 -14.094 1.00 0.00 H new ATOM 0 HB3 ARG A 78 6.722 -26.031 -13.646 1.00 0.00 H new ATOM 0 HG2 ARG A 78 6.339 -28.321 -15.558 1.00 0.00 H new ATOM 0 HG3 ARG A 78 6.092 -26.689 -16.146 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.452 -26.398 -14.753 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.600 -28.049 -15.324 1.00 0.00 H new ATOM 0 HE ARG A 78 7.779 -26.115 -17.386 1.00 0.00 H new ATOM 0 HH11 ARG A 78 10.434 -27.766 -15.747 1.00 0.00 H new ATOM 0 HH12 ARG A 78 11.564 -27.518 -17.082 1.00 0.00 H new ATOM 0 HH21 ARG A 78 9.236 -25.802 -19.098 1.00 0.00 H new ATOM 0 HH22 ARG A 78 10.890 -26.411 -18.970 1.00 0.00 H new ATOM 1266 N GLU A 79 4.002 -29.142 -13.024 1.00 0.00 N ATOM 1267 CA GLU A 79 3.067 -30.194 -13.405 1.00 0.00 C ATOM 1268 C GLU A 79 1.920 -29.628 -14.236 1.00 0.00 C ATOM 1269 O GLU A 79 1.542 -28.467 -14.081 1.00 0.00 O ATOM 1270 CB GLU A 79 2.514 -30.891 -12.160 1.00 0.00 C ATOM 1271 CG GLU A 79 1.778 -29.956 -11.215 1.00 0.00 C ATOM 1272 CD GLU A 79 1.240 -30.669 -9.990 1.00 0.00 C ATOM 1273 OE1 GLU A 79 0.499 -31.660 -10.157 1.00 0.00 O ATOM 1274 OE2 GLU A 79 1.561 -30.235 -8.863 1.00 0.00 O ATOM 0 H GLU A 79 3.605 -28.424 -12.417 1.00 0.00 H new ATOM 0 HA GLU A 79 3.607 -30.922 -14.011 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.837 -31.687 -12.470 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.337 -31.363 -11.623 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.452 -29.159 -10.900 1.00 0.00 H new ATOM 0 HG3 GLU A 79 0.953 -29.483 -11.747 1.00 0.00 H new ATOM 1281 N GLU A 80 1.371 -30.457 -15.118 1.00 0.00 N ATOM 1282 CA GLU A 80 0.267 -30.038 -15.975 1.00 0.00 C ATOM 1283 C GLU A 80 -0.953 -29.656 -15.143 1.00 0.00 C ATOM 1284 O GLU A 80 -1.436 -30.445 -14.331 1.00 0.00 O ATOM 1285 CB GLU A 80 -0.099 -31.155 -16.955 1.00 0.00 C ATOM 1286 CG GLU A 80 -1.060 -30.716 -18.046 1.00 0.00 C ATOM 1287 CD GLU A 80 -0.987 -31.597 -19.278 1.00 0.00 C ATOM 1288 OE1 GLU A 80 0.126 -31.768 -19.819 1.00 0.00 O ATOM 1289 OE2 GLU A 80 -2.041 -32.116 -19.700 1.00 0.00 O ATOM 0 H GLU A 80 1.672 -31.422 -15.258 1.00 0.00 H new ATOM 0 HA GLU A 80 0.590 -29.162 -16.538 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.812 -31.535 -17.417 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.544 -31.981 -16.401 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.077 -30.728 -17.655 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -0.839 -29.686 -18.327 1.00 0.00 H new ATOM 1296 N SER A 81 -1.447 -28.440 -15.351 1.00 0.00 N ATOM 1297 CA SER A 81 -2.608 -27.950 -14.617 1.00 0.00 C ATOM 1298 C SER A 81 -3.747 -27.604 -15.572 1.00 0.00 C ATOM 1299 O SER A 81 -3.545 -27.490 -16.779 1.00 0.00 O ATOM 1300 CB SER A 81 -2.233 -26.722 -13.787 1.00 0.00 C ATOM 1301 OG SER A 81 -1.721 -25.687 -14.609 1.00 0.00 O ATOM 0 H SER A 81 -1.061 -27.776 -16.022 1.00 0.00 H new ATOM 0 HA SER A 81 -2.945 -28.742 -13.948 1.00 0.00 H new ATOM 0 HB2 SER A 81 -3.109 -26.362 -13.248 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.490 -26.998 -13.039 1.00 0.00 H new ATOM 0 HG SER A 81 -1.490 -24.913 -14.054 1.00 0.00 H new TER 1307 SER A 81