USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1112 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 1 MET CE :methyl 176:sc= 0 (180deg=0) USER MOD Set 1.2: A 3 THR OG1 : rot -160:sc= 0 USER MOD Single : A 1 MET N :NH3+ -156:sc= 1.38 (180deg=1.03) USER MOD Single : A 5 THR OG1 : rot 180:sc= -2.86! USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 155:sc= -0.0884 (180deg=-0.427) USER MOD Single : A 8 GLN : amide:sc= 0.117 X(o=0.12,f=-0.13) USER MOD Single : A 9 MET CE :methyl -112:sc= -0.596 (180deg=-2.5!) USER MOD Single : A 12 MET CE :methyl -173:sc= -1.07 (180deg=-1.2) USER MOD Single : A 15 HIS : no HD1:sc= -0.204 K(o=-0.2,f=-3.7!) USER MOD Single : A 18 GLN :FLIP amide:sc= -0.0319 F(o=-1.3!,f=-0.032) USER MOD Single : A 22 ASN : amide:sc= 0.157 K(o=0.16,f=-1.3) USER MOD Single : A 25 CYS SG : rot 10:sc= 0.364 USER MOD Single : A 43 TYR OH : rot -89:sc= 1.25 USER MOD Single : A 46 ASN : amide:sc= -0.0753 K(o=-0.075,f=-1.6) USER MOD Single : A 47 ASN : amide:sc= 0.636 K(o=0.64,f=-7.6!) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 54 HIS :FLIP no HD1:sc= -1.05 F(o=-2.1!,f=-1) USER MOD Single : A 56 SER OG : rot 151:sc= 1.29 USER MOD Single : A 57 MET CE :methyl -162:sc= -0.156 (180deg=-0.757) USER MOD Single : A 62 GLN : amide:sc=-0.00163 K(o=-0.0016,f=-1.4) USER MOD Single : A 64 THR OG1 : rot 83:sc= 1.23 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl 164:sc= -1.3 (180deg=-2.59!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= 0.933 K(o=0.93,f=0) USER MOD Single : A 76 MET CE :methyl -136:sc= -0.263 (180deg=-1.98!) USER MOD Single : A 79 ASN : amide:sc= 0.621 K(o=0.62,f=-0.07) USER MOD Single : A 81 HIS : no HD1:sc= -0.0374 K(o=-0.037,f=-4.3!) USER MOD Single : A 82 SER OG : rot 110:sc= -0.875 USER MOD Single : A 83 HIS : no HD1:sc= 0.192 K(o=0.19,f=-0.78) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.973 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 2:sc= 1.12 USER MOD Single : A 104 SER OG : rot -120:sc= -0.322 USER MOD Single : A 105 TYR OH : rot 17:sc= 1.22 USER MOD Single : A 109 SER OG : rot -126:sc= 1.14 USER MOD Single : A 114 GLN : amide:sc= -0.0274 K(o=-0.027,f=-1.3!) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 180:sc= 0.0322 USER MOD Single : A 119 LYS NZ :NH3+ 151:sc= 2.47 (180deg=2.32) USER MOD Single : A 120 SER OG : rot 13:sc= 0.0951 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.657 -3.176 4.438 1.00 0.00 N ATOM 2 CA MET A 1 -13.015 -3.418 3.127 1.00 0.00 C ATOM 3 C MET A 1 -12.114 -2.251 2.763 1.00 0.00 C ATOM 4 O MET A 1 -12.233 -1.164 3.333 1.00 0.00 O ATOM 5 CB MET A 1 -14.073 -3.618 2.030 1.00 0.00 C ATOM 6 CG MET A 1 -14.759 -2.333 1.577 1.00 0.00 C ATOM 7 SD MET A 1 -15.633 -1.491 2.910 1.00 0.00 S ATOM 8 CE MET A 1 -16.230 -0.033 2.059 1.00 0.00 C ATOM 0 H1 MET A 1 -13.925 -4.085 4.866 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.991 -2.681 5.065 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.507 -2.591 4.306 1.00 0.00 H new ATOM 0 HA MET A 1 -12.416 -4.326 3.203 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.600 -4.087 1.167 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.831 -4.311 2.395 1.00 0.00 H new ATOM 0 HG2 MET A 1 -14.013 -1.659 1.157 1.00 0.00 H new ATOM 0 HG3 MET A 1 -15.464 -2.566 0.779 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.851 0.554 2.735 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.383 0.569 1.730 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.820 -0.333 1.193 1.00 0.00 H new ATOM 20 N ILE A 2 -11.211 -2.473 1.822 1.00 0.00 N ATOM 21 CA ILE A 2 -10.344 -1.413 1.347 1.00 0.00 C ATOM 22 C ILE A 2 -10.871 -0.854 0.031 1.00 0.00 C ATOM 23 O ILE A 2 -11.235 -1.602 -0.879 1.00 0.00 O ATOM 24 CB ILE A 2 -8.879 -1.889 1.187 1.00 0.00 C ATOM 25 CG1 ILE A 2 -8.010 -0.757 0.638 1.00 0.00 C ATOM 26 CG2 ILE A 2 -8.798 -3.117 0.292 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.541 -1.101 0.549 1.00 0.00 C ATOM 0 H ILE A 2 -11.061 -3.377 1.374 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.346 -0.623 2.098 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.501 -2.169 2.170 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.370 -0.484 -0.354 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.130 0.121 1.273 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -7.758 -3.430 0.197 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.382 -3.926 0.731 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -9.196 -2.876 -0.694 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -5.991 -0.248 0.151 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.164 -1.345 1.542 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.407 -1.959 -0.110 1.00 0.00 H new ATOM 39 N THR A 3 -10.949 0.462 -0.049 1.00 0.00 N ATOM 40 CA THR A 3 -11.487 1.118 -1.222 1.00 0.00 C ATOM 41 C THR A 3 -10.479 2.095 -1.818 1.00 0.00 C ATOM 42 O THR A 3 -9.938 2.959 -1.119 1.00 0.00 O ATOM 43 CB THR A 3 -12.785 1.866 -0.870 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.652 1.006 -0.119 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.499 2.335 -2.125 1.00 0.00 C ATOM 0 H THR A 3 -10.645 1.098 0.688 1.00 0.00 H new ATOM 0 HA THR A 3 -11.703 0.348 -1.963 1.00 0.00 H new ATOM 0 HB THR A 3 -12.525 2.740 -0.272 1.00 0.00 H new ATOM 0 HG1 THR A 3 -14.570 1.344 -0.167 1.00 0.00 H new ATOM 0 HG21 THR A 3 -14.413 2.861 -1.849 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.848 3.008 -2.684 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.749 1.474 -2.745 1.00 0.00 H new ATOM 53 N LEU A 4 -10.222 1.943 -3.106 1.00 0.00 N ATOM 54 CA LEU A 4 -9.353 2.853 -3.827 1.00 0.00 C ATOM 55 C LEU A 4 -9.814 2.971 -5.268 1.00 0.00 C ATOM 56 O LEU A 4 -10.621 2.172 -5.739 1.00 0.00 O ATOM 57 CB LEU A 4 -7.884 2.418 -3.740 1.00 0.00 C ATOM 58 CG LEU A 4 -7.573 0.979 -4.162 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.266 0.905 -5.647 1.00 0.00 C ATOM 60 CD2 LEU A 4 -6.412 0.427 -3.350 1.00 0.00 C ATOM 0 H LEU A 4 -10.607 1.191 -3.677 1.00 0.00 H new ATOM 0 HA LEU A 4 -9.417 3.836 -3.360 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.291 3.091 -4.359 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.548 2.552 -2.712 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.455 0.369 -3.967 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.048 -0.127 -5.923 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.127 1.258 -6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.402 1.530 -5.872 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.204 -0.596 -3.662 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.528 1.043 -3.514 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.671 0.438 -2.291 1.00 0.00 H new ATOM 72 N THR A 5 -9.321 3.976 -5.957 1.00 0.00 N ATOM 73 CA THR A 5 -9.791 4.263 -7.298 1.00 0.00 C ATOM 74 C THR A 5 -8.849 3.674 -8.340 1.00 0.00 C ATOM 75 O THR A 5 -7.759 3.199 -8.004 1.00 0.00 O ATOM 76 CB THR A 5 -9.918 5.780 -7.518 1.00 0.00 C ATOM 77 OG1 THR A 5 -8.621 6.388 -7.545 1.00 0.00 O ATOM 78 CG2 THR A 5 -10.734 6.402 -6.399 1.00 0.00 C ATOM 0 H THR A 5 -8.597 4.608 -5.614 1.00 0.00 H new ATOM 0 HA THR A 5 -10.773 3.804 -7.410 1.00 0.00 H new ATOM 0 HB THR A 5 -10.417 5.949 -8.472 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.715 7.353 -7.687 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.818 7.476 -6.564 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.729 5.958 -6.384 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.241 6.219 -5.444 1.00 0.00 H new ATOM 86 N LYS A 6 -9.277 3.699 -9.599 1.00 0.00 N ATOM 87 CA LYS A 6 -8.434 3.261 -10.704 1.00 0.00 C ATOM 88 C LYS A 6 -7.113 4.019 -10.702 1.00 0.00 C ATOM 89 O LYS A 6 -6.055 3.433 -10.898 1.00 0.00 O ATOM 90 CB LYS A 6 -9.153 3.475 -12.037 1.00 0.00 C ATOM 91 CG LYS A 6 -10.191 2.413 -12.355 1.00 0.00 C ATOM 92 CD LYS A 6 -9.534 1.081 -12.681 1.00 0.00 C ATOM 93 CE LYS A 6 -10.562 0.024 -13.049 1.00 0.00 C ATOM 94 NZ LYS A 6 -9.927 -1.251 -13.474 1.00 0.00 N ATOM 0 H LYS A 6 -10.204 4.019 -9.878 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.229 2.198 -10.577 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.638 4.451 -12.024 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.414 3.497 -12.838 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.863 2.292 -11.505 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -10.800 2.737 -13.199 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -8.835 1.212 -13.507 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.954 0.742 -11.823 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -11.211 -0.163 -12.194 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -11.195 0.399 -13.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -10.665 -1.943 -13.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -9.327 -1.080 -14.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -9.344 -1.624 -12.698 1.00 0.00 H new ATOM 108 N LYS A 7 -7.195 5.319 -10.450 1.00 0.00 N ATOM 109 CA LYS A 7 -6.035 6.192 -10.423 1.00 0.00 C ATOM 110 C LYS A 7 -5.030 5.732 -9.363 1.00 0.00 C ATOM 111 O LYS A 7 -3.832 5.655 -9.628 1.00 0.00 O ATOM 112 CB LYS A 7 -6.518 7.613 -10.132 1.00 0.00 C ATOM 113 CG LYS A 7 -5.618 8.718 -10.642 1.00 0.00 C ATOM 114 CD LYS A 7 -4.324 8.825 -9.854 1.00 0.00 C ATOM 115 CE LYS A 7 -3.721 10.212 -9.978 1.00 0.00 C ATOM 116 NZ LYS A 7 -4.556 11.234 -9.288 1.00 0.00 N ATOM 0 H LYS A 7 -8.075 5.798 -10.258 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.524 6.161 -11.385 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.507 7.740 -10.572 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.631 7.727 -9.054 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -5.386 8.538 -11.692 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -6.150 9.668 -10.591 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -4.514 8.600 -8.804 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -3.612 8.082 -10.215 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -2.718 10.213 -9.552 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -3.621 10.473 -11.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -3.961 12.043 -9.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -5.309 11.557 -9.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -4.981 10.817 -8.435 1.00 0.00 H new ATOM 130 N GLN A 8 -5.525 5.418 -8.169 1.00 0.00 N ATOM 131 CA GLN A 8 -4.665 4.959 -7.078 1.00 0.00 C ATOM 132 C GLN A 8 -3.987 3.651 -7.470 1.00 0.00 C ATOM 133 O GLN A 8 -2.796 3.455 -7.217 1.00 0.00 O ATOM 134 CB GLN A 8 -5.480 4.743 -5.798 1.00 0.00 C ATOM 135 CG GLN A 8 -6.444 5.875 -5.470 1.00 0.00 C ATOM 136 CD GLN A 8 -5.759 7.211 -5.274 1.00 0.00 C ATOM 137 OE1 GLN A 8 -5.565 7.968 -6.223 1.00 0.00 O ATOM 138 NE2 GLN A 8 -5.417 7.521 -4.037 1.00 0.00 N ATOM 0 H GLN A 8 -6.515 5.472 -7.931 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.912 5.724 -6.891 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -6.046 3.816 -5.894 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.793 4.613 -4.962 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -7.175 5.964 -6.274 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.996 5.622 -4.565 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -5.596 6.863 -3.278 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -4.974 8.418 -3.840 1.00 0.00 H new ATOM 147 N MET A 9 -4.754 2.764 -8.095 1.00 0.00 N ATOM 148 CA MET A 9 -4.220 1.500 -8.586 1.00 0.00 C ATOM 149 C MET A 9 -3.155 1.760 -9.645 1.00 0.00 C ATOM 150 O MET A 9 -2.083 1.168 -9.609 1.00 0.00 O ATOM 151 CB MET A 9 -5.343 0.630 -9.159 1.00 0.00 C ATOM 152 CG MET A 9 -4.869 -0.712 -9.700 1.00 0.00 C ATOM 153 SD MET A 9 -4.143 -1.772 -8.429 1.00 0.00 S ATOM 154 CE MET A 9 -5.555 -2.050 -7.362 1.00 0.00 C ATOM 0 H MET A 9 -5.749 2.898 -8.273 1.00 0.00 H new ATOM 0 HA MET A 9 -3.764 0.965 -7.753 1.00 0.00 H new ATOM 0 HB2 MET A 9 -6.086 0.455 -8.381 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.841 1.178 -9.959 1.00 0.00 H new ATOM 0 HG2 MET A 9 -5.711 -1.230 -10.159 1.00 0.00 H new ATOM 0 HG3 MET A 9 -4.133 -0.541 -10.486 1.00 0.00 H new ATOM 0 HE1 MET A 9 -5.391 -1.554 -6.405 1.00 0.00 H new ATOM 0 HE2 MET A 9 -6.451 -1.645 -7.832 1.00 0.00 H new ATOM 0 HE3 MET A 9 -5.683 -3.120 -7.199 1.00 0.00 H new ATOM 164 N GLU A 10 -3.455 2.669 -10.567 1.00 0.00 N ATOM 165 CA GLU A 10 -2.530 3.065 -11.613 1.00 0.00 C ATOM 166 C GLU A 10 -1.242 3.635 -11.023 1.00 0.00 C ATOM 167 O GLU A 10 -0.145 3.313 -11.478 1.00 0.00 O ATOM 168 CB GLU A 10 -3.211 4.104 -12.500 1.00 0.00 C ATOM 169 CG GLU A 10 -4.277 3.527 -13.419 1.00 0.00 C ATOM 170 CD GLU A 10 -3.713 2.599 -14.473 1.00 0.00 C ATOM 171 OE1 GLU A 10 -3.349 3.087 -15.565 1.00 0.00 O ATOM 172 OE2 GLU A 10 -3.654 1.375 -14.230 1.00 0.00 O ATOM 0 H GLU A 10 -4.353 3.152 -10.606 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.261 2.189 -12.203 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.665 4.866 -11.867 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.454 4.602 -13.106 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.009 2.985 -12.821 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.807 4.344 -13.909 1.00 0.00 H new ATOM 179 N GLU A 11 -1.386 4.477 -10.007 1.00 0.00 N ATOM 180 CA GLU A 11 -0.249 5.067 -9.320 1.00 0.00 C ATOM 181 C GLU A 11 0.649 3.993 -8.708 1.00 0.00 C ATOM 182 O GLU A 11 1.878 4.063 -8.816 1.00 0.00 O ATOM 183 CB GLU A 11 -0.743 6.053 -8.255 1.00 0.00 C ATOM 184 CG GLU A 11 -0.756 7.499 -8.734 1.00 0.00 C ATOM 185 CD GLU A 11 -0.918 8.504 -7.607 1.00 0.00 C ATOM 186 OE1 GLU A 11 0.104 8.902 -7.009 1.00 0.00 O ATOM 187 OE2 GLU A 11 -2.058 8.932 -7.335 1.00 0.00 O ATOM 0 H GLU A 11 -2.292 4.768 -9.639 1.00 0.00 H new ATOM 0 HA GLU A 11 0.354 5.611 -10.047 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.750 5.770 -7.947 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.106 5.975 -7.374 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.173 7.707 -9.266 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.569 7.631 -9.448 1.00 0.00 H new ATOM 194 N MET A 12 0.038 2.994 -8.085 1.00 0.00 N ATOM 195 CA MET A 12 0.788 1.880 -7.519 1.00 0.00 C ATOM 196 C MET A 12 1.370 1.000 -8.624 1.00 0.00 C ATOM 197 O MET A 12 2.552 0.666 -8.604 1.00 0.00 O ATOM 198 CB MET A 12 -0.103 1.047 -6.591 1.00 0.00 C ATOM 199 CG MET A 12 -0.571 1.799 -5.354 1.00 0.00 C ATOM 200 SD MET A 12 -1.556 0.777 -4.242 1.00 0.00 S ATOM 201 CE MET A 12 -2.930 0.346 -5.305 1.00 0.00 C ATOM 0 H MET A 12 -0.972 2.932 -7.959 1.00 0.00 H new ATOM 0 HA MET A 12 1.613 2.289 -6.935 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.975 0.706 -7.149 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.444 0.157 -6.279 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.297 2.179 -4.816 1.00 0.00 H new ATOM 0 HG3 MET A 12 -1.159 2.664 -5.662 1.00 0.00 H new ATOM 0 HE1 MET A 12 -3.687 -0.181 -4.725 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.362 1.253 -5.727 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.578 -0.297 -6.112 1.00 0.00 H new ATOM 211 N LEU A 13 0.533 0.656 -9.599 1.00 0.00 N ATOM 212 CA LEU A 13 0.927 -0.215 -10.704 1.00 0.00 C ATOM 213 C LEU A 13 2.108 0.352 -11.484 1.00 0.00 C ATOM 214 O LEU A 13 3.035 -0.379 -11.831 1.00 0.00 O ATOM 215 CB LEU A 13 -0.252 -0.441 -11.652 1.00 0.00 C ATOM 216 CG LEU A 13 -1.332 -1.396 -11.138 1.00 0.00 C ATOM 217 CD1 LEU A 13 -2.416 -1.590 -12.188 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.722 -2.734 -10.747 1.00 0.00 C ATOM 0 H LEU A 13 -0.436 0.972 -9.646 1.00 0.00 H new ATOM 0 HA LEU A 13 1.235 -1.166 -10.269 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.714 0.523 -11.866 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.132 -0.827 -12.596 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.787 -0.954 -10.251 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.175 -2.272 -11.805 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.875 -0.629 -12.419 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.975 -2.009 -13.093 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.506 -3.399 -10.384 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.240 -3.182 -11.616 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.017 -2.581 -9.960 1.00 0.00 H new ATOM 230 N ALA A 14 2.071 1.649 -11.768 1.00 0.00 N ATOM 231 CA ALA A 14 3.149 2.292 -12.508 1.00 0.00 C ATOM 232 C ALA A 14 4.458 2.202 -11.738 1.00 0.00 C ATOM 233 O ALA A 14 5.495 1.855 -12.303 1.00 0.00 O ATOM 234 CB ALA A 14 2.801 3.740 -12.810 1.00 0.00 C ATOM 0 H ALA A 14 1.310 2.273 -11.498 1.00 0.00 H new ATOM 0 HA ALA A 14 3.275 1.767 -13.455 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.618 4.203 -13.363 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.891 3.778 -13.408 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.644 4.279 -11.876 1.00 0.00 H new ATOM 240 N HIS A 15 4.400 2.491 -10.444 1.00 0.00 N ATOM 241 CA HIS A 15 5.586 2.405 -9.597 1.00 0.00 C ATOM 242 C HIS A 15 6.055 0.956 -9.498 1.00 0.00 C ATOM 243 O HIS A 15 7.253 0.686 -9.468 1.00 0.00 O ATOM 244 CB HIS A 15 5.298 2.956 -8.199 1.00 0.00 C ATOM 245 CG HIS A 15 6.538 3.287 -7.419 1.00 0.00 C ATOM 246 ND1 HIS A 15 7.141 4.522 -7.464 1.00 0.00 N ATOM 247 CD2 HIS A 15 7.277 2.544 -6.559 1.00 0.00 C ATOM 248 CE1 HIS A 15 8.195 4.530 -6.671 1.00 0.00 C ATOM 249 NE2 HIS A 15 8.303 3.342 -6.106 1.00 0.00 N ATOM 0 H HIS A 15 3.552 2.785 -9.960 1.00 0.00 H new ATOM 0 HA HIS A 15 6.374 3.007 -10.050 1.00 0.00 H new ATOM 0 HB2 HIS A 15 4.685 3.853 -8.290 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.712 2.224 -7.642 1.00 0.00 H new ATOM 0 HD2 HIS A 15 7.095 1.516 -6.281 1.00 0.00 H new ATOM 0 HE1 HIS A 15 8.858 5.367 -6.511 1.00 0.00 H new ATOM 0 HE2 HIS A 15 9.026 3.062 -5.444 1.00 0.00 H new ATOM 258 N ALA A 16 5.099 0.032 -9.452 1.00 0.00 N ATOM 259 CA ALA A 16 5.403 -1.390 -9.403 1.00 0.00 C ATOM 260 C ALA A 16 6.169 -1.820 -10.645 1.00 0.00 C ATOM 261 O ALA A 16 7.240 -2.411 -10.550 1.00 0.00 O ATOM 262 CB ALA A 16 4.126 -2.206 -9.266 1.00 0.00 C ATOM 0 H ALA A 16 4.102 0.247 -9.448 1.00 0.00 H new ATOM 0 HA ALA A 16 6.029 -1.572 -8.529 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.374 -3.267 -9.231 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.610 -1.923 -8.348 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.477 -2.013 -10.121 1.00 0.00 H new ATOM 268 N ARG A 17 5.627 -1.490 -11.810 1.00 0.00 N ATOM 269 CA ARG A 17 6.255 -1.844 -13.078 1.00 0.00 C ATOM 270 C ARG A 17 7.632 -1.208 -13.212 1.00 0.00 C ATOM 271 O ARG A 17 8.543 -1.800 -13.785 1.00 0.00 O ATOM 272 CB ARG A 17 5.368 -1.421 -14.246 1.00 0.00 C ATOM 273 CG ARG A 17 4.131 -2.288 -14.422 1.00 0.00 C ATOM 274 CD ARG A 17 4.454 -3.626 -15.078 1.00 0.00 C ATOM 275 NE ARG A 17 5.285 -4.489 -14.241 1.00 0.00 N ATOM 276 CZ ARG A 17 5.733 -5.685 -14.626 1.00 0.00 C ATOM 277 NH1 ARG A 17 5.454 -6.143 -15.841 1.00 0.00 N ATOM 278 NH2 ARG A 17 6.474 -6.415 -13.801 1.00 0.00 N ATOM 0 H ARG A 17 4.751 -0.976 -11.904 1.00 0.00 H new ATOM 0 HA ARG A 17 6.379 -2.927 -13.097 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.057 -0.387 -14.098 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.954 -1.450 -15.164 1.00 0.00 H new ATOM 0 HG2 ARG A 17 3.671 -2.464 -13.449 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.399 -1.755 -15.029 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.523 -4.143 -15.312 1.00 0.00 H new ATOM 0 HD3 ARG A 17 4.965 -3.446 -16.024 1.00 0.00 H new ATOM 0 HE ARG A 17 5.537 -4.158 -13.310 1.00 0.00 H new ATOM 0 HH11 ARG A 17 4.896 -5.580 -16.483 1.00 0.00 H new ATOM 0 HH12 ARG A 17 5.798 -7.058 -16.133 1.00 0.00 H new ATOM 0 HH21 ARG A 17 6.701 -6.061 -12.872 1.00 0.00 H new ATOM 0 HH22 ARG A 17 6.816 -7.329 -14.097 1.00 0.00 H new ATOM 292 N GLN A 18 7.775 -0.003 -12.676 1.00 0.00 N ATOM 293 CA GLN A 18 9.021 0.725 -12.729 1.00 0.00 C ATOM 294 C GLN A 18 10.085 0.141 -11.797 1.00 0.00 C ATOM 295 O GLN A 18 11.281 0.310 -12.034 1.00 0.00 O ATOM 296 CB GLN A 18 8.755 2.172 -12.358 1.00 0.00 C ATOM 297 CG GLN A 18 8.187 3.006 -13.495 1.00 0.00 C ATOM 298 CD GLN A 18 8.072 4.476 -13.142 1.00 0.00 C ATOM 299 OE1 GLN A 18 9.001 4.972 -12.337 1.00 0.00 O flip ATOM 300 NE2 GLN A 18 7.168 5.169 -13.611 1.00 0.00 N flip ATOM 0 H GLN A 18 7.025 0.492 -12.193 1.00 0.00 H new ATOM 0 HA GLN A 18 9.412 0.648 -13.744 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.060 2.200 -11.518 1.00 0.00 H new ATOM 0 HB3 GLN A 18 9.685 2.626 -12.017 1.00 0.00 H new ATOM 0 HG2 GLN A 18 8.823 2.896 -14.373 1.00 0.00 H new ATOM 0 HG3 GLN A 18 7.203 2.623 -13.764 1.00 0.00 H new ATOM 0 HE21 GLN A 18 6.471 4.750 -14.227 1.00 0.00 H new ATOM 0 HE22 GLN A 18 7.116 6.162 -13.383 1.00 0.00 H new ATOM 309 N ALA A 19 9.653 -0.523 -10.733 1.00 0.00 N ATOM 310 CA ALA A 19 10.583 -1.045 -9.736 1.00 0.00 C ATOM 311 C ALA A 19 10.852 -2.535 -9.931 1.00 0.00 C ATOM 312 O ALA A 19 11.912 -3.043 -9.554 1.00 0.00 O ATOM 313 CB ALA A 19 10.055 -0.773 -8.338 1.00 0.00 C ATOM 0 H ALA A 19 8.670 -0.713 -10.537 1.00 0.00 H new ATOM 0 HA ALA A 19 11.534 -0.528 -9.865 1.00 0.00 H new ATOM 0 HB1 ALA A 19 10.756 -1.166 -7.602 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.942 0.302 -8.194 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.087 -1.259 -8.214 1.00 0.00 H new ATOM 319 N LEU A 20 9.890 -3.239 -10.508 1.00 0.00 N ATOM 320 CA LEU A 20 10.055 -4.649 -10.809 1.00 0.00 C ATOM 321 C LEU A 20 11.096 -4.830 -11.915 1.00 0.00 C ATOM 322 O LEU A 20 11.356 -3.901 -12.676 1.00 0.00 O ATOM 323 CB LEU A 20 8.711 -5.262 -11.206 1.00 0.00 C ATOM 324 CG LEU A 20 7.672 -5.302 -10.082 1.00 0.00 C ATOM 325 CD1 LEU A 20 6.417 -6.025 -10.534 1.00 0.00 C ATOM 326 CD2 LEU A 20 8.250 -5.961 -8.840 1.00 0.00 C ATOM 0 H LEU A 20 8.985 -2.853 -10.777 1.00 0.00 H new ATOM 0 HA LEU A 20 10.413 -5.168 -9.920 1.00 0.00 H new ATOM 0 HB2 LEU A 20 8.301 -4.695 -12.042 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.881 -6.278 -11.562 1.00 0.00 H new ATOM 0 HG LEU A 20 7.403 -4.276 -9.832 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.693 -6.041 -9.719 1.00 0.00 H new ATOM 0 HD12 LEU A 20 5.987 -5.507 -11.391 1.00 0.00 H new ATOM 0 HD13 LEU A 20 6.668 -7.047 -10.817 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.496 -5.979 -8.053 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.552 -6.981 -9.077 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.117 -5.396 -8.498 1.00 0.00 H new ATOM 338 N PRO A 21 11.701 -6.024 -12.038 1.00 0.00 N ATOM 339 CA PRO A 21 11.346 -7.208 -11.255 1.00 0.00 C ATOM 340 C PRO A 21 12.080 -7.311 -9.915 1.00 0.00 C ATOM 341 O PRO A 21 12.437 -8.404 -9.481 1.00 0.00 O ATOM 342 CB PRO A 21 11.767 -8.343 -12.185 1.00 0.00 C ATOM 343 CG PRO A 21 12.955 -7.813 -12.919 1.00 0.00 C ATOM 344 CD PRO A 21 12.799 -6.313 -12.980 1.00 0.00 C ATOM 0 HA PRO A 21 10.294 -7.206 -10.971 1.00 0.00 H new ATOM 0 HB2 PRO A 21 12.018 -9.243 -11.623 1.00 0.00 H new ATOM 0 HB3 PRO A 21 10.964 -8.610 -12.872 1.00 0.00 H new ATOM 0 HG2 PRO A 21 13.878 -8.085 -12.407 1.00 0.00 H new ATOM 0 HG3 PRO A 21 13.010 -8.237 -13.922 1.00 0.00 H new ATOM 0 HD2 PRO A 21 13.718 -5.805 -12.688 1.00 0.00 H new ATOM 0 HD3 PRO A 21 12.557 -5.979 -13.989 1.00 0.00 H new ATOM 352 N ASN A 22 12.308 -6.184 -9.257 1.00 0.00 N ATOM 353 CA ASN A 22 12.856 -6.214 -7.909 1.00 0.00 C ATOM 354 C ASN A 22 11.721 -6.231 -6.891 1.00 0.00 C ATOM 355 O ASN A 22 11.255 -7.296 -6.495 1.00 0.00 O ATOM 356 CB ASN A 22 13.787 -5.018 -7.663 1.00 0.00 C ATOM 357 CG ASN A 22 14.907 -4.935 -8.681 1.00 0.00 C ATOM 358 OD1 ASN A 22 15.950 -5.568 -8.526 1.00 0.00 O ATOM 359 ND2 ASN A 22 14.702 -4.143 -9.722 1.00 0.00 N ATOM 0 H ASN A 22 12.126 -5.251 -9.627 1.00 0.00 H new ATOM 0 HA ASN A 22 13.449 -7.122 -7.796 1.00 0.00 H new ATOM 0 HB2 ASN A 22 13.205 -4.097 -7.692 1.00 0.00 H new ATOM 0 HB3 ASN A 22 14.214 -5.094 -6.663 1.00 0.00 H new ATOM 0 HD21 ASN A 22 15.425 -4.040 -10.435 1.00 0.00 H new ATOM 0 HD22 ASN A 22 13.821 -3.636 -9.811 1.00 0.00 H new ATOM 366 N GLU A 23 11.241 -5.050 -6.536 1.00 0.00 N ATOM 367 CA GLU A 23 10.150 -4.893 -5.581 1.00 0.00 C ATOM 368 C GLU A 23 9.746 -3.427 -5.558 1.00 0.00 C ATOM 369 O GLU A 23 10.582 -2.548 -5.786 1.00 0.00 O ATOM 370 CB GLU A 23 10.576 -5.348 -4.176 1.00 0.00 C ATOM 371 CG GLU A 23 9.662 -6.399 -3.547 1.00 0.00 C ATOM 372 CD GLU A 23 8.301 -5.860 -3.127 1.00 0.00 C ATOM 373 OE1 GLU A 23 8.131 -4.621 -3.071 1.00 0.00 O ATOM 374 OE2 GLU A 23 7.394 -6.677 -2.842 1.00 0.00 O ATOM 0 H GLU A 23 11.597 -4.167 -6.903 1.00 0.00 H new ATOM 0 HA GLU A 23 9.308 -5.514 -5.885 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.588 -5.749 -4.229 1.00 0.00 H new ATOM 0 HB3 GLU A 23 10.612 -4.477 -3.521 1.00 0.00 H new ATOM 0 HG2 GLU A 23 9.516 -7.212 -4.258 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.159 -6.823 -2.675 1.00 0.00 H new ATOM 381 N ALA A 24 8.484 -3.163 -5.293 1.00 0.00 N ATOM 382 CA ALA A 24 7.977 -1.805 -5.293 1.00 0.00 C ATOM 383 C ALA A 24 7.221 -1.528 -4.011 1.00 0.00 C ATOM 384 O ALA A 24 6.096 -1.989 -3.830 1.00 0.00 O ATOM 385 CB ALA A 24 7.085 -1.563 -6.497 1.00 0.00 C ATOM 0 H ALA A 24 7.786 -3.874 -5.074 1.00 0.00 H new ATOM 0 HA ALA A 24 8.824 -1.122 -5.355 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.716 -0.538 -6.476 1.00 0.00 H new ATOM 0 HB2 ALA A 24 7.656 -1.725 -7.411 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.241 -2.253 -6.469 1.00 0.00 H new ATOM 391 N CYS A 25 7.840 -0.764 -3.130 1.00 0.00 N ATOM 392 CA CYS A 25 7.262 -0.493 -1.831 1.00 0.00 C ATOM 393 C CYS A 25 6.936 0.988 -1.685 1.00 0.00 C ATOM 394 O CYS A 25 7.366 1.819 -2.489 1.00 0.00 O ATOM 395 CB CYS A 25 8.228 -0.925 -0.726 1.00 0.00 C ATOM 396 SG CYS A 25 8.723 -2.662 -0.801 1.00 0.00 S ATOM 0 H CYS A 25 8.744 -0.321 -3.293 1.00 0.00 H new ATOM 0 HA CYS A 25 6.337 -1.062 -1.741 1.00 0.00 H new ATOM 0 HB2 CYS A 25 9.122 -0.303 -0.778 1.00 0.00 H new ATOM 0 HB3 CYS A 25 7.763 -0.734 0.241 1.00 0.00 H new ATOM 0 HG CYS A 25 8.316 -3.181 -1.921 1.00 0.00 H new ATOM 402 N GLY A 26 6.166 1.301 -0.662 1.00 0.00 N ATOM 403 CA GLY A 26 5.786 2.667 -0.387 1.00 0.00 C ATOM 404 C GLY A 26 4.793 2.720 0.742 1.00 0.00 C ATOM 405 O GLY A 26 4.595 1.715 1.428 1.00 0.00 O ATOM 0 H GLY A 26 5.790 0.619 -0.004 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.669 3.252 -0.130 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.354 3.118 -1.281 1.00 0.00 H new ATOM 409 N LEU A 27 4.148 3.856 0.933 1.00 0.00 N ATOM 410 CA LEU A 27 3.176 3.986 2.002 1.00 0.00 C ATOM 411 C LEU A 27 1.828 4.420 1.453 1.00 0.00 C ATOM 412 O LEU A 27 1.745 5.071 0.409 1.00 0.00 O ATOM 413 CB LEU A 27 3.663 4.988 3.052 1.00 0.00 C ATOM 414 CG LEU A 27 4.921 4.572 3.816 1.00 0.00 C ATOM 415 CD1 LEU A 27 5.338 5.670 4.778 1.00 0.00 C ATOM 416 CD2 LEU A 27 4.686 3.271 4.569 1.00 0.00 C ATOM 0 H LEU A 27 4.278 4.695 0.367 1.00 0.00 H new ATOM 0 HA LEU A 27 3.061 3.011 2.475 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.855 5.941 2.560 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.860 5.156 3.770 1.00 0.00 H new ATOM 0 HG LEU A 27 5.724 4.412 3.097 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.235 5.362 5.316 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.546 6.583 4.220 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.534 5.855 5.490 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.593 2.992 5.106 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.870 3.404 5.279 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.426 2.483 3.862 1.00 0.00 H new ATOM 428 N LEU A 28 0.777 4.054 2.163 1.00 0.00 N ATOM 429 CA LEU A 28 -0.573 4.392 1.764 1.00 0.00 C ATOM 430 C LEU A 28 -1.297 5.080 2.905 1.00 0.00 C ATOM 431 O LEU A 28 -1.355 4.557 4.024 1.00 0.00 O ATOM 432 CB LEU A 28 -1.335 3.136 1.346 1.00 0.00 C ATOM 433 CG LEU A 28 -0.831 2.465 0.070 1.00 0.00 C ATOM 434 CD1 LEU A 28 -1.587 1.175 -0.182 1.00 0.00 C ATOM 435 CD2 LEU A 28 -0.980 3.400 -1.117 1.00 0.00 C ATOM 0 H LEU A 28 0.836 3.517 3.028 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.524 5.071 0.913 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.287 2.413 2.161 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.385 3.395 1.211 1.00 0.00 H new ATOM 0 HG LEU A 28 0.226 2.232 0.198 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.216 0.709 -1.095 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.439 0.496 0.658 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.650 1.391 -0.291 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.616 2.906 -2.018 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.031 3.660 -1.245 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.400 4.306 -0.941 1.00 0.00 H new ATOM 447 N GLY A 29 -1.851 6.244 2.621 1.00 0.00 N ATOM 448 CA GLY A 29 -2.523 7.001 3.645 1.00 0.00 C ATOM 449 C GLY A 29 -3.905 7.435 3.229 1.00 0.00 C ATOM 450 O GLY A 29 -4.315 7.245 2.077 1.00 0.00 O ATOM 0 H GLY A 29 -1.846 6.677 1.698 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.592 6.399 4.551 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.928 7.881 3.891 1.00 0.00 H new ATOM 454 N GLY A 30 -4.620 8.010 4.171 1.00 0.00 N ATOM 455 CA GLY A 30 -5.962 8.467 3.922 1.00 0.00 C ATOM 456 C GLY A 30 -6.794 8.409 5.177 1.00 0.00 C ATOM 457 O GLY A 30 -6.354 8.855 6.240 1.00 0.00 O ATOM 0 H GLY A 30 -4.288 8.171 5.122 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.938 9.489 3.545 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.422 7.852 3.148 1.00 0.00 H new ATOM 461 N ARG A 31 -7.977 7.837 5.069 1.00 0.00 N ATOM 462 CA ARG A 31 -8.871 7.730 6.203 1.00 0.00 C ATOM 463 C ARG A 31 -9.301 6.289 6.418 1.00 0.00 C ATOM 464 O ARG A 31 -9.517 5.537 5.466 1.00 0.00 O ATOM 465 CB ARG A 31 -10.089 8.628 6.002 1.00 0.00 C ATOM 466 CG ARG A 31 -9.772 10.105 6.159 1.00 0.00 C ATOM 467 CD ARG A 31 -10.942 10.982 5.749 1.00 0.00 C ATOM 468 NE ARG A 31 -10.710 12.387 6.085 1.00 0.00 N ATOM 469 CZ ARG A 31 -10.468 13.344 5.187 1.00 0.00 C ATOM 470 NH1 ARG A 31 -10.329 13.037 3.901 1.00 0.00 N ATOM 471 NH2 ARG A 31 -10.323 14.604 5.587 1.00 0.00 N ATOM 0 H ARG A 31 -8.342 7.438 4.204 1.00 0.00 H new ATOM 0 HA ARG A 31 -8.337 8.060 7.094 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -10.501 8.454 5.008 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.861 8.350 6.720 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -9.509 10.312 7.197 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -8.901 10.356 5.554 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -11.109 10.887 4.676 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -11.848 10.634 6.245 1.00 0.00 H new ATOM 0 HE ARG A 31 -10.735 12.652 7.070 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -10.407 12.067 3.597 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -10.144 13.772 3.218 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -10.397 14.836 6.577 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -10.138 15.338 4.903 1.00 0.00 H new ATOM 485 N ARG A 32 -9.390 5.908 7.677 1.00 0.00 N ATOM 486 CA ARG A 32 -9.840 4.583 8.056 1.00 0.00 C ATOM 487 C ARG A 32 -10.892 4.720 9.138 1.00 0.00 C ATOM 488 O ARG A 32 -10.633 5.300 10.193 1.00 0.00 O ATOM 489 CB ARG A 32 -8.666 3.737 8.558 1.00 0.00 C ATOM 490 CG ARG A 32 -9.052 2.339 9.011 1.00 0.00 C ATOM 491 CD ARG A 32 -7.839 1.546 9.466 1.00 0.00 C ATOM 492 NE ARG A 32 -8.210 0.217 9.955 1.00 0.00 N ATOM 493 CZ ARG A 32 -7.336 -0.743 10.266 1.00 0.00 C ATOM 494 NH1 ARG A 32 -6.031 -0.535 10.130 1.00 0.00 N ATOM 495 NH2 ARG A 32 -7.770 -1.914 10.715 1.00 0.00 N ATOM 0 H ARG A 32 -9.152 6.508 8.467 1.00 0.00 H new ATOM 0 HA ARG A 32 -10.266 4.080 7.188 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -7.925 3.657 7.763 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -8.188 4.256 9.388 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -9.771 2.406 9.827 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -9.545 1.814 8.193 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -7.139 1.446 8.637 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -7.323 2.093 10.255 1.00 0.00 H new ATOM 0 HE ARG A 32 -9.203 0.011 10.066 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -5.691 0.363 9.786 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -5.369 -1.273 10.370 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -8.771 -2.080 10.822 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -7.103 -2.648 10.953 1.00 0.00 H new ATOM 509 N ASP A 33 -12.071 4.186 8.881 1.00 0.00 N ATOM 510 CA ASP A 33 -13.197 4.369 9.798 1.00 0.00 C ATOM 511 C ASP A 33 -13.101 3.380 10.944 1.00 0.00 C ATOM 512 O ASP A 33 -13.858 3.432 11.912 1.00 0.00 O ATOM 513 CB ASP A 33 -14.522 4.199 9.057 1.00 0.00 C ATOM 514 CG ASP A 33 -15.693 4.769 9.829 1.00 0.00 C ATOM 515 OD1 ASP A 33 -15.873 6.007 9.803 1.00 0.00 O ATOM 516 OD2 ASP A 33 -16.443 3.990 10.456 1.00 0.00 O ATOM 0 H ASP A 33 -12.280 3.626 8.055 1.00 0.00 H new ATOM 0 HA ASP A 33 -13.157 5.380 10.203 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -14.457 4.690 8.086 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -14.696 3.140 8.868 1.00 0.00 H new ATOM 521 N GLY A 34 -12.123 2.507 10.831 1.00 0.00 N ATOM 522 CA GLY A 34 -11.934 1.450 11.791 1.00 0.00 C ATOM 523 C GLY A 34 -11.803 0.126 11.093 1.00 0.00 C ATOM 524 O GLY A 34 -10.720 -0.465 11.040 1.00 0.00 O ATOM 0 H GLY A 34 -11.441 2.513 10.073 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -11.041 1.645 12.385 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -12.777 1.422 12.482 1.00 0.00 H new ATOM 528 N ASP A 35 -12.902 -0.317 10.532 1.00 0.00 N ATOM 529 CA ASP A 35 -12.926 -1.534 9.741 1.00 0.00 C ATOM 530 C ASP A 35 -12.738 -1.189 8.270 1.00 0.00 C ATOM 531 O ASP A 35 -12.099 -1.929 7.522 1.00 0.00 O ATOM 532 CB ASP A 35 -14.246 -2.287 9.936 1.00 0.00 C ATOM 533 CG ASP A 35 -14.570 -2.542 11.396 1.00 0.00 C ATOM 534 OD1 ASP A 35 -13.951 -3.436 12.011 1.00 0.00 O ATOM 535 OD2 ASP A 35 -15.454 -1.845 11.940 1.00 0.00 O ATOM 0 H ASP A 35 -13.805 0.151 10.608 1.00 0.00 H new ATOM 0 HA ASP A 35 -12.113 -2.180 10.072 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -15.056 -1.714 9.484 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -14.197 -3.239 9.408 1.00 0.00 H new ATOM 540 N ASP A 36 -13.284 -0.045 7.862 1.00 0.00 N ATOM 541 CA ASP A 36 -13.169 0.390 6.472 1.00 0.00 C ATOM 542 C ASP A 36 -11.858 1.117 6.254 1.00 0.00 C ATOM 543 O ASP A 36 -11.388 1.864 7.113 1.00 0.00 O ATOM 544 CB ASP A 36 -14.317 1.300 6.037 1.00 0.00 C ATOM 545 CG ASP A 36 -15.687 0.740 6.366 1.00 0.00 C ATOM 546 OD1 ASP A 36 -16.030 -0.342 5.854 1.00 0.00 O ATOM 547 OD2 ASP A 36 -16.437 1.391 7.122 1.00 0.00 O ATOM 0 H ASP A 36 -13.805 0.591 8.466 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.210 -0.514 5.864 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.204 2.271 6.519 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -14.250 1.468 4.962 1.00 0.00 H new ATOM 552 N ARG A 37 -11.292 0.891 5.094 1.00 0.00 N ATOM 553 CA ARG A 37 -9.973 1.375 4.750 1.00 0.00 C ATOM 554 C ARG A 37 -10.015 2.102 3.408 1.00 0.00 C ATOM 555 O ARG A 37 -10.321 1.494 2.387 1.00 0.00 O ATOM 556 CB ARG A 37 -9.050 0.161 4.673 1.00 0.00 C ATOM 557 CG ARG A 37 -7.587 0.435 4.930 1.00 0.00 C ATOM 558 CD ARG A 37 -6.900 1.101 3.751 1.00 0.00 C ATOM 559 NE ARG A 37 -5.453 0.884 3.788 1.00 0.00 N ATOM 560 CZ ARG A 37 -4.550 1.723 3.284 1.00 0.00 C ATOM 561 NH1 ARG A 37 -4.931 2.884 2.757 1.00 0.00 N ATOM 562 NH2 ARG A 37 -3.260 1.406 3.332 1.00 0.00 N ATOM 0 H ARG A 37 -11.740 0.357 4.349 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.611 2.081 5.497 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -9.394 -0.581 5.394 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -9.149 -0.286 3.684 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -7.490 1.072 5.809 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -7.080 -0.503 5.158 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -7.306 0.705 2.820 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -7.110 2.171 3.761 1.00 0.00 H new ATOM 0 HE ARG A 37 -5.112 0.031 4.231 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -5.919 3.135 2.738 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -4.235 3.523 2.373 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -2.967 0.524 3.753 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -2.563 2.044 2.948 1.00 0.00 H new ATOM 576 N TRP A 38 -9.713 3.390 3.402 1.00 0.00 N ATOM 577 CA TRP A 38 -9.706 4.152 2.160 1.00 0.00 C ATOM 578 C TRP A 38 -8.289 4.546 1.762 1.00 0.00 C ATOM 579 O TRP A 38 -7.423 4.742 2.616 1.00 0.00 O ATOM 580 CB TRP A 38 -10.581 5.399 2.282 1.00 0.00 C ATOM 581 CG TRP A 38 -12.044 5.089 2.372 1.00 0.00 C ATOM 582 CD1 TRP A 38 -12.865 4.735 1.342 1.00 0.00 C ATOM 583 CD2 TRP A 38 -12.858 5.109 3.549 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.142 4.531 1.805 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.164 4.756 3.157 1.00 0.00 C ATOM 586 CE3 TRP A 38 -12.609 5.390 4.895 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -15.218 4.679 4.066 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -13.654 5.315 5.793 1.00 0.00 C ATOM 589 CH2 TRP A 38 -14.944 4.960 5.377 1.00 0.00 C ATOM 0 H TRP A 38 -9.471 3.928 4.234 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.116 3.511 1.380 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -10.280 5.960 3.167 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -10.405 6.043 1.421 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -12.556 4.630 0.312 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -14.943 4.257 1.236 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.617 5.661 5.226 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -16.214 4.408 3.748 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.474 5.534 6.835 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -15.739 4.907 6.106 1.00 0.00 H new ATOM 600 N VAL A 39 -8.053 4.622 0.462 1.00 0.00 N ATOM 601 CA VAL A 39 -6.777 5.079 -0.065 1.00 0.00 C ATOM 602 C VAL A 39 -6.971 6.393 -0.809 1.00 0.00 C ATOM 603 O VAL A 39 -7.296 6.398 -1.996 1.00 0.00 O ATOM 604 CB VAL A 39 -6.147 4.046 -1.025 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.752 4.483 -1.446 1.00 0.00 C ATOM 606 CG2 VAL A 39 -6.107 2.668 -0.383 1.00 0.00 C ATOM 0 H VAL A 39 -8.735 4.371 -0.253 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.102 5.215 0.780 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.770 3.988 -1.917 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.327 3.741 -2.122 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.810 5.446 -1.954 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.118 4.576 -0.564 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.660 1.956 -1.077 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.512 2.709 0.529 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.121 2.350 -0.141 1.00 0.00 H new ATOM 616 N GLU A 40 -6.792 7.504 -0.107 1.00 0.00 N ATOM 617 CA GLU A 40 -7.017 8.816 -0.701 1.00 0.00 C ATOM 618 C GLU A 40 -5.760 9.342 -1.386 1.00 0.00 C ATOM 619 O GLU A 40 -5.845 10.078 -2.369 1.00 0.00 O ATOM 620 CB GLU A 40 -7.515 9.818 0.345 1.00 0.00 C ATOM 621 CG GLU A 40 -8.891 9.476 0.895 1.00 0.00 C ATOM 622 CD GLU A 40 -9.520 10.616 1.672 1.00 0.00 C ATOM 623 OE1 GLU A 40 -10.099 11.525 1.039 1.00 0.00 O ATOM 624 OE2 GLU A 40 -9.460 10.602 2.917 1.00 0.00 O ATOM 0 H GLU A 40 -6.494 7.524 0.868 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.790 8.699 -1.460 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.802 9.859 1.168 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.546 10.813 -0.100 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.548 9.201 0.070 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.810 8.603 1.543 1.00 0.00 H new ATOM 631 N ARG A 41 -4.593 8.960 -0.885 1.00 0.00 N ATOM 632 CA ARG A 41 -3.346 9.395 -1.500 1.00 0.00 C ATOM 633 C ARG A 41 -2.292 8.296 -1.428 1.00 0.00 C ATOM 634 O ARG A 41 -2.114 7.656 -0.391 1.00 0.00 O ATOM 635 CB ARG A 41 -2.831 10.670 -0.825 1.00 0.00 C ATOM 636 CG ARG A 41 -1.740 11.389 -1.611 1.00 0.00 C ATOM 637 CD ARG A 41 -2.230 11.791 -2.995 1.00 0.00 C ATOM 638 NE ARG A 41 -1.210 12.509 -3.760 1.00 0.00 N ATOM 639 CZ ARG A 41 -0.541 11.982 -4.790 1.00 0.00 C ATOM 640 NH1 ARG A 41 -0.763 10.721 -5.149 1.00 0.00 N ATOM 641 NH2 ARG A 41 0.332 12.720 -5.468 1.00 0.00 N ATOM 0 H ARG A 41 -4.483 8.360 -0.068 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.544 9.611 -2.550 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.667 11.353 -0.675 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.446 10.416 0.163 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.419 12.276 -1.064 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -0.869 10.740 -1.705 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -2.532 10.899 -3.544 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.115 12.419 -2.896 1.00 0.00 H new ATOM 0 HE ARG A 41 -0.997 13.469 -3.491 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -1.443 10.158 -4.639 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -0.253 10.317 -5.935 1.00 0.00 H new ATOM 0 HH21 ARG A 41 0.493 13.692 -5.203 1.00 0.00 H new ATOM 0 HH22 ARG A 41 0.841 12.315 -6.254 1.00 0.00 H new ATOM 655 N VAL A 42 -1.615 8.075 -2.547 1.00 0.00 N ATOM 656 CA VAL A 42 -0.557 7.082 -2.630 1.00 0.00 C ATOM 657 C VAL A 42 0.806 7.764 -2.626 1.00 0.00 C ATOM 658 O VAL A 42 1.054 8.667 -3.428 1.00 0.00 O ATOM 659 CB VAL A 42 -0.685 6.233 -3.914 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.402 5.171 -3.975 1.00 0.00 C ATOM 661 CG2 VAL A 42 -2.060 5.597 -4.003 1.00 0.00 C ATOM 0 H VAL A 42 -1.784 8.578 -3.418 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.651 6.429 -1.763 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.558 6.896 -4.770 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.289 4.587 -4.888 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.381 5.651 -3.970 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.316 4.513 -3.111 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.128 5.004 -4.915 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.220 4.953 -3.138 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.821 6.377 -4.020 1.00 0.00 H new ATOM 671 N TYR A 43 1.675 7.348 -1.715 1.00 0.00 N ATOM 672 CA TYR A 43 3.041 7.855 -1.672 1.00 0.00 C ATOM 673 C TYR A 43 4.039 6.708 -1.763 1.00 0.00 C ATOM 674 O TYR A 43 4.467 6.154 -0.749 1.00 0.00 O ATOM 675 CB TYR A 43 3.297 8.692 -0.414 1.00 0.00 C ATOM 676 CG TYR A 43 2.703 10.080 -0.486 1.00 0.00 C ATOM 677 CD1 TYR A 43 3.095 10.966 -1.480 1.00 0.00 C ATOM 678 CD2 TYR A 43 1.758 10.503 0.435 1.00 0.00 C ATOM 679 CE1 TYR A 43 2.559 12.237 -1.554 1.00 0.00 C ATOM 680 CE2 TYR A 43 1.217 11.772 0.367 1.00 0.00 C ATOM 681 CZ TYR A 43 1.620 12.633 -0.629 1.00 0.00 C ATOM 682 OH TYR A 43 1.087 13.898 -0.694 1.00 0.00 O ATOM 0 H TYR A 43 1.458 6.660 -0.994 1.00 0.00 H new ATOM 0 HA TYR A 43 3.176 8.508 -2.534 1.00 0.00 H new ATOM 0 HB2 TYR A 43 2.883 8.172 0.450 1.00 0.00 H new ATOM 0 HB3 TYR A 43 4.372 8.773 -0.253 1.00 0.00 H new ATOM 0 HD1 TYR A 43 3.831 10.657 -2.207 1.00 0.00 H new ATOM 0 HD2 TYR A 43 1.440 9.830 1.218 1.00 0.00 H new ATOM 0 HE1 TYR A 43 2.875 12.916 -2.333 1.00 0.00 H new ATOM 0 HE2 TYR A 43 0.481 12.088 1.092 1.00 0.00 H new ATOM 0 HH TYR A 43 1.647 14.516 -0.179 1.00 0.00 H new ATOM 692 N PRO A 44 4.384 6.305 -2.991 1.00 0.00 N ATOM 693 CA PRO A 44 5.326 5.216 -3.233 1.00 0.00 C ATOM 694 C PRO A 44 6.758 5.633 -2.917 1.00 0.00 C ATOM 695 O PRO A 44 7.173 6.747 -3.232 1.00 0.00 O ATOM 696 CB PRO A 44 5.169 4.916 -4.732 1.00 0.00 C ATOM 697 CG PRO A 44 4.015 5.739 -5.201 1.00 0.00 C ATOM 698 CD PRO A 44 3.901 6.888 -4.245 1.00 0.00 C ATOM 0 HA PRO A 44 5.125 4.351 -2.601 1.00 0.00 H new ATOM 0 HB2 PRO A 44 6.077 5.172 -5.278 1.00 0.00 H new ATOM 0 HB3 PRO A 44 4.984 3.855 -4.900 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.179 6.095 -6.218 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.097 5.151 -5.213 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.508 7.738 -4.558 1.00 0.00 H new ATOM 0 HD3 PRO A 44 2.874 7.244 -4.158 1.00 0.00 H new ATOM 706 N LEU A 45 7.513 4.731 -2.308 1.00 0.00 N ATOM 707 CA LEU A 45 8.866 5.040 -1.879 1.00 0.00 C ATOM 708 C LEU A 45 9.880 4.221 -2.672 1.00 0.00 C ATOM 709 O LEU A 45 9.535 3.575 -3.666 1.00 0.00 O ATOM 710 CB LEU A 45 9.022 4.759 -0.379 1.00 0.00 C ATOM 711 CG LEU A 45 8.112 5.580 0.537 1.00 0.00 C ATOM 712 CD1 LEU A 45 8.285 5.143 1.982 1.00 0.00 C ATOM 713 CD2 LEU A 45 8.410 7.066 0.394 1.00 0.00 C ATOM 0 H LEU A 45 7.210 3.779 -2.100 1.00 0.00 H new ATOM 0 HA LEU A 45 9.053 6.098 -2.064 1.00 0.00 H new ATOM 0 HB2 LEU A 45 8.829 3.701 -0.202 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.058 4.946 -0.097 1.00 0.00 H new ATOM 0 HG LEU A 45 7.077 5.406 0.241 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.631 5.736 2.622 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.026 4.088 2.077 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.321 5.291 2.285 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.753 7.634 1.053 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.449 7.257 0.665 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.242 7.373 -0.638 1.00 0.00 H new ATOM 725 N ASN A 46 11.124 4.259 -2.230 1.00 0.00 N ATOM 726 CA ASN A 46 12.193 3.518 -2.879 1.00 0.00 C ATOM 727 C ASN A 46 12.527 2.268 -2.071 1.00 0.00 C ATOM 728 O ASN A 46 12.357 2.246 -0.852 1.00 0.00 O ATOM 729 CB ASN A 46 13.433 4.405 -3.022 1.00 0.00 C ATOM 730 CG ASN A 46 14.559 3.720 -3.777 1.00 0.00 C ATOM 731 OD1 ASN A 46 14.322 2.902 -4.664 1.00 0.00 O ATOM 732 ND2 ASN A 46 15.791 4.052 -3.428 1.00 0.00 N ATOM 0 H ASN A 46 11.421 4.799 -1.418 1.00 0.00 H new ATOM 0 HA ASN A 46 11.863 3.215 -3.873 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.160 5.324 -3.541 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.786 4.691 -2.031 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.588 3.625 -3.900 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.944 4.735 -2.687 1.00 0.00 H new ATOM 739 N ASN A 47 12.983 1.233 -2.750 1.00 0.00 N ATOM 740 CA ASN A 47 13.379 0.000 -2.085 1.00 0.00 C ATOM 741 C ASN A 47 14.896 -0.072 -2.008 1.00 0.00 C ATOM 742 O ASN A 47 15.581 -0.046 -3.029 1.00 0.00 O ATOM 743 CB ASN A 47 12.809 -1.218 -2.820 1.00 0.00 C ATOM 744 CG ASN A 47 13.243 -2.537 -2.201 1.00 0.00 C ATOM 745 OD1 ASN A 47 13.601 -2.603 -1.024 1.00 0.00 O ATOM 746 ND2 ASN A 47 13.169 -3.605 -2.979 1.00 0.00 N ATOM 0 H ASN A 47 13.090 1.219 -3.764 1.00 0.00 H new ATOM 0 HA ASN A 47 12.975 -0.006 -1.073 1.00 0.00 H new ATOM 0 HB2 ASN A 47 11.720 -1.162 -2.817 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.127 -1.189 -3.862 1.00 0.00 H new ATOM 0 HD21 ASN A 47 13.413 -4.524 -2.609 1.00 0.00 H new ATOM 0 HD22 ASN A 47 12.868 -3.510 -3.949 1.00 0.00 H new ATOM 753 N LEU A 48 15.409 -0.142 -0.787 1.00 0.00 N ATOM 754 CA LEU A 48 16.844 -0.085 -0.539 1.00 0.00 C ATOM 755 C LEU A 48 17.586 -1.278 -1.139 1.00 0.00 C ATOM 756 O LEU A 48 18.719 -1.137 -1.607 1.00 0.00 O ATOM 757 CB LEU A 48 17.115 -0.008 0.968 1.00 0.00 C ATOM 758 CG LEU A 48 16.861 1.355 1.630 1.00 0.00 C ATOM 759 CD1 LEU A 48 17.762 2.423 1.028 1.00 0.00 C ATOM 760 CD2 LEU A 48 15.402 1.773 1.515 1.00 0.00 C ATOM 0 H LEU A 48 14.845 -0.240 0.057 1.00 0.00 H new ATOM 0 HA LEU A 48 17.220 0.813 -1.029 1.00 0.00 H new ATOM 0 HB2 LEU A 48 16.495 -0.753 1.467 1.00 0.00 H new ATOM 0 HB3 LEU A 48 18.154 -0.287 1.145 1.00 0.00 H new ATOM 0 HG LEU A 48 17.097 1.250 2.689 1.00 0.00 H new ATOM 0 HD11 LEU A 48 17.565 3.380 1.512 1.00 0.00 H new ATOM 0 HD12 LEU A 48 18.805 2.147 1.181 1.00 0.00 H new ATOM 0 HD13 LEU A 48 17.562 2.508 -0.040 1.00 0.00 H new ATOM 0 HD21 LEU A 48 15.262 2.742 1.995 1.00 0.00 H new ATOM 0 HD22 LEU A 48 15.126 1.846 0.463 1.00 0.00 H new ATOM 0 HD23 LEU A 48 14.771 1.031 2.005 1.00 0.00 H new ATOM 772 N ASP A 49 16.959 -2.446 -1.128 1.00 0.00 N ATOM 773 CA ASP A 49 17.604 -3.655 -1.632 1.00 0.00 C ATOM 774 C ASP A 49 16.935 -4.136 -2.909 1.00 0.00 C ATOM 775 O ASP A 49 15.781 -4.558 -2.893 1.00 0.00 O ATOM 776 CB ASP A 49 17.582 -4.776 -0.584 1.00 0.00 C ATOM 777 CG ASP A 49 18.503 -4.505 0.589 1.00 0.00 C ATOM 778 OD1 ASP A 49 19.734 -4.408 0.381 1.00 0.00 O ATOM 779 OD2 ASP A 49 18.004 -4.381 1.727 1.00 0.00 O ATOM 0 H ASP A 49 16.011 -2.584 -0.779 1.00 0.00 H new ATOM 0 HA ASP A 49 18.642 -3.402 -1.849 1.00 0.00 H new ATOM 0 HB2 ASP A 49 16.563 -4.904 -0.218 1.00 0.00 H new ATOM 0 HB3 ASP A 49 17.871 -5.715 -1.057 1.00 0.00 H new ATOM 784 N GLN A 50 17.671 -4.088 -4.012 1.00 0.00 N ATOM 785 CA GLN A 50 17.144 -4.503 -5.304 1.00 0.00 C ATOM 786 C GLN A 50 17.099 -6.026 -5.400 1.00 0.00 C ATOM 787 O GLN A 50 17.990 -6.653 -5.981 1.00 0.00 O ATOM 788 CB GLN A 50 17.986 -3.930 -6.446 1.00 0.00 C ATOM 789 CG GLN A 50 17.919 -2.416 -6.567 1.00 0.00 C ATOM 790 CD GLN A 50 18.677 -1.896 -7.776 1.00 0.00 C ATOM 791 OE1 GLN A 50 18.123 -1.785 -8.869 1.00 0.00 O ATOM 792 NE2 GLN A 50 19.946 -1.564 -7.592 1.00 0.00 N ATOM 0 H GLN A 50 18.638 -3.764 -4.037 1.00 0.00 H new ATOM 0 HA GLN A 50 16.130 -4.115 -5.394 1.00 0.00 H new ATOM 0 HB2 GLN A 50 19.025 -4.227 -6.301 1.00 0.00 H new ATOM 0 HB3 GLN A 50 17.655 -4.374 -7.385 1.00 0.00 H new ATOM 0 HG2 GLN A 50 16.876 -2.106 -6.635 1.00 0.00 H new ATOM 0 HG3 GLN A 50 18.328 -1.964 -5.663 1.00 0.00 H new ATOM 0 HE21 GLN A 50 20.372 -1.669 -6.671 1.00 0.00 H new ATOM 0 HE22 GLN A 50 20.497 -1.203 -8.371 1.00 0.00 H new ATOM 801 N SER A 51 16.084 -6.614 -4.788 1.00 0.00 N ATOM 802 CA SER A 51 15.893 -8.055 -4.812 1.00 0.00 C ATOM 803 C SER A 51 14.428 -8.382 -5.084 1.00 0.00 C ATOM 804 O SER A 51 13.545 -7.657 -4.641 1.00 0.00 O ATOM 805 CB SER A 51 16.332 -8.656 -3.476 1.00 0.00 C ATOM 806 OG SER A 51 17.643 -8.237 -3.143 1.00 0.00 O ATOM 0 H SER A 51 15.371 -6.108 -4.262 1.00 0.00 H new ATOM 0 HA SER A 51 16.500 -8.485 -5.609 1.00 0.00 H new ATOM 0 HB2 SER A 51 15.639 -8.354 -2.691 1.00 0.00 H new ATOM 0 HB3 SER A 51 16.296 -9.744 -3.532 1.00 0.00 H new ATOM 0 HG SER A 51 17.904 -8.631 -2.285 1.00 0.00 H new ATOM 812 N PRO A 52 14.159 -9.469 -5.825 1.00 0.00 N ATOM 813 CA PRO A 52 12.793 -9.868 -6.193 1.00 0.00 C ATOM 814 C PRO A 52 11.972 -10.370 -5.004 1.00 0.00 C ATOM 815 O PRO A 52 10.749 -10.228 -4.978 1.00 0.00 O ATOM 816 CB PRO A 52 13.000 -11.008 -7.204 1.00 0.00 C ATOM 817 CG PRO A 52 14.445 -10.958 -7.575 1.00 0.00 C ATOM 818 CD PRO A 52 15.158 -10.387 -6.385 1.00 0.00 C ATOM 0 HA PRO A 52 12.233 -9.020 -6.586 1.00 0.00 H new ATOM 0 HB2 PRO A 52 12.741 -11.972 -6.766 1.00 0.00 H new ATOM 0 HB3 PRO A 52 12.365 -10.875 -8.080 1.00 0.00 H new ATOM 0 HG2 PRO A 52 14.821 -11.953 -7.815 1.00 0.00 H new ATOM 0 HG3 PRO A 52 14.600 -10.337 -8.458 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.442 -11.161 -5.672 1.00 0.00 H new ATOM 0 HD3 PRO A 52 16.072 -9.866 -6.671 1.00 0.00 H new ATOM 826 N GLU A 53 12.645 -10.985 -4.038 1.00 0.00 N ATOM 827 CA GLU A 53 11.964 -11.557 -2.883 1.00 0.00 C ATOM 828 C GLU A 53 12.149 -10.698 -1.638 1.00 0.00 C ATOM 829 O GLU A 53 11.419 -10.848 -0.661 1.00 0.00 O ATOM 830 CB GLU A 53 12.492 -12.966 -2.586 1.00 0.00 C ATOM 831 CG GLU A 53 12.609 -13.863 -3.806 1.00 0.00 C ATOM 832 CD GLU A 53 13.977 -13.786 -4.457 1.00 0.00 C ATOM 833 OE1 GLU A 53 14.664 -12.753 -4.302 1.00 0.00 O ATOM 834 OE2 GLU A 53 14.375 -14.765 -5.122 1.00 0.00 O ATOM 0 H GLU A 53 13.658 -11.100 -4.032 1.00 0.00 H new ATOM 0 HA GLU A 53 10.903 -11.600 -3.131 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.472 -12.882 -2.117 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.832 -13.443 -1.862 1.00 0.00 H new ATOM 0 HG2 GLU A 53 12.406 -14.894 -3.515 1.00 0.00 H new ATOM 0 HG3 GLU A 53 11.848 -13.582 -4.534 1.00 0.00 H new ATOM 841 N HIS A 54 13.129 -9.805 -1.668 1.00 0.00 N ATOM 842 CA HIS A 54 13.515 -9.070 -0.467 1.00 0.00 C ATOM 843 C HIS A 54 13.386 -7.573 -0.686 1.00 0.00 C ATOM 844 O HIS A 54 13.799 -7.050 -1.721 1.00 0.00 O ATOM 845 CB HIS A 54 14.957 -9.397 -0.055 1.00 0.00 C ATOM 846 CG HIS A 54 15.213 -10.850 0.203 1.00 0.00 C ATOM 847 ND1 HIS A 54 15.165 -11.913 -0.626 1.00 0.00 N flip ATOM 848 CD2 HIS A 54 15.598 -11.346 1.429 1.00 0.00 C flip ATOM 849 CE1 HIS A 54 15.517 -13.020 0.100 1.00 0.00 C flip ATOM 850 NE2 HIS A 54 15.775 -12.649 1.338 1.00 0.00 N flip ATOM 0 H HIS A 54 13.668 -9.572 -2.502 1.00 0.00 H new ATOM 0 HA HIS A 54 12.840 -9.378 0.332 1.00 0.00 H new ATOM 0 HB2 HIS A 54 15.632 -9.055 -0.839 1.00 0.00 H new ATOM 0 HB3 HIS A 54 15.202 -8.832 0.845 1.00 0.00 H new ATOM 0 HD2 HIS A 54 15.734 -10.759 2.325 1.00 0.00 H new ATOM 0 HE1 HIS A 54 15.574 -14.030 -0.279 1.00 0.00 H new ATOM 0 HE2 HIS A 54 16.063 -13.266 2.097 1.00 0.00 H new ATOM 859 N PHE A 55 12.839 -6.894 0.307 1.00 0.00 N ATOM 860 CA PHE A 55 12.636 -5.457 0.242 1.00 0.00 C ATOM 861 C PHE A 55 12.964 -4.817 1.587 1.00 0.00 C ATOM 862 O PHE A 55 12.835 -5.453 2.637 1.00 0.00 O ATOM 863 CB PHE A 55 11.193 -5.131 -0.171 1.00 0.00 C ATOM 864 CG PHE A 55 10.139 -5.689 0.748 1.00 0.00 C ATOM 865 CD1 PHE A 55 9.676 -6.986 0.585 1.00 0.00 C ATOM 866 CD2 PHE A 55 9.608 -4.917 1.769 1.00 0.00 C ATOM 867 CE1 PHE A 55 8.707 -7.500 1.424 1.00 0.00 C ATOM 868 CE2 PHE A 55 8.638 -5.426 2.611 1.00 0.00 C ATOM 869 CZ PHE A 55 8.187 -6.718 2.437 1.00 0.00 C ATOM 0 H PHE A 55 12.524 -7.321 1.178 1.00 0.00 H new ATOM 0 HA PHE A 55 13.307 -5.047 -0.513 1.00 0.00 H new ATOM 0 HB2 PHE A 55 11.078 -4.048 -0.220 1.00 0.00 H new ATOM 0 HB3 PHE A 55 11.021 -5.515 -1.176 1.00 0.00 H new ATOM 0 HD1 PHE A 55 10.078 -7.601 -0.207 1.00 0.00 H new ATOM 0 HD2 PHE A 55 9.957 -3.904 1.908 1.00 0.00 H new ATOM 0 HE1 PHE A 55 8.356 -8.512 1.288 1.00 0.00 H new ATOM 0 HE2 PHE A 55 8.234 -4.814 3.404 1.00 0.00 H new ATOM 0 HZ PHE A 55 7.428 -7.118 3.093 1.00 0.00 H new ATOM 879 N SER A 56 13.397 -3.566 1.550 1.00 0.00 N ATOM 880 CA SER A 56 13.750 -2.835 2.757 1.00 0.00 C ATOM 881 C SER A 56 13.312 -1.380 2.637 1.00 0.00 C ATOM 882 O SER A 56 13.468 -0.763 1.582 1.00 0.00 O ATOM 883 CB SER A 56 15.261 -2.901 2.999 1.00 0.00 C ATOM 884 OG SER A 56 15.730 -4.242 2.994 1.00 0.00 O ATOM 0 H SER A 56 13.513 -3.032 0.689 1.00 0.00 H new ATOM 0 HA SER A 56 13.237 -3.295 3.601 1.00 0.00 H new ATOM 0 HB2 SER A 56 15.779 -2.330 2.229 1.00 0.00 H new ATOM 0 HB3 SER A 56 15.498 -2.435 3.955 1.00 0.00 H new ATOM 0 HG SER A 56 16.661 -4.262 2.690 1.00 0.00 H new ATOM 890 N MET A 57 12.757 -0.844 3.714 1.00 0.00 N ATOM 891 CA MET A 57 12.322 0.547 3.745 1.00 0.00 C ATOM 892 C MET A 57 13.027 1.287 4.875 1.00 0.00 C ATOM 893 O MET A 57 13.073 0.804 6.010 1.00 0.00 O ATOM 894 CB MET A 57 10.802 0.623 3.930 1.00 0.00 C ATOM 895 CG MET A 57 10.255 2.041 3.913 1.00 0.00 C ATOM 896 SD MET A 57 8.472 2.104 4.188 1.00 0.00 S ATOM 897 CE MET A 57 7.879 1.108 2.822 1.00 0.00 C ATOM 0 H MET A 57 12.596 -1.353 4.583 1.00 0.00 H new ATOM 0 HA MET A 57 12.582 1.019 2.797 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.319 0.047 3.140 1.00 0.00 H new ATOM 0 HB3 MET A 57 10.536 0.152 4.876 1.00 0.00 H new ATOM 0 HG2 MET A 57 10.758 2.629 4.681 1.00 0.00 H new ATOM 0 HG3 MET A 57 10.487 2.504 2.954 1.00 0.00 H new ATOM 0 HE1 MET A 57 6.820 1.306 2.660 1.00 0.00 H new ATOM 0 HE2 MET A 57 8.437 1.359 1.920 1.00 0.00 H new ATOM 0 HE3 MET A 57 8.019 0.052 3.054 1.00 0.00 H new ATOM 907 N ASP A 58 13.585 2.448 4.567 1.00 0.00 N ATOM 908 CA ASP A 58 14.290 3.234 5.568 1.00 0.00 C ATOM 909 C ASP A 58 13.326 4.171 6.283 1.00 0.00 C ATOM 910 O ASP A 58 12.298 4.562 5.727 1.00 0.00 O ATOM 911 CB ASP A 58 15.437 4.031 4.936 1.00 0.00 C ATOM 912 CG ASP A 58 14.972 5.146 4.039 1.00 0.00 C ATOM 913 OD1 ASP A 58 14.783 4.897 2.836 1.00 0.00 O ATOM 914 OD2 ASP A 58 14.834 6.282 4.534 1.00 0.00 O ATOM 0 H ASP A 58 13.564 2.865 3.636 1.00 0.00 H new ATOM 0 HA ASP A 58 14.717 2.546 6.297 1.00 0.00 H new ATOM 0 HB2 ASP A 58 16.058 4.448 5.728 1.00 0.00 H new ATOM 0 HB3 ASP A 58 16.067 3.352 4.361 1.00 0.00 H new ATOM 919 N PRO A 59 13.635 4.525 7.539 1.00 0.00 N ATOM 920 CA PRO A 59 12.773 5.387 8.352 1.00 0.00 C ATOM 921 C PRO A 59 12.686 6.816 7.824 1.00 0.00 C ATOM 922 O PRO A 59 11.719 7.524 8.102 1.00 0.00 O ATOM 923 CB PRO A 59 13.435 5.365 9.733 1.00 0.00 C ATOM 924 CG PRO A 59 14.857 5.012 9.470 1.00 0.00 C ATOM 925 CD PRO A 59 14.837 4.098 8.278 1.00 0.00 C ATOM 0 HA PRO A 59 11.743 5.030 8.351 1.00 0.00 H new ATOM 0 HB2 PRO A 59 13.353 6.334 10.226 1.00 0.00 H new ATOM 0 HB3 PRO A 59 12.961 4.633 10.387 1.00 0.00 H new ATOM 0 HG2 PRO A 59 15.451 5.904 9.269 1.00 0.00 H new ATOM 0 HG3 PRO A 59 15.304 4.519 10.333 1.00 0.00 H new ATOM 0 HD2 PRO A 59 15.738 4.205 7.675 1.00 0.00 H new ATOM 0 HD3 PRO A 59 14.775 3.051 8.575 1.00 0.00 H new ATOM 933 N ARG A 60 13.678 7.237 7.047 1.00 0.00 N ATOM 934 CA ARG A 60 13.708 8.609 6.561 1.00 0.00 C ATOM 935 C ARG A 60 12.697 8.792 5.440 1.00 0.00 C ATOM 936 O ARG A 60 11.917 9.745 5.451 1.00 0.00 O ATOM 937 CB ARG A 60 15.106 9.003 6.075 1.00 0.00 C ATOM 938 CG ARG A 60 16.218 8.636 7.043 1.00 0.00 C ATOM 939 CD ARG A 60 17.473 9.455 6.788 1.00 0.00 C ATOM 940 NE ARG A 60 17.416 10.758 7.459 1.00 0.00 N ATOM 941 CZ ARG A 60 17.692 11.922 6.870 1.00 0.00 C ATOM 942 NH1 ARG A 60 18.016 11.958 5.584 1.00 0.00 N ATOM 943 NH2 ARG A 60 17.641 13.049 7.573 1.00 0.00 N ATOM 0 H ARG A 60 14.461 6.657 6.744 1.00 0.00 H new ATOM 0 HA ARG A 60 13.445 9.262 7.394 1.00 0.00 H new ATOM 0 HB2 ARG A 60 15.297 8.520 5.117 1.00 0.00 H new ATOM 0 HB3 ARG A 60 15.130 10.079 5.900 1.00 0.00 H new ATOM 0 HG2 ARG A 60 15.879 8.798 8.066 1.00 0.00 H new ATOM 0 HG3 ARG A 60 16.449 7.575 6.948 1.00 0.00 H new ATOM 0 HD2 ARG A 60 18.345 8.903 7.138 1.00 0.00 H new ATOM 0 HD3 ARG A 60 17.599 9.603 5.716 1.00 0.00 H new ATOM 0 HE ARG A 60 17.147 10.775 8.443 1.00 0.00 H new ATOM 0 HH11 ARG A 60 18.054 11.094 5.043 1.00 0.00 H new ATOM 0 HH12 ARG A 60 18.227 12.850 5.136 1.00 0.00 H new ATOM 0 HH21 ARG A 60 17.391 13.023 8.562 1.00 0.00 H new ATOM 0 HH22 ARG A 60 17.852 13.940 7.124 1.00 0.00 H new ATOM 957 N GLU A 61 12.683 7.861 4.487 1.00 0.00 N ATOM 958 CA GLU A 61 11.691 7.894 3.419 1.00 0.00 C ATOM 959 C GLU A 61 10.297 7.676 3.994 1.00 0.00 C ATOM 960 O GLU A 61 9.330 8.318 3.579 1.00 0.00 O ATOM 961 CB GLU A 61 11.996 6.836 2.361 1.00 0.00 C ATOM 962 CG GLU A 61 13.241 7.136 1.543 1.00 0.00 C ATOM 963 CD GLU A 61 13.055 8.289 0.577 1.00 0.00 C ATOM 964 OE1 GLU A 61 12.619 8.049 -0.571 1.00 0.00 O ATOM 965 OE2 GLU A 61 13.365 9.442 0.951 1.00 0.00 O ATOM 0 H GLU A 61 13.341 7.083 4.434 1.00 0.00 H new ATOM 0 HA GLU A 61 11.731 8.874 2.943 1.00 0.00 H new ATOM 0 HB2 GLU A 61 12.117 5.869 2.850 1.00 0.00 H new ATOM 0 HB3 GLU A 61 11.142 6.749 1.689 1.00 0.00 H new ATOM 0 HG2 GLU A 61 14.065 7.365 2.218 1.00 0.00 H new ATOM 0 HG3 GLU A 61 13.525 6.244 0.984 1.00 0.00 H new ATOM 972 N GLN A 62 10.213 6.783 4.972 1.00 0.00 N ATOM 973 CA GLN A 62 8.964 6.486 5.642 1.00 0.00 C ATOM 974 C GLN A 62 8.403 7.734 6.325 1.00 0.00 C ATOM 975 O GLN A 62 7.240 8.092 6.129 1.00 0.00 O ATOM 976 CB GLN A 62 9.200 5.385 6.674 1.00 0.00 C ATOM 977 CG GLN A 62 7.941 4.918 7.374 1.00 0.00 C ATOM 978 CD GLN A 62 8.227 3.946 8.505 1.00 0.00 C ATOM 979 OE1 GLN A 62 9.269 4.024 9.159 1.00 0.00 O ATOM 980 NE2 GLN A 62 7.317 3.016 8.740 1.00 0.00 N ATOM 0 H GLN A 62 11.009 6.248 5.319 1.00 0.00 H new ATOM 0 HA GLN A 62 8.236 6.150 4.904 1.00 0.00 H new ATOM 0 HB2 GLN A 62 9.667 4.532 6.181 1.00 0.00 H new ATOM 0 HB3 GLN A 62 9.906 5.747 7.421 1.00 0.00 H new ATOM 0 HG2 GLN A 62 7.408 5.783 7.769 1.00 0.00 H new ATOM 0 HG3 GLN A 62 7.282 4.441 6.648 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.466 2.982 8.179 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.466 2.333 9.483 1.00 0.00 H new ATOM 989 N LEU A 63 9.245 8.411 7.098 1.00 0.00 N ATOM 990 CA LEU A 63 8.816 9.575 7.863 1.00 0.00 C ATOM 991 C LEU A 63 8.456 10.734 6.942 1.00 0.00 C ATOM 992 O LEU A 63 7.535 11.499 7.227 1.00 0.00 O ATOM 993 CB LEU A 63 9.908 10.004 8.845 1.00 0.00 C ATOM 994 CG LEU A 63 9.524 11.145 9.789 1.00 0.00 C ATOM 995 CD1 LEU A 63 8.349 10.742 10.669 1.00 0.00 C ATOM 996 CD2 LEU A 63 10.719 11.547 10.639 1.00 0.00 C ATOM 0 H LEU A 63 10.230 8.173 7.211 1.00 0.00 H new ATOM 0 HA LEU A 63 7.925 9.295 8.426 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.196 9.140 9.444 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.788 10.305 8.276 1.00 0.00 H new ATOM 0 HG LEU A 63 9.219 12.004 9.191 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.092 11.567 11.333 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.491 10.500 10.042 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.622 9.870 11.263 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.434 12.360 11.307 1.00 0.00 H new ATOM 0 HD22 LEU A 63 11.050 10.692 11.229 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.531 11.878 9.992 1.00 0.00 H new ATOM 1008 N THR A 64 9.171 10.852 5.829 1.00 0.00 N ATOM 1009 CA THR A 64 8.913 11.913 4.867 1.00 0.00 C ATOM 1010 C THR A 64 7.501 11.788 4.288 1.00 0.00 C ATOM 1011 O THR A 64 6.803 12.789 4.104 1.00 0.00 O ATOM 1012 CB THR A 64 9.952 11.900 3.725 1.00 0.00 C ATOM 1013 OG1 THR A 64 11.275 12.007 4.273 1.00 0.00 O ATOM 1014 CG2 THR A 64 9.715 13.045 2.754 1.00 0.00 C ATOM 0 H THR A 64 9.934 10.225 5.572 1.00 0.00 H new ATOM 0 HA THR A 64 8.996 12.862 5.396 1.00 0.00 H new ATOM 0 HB THR A 64 9.848 10.960 3.183 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.584 11.121 4.557 1.00 0.00 H new ATOM 0 HG21 THR A 64 10.462 13.010 1.961 1.00 0.00 H new ATOM 0 HG22 THR A 64 8.720 12.953 2.319 1.00 0.00 H new ATOM 0 HG23 THR A 64 9.793 13.994 3.284 1.00 0.00 H new ATOM 1022 N ALA A 65 7.075 10.557 4.026 1.00 0.00 N ATOM 1023 CA ALA A 65 5.741 10.311 3.494 1.00 0.00 C ATOM 1024 C ALA A 65 4.674 10.535 4.563 1.00 0.00 C ATOM 1025 O ALA A 65 3.619 11.107 4.289 1.00 0.00 O ATOM 1026 CB ALA A 65 5.650 8.901 2.929 1.00 0.00 C ATOM 0 H ALA A 65 7.633 9.716 4.173 1.00 0.00 H new ATOM 0 HA ALA A 65 5.559 11.021 2.687 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.648 8.731 2.535 1.00 0.00 H new ATOM 0 HB2 ALA A 65 6.380 8.782 2.128 1.00 0.00 H new ATOM 0 HB3 ALA A 65 5.857 8.179 3.719 1.00 0.00 H new ATOM 1032 N VAL A 66 4.959 10.094 5.785 1.00 0.00 N ATOM 1033 CA VAL A 66 4.027 10.255 6.898 1.00 0.00 C ATOM 1034 C VAL A 66 3.842 11.733 7.248 1.00 0.00 C ATOM 1035 O VAL A 66 2.743 12.166 7.597 1.00 0.00 O ATOM 1036 CB VAL A 66 4.497 9.475 8.150 1.00 0.00 C ATOM 1037 CG1 VAL A 66 3.562 9.709 9.328 1.00 0.00 C ATOM 1038 CG2 VAL A 66 4.603 7.988 7.845 1.00 0.00 C ATOM 0 H VAL A 66 5.829 9.622 6.030 1.00 0.00 H new ATOM 0 HA VAL A 66 3.070 9.845 6.577 1.00 0.00 H new ATOM 0 HB VAL A 66 5.484 9.847 8.424 1.00 0.00 H new ATOM 0 HG11 VAL A 66 3.918 9.148 10.192 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.540 10.772 9.569 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.558 9.375 9.067 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.935 7.456 8.737 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.628 7.609 7.538 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.322 7.832 7.041 1.00 0.00 H new ATOM 1048 N LYS A 67 4.921 12.503 7.136 1.00 0.00 N ATOM 1049 CA LYS A 67 4.877 13.936 7.421 1.00 0.00 C ATOM 1050 C LYS A 67 3.880 14.637 6.505 1.00 0.00 C ATOM 1051 O LYS A 67 3.045 15.423 6.959 1.00 0.00 O ATOM 1052 CB LYS A 67 6.266 14.557 7.239 1.00 0.00 C ATOM 1053 CG LYS A 67 6.324 16.039 7.590 1.00 0.00 C ATOM 1054 CD LYS A 67 7.687 16.642 7.288 1.00 0.00 C ATOM 1055 CE LYS A 67 8.783 16.009 8.129 1.00 0.00 C ATOM 1056 NZ LYS A 67 10.102 16.637 7.867 1.00 0.00 N ATOM 0 H LYS A 67 5.838 12.159 6.850 1.00 0.00 H new ATOM 0 HA LYS A 67 4.557 14.066 8.455 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.980 14.017 7.861 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.581 14.425 6.204 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.558 16.575 7.029 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.095 16.171 8.648 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.917 16.509 6.231 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.659 17.715 7.475 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.535 16.108 9.186 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.838 14.942 7.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.827 16.181 8.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.349 16.520 6.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 10.056 17.650 8.096 1.00 0.00 H new ATOM 1070 N ASP A 68 3.960 14.329 5.218 1.00 0.00 N ATOM 1071 CA ASP A 68 3.083 14.949 4.227 1.00 0.00 C ATOM 1072 C ASP A 68 1.653 14.476 4.433 1.00 0.00 C ATOM 1073 O ASP A 68 0.695 15.233 4.269 1.00 0.00 O ATOM 1074 CB ASP A 68 3.546 14.597 2.812 1.00 0.00 C ATOM 1075 CG ASP A 68 2.960 15.517 1.755 1.00 0.00 C ATOM 1076 OD1 ASP A 68 1.797 15.311 1.352 1.00 0.00 O ATOM 1077 OD2 ASP A 68 3.675 16.443 1.305 1.00 0.00 O ATOM 0 H ASP A 68 4.621 13.655 4.833 1.00 0.00 H new ATOM 0 HA ASP A 68 3.125 16.031 4.352 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.634 14.647 2.768 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.265 13.568 2.588 1.00 0.00 H new ATOM 1082 N MET A 69 1.529 13.216 4.816 1.00 0.00 N ATOM 1083 CA MET A 69 0.233 12.610 5.082 1.00 0.00 C ATOM 1084 C MET A 69 -0.506 13.384 6.166 1.00 0.00 C ATOM 1085 O MET A 69 -1.668 13.759 6.001 1.00 0.00 O ATOM 1086 CB MET A 69 0.421 11.167 5.545 1.00 0.00 C ATOM 1087 CG MET A 69 -0.795 10.289 5.325 1.00 0.00 C ATOM 1088 SD MET A 69 -1.036 9.881 3.590 1.00 0.00 S ATOM 1089 CE MET A 69 0.482 8.990 3.255 1.00 0.00 C ATOM 0 H MET A 69 2.320 12.586 4.951 1.00 0.00 H new ATOM 0 HA MET A 69 -0.351 12.633 4.162 1.00 0.00 H new ATOM 0 HB2 MET A 69 1.270 10.734 5.017 1.00 0.00 H new ATOM 0 HB3 MET A 69 0.671 11.166 6.606 1.00 0.00 H new ATOM 0 HG2 MET A 69 -0.686 9.370 5.901 1.00 0.00 H new ATOM 0 HG3 MET A 69 -1.682 10.798 5.703 1.00 0.00 H new ATOM 0 HE1 MET A 69 0.377 8.429 2.327 1.00 0.00 H new ATOM 0 HE2 MET A 69 1.306 9.697 3.160 1.00 0.00 H new ATOM 0 HE3 MET A 69 0.688 8.301 4.074 1.00 0.00 H new ATOM 1099 N ARG A 70 0.196 13.654 7.260 1.00 0.00 N ATOM 1100 CA ARG A 70 -0.388 14.349 8.401 1.00 0.00 C ATOM 1101 C ARG A 70 -0.640 15.814 8.062 1.00 0.00 C ATOM 1102 O ARG A 70 -1.539 16.447 8.613 1.00 0.00 O ATOM 1103 CB ARG A 70 0.540 14.246 9.611 1.00 0.00 C ATOM 1104 CG ARG A 70 -0.151 14.524 10.939 1.00 0.00 C ATOM 1105 CD ARG A 70 0.830 14.502 12.101 1.00 0.00 C ATOM 1106 NE ARG A 70 1.588 15.749 12.214 1.00 0.00 N ATOM 1107 CZ ARG A 70 2.814 15.834 12.724 1.00 0.00 C ATOM 1108 NH1 ARG A 70 3.501 14.738 13.016 1.00 0.00 N ATOM 1109 NH2 ARG A 70 3.371 17.019 12.899 1.00 0.00 N ATOM 0 H ARG A 70 1.177 13.400 7.381 1.00 0.00 H new ATOM 0 HA ARG A 70 -1.341 13.878 8.642 1.00 0.00 H new ATOM 0 HB2 ARG A 70 0.975 13.247 9.640 1.00 0.00 H new ATOM 0 HB3 ARG A 70 1.364 14.949 9.486 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -0.643 15.496 10.897 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -0.930 13.780 11.106 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.286 14.325 13.029 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.522 13.670 11.973 1.00 0.00 H new ATOM 0 HE ARG A 70 1.149 16.607 11.881 1.00 0.00 H new ATOM 0 HH11 ARG A 70 3.090 13.819 12.850 1.00 0.00 H new ATOM 0 HH12 ARG A 70 4.440 14.814 13.407 1.00 0.00 H new ATOM 0 HH21 ARG A 70 2.861 17.865 12.643 1.00 0.00 H new ATOM 0 HH22 ARG A 70 4.311 17.088 13.290 1.00 0.00 H new ATOM 1123 N LYS A 71 0.152 16.338 7.136 1.00 0.00 N ATOM 1124 CA LYS A 71 0.028 17.724 6.702 1.00 0.00 C ATOM 1125 C LYS A 71 -1.300 17.947 5.982 1.00 0.00 C ATOM 1126 O LYS A 71 -1.857 19.046 5.989 1.00 0.00 O ATOM 1127 CB LYS A 71 1.193 18.077 5.776 1.00 0.00 C ATOM 1128 CG LYS A 71 1.330 19.564 5.495 1.00 0.00 C ATOM 1129 CD LYS A 71 1.616 20.352 6.762 1.00 0.00 C ATOM 1130 CE LYS A 71 1.710 21.840 6.477 1.00 0.00 C ATOM 1131 NZ LYS A 71 2.012 22.621 7.703 1.00 0.00 N ATOM 0 H LYS A 71 0.894 15.819 6.667 1.00 0.00 H new ATOM 0 HA LYS A 71 0.054 18.370 7.579 1.00 0.00 H new ATOM 0 HB2 LYS A 71 2.120 17.715 6.221 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.065 17.549 4.831 1.00 0.00 H new ATOM 0 HG2 LYS A 71 2.134 19.726 4.777 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.413 19.933 5.036 1.00 0.00 H new ATOM 0 HD2 LYS A 71 0.828 20.169 7.492 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.549 20.005 7.206 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.486 22.019 5.733 1.00 0.00 H new ATOM 0 HE3 LYS A 71 0.770 22.187 6.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.068 23.632 7.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.259 22.471 8.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.921 22.308 8.099 1.00 0.00 H new ATOM 1145 N ASN A 72 -1.796 16.890 5.352 1.00 0.00 N ATOM 1146 CA ASN A 72 -3.084 16.935 4.660 1.00 0.00 C ATOM 1147 C ASN A 72 -4.219 16.556 5.606 1.00 0.00 C ATOM 1148 O ASN A 72 -5.397 16.701 5.274 1.00 0.00 O ATOM 1149 CB ASN A 72 -3.087 15.988 3.457 1.00 0.00 C ATOM 1150 CG ASN A 72 -2.276 16.503 2.284 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -2.792 17.205 1.414 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -1.001 16.151 2.242 1.00 0.00 N ATOM 0 H ASN A 72 -1.326 15.986 5.304 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.237 17.956 4.310 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.692 15.020 3.765 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -4.115 15.825 3.135 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -0.411 16.463 1.470 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -0.608 15.568 2.981 1.00 0.00 H new ATOM 1159 N GLY A 73 -3.858 16.075 6.786 1.00 0.00 N ATOM 1160 CA GLY A 73 -4.850 15.648 7.748 1.00 0.00 C ATOM 1161 C GLY A 73 -5.192 14.179 7.607 1.00 0.00 C ATOM 1162 O GLY A 73 -6.231 13.727 8.084 1.00 0.00 O ATOM 0 H GLY A 73 -2.891 15.973 7.095 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -4.481 15.838 8.756 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.755 16.243 7.622 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.319 13.434 6.946 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.511 12.000 6.783 1.00 0.00 C ATOM 1168 C TRP A 74 -3.593 11.230 7.719 1.00 0.00 C ATOM 1169 O TRP A 74 -2.680 11.797 8.320 1.00 0.00 O ATOM 1170 CB TRP A 74 -4.234 11.567 5.343 1.00 0.00 C ATOM 1171 CG TRP A 74 -5.245 12.051 4.351 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -6.604 12.040 4.488 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -4.979 12.588 3.051 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -7.196 12.549 3.359 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -6.219 12.892 2.463 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -3.809 12.845 2.330 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -6.325 13.440 1.186 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -3.915 13.389 1.062 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -5.165 13.681 0.504 1.00 0.00 C ATOM 0 H TRP A 74 -3.470 13.798 6.513 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.550 11.779 7.026 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.250 11.931 5.049 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -4.196 10.478 5.304 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -7.135 11.683 5.358 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -8.200 12.654 3.212 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -2.841 12.623 2.755 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -7.288 13.666 0.751 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -3.019 13.591 0.494 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -5.214 14.106 -0.488 1.00 0.00 H new ATOM 1190 N VAL A 75 -3.837 9.935 7.832 1.00 0.00 N ATOM 1191 CA VAL A 75 -2.989 9.066 8.627 1.00 0.00 C ATOM 1192 C VAL A 75 -2.518 7.886 7.786 1.00 0.00 C ATOM 1193 O VAL A 75 -3.114 7.571 6.752 1.00 0.00 O ATOM 1194 CB VAL A 75 -3.708 8.550 9.896 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -3.914 9.683 10.892 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.038 7.903 9.539 1.00 0.00 C ATOM 0 H VAL A 75 -4.620 9.462 7.380 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.132 9.656 8.951 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.076 7.793 10.361 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -4.421 9.301 11.778 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.947 10.097 11.178 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -4.522 10.464 10.434 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.525 7.548 10.447 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.678 8.635 9.046 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.865 7.062 8.867 1.00 0.00 H new ATOM 1206 N MET A 76 -1.441 7.250 8.218 1.00 0.00 N ATOM 1207 CA MET A 76 -0.893 6.109 7.501 1.00 0.00 C ATOM 1208 C MET A 76 -1.665 4.855 7.889 1.00 0.00 C ATOM 1209 O MET A 76 -1.806 4.541 9.073 1.00 0.00 O ATOM 1210 CB MET A 76 0.606 5.972 7.806 1.00 0.00 C ATOM 1211 CG MET A 76 1.324 4.896 7.000 1.00 0.00 C ATOM 1212 SD MET A 76 1.138 3.245 7.699 1.00 0.00 S ATOM 1213 CE MET A 76 1.909 3.469 9.301 1.00 0.00 C ATOM 0 H MET A 76 -0.928 7.504 9.062 1.00 0.00 H new ATOM 0 HA MET A 76 -0.998 6.255 6.426 1.00 0.00 H new ATOM 0 HB2 MET A 76 1.090 6.931 7.619 1.00 0.00 H new ATOM 0 HB3 MET A 76 0.729 5.755 8.867 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.939 4.897 5.980 1.00 0.00 H new ATOM 0 HG3 MET A 76 2.384 5.142 6.941 1.00 0.00 H new ATOM 0 HE1 MET A 76 2.557 2.619 9.515 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.501 4.385 9.295 1.00 0.00 H new ATOM 0 HE3 MET A 76 1.139 3.540 10.069 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.188 4.159 6.889 1.00 0.00 N ATOM 1224 CA LEU A 77 -3.074 3.028 7.137 1.00 0.00 C ATOM 1225 C LEU A 77 -2.407 1.710 6.775 1.00 0.00 C ATOM 1226 O LEU A 77 -2.968 0.635 7.003 1.00 0.00 O ATOM 1227 CB LEU A 77 -4.360 3.191 6.330 1.00 0.00 C ATOM 1228 CG LEU A 77 -5.068 4.534 6.501 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -6.288 4.608 5.603 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -5.456 4.750 7.955 1.00 0.00 C ATOM 0 H LEU A 77 -2.016 4.355 5.903 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.306 3.010 8.202 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.128 3.052 5.274 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -5.050 2.396 6.612 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.380 5.328 6.210 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.781 5.571 5.737 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.981 4.499 4.563 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.980 3.807 5.863 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -5.959 5.711 8.058 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.127 3.953 8.275 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.560 4.741 8.576 1.00 0.00 H new ATOM 1242 N GLY A 78 -1.224 1.798 6.197 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.487 0.614 5.824 1.00 0.00 C ATOM 1244 C GLY A 78 0.458 0.883 4.678 1.00 0.00 C ATOM 1245 O GLY A 78 0.613 2.030 4.249 1.00 0.00 O ATOM 0 H GLY A 78 -0.756 2.678 5.977 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.077 0.251 6.683 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.184 -0.175 5.543 1.00 0.00 H new ATOM 1249 N ASN A 79 1.078 -0.165 4.170 1.00 0.00 N ATOM 1250 CA ASN A 79 2.017 -0.033 3.070 1.00 0.00 C ATOM 1251 C ASN A 79 1.703 -1.045 1.987 1.00 0.00 C ATOM 1252 O ASN A 79 0.874 -1.939 2.175 1.00 0.00 O ATOM 1253 CB ASN A 79 3.464 -0.219 3.544 1.00 0.00 C ATOM 1254 CG ASN A 79 3.723 -1.583 4.155 1.00 0.00 C ATOM 1255 OD1 ASN A 79 4.041 -2.543 3.451 1.00 0.00 O ATOM 1256 ND2 ASN A 79 3.601 -1.675 5.470 1.00 0.00 N ATOM 0 H ASN A 79 0.948 -1.121 4.502 1.00 0.00 H new ATOM 0 HA ASN A 79 1.915 0.975 2.667 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.138 -0.073 2.700 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.701 0.551 4.278 1.00 0.00 H new ATOM 0 HD21 ASN A 79 3.772 -2.565 5.937 1.00 0.00 H new ATOM 0 HD22 ASN A 79 3.336 -0.855 6.016 1.00 0.00 H new ATOM 1263 N PHE A 80 2.372 -0.907 0.863 1.00 0.00 N ATOM 1264 CA PHE A 80 2.172 -1.805 -0.258 1.00 0.00 C ATOM 1265 C PHE A 80 3.513 -2.256 -0.810 1.00 0.00 C ATOM 1266 O PHE A 80 4.515 -1.549 -0.678 1.00 0.00 O ATOM 1267 CB PHE A 80 1.336 -1.135 -1.359 1.00 0.00 C ATOM 1268 CG PHE A 80 2.034 -0.014 -2.082 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.090 1.258 -1.537 1.00 0.00 C ATOM 1270 CD2 PHE A 80 2.626 -0.234 -3.318 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.722 2.286 -2.207 1.00 0.00 C ATOM 1272 CE2 PHE A 80 3.261 0.792 -3.991 1.00 0.00 C ATOM 1273 CZ PHE A 80 3.307 2.053 -3.434 1.00 0.00 C ATOM 0 H PHE A 80 3.065 -0.176 0.699 1.00 0.00 H new ATOM 0 HA PHE A 80 1.623 -2.678 0.096 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.044 -1.892 -2.086 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.419 -0.748 -0.915 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.634 1.448 -0.577 1.00 0.00 H new ATOM 0 HD2 PHE A 80 2.590 -1.219 -3.759 1.00 0.00 H new ATOM 0 HE1 PHE A 80 2.758 3.273 -1.770 1.00 0.00 H new ATOM 0 HE2 PHE A 80 3.720 0.607 -4.951 1.00 0.00 H new ATOM 0 HZ PHE A 80 3.801 2.858 -3.959 1.00 0.00 H new ATOM 1283 N HIS A 81 3.528 -3.441 -1.390 1.00 0.00 N ATOM 1284 CA HIS A 81 4.711 -3.963 -2.053 1.00 0.00 C ATOM 1285 C HIS A 81 4.300 -5.025 -3.061 1.00 0.00 C ATOM 1286 O HIS A 81 3.432 -5.856 -2.781 1.00 0.00 O ATOM 1287 CB HIS A 81 5.734 -4.508 -1.040 1.00 0.00 C ATOM 1288 CG HIS A 81 5.210 -5.541 -0.086 1.00 0.00 C ATOM 1289 ND1 HIS A 81 4.664 -5.223 1.141 1.00 0.00 N ATOM 1290 CD2 HIS A 81 5.188 -6.892 -0.163 1.00 0.00 C ATOM 1291 CE1 HIS A 81 4.332 -6.335 1.772 1.00 0.00 C ATOM 1292 NE2 HIS A 81 4.637 -7.363 1.006 1.00 0.00 N ATOM 0 H HIS A 81 2.724 -4.068 -1.416 1.00 0.00 H new ATOM 0 HA HIS A 81 5.204 -3.149 -2.584 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.571 -4.938 -1.590 1.00 0.00 H new ATOM 0 HB3 HIS A 81 6.128 -3.672 -0.462 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.539 -7.491 -0.991 1.00 0.00 H new ATOM 0 HE1 HIS A 81 3.885 -6.392 2.753 1.00 0.00 H new ATOM 0 HE2 HIS A 81 4.489 -8.345 1.241 1.00 0.00 H new ATOM 1301 N SER A 82 4.899 -4.984 -4.237 1.00 0.00 N ATOM 1302 CA SER A 82 4.483 -5.847 -5.329 1.00 0.00 C ATOM 1303 C SER A 82 5.570 -6.845 -5.688 1.00 0.00 C ATOM 1304 O SER A 82 6.743 -6.489 -5.792 1.00 0.00 O ATOM 1305 CB SER A 82 4.136 -4.996 -6.550 1.00 0.00 C ATOM 1306 OG SER A 82 5.249 -4.218 -6.954 1.00 0.00 O ATOM 0 H SER A 82 5.676 -4.362 -4.461 1.00 0.00 H new ATOM 0 HA SER A 82 3.605 -6.407 -5.008 1.00 0.00 H new ATOM 0 HB2 SER A 82 3.820 -5.641 -7.370 1.00 0.00 H new ATOM 0 HB3 SER A 82 3.295 -4.343 -6.316 1.00 0.00 H new ATOM 0 HG SER A 82 5.596 -4.560 -7.804 1.00 0.00 H new ATOM 1312 N HIS A 83 5.167 -8.085 -5.917 1.00 0.00 N ATOM 1313 CA HIS A 83 6.109 -9.137 -6.258 1.00 0.00 C ATOM 1314 C HIS A 83 6.158 -9.322 -7.775 1.00 0.00 C ATOM 1315 O HIS A 83 5.139 -9.181 -8.457 1.00 0.00 O ATOM 1316 CB HIS A 83 5.730 -10.451 -5.561 1.00 0.00 C ATOM 1317 CG HIS A 83 5.815 -10.398 -4.061 1.00 0.00 C ATOM 1318 ND1 HIS A 83 4.949 -11.092 -3.237 1.00 0.00 N ATOM 1319 CD2 HIS A 83 6.675 -9.750 -3.233 1.00 0.00 C ATOM 1320 CE1 HIS A 83 5.270 -10.870 -1.974 1.00 0.00 C ATOM 1321 NE2 HIS A 83 6.313 -10.064 -1.943 1.00 0.00 N ATOM 0 H HIS A 83 4.194 -8.387 -5.873 1.00 0.00 H new ATOM 0 HA HIS A 83 7.100 -8.847 -5.910 1.00 0.00 H new ATOM 0 HB2 HIS A 83 4.714 -10.721 -5.847 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.385 -11.244 -5.923 1.00 0.00 H new ATOM 0 HD2 HIS A 83 7.491 -9.108 -3.531 1.00 0.00 H new ATOM 0 HE1 HIS A 83 4.763 -11.280 -1.113 1.00 0.00 H new ATOM 0 HE2 HIS A 83 6.777 -9.728 -1.099 1.00 0.00 H new ATOM 1330 N PRO A 84 7.347 -9.636 -8.319 1.00 0.00 N ATOM 1331 CA PRO A 84 7.577 -9.694 -9.770 1.00 0.00 C ATOM 1332 C PRO A 84 6.827 -10.829 -10.465 1.00 0.00 C ATOM 1333 O PRO A 84 6.065 -10.595 -11.403 1.00 0.00 O ATOM 1334 CB PRO A 84 9.093 -9.918 -9.891 1.00 0.00 C ATOM 1335 CG PRO A 84 9.652 -9.615 -8.542 1.00 0.00 C ATOM 1336 CD PRO A 84 8.569 -9.939 -7.561 1.00 0.00 C ATOM 0 HA PRO A 84 7.215 -8.787 -10.254 1.00 0.00 H new ATOM 0 HB2 PRO A 84 9.315 -10.943 -10.186 1.00 0.00 H new ATOM 0 HB3 PRO A 84 9.526 -9.267 -10.650 1.00 0.00 H new ATOM 0 HG2 PRO A 84 10.545 -10.210 -8.348 1.00 0.00 H new ATOM 0 HG3 PRO A 84 9.944 -8.568 -8.468 1.00 0.00 H new ATOM 0 HD2 PRO A 84 8.604 -10.983 -7.249 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.646 -9.334 -6.658 1.00 0.00 H new ATOM 1344 N ALA A 85 7.044 -12.053 -10.008 1.00 0.00 N ATOM 1345 CA ALA A 85 6.454 -13.218 -10.651 1.00 0.00 C ATOM 1346 C ALA A 85 6.178 -14.313 -9.632 1.00 0.00 C ATOM 1347 O ALA A 85 6.694 -15.430 -9.740 1.00 0.00 O ATOM 1348 CB ALA A 85 7.367 -13.728 -11.754 1.00 0.00 C ATOM 0 H ALA A 85 7.623 -12.266 -9.196 1.00 0.00 H new ATOM 0 HA ALA A 85 5.503 -12.924 -11.096 1.00 0.00 H new ATOM 0 HB1 ALA A 85 6.914 -14.599 -12.227 1.00 0.00 H new ATOM 0 HB2 ALA A 85 7.511 -12.945 -12.498 1.00 0.00 H new ATOM 0 HB3 ALA A 85 8.331 -14.006 -11.329 1.00 0.00 H new ATOM 1354 N THR A 86 5.367 -13.978 -8.643 1.00 0.00 N ATOM 1355 CA THR A 86 5.014 -14.898 -7.571 1.00 0.00 C ATOM 1356 C THR A 86 3.601 -14.599 -7.069 1.00 0.00 C ATOM 1357 O THR A 86 3.073 -13.515 -7.328 1.00 0.00 O ATOM 1358 CB THR A 86 6.020 -14.808 -6.400 1.00 0.00 C ATOM 1359 OG1 THR A 86 6.475 -13.457 -6.237 1.00 0.00 O ATOM 1360 CG2 THR A 86 7.215 -15.724 -6.624 1.00 0.00 C ATOM 0 H THR A 86 4.933 -13.059 -8.559 1.00 0.00 H new ATOM 0 HA THR A 86 5.050 -15.911 -7.971 1.00 0.00 H new ATOM 0 HB THR A 86 5.504 -15.130 -5.496 1.00 0.00 H new ATOM 0 HG1 THR A 86 7.110 -13.413 -5.492 1.00 0.00 H new ATOM 0 HG21 THR A 86 7.903 -15.637 -5.783 1.00 0.00 H new ATOM 0 HG22 THR A 86 6.872 -16.755 -6.707 1.00 0.00 H new ATOM 0 HG23 THR A 86 7.727 -15.437 -7.542 1.00 0.00 H new ATOM 1368 N PRO A 87 2.966 -15.555 -6.360 1.00 0.00 N ATOM 1369 CA PRO A 87 1.593 -15.397 -5.861 1.00 0.00 C ATOM 1370 C PRO A 87 1.441 -14.198 -4.929 1.00 0.00 C ATOM 1371 O PRO A 87 2.393 -13.780 -4.261 1.00 0.00 O ATOM 1372 CB PRO A 87 1.320 -16.705 -5.105 1.00 0.00 C ATOM 1373 CG PRO A 87 2.663 -17.298 -4.851 1.00 0.00 C ATOM 1374 CD PRO A 87 3.528 -16.864 -5.997 1.00 0.00 C ATOM 0 HA PRO A 87 0.892 -15.212 -6.675 1.00 0.00 H new ATOM 0 HB2 PRO A 87 0.790 -16.517 -4.171 1.00 0.00 H new ATOM 0 HB3 PRO A 87 0.698 -17.378 -5.695 1.00 0.00 H new ATOM 0 HG2 PRO A 87 3.070 -16.951 -3.901 1.00 0.00 H new ATOM 0 HG3 PRO A 87 2.606 -18.385 -4.795 1.00 0.00 H new ATOM 0 HD2 PRO A 87 4.575 -16.786 -5.705 1.00 0.00 H new ATOM 0 HD3 PRO A 87 3.480 -17.568 -6.828 1.00 0.00 H new ATOM 1382 N ALA A 88 0.238 -13.643 -4.890 1.00 0.00 N ATOM 1383 CA ALA A 88 -0.040 -12.473 -4.071 1.00 0.00 C ATOM 1384 C ALA A 88 -0.386 -12.878 -2.644 1.00 0.00 C ATOM 1385 O ALA A 88 -1.505 -12.674 -2.182 1.00 0.00 O ATOM 1386 CB ALA A 88 -1.165 -11.648 -4.685 1.00 0.00 C ATOM 0 H ALA A 88 -0.564 -13.986 -5.419 1.00 0.00 H new ATOM 0 HA ALA A 88 0.860 -11.859 -4.037 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -1.360 -10.777 -4.060 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.873 -11.321 -5.683 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -2.067 -12.256 -4.752 1.00 0.00 H new ATOM 1392 N ARG A 89 0.576 -13.479 -1.965 1.00 0.00 N ATOM 1393 CA ARG A 89 0.418 -13.852 -0.569 1.00 0.00 C ATOM 1394 C ARG A 89 1.720 -13.599 0.179 1.00 0.00 C ATOM 1395 O ARG A 89 2.804 -13.763 -0.387 1.00 0.00 O ATOM 1396 CB ARG A 89 -0.005 -15.324 -0.433 1.00 0.00 C ATOM 1397 CG ARG A 89 -1.484 -15.557 -0.714 1.00 0.00 C ATOM 1398 CD ARG A 89 -1.881 -17.012 -0.528 1.00 0.00 C ATOM 1399 NE ARG A 89 -3.335 -17.179 -0.585 1.00 0.00 N ATOM 1400 CZ ARG A 89 -3.957 -18.350 -0.708 1.00 0.00 C ATOM 1401 NH1 ARG A 89 -3.261 -19.473 -0.823 1.00 0.00 N ATOM 1402 NH2 ARG A 89 -5.286 -18.382 -0.724 1.00 0.00 N ATOM 0 H ARG A 89 1.484 -13.721 -2.363 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.371 -13.239 -0.133 1.00 0.00 H new ATOM 0 HB2 ARG A 89 0.587 -15.929 -1.119 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.224 -15.669 0.575 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -2.081 -14.932 -0.050 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.712 -15.248 -1.734 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -1.412 -17.621 -1.301 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.509 -17.373 0.431 1.00 0.00 H new ATOM 0 HE ARG A 89 -3.911 -16.340 -0.526 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -2.241 -19.444 -0.818 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -3.745 -20.366 -0.917 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -5.818 -17.516 -0.643 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -5.774 -19.273 -0.818 1.00 0.00 H new ATOM 1416 N PRO A 90 1.630 -13.176 1.449 1.00 0.00 N ATOM 1417 CA PRO A 90 2.802 -12.849 2.265 1.00 0.00 C ATOM 1418 C PRO A 90 3.670 -14.068 2.554 1.00 0.00 C ATOM 1419 O PRO A 90 3.214 -15.039 3.161 1.00 0.00 O ATOM 1420 CB PRO A 90 2.207 -12.302 3.571 1.00 0.00 C ATOM 1421 CG PRO A 90 0.779 -12.008 3.265 1.00 0.00 C ATOM 1422 CD PRO A 90 0.380 -12.980 2.195 1.00 0.00 C ATOM 0 HA PRO A 90 3.456 -12.143 1.754 1.00 0.00 H new ATOM 0 HB2 PRO A 90 2.294 -13.030 4.377 1.00 0.00 H new ATOM 0 HB3 PRO A 90 2.732 -11.404 3.895 1.00 0.00 H new ATOM 0 HG2 PRO A 90 0.157 -12.127 4.152 1.00 0.00 H new ATOM 0 HG3 PRO A 90 0.656 -10.980 2.924 1.00 0.00 H new ATOM 0 HD2 PRO A 90 0.010 -13.915 2.616 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -0.411 -12.580 1.560 1.00 0.00 H new ATOM 1430 N SER A 91 4.916 -14.011 2.102 1.00 0.00 N ATOM 1431 CA SER A 91 5.889 -15.051 2.391 1.00 0.00 C ATOM 1432 C SER A 91 6.278 -14.992 3.870 1.00 0.00 C ATOM 1433 O SER A 91 5.805 -14.121 4.598 1.00 0.00 O ATOM 1434 CB SER A 91 7.118 -14.863 1.501 1.00 0.00 C ATOM 1435 OG SER A 91 6.735 -14.691 0.146 1.00 0.00 O ATOM 0 H SER A 91 5.277 -13.248 1.529 1.00 0.00 H new ATOM 0 HA SER A 91 5.456 -16.030 2.184 1.00 0.00 H new ATOM 0 HB2 SER A 91 7.686 -13.995 1.836 1.00 0.00 H new ATOM 0 HB3 SER A 91 7.774 -15.729 1.591 1.00 0.00 H new ATOM 0 HG SER A 91 7.535 -14.571 -0.407 1.00 0.00 H new ATOM 1441 N ALA A 92 7.139 -15.895 4.315 1.00 0.00 N ATOM 1442 CA ALA A 92 7.487 -15.968 5.729 1.00 0.00 C ATOM 1443 C ALA A 92 8.159 -14.686 6.210 1.00 0.00 C ATOM 1444 O ALA A 92 7.770 -14.128 7.232 1.00 0.00 O ATOM 1445 CB ALA A 92 8.387 -17.163 5.992 1.00 0.00 C ATOM 0 H ALA A 92 7.607 -16.583 3.725 1.00 0.00 H new ATOM 0 HA ALA A 92 6.561 -16.089 6.290 1.00 0.00 H new ATOM 0 HB1 ALA A 92 8.638 -17.203 7.052 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.869 -18.079 5.707 1.00 0.00 H new ATOM 0 HB3 ALA A 92 9.301 -17.066 5.406 1.00 0.00 H new ATOM 1451 N GLU A 93 9.151 -14.210 5.468 1.00 0.00 N ATOM 1452 CA GLU A 93 9.833 -12.970 5.825 1.00 0.00 C ATOM 1453 C GLU A 93 8.953 -11.758 5.521 1.00 0.00 C ATOM 1454 O GLU A 93 8.979 -10.768 6.250 1.00 0.00 O ATOM 1455 CB GLU A 93 11.187 -12.867 5.119 1.00 0.00 C ATOM 1456 CG GLU A 93 11.117 -12.985 3.608 1.00 0.00 C ATOM 1457 CD GLU A 93 12.492 -13.025 2.979 1.00 0.00 C ATOM 1458 OE1 GLU A 93 13.048 -11.949 2.692 1.00 0.00 O ATOM 1459 OE2 GLU A 93 13.027 -14.141 2.785 1.00 0.00 O ATOM 0 H GLU A 93 9.500 -14.659 4.621 1.00 0.00 H new ATOM 0 HA GLU A 93 10.021 -12.983 6.899 1.00 0.00 H new ATOM 0 HB2 GLU A 93 11.645 -11.912 5.376 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.843 -13.648 5.502 1.00 0.00 H new ATOM 0 HG2 GLU A 93 10.569 -13.888 3.340 1.00 0.00 H new ATOM 0 HG3 GLU A 93 10.558 -12.141 3.204 1.00 0.00 H new ATOM 1466 N ASP A 94 8.164 -11.862 4.453 1.00 0.00 N ATOM 1467 CA ASP A 94 7.210 -10.816 4.072 1.00 0.00 C ATOM 1468 C ASP A 94 6.228 -10.578 5.222 1.00 0.00 C ATOM 1469 O ASP A 94 5.938 -9.442 5.592 1.00 0.00 O ATOM 1470 CB ASP A 94 6.456 -11.255 2.807 1.00 0.00 C ATOM 1471 CG ASP A 94 5.751 -10.118 2.079 1.00 0.00 C ATOM 1472 OD1 ASP A 94 4.718 -9.628 2.573 1.00 0.00 O ATOM 1473 OD2 ASP A 94 6.215 -9.730 0.986 1.00 0.00 O ATOM 0 H ASP A 94 8.166 -12.669 3.829 1.00 0.00 H new ATOM 0 HA ASP A 94 7.740 -9.887 3.865 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.160 -11.729 2.123 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.719 -12.010 3.080 1.00 0.00 H new ATOM 1478 N LYS A 95 5.752 -11.679 5.797 1.00 0.00 N ATOM 1479 CA LYS A 95 4.849 -11.648 6.946 1.00 0.00 C ATOM 1480 C LYS A 95 5.589 -11.208 8.210 1.00 0.00 C ATOM 1481 O LYS A 95 5.041 -10.501 9.054 1.00 0.00 O ATOM 1482 CB LYS A 95 4.255 -13.047 7.167 1.00 0.00 C ATOM 1483 CG LYS A 95 3.226 -13.111 8.285 1.00 0.00 C ATOM 1484 CD LYS A 95 2.714 -14.529 8.488 1.00 0.00 C ATOM 1485 CE LYS A 95 1.781 -14.624 9.687 1.00 0.00 C ATOM 1486 NZ LYS A 95 1.274 -16.009 9.889 1.00 0.00 N ATOM 0 H LYS A 95 5.982 -12.621 5.479 1.00 0.00 H new ATOM 0 HA LYS A 95 4.054 -10.931 6.741 1.00 0.00 H new ATOM 0 HB2 LYS A 95 3.791 -13.384 6.240 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.064 -13.743 7.391 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.670 -12.747 9.211 1.00 0.00 H new ATOM 0 HG3 LYS A 95 2.391 -12.451 8.051 1.00 0.00 H new ATOM 0 HD2 LYS A 95 2.189 -14.858 7.591 1.00 0.00 H new ATOM 0 HD3 LYS A 95 3.558 -15.204 8.629 1.00 0.00 H new ATOM 0 HE2 LYS A 95 2.308 -14.296 10.583 1.00 0.00 H new ATOM 0 HE3 LYS A 95 0.939 -13.946 9.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 0.642 -16.030 10.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 0.749 -16.313 9.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 2.075 -16.652 10.049 1.00 0.00 H new ATOM 1500 N ARG A 96 6.840 -11.634 8.321 1.00 0.00 N ATOM 1501 CA ARG A 96 7.651 -11.413 9.504 1.00 0.00 C ATOM 1502 C ARG A 96 7.955 -9.932 9.730 1.00 0.00 C ATOM 1503 O ARG A 96 8.230 -9.513 10.855 1.00 0.00 O ATOM 1504 CB ARG A 96 8.946 -12.214 9.356 1.00 0.00 C ATOM 1505 CG ARG A 96 9.930 -12.013 10.481 1.00 0.00 C ATOM 1506 CD ARG A 96 11.124 -12.938 10.332 1.00 0.00 C ATOM 1507 NE ARG A 96 12.196 -12.608 11.267 1.00 0.00 N ATOM 1508 CZ ARG A 96 12.585 -13.391 12.268 1.00 0.00 C ATOM 1509 NH1 ARG A 96 11.969 -14.546 12.502 1.00 0.00 N ATOM 1510 NH2 ARG A 96 13.593 -13.018 13.038 1.00 0.00 N ATOM 0 H ARG A 96 7.322 -12.147 7.583 1.00 0.00 H new ATOM 0 HA ARG A 96 7.094 -11.748 10.379 1.00 0.00 H new ATOM 0 HB2 ARG A 96 8.699 -13.274 9.290 1.00 0.00 H new ATOM 0 HB3 ARG A 96 9.425 -11.939 8.416 1.00 0.00 H new ATOM 0 HG2 ARG A 96 10.268 -10.977 10.493 1.00 0.00 H new ATOM 0 HG3 ARG A 96 9.439 -12.199 11.436 1.00 0.00 H new ATOM 0 HD2 ARG A 96 10.806 -13.968 10.495 1.00 0.00 H new ATOM 0 HD3 ARG A 96 11.503 -12.879 9.312 1.00 0.00 H new ATOM 0 HE ARG A 96 12.678 -11.718 11.144 1.00 0.00 H new ATOM 0 HH11 ARG A 96 11.191 -14.838 11.911 1.00 0.00 H new ATOM 0 HH12 ARG A 96 12.275 -15.140 13.273 1.00 0.00 H new ATOM 0 HH21 ARG A 96 14.068 -12.133 12.863 1.00 0.00 H new ATOM 0 HH22 ARG A 96 13.895 -13.615 13.807 1.00 0.00 H new ATOM 1524 N LEU A 97 7.893 -9.140 8.671 1.00 0.00 N ATOM 1525 CA LEU A 97 8.209 -7.723 8.761 1.00 0.00 C ATOM 1526 C LEU A 97 7.017 -6.912 9.273 1.00 0.00 C ATOM 1527 O LEU A 97 7.026 -5.681 9.232 1.00 0.00 O ATOM 1528 CB LEU A 97 8.664 -7.200 7.399 1.00 0.00 C ATOM 1529 CG LEU A 97 9.956 -7.824 6.862 1.00 0.00 C ATOM 1530 CD1 LEU A 97 10.305 -7.246 5.500 1.00 0.00 C ATOM 1531 CD2 LEU A 97 11.102 -7.604 7.840 1.00 0.00 C ATOM 0 H LEU A 97 7.626 -9.455 7.738 1.00 0.00 H new ATOM 0 HA LEU A 97 9.020 -7.605 9.479 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.867 -7.373 6.676 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.802 -6.121 7.469 1.00 0.00 H new ATOM 0 HG LEU A 97 9.796 -8.896 6.750 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.226 -7.702 5.136 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.496 -7.452 4.799 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.444 -6.168 5.587 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.011 -8.054 7.442 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.258 -6.535 7.983 1.00 0.00 H new ATOM 0 HD23 LEU A 97 10.858 -8.066 8.797 1.00 0.00 H new ATOM 1543 N ALA A 98 5.999 -7.607 9.764 1.00 0.00 N ATOM 1544 CA ALA A 98 4.827 -6.953 10.317 1.00 0.00 C ATOM 1545 C ALA A 98 4.918 -6.893 11.837 1.00 0.00 C ATOM 1546 O ALA A 98 4.694 -7.888 12.526 1.00 0.00 O ATOM 1547 CB ALA A 98 3.557 -7.668 9.888 1.00 0.00 C ATOM 0 H ALA A 98 5.964 -8.626 9.789 1.00 0.00 H new ATOM 0 HA ALA A 98 4.791 -5.934 9.931 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.692 -7.160 10.314 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.484 -7.659 8.801 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.583 -8.699 10.241 1.00 0.00 H new ATOM 1553 N PHE A 99 5.292 -5.731 12.346 1.00 0.00 N ATOM 1554 CA PHE A 99 5.363 -5.509 13.786 1.00 0.00 C ATOM 1555 C PHE A 99 4.346 -4.453 14.199 1.00 0.00 C ATOM 1556 O PHE A 99 4.395 -3.908 15.306 1.00 0.00 O ATOM 1557 CB PHE A 99 6.773 -5.074 14.197 1.00 0.00 C ATOM 1558 CG PHE A 99 7.821 -6.127 13.967 1.00 0.00 C ATOM 1559 CD1 PHE A 99 7.994 -7.159 14.875 1.00 0.00 C ATOM 1560 CD2 PHE A 99 8.636 -6.081 12.847 1.00 0.00 C ATOM 1561 CE1 PHE A 99 8.959 -8.127 14.669 1.00 0.00 C ATOM 1562 CE2 PHE A 99 9.602 -7.046 12.637 1.00 0.00 C ATOM 1563 CZ PHE A 99 9.763 -8.069 13.548 1.00 0.00 C ATOM 0 H PHE A 99 5.553 -4.922 11.783 1.00 0.00 H new ATOM 0 HA PHE A 99 5.131 -6.445 14.294 1.00 0.00 H new ATOM 0 HB2 PHE A 99 7.044 -4.177 13.640 1.00 0.00 H new ATOM 0 HB3 PHE A 99 6.767 -4.804 15.253 1.00 0.00 H new ATOM 0 HD1 PHE A 99 7.368 -7.208 15.754 1.00 0.00 H new ATOM 0 HD2 PHE A 99 8.515 -5.282 12.131 1.00 0.00 H new ATOM 0 HE1 PHE A 99 9.084 -8.927 15.384 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.231 -6.999 11.760 1.00 0.00 H new ATOM 0 HZ PHE A 99 10.518 -8.824 13.385 1.00 0.00 H new ATOM 1573 N ASP A 100 3.423 -4.179 13.297 1.00 0.00 N ATOM 1574 CA ASP A 100 2.378 -3.189 13.513 1.00 0.00 C ATOM 1575 C ASP A 100 1.201 -3.812 14.265 1.00 0.00 C ATOM 1576 O ASP A 100 1.143 -5.030 14.430 1.00 0.00 O ATOM 1577 CB ASP A 100 1.906 -2.636 12.171 1.00 0.00 C ATOM 1578 CG ASP A 100 1.254 -3.701 11.319 1.00 0.00 C ATOM 1579 OD1 ASP A 100 1.993 -4.500 10.706 1.00 0.00 O ATOM 1580 OD2 ASP A 100 0.010 -3.742 11.274 1.00 0.00 O ATOM 0 H ASP A 100 3.374 -4.638 12.387 1.00 0.00 H new ATOM 0 HA ASP A 100 2.783 -2.375 14.114 1.00 0.00 H new ATOM 0 HB2 ASP A 100 1.199 -1.824 12.342 1.00 0.00 H new ATOM 0 HB3 ASP A 100 2.755 -2.212 11.635 1.00 0.00 H new ATOM 1585 N PRO A 101 0.275 -2.986 14.785 1.00 0.00 N ATOM 1586 CA PRO A 101 -0.902 -3.488 15.496 1.00 0.00 C ATOM 1587 C PRO A 101 -1.883 -4.230 14.589 1.00 0.00 C ATOM 1588 O PRO A 101 -2.197 -5.396 14.837 1.00 0.00 O ATOM 1589 CB PRO A 101 -1.559 -2.221 16.064 1.00 0.00 C ATOM 1590 CG PRO A 101 -0.530 -1.147 15.946 1.00 0.00 C ATOM 1591 CD PRO A 101 0.317 -1.516 14.765 1.00 0.00 C ATOM 0 HA PRO A 101 -0.618 -4.217 16.255 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -2.460 -1.963 15.507 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -1.857 -2.366 17.102 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -0.997 -0.173 15.802 1.00 0.00 H new ATOM 0 HG3 PRO A 101 0.072 -1.081 16.853 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -0.085 -1.112 13.836 1.00 0.00 H new ATOM 0 HD3 PRO A 101 1.335 -1.138 14.863 1.00 0.00 H new ATOM 1599 N SER A 102 -2.349 -3.555 13.537 1.00 0.00 N ATOM 1600 CA SER A 102 -3.365 -4.095 12.637 1.00 0.00 C ATOM 1601 C SER A 102 -3.520 -3.194 11.413 1.00 0.00 C ATOM 1602 O SER A 102 -4.620 -2.723 11.101 1.00 0.00 O ATOM 1603 CB SER A 102 -4.717 -4.221 13.351 1.00 0.00 C ATOM 1604 OG SER A 102 -4.712 -5.267 14.308 1.00 0.00 O ATOM 0 H SER A 102 -2.032 -2.619 13.286 1.00 0.00 H new ATOM 0 HA SER A 102 -3.040 -5.086 12.320 1.00 0.00 H new ATOM 0 HB2 SER A 102 -4.957 -3.279 13.844 1.00 0.00 H new ATOM 0 HB3 SER A 102 -5.500 -4.405 12.616 1.00 0.00 H new ATOM 0 HG SER A 102 -3.824 -5.680 14.336 1.00 0.00 H new ATOM 1610 N LEU A 103 -2.414 -2.934 10.741 1.00 0.00 N ATOM 1611 CA LEU A 103 -2.428 -2.107 9.543 1.00 0.00 C ATOM 1612 C LEU A 103 -2.850 -2.926 8.329 1.00 0.00 C ATOM 1613 O LEU A 103 -2.970 -4.148 8.400 1.00 0.00 O ATOM 1614 CB LEU A 103 -1.052 -1.480 9.310 1.00 0.00 C ATOM 1615 CG LEU A 103 -0.625 -0.437 10.344 1.00 0.00 C ATOM 1616 CD1 LEU A 103 0.760 0.097 10.019 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -1.636 0.699 10.408 1.00 0.00 C ATOM 0 H LEU A 103 -1.492 -3.283 11.003 1.00 0.00 H new ATOM 0 HA LEU A 103 -3.155 -1.307 9.688 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.307 -2.275 9.292 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.045 -1.014 8.324 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.588 -0.917 11.322 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.048 0.838 10.765 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.477 -0.724 10.027 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.749 0.560 9.032 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.315 1.431 11.149 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.707 1.178 9.432 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -2.612 0.302 10.689 1.00 0.00 H new ATOM 1629 N SER A 104 -3.086 -2.248 7.216 1.00 0.00 N ATOM 1630 CA SER A 104 -3.535 -2.912 6.005 1.00 0.00 C ATOM 1631 C SER A 104 -2.417 -2.961 4.968 1.00 0.00 C ATOM 1632 O SER A 104 -2.018 -1.930 4.417 1.00 0.00 O ATOM 1633 CB SER A 104 -4.752 -2.188 5.432 1.00 0.00 C ATOM 1634 OG SER A 104 -5.755 -2.023 6.423 1.00 0.00 O ATOM 0 H SER A 104 -2.974 -1.238 7.128 1.00 0.00 H new ATOM 0 HA SER A 104 -3.814 -3.935 6.256 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.452 -1.214 5.046 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.155 -2.754 4.592 1.00 0.00 H new ATOM 0 HG SER A 104 -6.577 -2.473 6.135 1.00 0.00 H new ATOM 1640 N TYR A 105 -1.909 -4.161 4.721 1.00 0.00 N ATOM 1641 CA TYR A 105 -0.846 -4.361 3.745 1.00 0.00 C ATOM 1642 C TYR A 105 -1.436 -4.718 2.390 1.00 0.00 C ATOM 1643 O TYR A 105 -2.367 -5.518 2.302 1.00 0.00 O ATOM 1644 CB TYR A 105 0.108 -5.470 4.207 1.00 0.00 C ATOM 1645 CG TYR A 105 0.981 -5.085 5.380 1.00 0.00 C ATOM 1646 CD1 TYR A 105 0.427 -4.675 6.585 1.00 0.00 C ATOM 1647 CD2 TYR A 105 2.364 -5.138 5.281 1.00 0.00 C ATOM 1648 CE1 TYR A 105 1.225 -4.326 7.654 1.00 0.00 C ATOM 1649 CE2 TYR A 105 3.170 -4.791 6.346 1.00 0.00 C ATOM 1650 CZ TYR A 105 2.595 -4.385 7.531 1.00 0.00 C ATOM 1651 OH TYR A 105 3.391 -4.038 8.597 1.00 0.00 O ATOM 0 H TYR A 105 -2.218 -5.015 5.186 1.00 0.00 H new ATOM 0 HA TYR A 105 -0.284 -3.431 3.655 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.477 -6.349 4.477 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.747 -5.757 3.371 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -0.647 -4.629 6.687 1.00 0.00 H new ATOM 0 HD2 TYR A 105 2.818 -5.456 4.354 1.00 0.00 H new ATOM 0 HE1 TYR A 105 0.777 -4.008 8.584 1.00 0.00 H new ATOM 0 HE2 TYR A 105 4.245 -4.837 6.252 1.00 0.00 H new ATOM 0 HH TYR A 105 2.857 -4.039 9.418 1.00 0.00 H new ATOM 1661 N LEU A 106 -0.916 -4.106 1.341 1.00 0.00 N ATOM 1662 CA LEU A 106 -1.355 -4.418 -0.010 1.00 0.00 C ATOM 1663 C LEU A 106 -0.267 -5.161 -0.763 1.00 0.00 C ATOM 1664 O LEU A 106 0.892 -4.740 -0.778 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.754 -3.155 -0.782 1.00 0.00 C ATOM 1666 CG LEU A 106 -3.111 -2.547 -0.411 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -3.061 -1.880 0.957 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.549 -1.555 -1.478 1.00 0.00 C ATOM 0 H LEU A 106 -0.191 -3.391 1.397 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.236 -5.055 0.072 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -0.984 -2.399 -0.627 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.761 -3.390 -1.846 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.843 -3.353 -0.359 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.038 -1.458 1.192 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.793 -2.619 1.712 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.315 -1.085 0.947 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.514 -1.129 -1.204 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.810 -0.758 -1.559 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.637 -2.067 -2.436 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.644 -6.274 -1.371 1.00 0.00 N ATOM 1681 CA ILE A 107 0.284 -7.066 -2.157 1.00 0.00 C ATOM 1682 C ILE A 107 -0.272 -7.276 -3.557 1.00 0.00 C ATOM 1683 O ILE A 107 -1.351 -7.845 -3.732 1.00 0.00 O ATOM 1684 CB ILE A 107 0.580 -8.435 -1.500 1.00 0.00 C ATOM 1685 CG1 ILE A 107 1.195 -8.238 -0.107 1.00 0.00 C ATOM 1686 CG2 ILE A 107 1.509 -9.259 -2.387 1.00 0.00 C ATOM 1687 CD1 ILE A 107 1.500 -9.533 0.615 1.00 0.00 C ATOM 0 H ILE A 107 -1.592 -6.650 -1.334 1.00 0.00 H new ATOM 0 HA ILE A 107 1.223 -6.515 -2.210 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.358 -8.978 -1.387 1.00 0.00 H new ATOM 0 HG12 ILE A 107 2.115 -7.662 -0.205 1.00 0.00 H new ATOM 0 HG13 ILE A 107 0.511 -7.646 0.501 1.00 0.00 H new ATOM 0 HG21 ILE A 107 1.708 -10.220 -1.912 1.00 0.00 H new ATOM 0 HG22 ILE A 107 1.036 -9.424 -3.355 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.447 -8.723 -2.529 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.932 -9.312 1.591 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.580 -10.102 0.746 1.00 0.00 H new ATOM 0 HD13 ILE A 107 2.208 -10.118 0.029 1.00 0.00 H new ATOM 1699 N ILE A 108 0.453 -6.784 -4.548 1.00 0.00 N ATOM 1700 CA ILE A 108 0.032 -6.913 -5.930 1.00 0.00 C ATOM 1701 C ILE A 108 1.060 -7.720 -6.716 1.00 0.00 C ATOM 1702 O ILE A 108 2.261 -7.464 -6.628 1.00 0.00 O ATOM 1703 CB ILE A 108 -0.158 -5.526 -6.589 1.00 0.00 C ATOM 1704 CG1 ILE A 108 -1.130 -4.670 -5.763 1.00 0.00 C ATOM 1705 CG2 ILE A 108 -0.666 -5.679 -8.018 1.00 0.00 C ATOM 1706 CD1 ILE A 108 -1.301 -3.261 -6.290 1.00 0.00 C ATOM 0 H ILE A 108 1.337 -6.291 -4.419 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.926 -7.432 -5.943 1.00 0.00 H new ATOM 0 HB ILE A 108 0.808 -5.022 -6.619 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -2.103 -5.161 -5.741 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -0.774 -4.623 -4.734 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -0.794 -4.694 -8.466 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.055 -6.252 -8.601 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -1.623 -6.201 -8.010 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -2.001 -2.718 -5.656 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.337 -2.752 -6.286 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -1.688 -3.298 -7.308 1.00 0.00 H new ATOM 1718 N SER A 109 0.591 -8.707 -7.455 1.00 0.00 N ATOM 1719 CA SER A 109 1.468 -9.539 -8.258 1.00 0.00 C ATOM 1720 C SER A 109 1.375 -9.168 -9.729 1.00 0.00 C ATOM 1721 O SER A 109 0.327 -9.319 -10.363 1.00 0.00 O ATOM 1722 CB SER A 109 1.129 -11.013 -8.061 1.00 0.00 C ATOM 1723 OG SER A 109 1.400 -11.421 -6.735 1.00 0.00 O ATOM 0 H SER A 109 -0.397 -8.953 -7.516 1.00 0.00 H new ATOM 0 HA SER A 109 2.493 -9.367 -7.929 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.077 -11.182 -8.290 1.00 0.00 H new ATOM 0 HB3 SER A 109 1.708 -11.619 -8.758 1.00 0.00 H new ATOM 0 HG SER A 109 1.993 -12.201 -6.748 1.00 0.00 H new ATOM 1729 N LEU A 110 2.480 -8.684 -10.267 1.00 0.00 N ATOM 1730 CA LEU A 110 2.561 -8.343 -11.678 1.00 0.00 C ATOM 1731 C LEU A 110 3.085 -9.530 -12.470 1.00 0.00 C ATOM 1732 O LEU A 110 4.017 -9.394 -13.265 1.00 0.00 O ATOM 1733 CB LEU A 110 3.472 -7.129 -11.897 1.00 0.00 C ATOM 1734 CG LEU A 110 2.807 -5.756 -11.768 1.00 0.00 C ATOM 1735 CD1 LEU A 110 1.713 -5.592 -12.809 1.00 0.00 C ATOM 1736 CD2 LEU A 110 2.248 -5.544 -10.372 1.00 0.00 C ATOM 0 H LEU A 110 3.340 -8.517 -9.745 1.00 0.00 H new ATOM 0 HA LEU A 110 1.560 -8.089 -12.026 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.292 -7.182 -11.181 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.912 -7.205 -12.891 1.00 0.00 H new ATOM 0 HG LEU A 110 3.571 -4.998 -11.943 1.00 0.00 H new ATOM 0 HD11 LEU A 110 1.252 -4.610 -12.701 1.00 0.00 H new ATOM 0 HD12 LEU A 110 2.143 -5.683 -13.806 1.00 0.00 H new ATOM 0 HD13 LEU A 110 0.957 -6.365 -12.668 1.00 0.00 H new ATOM 0 HD21 LEU A 110 1.782 -4.560 -10.312 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.504 -6.311 -10.158 1.00 0.00 H new ATOM 0 HD23 LEU A 110 3.056 -5.608 -9.643 1.00 0.00 H new ATOM 1748 N ALA A 111 2.483 -10.694 -12.239 1.00 0.00 N ATOM 1749 CA ALA A 111 2.861 -11.908 -12.947 1.00 0.00 C ATOM 1750 C ALA A 111 2.753 -11.683 -14.449 1.00 0.00 C ATOM 1751 O ALA A 111 3.664 -12.022 -15.210 1.00 0.00 O ATOM 1752 CB ALA A 111 1.988 -13.073 -12.512 1.00 0.00 C ATOM 0 H ALA A 111 1.729 -10.819 -11.564 1.00 0.00 H new ATOM 0 HA ALA A 111 3.895 -12.154 -12.703 1.00 0.00 H new ATOM 0 HB1 ALA A 111 2.285 -13.972 -13.052 1.00 0.00 H new ATOM 0 HB2 ALA A 111 2.107 -13.237 -11.441 1.00 0.00 H new ATOM 0 HB3 ALA A 111 0.944 -12.847 -12.731 1.00 0.00 H new ATOM 1758 N GLU A 112 1.630 -11.115 -14.869 1.00 0.00 N ATOM 1759 CA GLU A 112 1.493 -10.607 -16.219 1.00 0.00 C ATOM 1760 C GLU A 112 0.673 -9.313 -16.171 1.00 0.00 C ATOM 1761 O GLU A 112 -0.277 -9.207 -15.394 1.00 0.00 O ATOM 1762 CB GLU A 112 0.822 -11.648 -17.125 1.00 0.00 C ATOM 1763 CG GLU A 112 1.236 -11.533 -18.581 1.00 0.00 C ATOM 1764 CD GLU A 112 0.554 -12.543 -19.476 1.00 0.00 C ATOM 1765 OE1 GLU A 112 0.934 -13.732 -19.439 1.00 0.00 O ATOM 1766 OE2 GLU A 112 -0.349 -12.148 -20.238 1.00 0.00 O ATOM 0 H GLU A 112 0.800 -10.996 -14.288 1.00 0.00 H new ATOM 0 HA GLU A 112 2.478 -10.400 -16.637 1.00 0.00 H new ATOM 0 HB2 GLU A 112 1.067 -12.646 -16.763 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -0.260 -11.539 -17.052 1.00 0.00 H new ATOM 0 HG2 GLU A 112 1.009 -10.529 -18.938 1.00 0.00 H new ATOM 0 HG3 GLU A 112 2.316 -11.661 -18.656 1.00 0.00 H new ATOM 1773 N PRO A 113 1.016 -8.311 -17.000 1.00 0.00 N ATOM 1774 CA PRO A 113 0.390 -6.985 -16.933 1.00 0.00 C ATOM 1775 C PRO A 113 -1.027 -6.939 -17.485 1.00 0.00 C ATOM 1776 O PRO A 113 -1.689 -5.902 -17.413 1.00 0.00 O ATOM 1777 CB PRO A 113 1.318 -6.116 -17.776 1.00 0.00 C ATOM 1778 CG PRO A 113 1.930 -7.056 -18.756 1.00 0.00 C ATOM 1779 CD PRO A 113 2.053 -8.379 -18.048 1.00 0.00 C ATOM 0 HA PRO A 113 0.279 -6.659 -15.899 1.00 0.00 H new ATOM 0 HB2 PRO A 113 0.767 -5.322 -18.280 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.078 -5.636 -17.160 1.00 0.00 H new ATOM 0 HG2 PRO A 113 1.309 -7.148 -19.647 1.00 0.00 H new ATOM 0 HG3 PRO A 113 2.906 -6.697 -19.083 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.882 -9.214 -18.727 1.00 0.00 H new ATOM 0 HD3 PRO A 113 3.047 -8.514 -17.620 1.00 0.00 H new ATOM 1787 N GLN A 114 -1.484 -8.048 -18.040 1.00 0.00 N ATOM 1788 CA GLN A 114 -2.850 -8.130 -18.532 1.00 0.00 C ATOM 1789 C GLN A 114 -3.834 -8.015 -17.371 1.00 0.00 C ATOM 1790 O GLN A 114 -4.822 -7.285 -17.454 1.00 0.00 O ATOM 1791 CB GLN A 114 -3.087 -9.435 -19.302 1.00 0.00 C ATOM 1792 CG GLN A 114 -2.920 -10.692 -18.462 1.00 0.00 C ATOM 1793 CD GLN A 114 -3.425 -11.937 -19.166 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -4.335 -11.869 -19.994 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -2.864 -13.084 -18.822 1.00 0.00 N ATOM 0 H GLN A 114 -0.935 -8.899 -18.161 1.00 0.00 H new ATOM 0 HA GLN A 114 -3.012 -7.301 -19.220 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -4.094 -9.421 -19.718 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -2.395 -9.479 -20.143 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -1.866 -10.821 -18.215 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -3.456 -10.569 -17.521 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -2.113 -13.098 -18.132 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -3.182 -13.955 -19.247 1.00 0.00 H new ATOM 1804 N LYS A 115 -3.529 -8.712 -16.278 1.00 0.00 N ATOM 1805 CA LYS A 115 -4.398 -8.763 -15.116 1.00 0.00 C ATOM 1806 C LYS A 115 -3.574 -8.992 -13.855 1.00 0.00 C ATOM 1807 O LYS A 115 -3.374 -10.135 -13.435 1.00 0.00 O ATOM 1808 CB LYS A 115 -5.437 -9.881 -15.250 1.00 0.00 C ATOM 1809 CG LYS A 115 -6.516 -9.618 -16.291 1.00 0.00 C ATOM 1810 CD LYS A 115 -7.365 -8.408 -15.930 1.00 0.00 C ATOM 1811 CE LYS A 115 -8.292 -8.022 -17.072 1.00 0.00 C ATOM 1812 NZ LYS A 115 -9.052 -6.776 -16.784 1.00 0.00 N ATOM 0 H LYS A 115 -2.672 -9.255 -16.178 1.00 0.00 H new ATOM 0 HA LYS A 115 -4.919 -7.808 -15.048 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -4.924 -10.808 -15.504 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -5.914 -10.035 -14.282 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -6.051 -9.459 -17.264 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -7.155 -10.496 -16.382 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -7.954 -8.627 -15.039 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -6.717 -7.567 -15.685 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -7.707 -7.887 -17.982 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -8.991 -8.836 -17.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -9.670 -6.552 -17.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -9.631 -6.912 -15.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -8.387 -5.992 -16.630 1.00 0.00 H new ATOM 1826 N PRO A 116 -3.049 -7.919 -13.254 1.00 0.00 N ATOM 1827 CA PRO A 116 -2.278 -8.017 -12.017 1.00 0.00 C ATOM 1828 C PRO A 116 -3.156 -8.426 -10.841 1.00 0.00 C ATOM 1829 O PRO A 116 -4.240 -7.868 -10.643 1.00 0.00 O ATOM 1830 CB PRO A 116 -1.739 -6.601 -11.809 1.00 0.00 C ATOM 1831 CG PRO A 116 -2.670 -5.719 -12.566 1.00 0.00 C ATOM 1832 CD PRO A 116 -3.160 -6.529 -13.733 1.00 0.00 C ATOM 0 HA PRO A 116 -1.495 -8.772 -12.081 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -1.718 -6.338 -10.751 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -0.718 -6.509 -12.180 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -3.501 -5.400 -11.937 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -2.162 -4.816 -12.905 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -4.187 -6.275 -13.995 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -2.553 -6.361 -14.622 1.00 0.00 H new ATOM 1840 N VAL A 117 -2.700 -9.400 -10.067 1.00 0.00 N ATOM 1841 CA VAL A 117 -3.461 -9.856 -8.913 1.00 0.00 C ATOM 1842 C VAL A 117 -3.291 -8.874 -7.767 1.00 0.00 C ATOM 1843 O VAL A 117 -2.173 -8.619 -7.324 1.00 0.00 O ATOM 1844 CB VAL A 117 -3.004 -11.257 -8.450 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -3.871 -11.765 -7.304 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -3.034 -12.245 -9.606 1.00 0.00 C ATOM 0 H VAL A 117 -1.815 -9.886 -10.215 1.00 0.00 H new ATOM 0 HA VAL A 117 -4.509 -9.916 -9.207 1.00 0.00 H new ATOM 0 HB VAL A 117 -1.978 -11.169 -8.093 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -3.527 -12.753 -6.998 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -3.798 -11.078 -6.461 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -4.908 -11.828 -7.633 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -2.708 -13.225 -9.256 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.049 -12.318 -9.996 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -2.366 -11.901 -10.396 1.00 0.00 H new ATOM 1856 N CYS A 118 -4.398 -8.324 -7.299 1.00 0.00 N ATOM 1857 CA CYS A 118 -4.372 -7.347 -6.226 1.00 0.00 C ATOM 1858 C CYS A 118 -5.100 -7.864 -4.988 1.00 0.00 C ATOM 1859 O CYS A 118 -6.295 -8.157 -5.036 1.00 0.00 O ATOM 1860 CB CYS A 118 -4.976 -6.024 -6.707 1.00 0.00 C ATOM 1861 SG CYS A 118 -6.521 -6.200 -7.640 1.00 0.00 S ATOM 0 H CYS A 118 -5.332 -8.540 -7.648 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.334 -7.174 -5.943 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -5.159 -5.387 -5.842 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -4.245 -5.511 -7.332 1.00 0.00 H new ATOM 0 HG CYS A 118 -6.948 -5.025 -7.997 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.377 -7.985 -3.885 1.00 0.00 N ATOM 1868 CA LYS A 119 -4.979 -8.406 -2.629 1.00 0.00 C ATOM 1869 C LYS A 119 -4.549 -7.483 -1.502 1.00 0.00 C ATOM 1870 O LYS A 119 -3.548 -6.770 -1.610 1.00 0.00 O ATOM 1871 CB LYS A 119 -4.572 -9.839 -2.276 1.00 0.00 C ATOM 1872 CG LYS A 119 -4.909 -10.872 -3.343 1.00 0.00 C ATOM 1873 CD LYS A 119 -6.395 -11.196 -3.374 1.00 0.00 C ATOM 1874 CE LYS A 119 -6.834 -11.920 -2.111 1.00 0.00 C ATOM 1875 NZ LYS A 119 -8.248 -12.366 -2.191 1.00 0.00 N ATOM 0 H LYS A 119 -3.376 -7.798 -3.834 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.061 -8.362 -2.752 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.498 -9.863 -2.091 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.062 -10.124 -1.345 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -4.599 -10.499 -4.319 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -4.343 -11.784 -3.156 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -6.967 -10.275 -3.484 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -6.616 -11.814 -4.244 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -6.190 -12.784 -1.945 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.710 -11.260 -1.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -8.376 -13.220 -1.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -8.871 -11.611 -1.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -8.489 -12.580 -3.180 1.00 0.00 H new ATOM 1889 N SER A 120 -5.311 -7.503 -0.426 1.00 0.00 N ATOM 1890 CA SER A 120 -4.964 -6.773 0.776 1.00 0.00 C ATOM 1891 C SER A 120 -4.960 -7.753 1.938 1.00 0.00 C ATOM 1892 O SER A 120 -5.756 -8.692 1.956 1.00 0.00 O ATOM 1893 CB SER A 120 -5.955 -5.633 1.035 1.00 0.00 C ATOM 1894 OG SER A 120 -5.468 -4.743 2.027 1.00 0.00 O ATOM 0 H SER A 120 -6.185 -8.024 -0.361 1.00 0.00 H new ATOM 0 HA SER A 120 -3.979 -6.322 0.660 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.134 -5.086 0.109 1.00 0.00 H new ATOM 0 HB3 SER A 120 -6.913 -6.046 1.352 1.00 0.00 H new ATOM 0 HG SER A 120 -4.519 -4.923 2.190 1.00 0.00 H new ATOM 1900 N PHE A 121 -4.057 -7.566 2.882 1.00 0.00 N ATOM 1901 CA PHE A 121 -3.917 -8.514 3.970 1.00 0.00 C ATOM 1902 C PHE A 121 -3.790 -7.825 5.315 1.00 0.00 C ATOM 1903 O PHE A 121 -3.060 -6.844 5.467 1.00 0.00 O ATOM 1904 CB PHE A 121 -2.702 -9.413 3.743 1.00 0.00 C ATOM 1905 CG PHE A 121 -2.835 -10.317 2.552 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -3.620 -11.455 2.617 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -2.176 -10.028 1.369 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -3.746 -12.288 1.523 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -2.298 -10.857 0.273 1.00 0.00 C ATOM 1910 CZ PHE A 121 -3.083 -11.989 0.350 1.00 0.00 C ATOM 0 H PHE A 121 -3.415 -6.774 2.918 1.00 0.00 H new ATOM 0 HA PHE A 121 -4.825 -9.117 3.984 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -1.817 -8.789 3.617 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.539 -10.021 4.633 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.140 -11.694 3.533 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.560 -9.144 1.304 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -4.363 -13.172 1.585 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -1.780 -10.620 -0.644 1.00 0.00 H new ATOM 0 HZ PHE A 121 -3.179 -12.640 -0.506 1.00 0.00 H new ATOM 1920 N LEU A 122 -4.526 -8.346 6.277 1.00 0.00 N ATOM 1921 CA LEU A 122 -4.349 -7.979 7.665 1.00 0.00 C ATOM 1922 C LEU A 122 -3.482 -9.038 8.324 1.00 0.00 C ATOM 1923 O LEU A 122 -3.917 -10.178 8.523 1.00 0.00 O ATOM 1924 CB LEU A 122 -5.702 -7.878 8.378 1.00 0.00 C ATOM 1925 CG LEU A 122 -6.671 -6.840 7.802 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -8.000 -6.889 8.539 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -6.066 -5.443 7.880 1.00 0.00 C ATOM 0 H LEU A 122 -5.262 -9.034 6.117 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.870 -7.002 7.732 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -6.183 -8.856 8.348 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.524 -7.642 9.427 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.849 -7.078 6.753 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.677 -6.146 8.118 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.439 -7.881 8.433 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.838 -6.675 9.596 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.768 -4.719 7.467 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.859 -5.194 8.921 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.138 -5.416 7.309 1.00 0.00 H new ATOM 1939 N ILE A 123 -2.249 -8.677 8.627 1.00 0.00 N ATOM 1940 CA ILE A 123 -1.281 -9.640 9.113 1.00 0.00 C ATOM 1941 C ILE A 123 -1.350 -9.778 10.626 1.00 0.00 C ATOM 1942 O ILE A 123 -1.127 -8.819 11.361 1.00 0.00 O ATOM 1943 CB ILE A 123 0.153 -9.259 8.691 1.00 0.00 C ATOM 1944 CG1 ILE A 123 0.241 -9.130 7.165 1.00 0.00 C ATOM 1945 CG2 ILE A 123 1.149 -10.296 9.199 1.00 0.00 C ATOM 1946 CD1 ILE A 123 1.613 -8.728 6.664 1.00 0.00 C ATOM 0 H ILE A 123 -1.895 -7.724 8.545 1.00 0.00 H new ATOM 0 HA ILE A 123 -1.534 -10.599 8.662 1.00 0.00 H new ATOM 0 HB ILE A 123 0.403 -8.295 9.135 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.036 -10.082 6.713 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.489 -8.393 6.829 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.156 -10.013 8.893 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.100 -10.345 10.287 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.903 -11.272 8.781 1.00 0.00 H new ATOM 0 HD11 ILE A 123 1.597 -8.657 5.576 1.00 0.00 H new ATOM 0 HD12 ILE A 123 1.886 -7.761 7.087 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.345 -9.476 6.968 1.00 0.00 H new ATOM 1958 N LYS A 124 -1.679 -10.977 11.078 1.00 0.00 N ATOM 1959 CA LYS A 124 -1.680 -11.283 12.494 1.00 0.00 C ATOM 1960 C LYS A 124 -0.672 -12.381 12.798 1.00 0.00 C ATOM 1961 O LYS A 124 -0.086 -12.982 11.893 1.00 0.00 O ATOM 1962 CB LYS A 124 -3.063 -11.744 12.968 1.00 0.00 C ATOM 1963 CG LYS A 124 -4.136 -10.671 12.950 1.00 0.00 C ATOM 1964 CD LYS A 124 -5.371 -11.148 13.699 1.00 0.00 C ATOM 1965 CE LYS A 124 -6.480 -10.111 13.698 1.00 0.00 C ATOM 1966 NZ LYS A 124 -7.596 -10.505 14.600 1.00 0.00 N ATOM 0 H LYS A 124 -1.950 -11.757 10.479 1.00 0.00 H new ATOM 0 HA LYS A 124 -1.411 -10.368 13.022 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -3.388 -12.573 12.340 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -2.973 -12.130 13.983 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -3.755 -9.758 13.407 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -4.398 -10.426 11.921 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -5.737 -12.069 13.244 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -5.100 -11.387 14.728 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -6.079 -9.148 14.013 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -6.858 -9.982 12.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -8.336 -9.775 14.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -7.994 -11.412 14.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -7.239 -10.603 15.572 1.00 0.00 H new ATOM 1980 N LYS A 125 -0.486 -12.630 14.079 1.00 0.00 N ATOM 1981 CA LYS A 125 0.326 -13.739 14.552 1.00 0.00 C ATOM 1982 C LYS A 125 -0.314 -15.057 14.142 1.00 0.00 C ATOM 1983 O LYS A 125 0.299 -15.888 13.470 1.00 0.00 O ATOM 1984 CB LYS A 125 0.410 -13.659 16.070 1.00 0.00 C ATOM 1985 CG LYS A 125 1.148 -14.809 16.728 1.00 0.00 C ATOM 1986 CD LYS A 125 0.971 -14.756 18.236 1.00 0.00 C ATOM 1987 CE LYS A 125 -0.505 -14.752 18.607 1.00 0.00 C ATOM 1988 NZ LYS A 125 -0.726 -14.377 20.023 1.00 0.00 N ATOM 0 H LYS A 125 -0.894 -12.068 14.826 1.00 0.00 H new ATOM 0 HA LYS A 125 1.324 -13.684 14.118 1.00 0.00 H new ATOM 0 HB2 LYS A 125 0.902 -12.726 16.344 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -0.601 -13.616 16.474 1.00 0.00 H new ATOM 0 HG2 LYS A 125 0.773 -15.758 16.344 1.00 0.00 H new ATOM 0 HG3 LYS A 125 2.208 -14.761 16.478 1.00 0.00 H new ATOM 0 HD2 LYS A 125 1.464 -15.613 18.695 1.00 0.00 H new ATOM 0 HD3 LYS A 125 1.453 -13.862 18.632 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -1.038 -14.055 17.961 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -0.926 -15.741 18.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -1.745 -14.388 20.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -0.240 -15.057 20.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -0.348 -13.423 20.192 1.00 0.00 H new ATOM 2002 N ASP A 126 -1.565 -15.205 14.560 1.00 0.00 N ATOM 2003 CA ASP A 126 -2.381 -16.387 14.283 1.00 0.00 C ATOM 2004 C ASP A 126 -2.350 -16.749 12.807 1.00 0.00 C ATOM 2005 O ASP A 126 -2.176 -17.912 12.439 1.00 0.00 O ATOM 2006 CB ASP A 126 -3.835 -16.130 14.699 1.00 0.00 C ATOM 2007 CG ASP A 126 -3.972 -15.680 16.141 1.00 0.00 C ATOM 2008 OD1 ASP A 126 -3.433 -14.606 16.486 1.00 0.00 O ATOM 2009 OD2 ASP A 126 -4.644 -16.379 16.927 1.00 0.00 O ATOM 0 H ASP A 126 -2.052 -14.497 15.110 1.00 0.00 H new ATOM 0 HA ASP A 126 -1.966 -17.216 14.857 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -4.264 -15.371 14.046 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -4.415 -17.041 14.553 1.00 0.00 H new ATOM 2014 N GLY A 127 -2.526 -15.747 11.963 1.00 0.00 N ATOM 2015 CA GLY A 127 -2.546 -15.974 10.540 1.00 0.00 C ATOM 2016 C GLY A 127 -2.747 -14.688 9.779 1.00 0.00 C ATOM 2017 O GLY A 127 -2.597 -13.605 10.338 1.00 0.00 O ATOM 0 H GLY A 127 -2.656 -14.775 12.243 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -1.609 -16.438 10.231 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -3.345 -16.673 10.293 1.00 0.00 H new ATOM 2021 N VAL A 128 -3.084 -14.793 8.511 1.00 0.00 N ATOM 2022 CA VAL A 128 -3.309 -13.614 7.700 1.00 0.00 C ATOM 2023 C VAL A 128 -4.737 -13.604 7.159 1.00 0.00 C ATOM 2024 O VAL A 128 -5.249 -14.628 6.704 1.00 0.00 O ATOM 2025 CB VAL A 128 -2.283 -13.518 6.546 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -2.425 -14.679 5.572 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -2.402 -12.184 5.829 1.00 0.00 C ATOM 0 H VAL A 128 -3.208 -15.679 8.020 1.00 0.00 H new ATOM 0 HA VAL A 128 -3.172 -12.739 8.335 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.286 -13.582 6.983 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.688 -14.578 4.775 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -2.262 -15.619 6.100 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -3.427 -14.673 5.143 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.671 -12.138 5.022 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -3.406 -12.081 5.416 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -2.215 -11.374 6.534 1.00 0.00 H new ATOM 2037 N ASP A 129 -5.388 -12.458 7.247 1.00 0.00 N ATOM 2038 CA ASP A 129 -6.746 -12.319 6.750 1.00 0.00 C ATOM 2039 C ASP A 129 -6.744 -11.471 5.487 1.00 0.00 C ATOM 2040 O ASP A 129 -6.097 -10.424 5.439 1.00 0.00 O ATOM 2041 CB ASP A 129 -7.639 -11.691 7.818 1.00 0.00 C ATOM 2042 CG ASP A 129 -9.110 -11.859 7.499 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -9.599 -13.009 7.553 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -9.784 -10.856 7.206 1.00 0.00 O ATOM 0 H ASP A 129 -4.999 -11.610 7.658 1.00 0.00 H new ATOM 0 HA ASP A 129 -7.143 -13.306 6.511 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.423 -12.147 8.784 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.406 -10.630 7.907 1.00 0.00 H new ATOM 2049 N GLU A 130 -7.441 -11.933 4.457 1.00 0.00 N ATOM 2050 CA GLU A 130 -7.425 -11.263 3.173 1.00 0.00 C ATOM 2051 C GLU A 130 -8.618 -10.326 3.008 1.00 0.00 C ATOM 2052 O GLU A 130 -9.771 -10.709 3.219 1.00 0.00 O ATOM 2053 CB GLU A 130 -7.395 -12.292 2.045 1.00 0.00 C ATOM 2054 CG GLU A 130 -8.534 -13.301 2.079 1.00 0.00 C ATOM 2055 CD GLU A 130 -8.466 -14.272 0.922 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -8.991 -13.951 -0.163 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -7.872 -15.359 1.090 1.00 0.00 O ATOM 0 H GLU A 130 -8.023 -12.770 4.491 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.523 -10.653 3.127 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -7.421 -11.766 1.090 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -6.448 -12.831 2.087 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -8.501 -13.853 3.018 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -9.487 -12.773 2.053 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.322 -9.099 2.630 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.344 -8.107 2.362 1.00 0.00 C ATOM 2066 C GLU A 131 -9.430 -7.858 0.861 1.00 0.00 C ATOM 2067 O GLU A 131 -8.408 -7.857 0.165 1.00 0.00 O ATOM 2068 CB GLU A 131 -9.029 -6.805 3.103 1.00 0.00 C ATOM 2069 CG GLU A 131 -10.109 -5.742 2.967 1.00 0.00 C ATOM 2070 CD GLU A 131 -11.461 -6.218 3.455 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -12.142 -6.952 2.709 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -11.857 -5.839 4.574 1.00 0.00 O ATOM 0 H GLU A 131 -7.368 -8.762 2.500 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.305 -8.478 2.718 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.882 -7.026 4.160 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -8.088 -6.403 2.727 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -9.815 -4.857 3.531 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -10.189 -5.443 1.922 1.00 0.00 H new ATOM 2079 N GLU A 132 -10.640 -7.660 0.368 1.00 0.00 N ATOM 2080 CA GLU A 132 -10.860 -7.431 -1.042 1.00 0.00 C ATOM 2081 C GLU A 132 -10.800 -5.947 -1.362 1.00 0.00 C ATOM 2082 O GLU A 132 -11.182 -5.108 -0.543 1.00 0.00 O ATOM 2083 CB GLU A 132 -12.210 -7.998 -1.458 1.00 0.00 C ATOM 2084 CG GLU A 132 -12.229 -9.511 -1.538 1.00 0.00 C ATOM 2085 CD GLU A 132 -11.247 -10.052 -2.558 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -11.505 -9.909 -3.771 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -10.221 -10.636 -2.156 1.00 0.00 O ATOM 0 H GLU A 132 -11.490 -7.654 0.932 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.072 -7.937 -1.600 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.968 -7.670 -0.747 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.485 -7.587 -2.429 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -11.995 -9.926 -0.558 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.234 -9.845 -1.794 1.00 0.00 H new ATOM 2094 N ILE A 133 -10.334 -5.636 -2.559 1.00 0.00 N ATOM 2095 CA ILE A 133 -10.168 -4.253 -2.975 1.00 0.00 C ATOM 2096 C ILE A 133 -11.347 -3.804 -3.827 1.00 0.00 C ATOM 2097 O ILE A 133 -11.669 -4.426 -4.842 1.00 0.00 O ATOM 2098 CB ILE A 133 -8.854 -4.057 -3.764 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -7.658 -4.509 -2.917 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -8.696 -2.599 -4.187 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -6.332 -4.391 -3.635 1.00 0.00 C ATOM 0 H ILE A 133 -10.063 -6.324 -3.262 1.00 0.00 H new ATOM 0 HA ILE A 133 -10.124 -3.643 -2.072 1.00 0.00 H new ATOM 0 HB ILE A 133 -8.892 -4.669 -4.665 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -7.623 -3.913 -2.005 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -7.808 -5.546 -2.615 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.765 -2.480 -4.741 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -9.535 -2.311 -4.820 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.675 -1.964 -3.302 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -5.531 -4.728 -2.977 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -6.348 -5.009 -4.533 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.160 -3.351 -3.913 1.00 0.00 H new ATOM 2113 N ILE A 134 -11.991 -2.730 -3.400 1.00 0.00 N ATOM 2114 CA ILE A 134 -13.102 -2.162 -4.141 1.00 0.00 C ATOM 2115 C ILE A 134 -12.612 -0.968 -4.950 1.00 0.00 C ATOM 2116 O ILE A 134 -12.061 -0.013 -4.395 1.00 0.00 O ATOM 2117 CB ILE A 134 -14.267 -1.736 -3.203 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -15.071 -2.957 -2.727 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.192 -0.742 -3.890 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -14.317 -3.881 -1.793 1.00 0.00 C ATOM 0 H ILE A 134 -11.761 -2.233 -2.540 1.00 0.00 H new ATOM 0 HA ILE A 134 -13.491 -2.929 -4.811 1.00 0.00 H new ATOM 0 HB ILE A 134 -13.822 -1.252 -2.334 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -15.972 -2.608 -2.223 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -15.393 -3.526 -3.599 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -15.996 -0.463 -3.209 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -14.627 0.148 -4.169 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -15.616 -1.198 -4.785 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -14.960 -4.714 -1.508 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -13.430 -4.263 -2.298 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.018 -3.331 -0.900 1.00 0.00 H new ATOM 2132 N LEU A 135 -12.791 -1.045 -6.259 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.293 -0.025 -7.166 1.00 0.00 C ATOM 2134 C LEU A 135 -13.386 0.970 -7.516 1.00 0.00 C ATOM 2135 O LEU A 135 -14.457 0.587 -7.994 1.00 0.00 O ATOM 2136 CB LEU A 135 -11.758 -0.675 -8.446 1.00 0.00 C ATOM 2137 CG LEU A 135 -10.585 -1.639 -8.250 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -10.193 -2.282 -9.569 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -9.395 -0.914 -7.645 1.00 0.00 C ATOM 0 H LEU A 135 -13.282 -1.811 -6.720 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.485 0.509 -6.666 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -12.573 -1.214 -8.928 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.448 0.113 -9.132 1.00 0.00 H new ATOM 0 HG LEU A 135 -10.901 -2.424 -7.563 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -9.358 -2.963 -9.408 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.041 -2.837 -9.970 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -9.898 -1.508 -10.278 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.571 -1.615 -7.513 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.083 -0.108 -8.310 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -9.676 -0.498 -6.678 1.00 0.00 H new ATOM 2151 N LYS A 136 -13.118 2.240 -7.267 1.00 0.00 N ATOM 2152 CA LYS A 136 -14.036 3.302 -7.646 1.00 0.00 C ATOM 2153 C LYS A 136 -13.544 4.004 -8.904 1.00 0.00 C ATOM 2154 O LYS A 136 -12.350 3.981 -9.219 1.00 0.00 O ATOM 2155 CB LYS A 136 -14.207 4.319 -6.513 1.00 0.00 C ATOM 2156 CG LYS A 136 -14.973 3.784 -5.313 1.00 0.00 C ATOM 2157 CD LYS A 136 -15.413 4.906 -4.382 1.00 0.00 C ATOM 2158 CE LYS A 136 -16.229 4.370 -3.214 1.00 0.00 C ATOM 2159 NZ LYS A 136 -16.915 5.454 -2.458 1.00 0.00 N ATOM 0 H LYS A 136 -12.269 2.562 -6.802 1.00 0.00 H new ATOM 0 HA LYS A 136 -15.006 2.848 -7.846 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -13.222 4.650 -6.184 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -14.725 5.196 -6.901 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -15.848 3.231 -5.656 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -14.346 3.081 -4.765 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -14.536 5.432 -4.004 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -16.005 5.632 -4.939 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -16.971 3.664 -3.586 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -15.574 3.818 -2.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -17.457 5.040 -1.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -16.207 6.115 -2.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -17.561 5.965 -3.093 1.00 0.00 H new ATOM 2173 N GLU A 137 -14.469 4.635 -9.616 1.00 0.00 N ATOM 2174 CA GLU A 137 -14.144 5.323 -10.859 1.00 0.00 C ATOM 2175 C GLU A 137 -13.608 6.706 -10.542 1.00 0.00 C ATOM 2176 O GLU A 137 -12.759 7.254 -11.247 1.00 0.00 O ATOM 2177 CB GLU A 137 -15.420 5.433 -11.707 1.00 0.00 C ATOM 2178 CG GLU A 137 -15.202 5.734 -13.189 1.00 0.00 C ATOM 2179 CD GLU A 137 -14.786 7.168 -13.467 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -15.543 8.101 -13.110 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -13.705 7.371 -14.056 1.00 0.00 O ATOM 0 H GLU A 137 -15.453 4.685 -9.353 1.00 0.00 H new ATOM 0 HA GLU A 137 -13.385 4.769 -11.411 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -15.973 4.498 -11.622 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.050 6.216 -11.284 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -14.438 5.062 -13.578 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -16.122 5.520 -13.733 1.00 0.00 H new ATOM 2188 N GLU A 138 -14.066 7.219 -9.428 1.00 0.00 N ATOM 2189 CA GLU A 138 -13.740 8.570 -9.014 1.00 0.00 C ATOM 2190 C GLU A 138 -13.295 8.579 -7.561 1.00 0.00 C ATOM 2191 O GLU A 138 -13.615 7.661 -6.802 1.00 0.00 O ATOM 2192 CB GLU A 138 -14.957 9.473 -9.218 1.00 0.00 C ATOM 2193 CG GLU A 138 -14.662 10.959 -9.110 1.00 0.00 C ATOM 2194 CD GLU A 138 -15.817 11.801 -9.608 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -16.045 11.832 -10.837 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -16.502 12.434 -8.779 1.00 0.00 O ATOM 0 H GLU A 138 -14.674 6.718 -8.781 1.00 0.00 H new ATOM 0 HA GLU A 138 -12.918 8.949 -9.621 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -15.384 9.270 -10.200 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -15.716 9.211 -8.481 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -14.449 11.212 -8.071 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -13.767 11.194 -9.685 1.00 0.00 H new ATOM 2203 N LEU A 139 -12.550 9.610 -7.185 1.00 0.00 N ATOM 2204 CA LEU A 139 -12.032 9.737 -5.830 1.00 0.00 C ATOM 2205 C LEU A 139 -13.163 9.960 -4.833 1.00 0.00 C ATOM 2206 O LEU A 139 -14.290 10.282 -5.214 1.00 0.00 O ATOM 2207 CB LEU A 139 -11.034 10.898 -5.745 1.00 0.00 C ATOM 2208 CG LEU A 139 -9.758 10.734 -6.576 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -8.930 12.010 -6.540 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -8.938 9.556 -6.070 1.00 0.00 C ATOM 0 H LEU A 139 -12.289 10.376 -7.806 1.00 0.00 H new ATOM 0 HA LEU A 139 -11.523 8.807 -5.578 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -11.538 11.811 -6.062 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -10.752 11.036 -4.701 1.00 0.00 H new ATOM 0 HG LEU A 139 -10.045 10.537 -7.609 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -8.027 11.875 -7.136 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -9.514 12.835 -6.948 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -8.654 12.236 -5.510 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -8.035 9.455 -6.673 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -8.662 9.725 -5.029 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -9.528 8.643 -6.145 1.00 0.00 H new