USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 922 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -125:sc=-0.00105 (180deg=-1.89) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.00197 USER MOD Single : A 11 THR OG1 : rot 37:sc= 0.571 USER MOD Single : A 13 MET CE :methyl -162:sc= -0.193 (180deg=-1.05) USER MOD Single : A 19 THR OG1 : rot 180:sc= -0.69 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 160:sc= -0.0195 (180deg=-0.201) USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=-0.0015) USER MOD Single : A 48 TYR OH : rot 150:sc= -1.36 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 52 GLN : amide:sc= -0.0251 K(o=-0.025,f=-1.2) USER MOD Single : A 55 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00086) USER MOD Single : B 1 MET CE :methyl -126:sc=-0.00756 (180deg=-1.89) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 THR OG1 : rot 40:sc= 0.69 USER MOD Single : B 13 MET CE :methyl -162:sc= -0.192 (180deg=-1.05) USER MOD Single : B 19 THR OG1 : rot 180:sc= -0.552 USER MOD Single : B 21 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 LYS NZ :NH3+ 160:sc= -0.0123 (180deg=-0.179) USER MOD Single : B 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 43 HIS : no HD1:sc= 0 X(o=0,f=-0.0036) USER MOD Single : B 48 TYR OH : rot 150:sc= -1.35 USER MOD Single : B 49 GLN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : B 52 GLN : amide:sc= -0.0123 K(o=-0.012,f=-1.1) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.661 -10.108 -7.494 1.00 0.00 N ATOM 2 CA MET A 1 -0.690 -9.713 -6.061 1.00 0.00 C ATOM 3 C MET A 1 0.712 -9.710 -5.460 1.00 0.00 C ATOM 4 O MET A 1 1.446 -10.693 -5.567 1.00 0.00 O ATOM 5 CB MET A 1 -1.588 -10.693 -5.303 1.00 0.00 C ATOM 6 CG MET A 1 -1.812 -10.313 -3.849 1.00 0.00 C ATOM 7 SD MET A 1 -0.749 -11.232 -2.719 1.00 0.00 S ATOM 8 CE MET A 1 -1.508 -10.840 -1.145 1.00 0.00 C ATOM 0 H1 MET A 1 -1.628 -10.101 -7.876 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.073 -9.436 -8.028 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.261 -11.064 -7.583 1.00 0.00 H new ATOM 0 HA MET A 1 -1.084 -8.700 -5.978 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.553 -10.753 -5.807 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.144 -11.687 -5.346 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.631 -9.245 -3.725 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.855 -10.492 -3.587 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.759 -10.419 -0.474 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.307 -10.115 -1.297 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.921 -11.747 -0.704 1.00 0.00 H new ATOM 20 N LEU A 2 1.076 -8.600 -4.827 1.00 0.00 N ATOM 21 CA LEU A 2 2.390 -8.468 -4.207 1.00 0.00 C ATOM 22 C LEU A 2 2.261 -8.259 -2.702 1.00 0.00 C ATOM 23 O LEU A 2 1.830 -7.199 -2.248 1.00 0.00 O ATOM 24 CB LEU A 2 3.156 -7.301 -4.832 1.00 0.00 C ATOM 25 CG LEU A 2 3.672 -7.552 -6.253 1.00 0.00 C ATOM 26 CD1 LEU A 2 3.142 -6.496 -7.212 1.00 0.00 C ATOM 27 CD2 LEU A 2 5.194 -7.576 -6.274 1.00 0.00 C ATOM 0 H LEU A 2 0.480 -7.778 -4.730 1.00 0.00 H new ATOM 0 HA LEU A 2 2.942 -9.391 -4.382 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.506 -6.426 -4.847 1.00 0.00 H new ATOM 0 HB3 LEU A 2 4.004 -7.058 -4.191 1.00 0.00 H new ATOM 0 HG LEU A 2 3.308 -8.526 -6.581 1.00 0.00 H new ATOM 0 HD11 LEU A 2 3.520 -6.693 -8.215 1.00 0.00 H new ATOM 0 HD12 LEU A 2 2.053 -6.528 -7.222 1.00 0.00 H new ATOM 0 HD13 LEU A 2 3.473 -5.510 -6.886 1.00 0.00 H new ATOM 0 HD21 LEU A 2 5.541 -7.755 -7.292 1.00 0.00 H new ATOM 0 HD22 LEU A 2 5.578 -6.618 -5.923 1.00 0.00 H new ATOM 0 HD23 LEU A 2 5.554 -8.372 -5.622 1.00 0.00 H new ATOM 39 N ILE A 3 2.625 -9.280 -1.933 1.00 0.00 N ATOM 40 CA ILE A 3 2.535 -9.211 -0.479 1.00 0.00 C ATOM 41 C ILE A 3 3.765 -8.543 0.127 1.00 0.00 C ATOM 42 O ILE A 3 4.877 -9.065 0.042 1.00 0.00 O ATOM 43 CB ILE A 3 2.362 -10.613 0.141 1.00 0.00 C ATOM 44 CG1 ILE A 3 2.119 -10.505 1.647 1.00 0.00 C ATOM 45 CG2 ILE A 3 3.581 -11.480 -0.142 1.00 0.00 C ATOM 46 CD1 ILE A 3 1.227 -11.598 2.196 1.00 0.00 C ATOM 0 H ILE A 3 2.985 -10.164 -2.292 1.00 0.00 H new ATOM 0 HA ILE A 3 1.656 -8.609 -0.249 1.00 0.00 H new ATOM 0 HB ILE A 3 1.493 -11.086 -0.317 1.00 0.00 H new ATOM 0 HG12 ILE A 3 3.078 -10.536 2.165 1.00 0.00 H new ATOM 0 HG13 ILE A 3 1.670 -9.536 1.866 1.00 0.00 H new ATOM 0 HG21 ILE A 3 3.439 -12.464 0.304 1.00 0.00 H new ATOM 0 HG22 ILE A 3 3.711 -11.585 -1.219 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.467 -11.012 0.286 1.00 0.00 H new ATOM 0 HD11 ILE A 3 1.099 -11.458 3.269 1.00 0.00 H new ATOM 0 HD12 ILE A 3 0.255 -11.555 1.705 1.00 0.00 H new ATOM 0 HD13 ILE A 3 1.685 -12.569 2.009 1.00 0.00 H new ATOM 58 N LEU A 4 3.551 -7.385 0.744 1.00 0.00 N ATOM 59 CA LEU A 4 4.633 -6.638 1.374 1.00 0.00 C ATOM 60 C LEU A 4 4.428 -6.564 2.882 1.00 0.00 C ATOM 61 O LEU A 4 3.306 -6.689 3.372 1.00 0.00 O ATOM 62 CB LEU A 4 4.723 -5.228 0.785 1.00 0.00 C ATOM 63 CG LEU A 4 6.145 -4.717 0.546 1.00 0.00 C ATOM 64 CD1 LEU A 4 6.184 -3.792 -0.661 1.00 0.00 C ATOM 65 CD2 LEU A 4 6.671 -4.004 1.783 1.00 0.00 C ATOM 0 H LEU A 4 2.635 -6.943 0.821 1.00 0.00 H new ATOM 0 HA LEU A 4 5.569 -7.161 1.176 1.00 0.00 H new ATOM 0 HB2 LEU A 4 4.183 -5.211 -0.162 1.00 0.00 H new ATOM 0 HB3 LEU A 4 4.213 -4.537 1.456 1.00 0.00 H new ATOM 0 HG LEU A 4 6.788 -5.573 0.343 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.203 -3.438 -0.816 1.00 0.00 H new ATOM 0 HD12 LEU A 4 5.850 -4.334 -1.546 1.00 0.00 H new ATOM 0 HD13 LEU A 4 5.527 -2.940 -0.488 1.00 0.00 H new ATOM 0 HD21 LEU A 4 7.684 -3.647 1.594 1.00 0.00 H new ATOM 0 HD22 LEU A 4 6.026 -3.157 2.017 1.00 0.00 H new ATOM 0 HD23 LEU A 4 6.681 -4.696 2.625 1.00 0.00 H new ATOM 77 N THR A 5 5.518 -6.365 3.616 1.00 0.00 N ATOM 78 CA THR A 5 5.445 -6.283 5.067 1.00 0.00 C ATOM 79 C THR A 5 5.364 -4.839 5.540 1.00 0.00 C ATOM 80 O THR A 5 6.254 -4.033 5.271 1.00 0.00 O ATOM 81 CB THR A 5 6.649 -6.967 5.713 1.00 0.00 C ATOM 82 OG1 THR A 5 7.326 -7.789 4.778 1.00 0.00 O ATOM 83 CG2 THR A 5 6.273 -7.828 6.898 1.00 0.00 C ATOM 0 H THR A 5 6.456 -6.258 3.231 1.00 0.00 H new ATOM 0 HA THR A 5 4.535 -6.799 5.373 1.00 0.00 H new ATOM 0 HB THR A 5 7.293 -6.158 6.058 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.094 -8.215 5.213 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.170 -8.287 7.314 1.00 0.00 H new ATOM 0 HG22 THR A 5 5.795 -7.211 7.659 1.00 0.00 H new ATOM 0 HG23 THR A 5 5.582 -8.608 6.577 1.00 0.00 H new ATOM 91 N ARG A 6 4.294 -4.525 6.258 1.00 0.00 N ATOM 92 CA ARG A 6 4.095 -3.185 6.785 1.00 0.00 C ATOM 93 C ARG A 6 4.665 -3.076 8.188 1.00 0.00 C ATOM 94 O ARG A 6 4.697 -4.056 8.932 1.00 0.00 O ATOM 95 CB ARG A 6 2.612 -2.818 6.793 1.00 0.00 C ATOM 96 CG ARG A 6 2.252 -1.740 5.784 1.00 0.00 C ATOM 97 CD ARG A 6 2.274 -2.276 4.362 1.00 0.00 C ATOM 98 NE ARG A 6 3.473 -1.858 3.639 1.00 0.00 N ATOM 99 CZ ARG A 6 3.600 -1.918 2.315 1.00 0.00 C ATOM 100 NH1 ARG A 6 2.606 -2.381 1.567 1.00 0.00 N ATOM 101 NH2 ARG A 6 4.723 -1.514 1.738 1.00 0.00 N ATOM 0 H ARG A 6 3.550 -5.183 6.488 1.00 0.00 H new ATOM 0 HA ARG A 6 4.621 -2.486 6.135 1.00 0.00 H new ATOM 0 HB2 ARG A 6 2.023 -3.711 6.585 1.00 0.00 H new ATOM 0 HB3 ARG A 6 2.335 -2.479 7.791 1.00 0.00 H new ATOM 0 HG2 ARG A 6 1.261 -1.346 6.010 1.00 0.00 H new ATOM 0 HG3 ARG A 6 2.953 -0.910 5.872 1.00 0.00 H new ATOM 0 HD2 ARG A 6 2.225 -3.365 4.384 1.00 0.00 H new ATOM 0 HD3 ARG A 6 1.389 -1.928 3.829 1.00 0.00 H new ATOM 0 HE ARG A 6 4.259 -1.499 4.181 1.00 0.00 H new ATOM 0 HH11 ARG A 6 1.740 -2.693 2.006 1.00 0.00 H new ATOM 0 HH12 ARG A 6 2.708 -2.425 0.553 1.00 0.00 H new ATOM 0 HH21 ARG A 6 5.490 -1.157 2.308 1.00 0.00 H new ATOM 0 HH22 ARG A 6 4.820 -1.560 0.724 1.00 0.00 H new ATOM 115 N ARG A 7 5.130 -1.881 8.537 1.00 0.00 N ATOM 116 CA ARG A 7 5.715 -1.637 9.850 1.00 0.00 C ATOM 117 C ARG A 7 7.138 -2.182 9.888 1.00 0.00 C ATOM 118 O ARG A 7 7.364 -3.336 10.251 1.00 0.00 O ATOM 119 CB ARG A 7 4.852 -2.272 10.952 1.00 0.00 C ATOM 120 CG ARG A 7 4.260 -1.262 11.923 1.00 0.00 C ATOM 121 CD ARG A 7 3.591 -1.949 13.103 1.00 0.00 C ATOM 122 NE ARG A 7 4.564 -2.568 14.000 1.00 0.00 N ATOM 123 CZ ARG A 7 4.238 -3.399 14.987 1.00 0.00 C ATOM 124 NH1 ARG A 7 2.968 -3.712 15.208 1.00 0.00 N ATOM 125 NH2 ARG A 7 5.185 -3.918 15.757 1.00 0.00 N ATOM 0 H ARG A 7 5.113 -1.064 7.926 1.00 0.00 H new ATOM 0 HA ARG A 7 5.748 -0.563 10.032 1.00 0.00 H new ATOM 0 HB2 ARG A 7 4.042 -2.835 10.488 1.00 0.00 H new ATOM 0 HB3 ARG A 7 5.458 -2.987 11.509 1.00 0.00 H new ATOM 0 HG2 ARG A 7 5.046 -0.599 12.285 1.00 0.00 H new ATOM 0 HG3 ARG A 7 3.532 -0.639 11.403 1.00 0.00 H new ATOM 0 HD2 ARG A 7 2.998 -1.221 13.658 1.00 0.00 H new ATOM 0 HD3 ARG A 7 2.901 -2.709 12.736 1.00 0.00 H new ATOM 0 HE ARG A 7 5.551 -2.351 13.862 1.00 0.00 H new ATOM 0 HH11 ARG A 7 2.235 -3.315 14.620 1.00 0.00 H new ATOM 0 HH12 ARG A 7 2.724 -4.350 15.966 1.00 0.00 H new ATOM 0 HH21 ARG A 7 6.163 -3.680 15.593 1.00 0.00 H new ATOM 0 HH22 ARG A 7 4.935 -4.555 16.514 1.00 0.00 H new ATOM 139 N VAL A 8 8.088 -1.342 9.477 1.00 0.00 N ATOM 140 CA VAL A 8 9.500 -1.714 9.420 1.00 0.00 C ATOM 141 C VAL A 8 9.784 -2.513 8.149 1.00 0.00 C ATOM 142 O VAL A 8 10.297 -3.631 8.204 1.00 0.00 O ATOM 143 CB VAL A 8 9.952 -2.529 10.655 1.00 0.00 C ATOM 144 CG1 VAL A 8 11.437 -2.849 10.570 1.00 0.00 C ATOM 145 CG2 VAL A 8 9.641 -1.778 11.942 1.00 0.00 C ATOM 0 H VAL A 8 7.900 -0.386 9.175 1.00 0.00 H new ATOM 0 HA VAL A 8 10.070 -0.785 9.414 1.00 0.00 H new ATOM 0 HB VAL A 8 9.397 -3.467 10.665 1.00 0.00 H new ATOM 0 HG11 VAL A 8 11.736 -3.423 11.447 1.00 0.00 H new ATOM 0 HG12 VAL A 8 11.632 -3.433 9.671 1.00 0.00 H new ATOM 0 HG13 VAL A 8 12.008 -1.921 10.531 1.00 0.00 H new ATOM 0 HG21 VAL A 8 9.968 -2.370 12.797 1.00 0.00 H new ATOM 0 HG22 VAL A 8 10.165 -0.822 11.941 1.00 0.00 H new ATOM 0 HG23 VAL A 8 8.567 -1.603 12.011 1.00 0.00 H new ATOM 155 N GLY A 9 9.441 -1.926 7.002 1.00 0.00 N ATOM 156 CA GLY A 9 9.659 -2.590 5.728 1.00 0.00 C ATOM 157 C GLY A 9 10.079 -1.625 4.633 1.00 0.00 C ATOM 158 O GLY A 9 10.745 -0.625 4.900 1.00 0.00 O ATOM 0 H GLY A 9 9.016 -1.001 6.934 1.00 0.00 H new ATOM 0 HA2 GLY A 9 10.426 -3.355 5.847 1.00 0.00 H new ATOM 0 HA3 GLY A 9 8.744 -3.100 5.427 1.00 0.00 H new ATOM 162 N GLU A 10 9.694 -1.929 3.394 1.00 0.00 N ATOM 163 CA GLU A 10 10.043 -1.083 2.254 1.00 0.00 C ATOM 164 C GLU A 10 8.807 -0.422 1.644 1.00 0.00 C ATOM 165 O GLU A 10 7.875 -1.100 1.211 1.00 0.00 O ATOM 166 CB GLU A 10 10.769 -1.908 1.189 1.00 0.00 C ATOM 167 CG GLU A 10 12.283 -1.796 1.261 1.00 0.00 C ATOM 168 CD GLU A 10 12.921 -2.967 1.983 1.00 0.00 C ATOM 169 OE1 GLU A 10 12.843 -3.010 3.229 1.00 0.00 O ATOM 170 OE2 GLU A 10 13.498 -3.840 1.303 1.00 0.00 O ATOM 0 H GLU A 10 9.142 -2.753 3.155 1.00 0.00 H new ATOM 0 HA GLU A 10 10.702 -0.294 2.617 1.00 0.00 H new ATOM 0 HB2 GLU A 10 10.485 -2.955 1.296 1.00 0.00 H new ATOM 0 HB3 GLU A 10 10.436 -1.586 0.202 1.00 0.00 H new ATOM 0 HG2 GLU A 10 12.687 -1.733 0.251 1.00 0.00 H new ATOM 0 HG3 GLU A 10 12.551 -0.870 1.770 1.00 0.00 H new ATOM 177 N THR A 11 8.812 0.908 1.613 1.00 0.00 N ATOM 178 CA THR A 11 7.699 1.675 1.055 1.00 0.00 C ATOM 179 C THR A 11 7.447 1.309 -0.404 1.00 0.00 C ATOM 180 O THR A 11 8.373 0.975 -1.143 1.00 0.00 O ATOM 181 CB THR A 11 7.986 3.173 1.170 1.00 0.00 C ATOM 182 OG1 THR A 11 7.076 3.922 0.382 1.00 0.00 O ATOM 183 CG2 THR A 11 9.386 3.549 0.733 1.00 0.00 C ATOM 0 H THR A 11 9.578 1.480 1.969 1.00 0.00 H new ATOM 0 HA THR A 11 6.804 1.429 1.626 1.00 0.00 H new ATOM 0 HB THR A 11 7.876 3.406 2.229 1.00 0.00 H new ATOM 0 HG1 THR A 11 6.193 3.498 0.411 1.00 0.00 H new ATOM 0 HG21 THR A 11 9.524 4.625 0.840 1.00 0.00 H new ATOM 0 HG22 THR A 11 10.114 3.027 1.354 1.00 0.00 H new ATOM 0 HG23 THR A 11 9.530 3.266 -0.310 1.00 0.00 H new ATOM 191 N LEU A 12 6.182 1.375 -0.807 1.00 0.00 N ATOM 192 CA LEU A 12 5.790 1.054 -2.176 1.00 0.00 C ATOM 193 C LEU A 12 5.177 2.273 -2.864 1.00 0.00 C ATOM 194 O LEU A 12 4.639 3.162 -2.203 1.00 0.00 O ATOM 195 CB LEU A 12 4.804 -0.126 -2.186 1.00 0.00 C ATOM 196 CG LEU A 12 3.317 0.247 -2.125 1.00 0.00 C ATOM 197 CD1 LEU A 12 2.467 -0.833 -2.776 1.00 0.00 C ATOM 198 CD2 LEU A 12 2.878 0.478 -0.689 1.00 0.00 C ATOM 0 H LEU A 12 5.408 1.649 -0.202 1.00 0.00 H new ATOM 0 HA LEU A 12 6.683 0.765 -2.731 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.976 -0.711 -3.089 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.032 -0.773 -1.339 1.00 0.00 H new ATOM 0 HG LEU A 12 3.176 1.176 -2.678 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.416 -0.550 -2.723 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.760 -0.947 -3.820 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.615 -1.778 -2.253 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.820 0.741 -0.670 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.036 -0.431 -0.109 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.462 1.290 -0.256 1.00 0.00 H new ATOM 210 N MET A 13 5.253 2.308 -4.192 1.00 0.00 N ATOM 211 CA MET A 13 4.694 3.418 -4.954 1.00 0.00 C ATOM 212 C MET A 13 3.768 2.908 -6.051 1.00 0.00 C ATOM 213 O MET A 13 4.222 2.466 -7.106 1.00 0.00 O ATOM 214 CB MET A 13 5.812 4.262 -5.568 1.00 0.00 C ATOM 215 CG MET A 13 5.307 5.469 -6.342 1.00 0.00 C ATOM 216 SD MET A 13 6.528 6.109 -7.503 1.00 0.00 S ATOM 217 CE MET A 13 6.505 7.852 -7.092 1.00 0.00 C ATOM 0 H MET A 13 5.694 1.584 -4.759 1.00 0.00 H new ATOM 0 HA MET A 13 4.116 4.039 -4.270 1.00 0.00 H new ATOM 0 HB2 MET A 13 6.477 4.602 -4.774 1.00 0.00 H new ATOM 0 HB3 MET A 13 6.405 3.635 -6.234 1.00 0.00 H new ATOM 0 HG2 MET A 13 4.403 5.195 -6.886 1.00 0.00 H new ATOM 0 HG3 MET A 13 5.031 6.256 -5.640 1.00 0.00 H new ATOM 0 HE1 MET A 13 6.948 8.424 -7.907 1.00 0.00 H new ATOM 0 HE2 MET A 13 5.476 8.176 -6.939 1.00 0.00 H new ATOM 0 HE3 MET A 13 7.078 8.018 -6.180 1.00 0.00 H new ATOM 227 N ILE A 14 2.468 2.973 -5.794 1.00 0.00 N ATOM 228 CA ILE A 14 1.476 2.519 -6.754 1.00 0.00 C ATOM 229 C ILE A 14 0.613 3.683 -7.240 1.00 0.00 C ATOM 230 O ILE A 14 0.202 4.533 -6.451 1.00 0.00 O ATOM 231 CB ILE A 14 0.574 1.426 -6.142 1.00 0.00 C ATOM 232 CG1 ILE A 14 -0.520 1.003 -7.127 1.00 0.00 C ATOM 233 CG2 ILE A 14 -0.040 1.914 -4.837 1.00 0.00 C ATOM 234 CD1 ILE A 14 0.014 0.557 -8.470 1.00 0.00 C ATOM 0 H ILE A 14 2.077 3.337 -4.925 1.00 0.00 H new ATOM 0 HA ILE A 14 2.013 2.098 -7.604 1.00 0.00 H new ATOM 0 HB ILE A 14 1.192 0.554 -5.930 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.099 0.191 -6.687 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.205 1.838 -7.277 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -0.673 1.132 -4.418 1.00 0.00 H new ATOM 0 HG22 ILE A 14 0.753 2.156 -4.130 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -0.640 2.804 -5.028 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -0.817 0.272 -9.116 1.00 0.00 H new ATOM 0 HD12 ILE A 14 0.568 1.375 -8.931 1.00 0.00 H new ATOM 0 HD13 ILE A 14 0.676 -0.298 -8.333 1.00 0.00 H new ATOM 246 N GLY A 15 0.343 3.715 -8.542 1.00 0.00 N ATOM 247 CA GLY A 15 -0.467 4.780 -9.109 1.00 0.00 C ATOM 248 C GLY A 15 0.220 5.470 -10.272 1.00 0.00 C ATOM 249 O GLY A 15 0.331 4.905 -11.362 1.00 0.00 O ATOM 0 H GLY A 15 0.671 3.022 -9.215 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -1.419 4.370 -9.444 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -0.691 5.514 -8.335 1.00 0.00 H new ATOM 253 N ASP A 16 0.681 6.693 -10.039 1.00 0.00 N ATOM 254 CA ASP A 16 1.364 7.467 -11.074 1.00 0.00 C ATOM 255 C ASP A 16 2.340 8.484 -10.474 1.00 0.00 C ATOM 256 O ASP A 16 3.062 9.160 -11.207 1.00 0.00 O ATOM 257 CB ASP A 16 0.339 8.188 -11.952 1.00 0.00 C ATOM 258 CG ASP A 16 0.677 8.101 -13.427 1.00 0.00 C ATOM 259 OD1 ASP A 16 0.384 7.055 -14.043 1.00 0.00 O ATOM 260 OD2 ASP A 16 1.235 9.080 -13.967 1.00 0.00 O ATOM 0 H ASP A 16 0.595 7.172 -9.143 1.00 0.00 H new ATOM 0 HA ASP A 16 1.941 6.769 -11.681 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -0.648 7.757 -11.782 1.00 0.00 H new ATOM 0 HB3 ASP A 16 0.284 9.236 -11.656 1.00 0.00 H new ATOM 265 N GLU A 17 2.361 8.584 -9.143 1.00 0.00 N ATOM 266 CA GLU A 17 3.245 9.512 -8.440 1.00 0.00 C ATOM 267 C GLU A 17 2.885 9.544 -6.958 1.00 0.00 C ATOM 268 O GLU A 17 2.562 10.598 -6.409 1.00 0.00 O ATOM 269 CB GLU A 17 3.137 10.925 -9.025 1.00 0.00 C ATOM 270 CG GLU A 17 4.317 11.817 -8.678 1.00 0.00 C ATOM 271 CD GLU A 17 5.224 12.071 -9.866 1.00 0.00 C ATOM 272 OE1 GLU A 17 4.702 12.410 -10.949 1.00 0.00 O ATOM 273 OE2 GLU A 17 6.456 11.932 -9.714 1.00 0.00 O ATOM 0 H GLU A 17 1.769 8.027 -8.527 1.00 0.00 H new ATOM 0 HA GLU A 17 4.271 9.165 -8.563 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.051 10.855 -10.109 1.00 0.00 H new ATOM 0 HB3 GLU A 17 2.221 11.391 -8.662 1.00 0.00 H new ATOM 0 HG2 GLU A 17 3.948 12.769 -8.297 1.00 0.00 H new ATOM 0 HG3 GLU A 17 4.894 11.355 -7.877 1.00 0.00 H new ATOM 280 N VAL A 18 2.927 8.381 -6.318 1.00 0.00 N ATOM 281 CA VAL A 18 2.589 8.274 -4.914 1.00 0.00 C ATOM 282 C VAL A 18 3.817 7.947 -4.062 1.00 0.00 C ATOM 283 O VAL A 18 4.954 8.169 -4.480 1.00 0.00 O ATOM 284 CB VAL A 18 1.504 7.198 -4.710 1.00 0.00 C ATOM 285 CG1 VAL A 18 0.327 7.448 -5.641 1.00 0.00 C ATOM 286 CG2 VAL A 18 2.069 5.799 -4.920 1.00 0.00 C ATOM 0 H VAL A 18 3.193 7.499 -6.756 1.00 0.00 H new ATOM 0 HA VAL A 18 2.205 9.242 -4.590 1.00 0.00 H new ATOM 0 HB VAL A 18 1.153 7.263 -3.680 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.430 6.680 -5.485 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.101 8.428 -5.431 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.668 7.416 -6.676 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.280 5.062 -4.769 1.00 0.00 H new ATOM 0 HG22 VAL A 18 2.458 5.712 -5.935 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.874 5.621 -4.207 1.00 0.00 H new ATOM 296 N THR A 19 3.573 7.417 -2.867 1.00 0.00 N ATOM 297 CA THR A 19 4.634 7.051 -1.939 1.00 0.00 C ATOM 298 C THR A 19 4.023 6.621 -0.611 1.00 0.00 C ATOM 299 O THR A 19 3.598 7.456 0.184 1.00 0.00 O ATOM 300 CB THR A 19 5.594 8.223 -1.720 1.00 0.00 C ATOM 301 OG1 THR A 19 4.978 9.450 -2.070 1.00 0.00 O ATOM 302 CG2 THR A 19 6.872 8.107 -2.522 1.00 0.00 C ATOM 0 H THR A 19 2.634 7.230 -2.516 1.00 0.00 H new ATOM 0 HA THR A 19 5.200 6.223 -2.364 1.00 0.00 H new ATOM 0 HB THR A 19 5.845 8.196 -0.660 1.00 0.00 H new ATOM 0 HG1 THR A 19 5.608 10.186 -1.921 1.00 0.00 H new ATOM 0 HG21 THR A 19 7.507 8.969 -2.321 1.00 0.00 H new ATOM 0 HG22 THR A 19 7.398 7.195 -2.239 1.00 0.00 H new ATOM 0 HG23 THR A 19 6.633 8.073 -3.585 1.00 0.00 H new ATOM 310 N VAL A 20 3.970 5.315 -0.380 1.00 0.00 N ATOM 311 CA VAL A 20 3.394 4.790 0.851 1.00 0.00 C ATOM 312 C VAL A 20 4.482 4.352 1.825 1.00 0.00 C ATOM 313 O VAL A 20 5.075 3.283 1.671 1.00 0.00 O ATOM 314 CB VAL A 20 2.464 3.596 0.566 1.00 0.00 C ATOM 315 CG1 VAL A 20 1.783 3.125 1.843 1.00 0.00 C ATOM 316 CG2 VAL A 20 1.434 3.963 -0.492 1.00 0.00 C ATOM 0 H VAL A 20 4.316 4.604 -1.024 1.00 0.00 H new ATOM 0 HA VAL A 20 2.814 5.596 1.300 1.00 0.00 H new ATOM 0 HB VAL A 20 3.069 2.774 0.184 1.00 0.00 H new ATOM 0 HG11 VAL A 20 1.131 2.281 1.618 1.00 0.00 H new ATOM 0 HG12 VAL A 20 2.538 2.817 2.566 1.00 0.00 H new ATOM 0 HG13 VAL A 20 1.191 3.939 2.261 1.00 0.00 H new ATOM 0 HG21 VAL A 20 0.786 3.107 -0.681 1.00 0.00 H new ATOM 0 HG22 VAL A 20 0.834 4.802 -0.140 1.00 0.00 H new ATOM 0 HG23 VAL A 20 1.943 4.242 -1.414 1.00 0.00 H new ATOM 326 N THR A 21 4.739 5.188 2.824 1.00 0.00 N ATOM 327 CA THR A 21 5.758 4.895 3.825 1.00 0.00 C ATOM 328 C THR A 21 5.154 4.196 5.040 1.00 0.00 C ATOM 329 O THR A 21 3.958 4.311 5.308 1.00 0.00 O ATOM 330 CB THR A 21 6.459 6.184 4.258 1.00 0.00 C ATOM 331 OG1 THR A 21 6.626 7.058 3.156 1.00 0.00 O ATOM 332 CG2 THR A 21 7.825 5.947 4.866 1.00 0.00 C ATOM 0 H THR A 21 4.255 6.075 2.963 1.00 0.00 H new ATOM 0 HA THR A 21 6.488 4.223 3.374 1.00 0.00 H new ATOM 0 HB THR A 21 5.812 6.624 5.017 1.00 0.00 H new ATOM 0 HG1 THR A 21 7.074 7.877 3.453 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.267 6.902 5.151 1.00 0.00 H new ATOM 0 HG22 THR A 21 7.726 5.315 5.749 1.00 0.00 H new ATOM 0 HG23 THR A 21 8.467 5.453 4.137 1.00 0.00 H new ATOM 340 N VAL A 22 5.998 3.479 5.775 1.00 0.00 N ATOM 341 CA VAL A 22 5.563 2.765 6.970 1.00 0.00 C ATOM 342 C VAL A 22 6.065 3.468 8.227 1.00 0.00 C ATOM 343 O VAL A 22 6.635 4.556 8.149 1.00 0.00 O ATOM 344 CB VAL A 22 6.064 1.306 6.967 1.00 0.00 C ATOM 345 CG1 VAL A 22 5.497 0.550 5.775 1.00 0.00 C ATOM 346 CG2 VAL A 22 7.586 1.260 6.961 1.00 0.00 C ATOM 0 H VAL A 22 6.990 3.377 5.563 1.00 0.00 H new ATOM 0 HA VAL A 22 4.473 2.760 6.967 1.00 0.00 H new ATOM 0 HB VAL A 22 5.714 0.821 7.878 1.00 0.00 H new ATOM 0 HG11 VAL A 22 5.861 -0.477 5.789 1.00 0.00 H new ATOM 0 HG12 VAL A 22 4.408 0.550 5.829 1.00 0.00 H new ATOM 0 HG13 VAL A 22 5.815 1.035 4.852 1.00 0.00 H new ATOM 0 HG21 VAL A 22 7.919 0.222 6.959 1.00 0.00 H new ATOM 0 HG22 VAL A 22 7.962 1.763 6.070 1.00 0.00 H new ATOM 0 HG23 VAL A 22 7.969 1.762 7.850 1.00 0.00 H new ATOM 356 N LEU A 23 5.860 2.847 9.385 1.00 0.00 N ATOM 357 CA LEU A 23 6.304 3.424 10.648 1.00 0.00 C ATOM 358 C LEU A 23 7.145 2.415 11.424 1.00 0.00 C ATOM 359 O LEU A 23 8.274 2.704 11.818 1.00 0.00 O ATOM 360 CB LEU A 23 5.100 3.864 11.485 1.00 0.00 C ATOM 361 CG LEU A 23 5.379 4.979 12.495 1.00 0.00 C ATOM 362 CD1 LEU A 23 6.229 4.460 13.643 1.00 0.00 C ATOM 363 CD2 LEU A 23 6.060 6.158 11.815 1.00 0.00 C ATOM 0 H LEU A 23 5.390 1.946 9.474 1.00 0.00 H new ATOM 0 HA LEU A 23 6.918 4.299 10.433 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.311 4.196 10.810 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.716 2.997 12.022 1.00 0.00 H new ATOM 0 HG LEU A 23 4.427 5.320 12.901 1.00 0.00 H new ATOM 0 HD11 LEU A 23 6.417 5.267 14.351 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.703 3.650 14.148 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.178 4.090 13.255 1.00 0.00 H new ATOM 0 HD21 LEU A 23 6.250 6.941 12.549 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.004 5.831 11.380 1.00 0.00 H new ATOM 0 HD23 LEU A 23 5.414 6.547 11.029 1.00 0.00 H new ATOM 375 N GLY A 24 6.588 1.223 11.629 1.00 0.00 N ATOM 376 CA GLY A 24 7.304 0.182 12.343 1.00 0.00 C ATOM 377 C GLY A 24 6.995 0.156 13.827 1.00 0.00 C ATOM 378 O GLY A 24 6.872 -0.913 14.425 1.00 0.00 O ATOM 0 H GLY A 24 5.654 0.961 11.313 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.053 -0.786 11.909 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.375 0.326 12.204 1.00 0.00 H new ATOM 382 N VAL A 25 6.884 1.335 14.422 1.00 0.00 N ATOM 383 CA VAL A 25 6.605 1.457 15.843 1.00 0.00 C ATOM 384 C VAL A 25 5.107 1.404 16.125 1.00 0.00 C ATOM 385 O VAL A 25 4.298 1.809 15.291 1.00 0.00 O ATOM 386 CB VAL A 25 7.188 2.762 16.412 1.00 0.00 C ATOM 387 CG1 VAL A 25 7.154 2.746 17.933 1.00 0.00 C ATOM 388 CG2 VAL A 25 8.608 2.976 15.901 1.00 0.00 C ATOM 0 H VAL A 25 6.984 2.227 13.937 1.00 0.00 H new ATOM 0 HA VAL A 25 7.083 0.609 16.334 1.00 0.00 H new ATOM 0 HB VAL A 25 6.573 3.595 16.071 1.00 0.00 H new ATOM 0 HG11 VAL A 25 7.571 3.678 18.316 1.00 0.00 H new ATOM 0 HG12 VAL A 25 6.124 2.643 18.273 1.00 0.00 H new ATOM 0 HG13 VAL A 25 7.744 1.906 18.301 1.00 0.00 H new ATOM 0 HG21 VAL A 25 9.007 3.903 16.312 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.236 2.141 16.212 1.00 0.00 H new ATOM 0 HG23 VAL A 25 8.598 3.037 14.813 1.00 0.00 H new ATOM 398 N LYS A 26 4.753 0.890 17.310 1.00 0.00 N ATOM 399 CA LYS A 26 3.357 0.757 17.745 1.00 0.00 C ATOM 400 C LYS A 26 2.870 -0.679 17.576 1.00 0.00 C ATOM 401 O LYS A 26 2.808 -1.198 16.461 1.00 0.00 O ATOM 402 CB LYS A 26 2.431 1.715 16.991 1.00 0.00 C ATOM 403 CG LYS A 26 1.120 1.986 17.712 1.00 0.00 C ATOM 404 CD LYS A 26 0.213 2.894 16.898 1.00 0.00 C ATOM 405 CE LYS A 26 -0.510 3.897 17.784 1.00 0.00 C ATOM 406 NZ LYS A 26 0.421 4.915 18.345 1.00 0.00 N ATOM 0 H LYS A 26 5.429 0.554 17.996 1.00 0.00 H new ATOM 0 HA LYS A 26 3.326 1.021 18.802 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.951 2.660 16.832 1.00 0.00 H new ATOM 0 HB3 LYS A 26 2.216 1.300 16.006 1.00 0.00 H new ATOM 0 HG2 LYS A 26 0.610 1.043 17.909 1.00 0.00 H new ATOM 0 HG3 LYS A 26 1.324 2.446 18.679 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.803 3.425 16.151 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -0.517 2.291 16.358 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -1.289 4.396 17.207 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -1.006 3.370 18.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.120 5.750 18.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.924 4.513 19.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 1.110 5.194 17.617 1.00 0.00 H new ATOM 420 N GLY A 27 2.530 -1.314 18.694 1.00 0.00 N ATOM 421 CA GLY A 27 2.056 -2.686 18.657 1.00 0.00 C ATOM 422 C GLY A 27 0.560 -2.782 18.425 1.00 0.00 C ATOM 423 O GLY A 27 -0.134 -1.766 18.379 1.00 0.00 O ATOM 0 H GLY A 27 2.574 -0.902 19.626 1.00 0.00 H new ATOM 0 HA2 GLY A 27 2.578 -3.225 17.866 1.00 0.00 H new ATOM 0 HA3 GLY A 27 2.306 -3.178 19.597 1.00 0.00 H new ATOM 427 N ASN A 28 0.064 -4.006 18.270 1.00 0.00 N ATOM 428 CA ASN A 28 -1.357 -4.233 18.032 1.00 0.00 C ATOM 429 C ASN A 28 -1.777 -3.613 16.701 1.00 0.00 C ATOM 430 O ASN A 28 -1.820 -4.294 15.677 1.00 0.00 O ATOM 431 CB ASN A 28 -2.192 -3.655 19.179 1.00 0.00 C ATOM 432 CG ASN A 28 -2.711 -4.729 20.115 1.00 0.00 C ATOM 433 OD1 ASN A 28 -3.789 -5.284 19.903 1.00 0.00 O ATOM 434 ND2 ASN A 28 -1.945 -5.027 21.157 1.00 0.00 N ATOM 0 H ASN A 28 0.626 -4.856 18.305 1.00 0.00 H new ATOM 0 HA ASN A 28 -1.533 -5.308 17.986 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -1.587 -2.946 19.744 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -3.034 -3.098 18.767 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -2.243 -5.742 21.821 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -1.058 -4.541 21.294 1.00 0.00 H new ATOM 441 N GLN A 29 -2.079 -2.318 16.720 1.00 0.00 N ATOM 442 CA GLN A 29 -2.484 -1.608 15.514 1.00 0.00 C ATOM 443 C GLN A 29 -1.260 -1.135 14.739 1.00 0.00 C ATOM 444 O GLN A 29 -0.298 -0.638 15.326 1.00 0.00 O ATOM 445 CB GLN A 29 -3.371 -0.415 15.871 1.00 0.00 C ATOM 446 CG GLN A 29 -4.850 -0.758 15.946 1.00 0.00 C ATOM 447 CD GLN A 29 -5.593 0.088 16.962 1.00 0.00 C ATOM 448 OE1 GLN A 29 -5.875 -0.361 18.074 1.00 0.00 O ATOM 449 NE2 GLN A 29 -5.916 1.319 16.584 1.00 0.00 N ATOM 0 H GLN A 29 -2.050 -1.739 17.559 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.053 -2.293 14.886 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -3.051 -0.010 16.831 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -3.226 0.370 15.129 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.302 -0.620 14.964 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.963 -1.811 16.203 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.662 1.650 15.653 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.418 1.934 17.225 1.00 0.00 H new ATOM 458 N VAL A 30 -1.294 -1.298 13.422 1.00 0.00 N ATOM 459 CA VAL A 30 -0.176 -0.890 12.585 1.00 0.00 C ATOM 460 C VAL A 30 -0.373 0.529 12.070 1.00 0.00 C ATOM 461 O VAL A 30 -1.295 0.798 11.304 1.00 0.00 O ATOM 462 CB VAL A 30 0.005 -1.837 11.385 1.00 0.00 C ATOM 463 CG1 VAL A 30 1.287 -1.512 10.637 1.00 0.00 C ATOM 464 CG2 VAL A 30 -0.001 -3.287 11.843 1.00 0.00 C ATOM 0 H VAL A 30 -2.079 -1.707 12.915 1.00 0.00 H new ATOM 0 HA VAL A 30 0.718 -0.932 13.207 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.833 -1.693 10.703 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.398 -2.192 9.792 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.246 -0.485 10.274 1.00 0.00 H new ATOM 0 HG13 VAL A 30 2.138 -1.625 11.308 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.128 -3.941 10.981 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.815 -3.449 12.547 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.950 -3.511 12.330 1.00 0.00 H new ATOM 474 N ARG A 31 0.510 1.430 12.486 1.00 0.00 N ATOM 475 CA ARG A 31 0.443 2.810 12.060 1.00 0.00 C ATOM 476 C ARG A 31 1.183 2.984 10.742 1.00 0.00 C ATOM 477 O ARG A 31 2.410 3.072 10.717 1.00 0.00 O ATOM 478 CB ARG A 31 1.039 3.730 13.130 1.00 0.00 C ATOM 479 CG ARG A 31 0.012 4.624 13.806 1.00 0.00 C ATOM 480 CD ARG A 31 0.669 5.588 14.781 1.00 0.00 C ATOM 481 NE ARG A 31 1.204 6.768 14.108 1.00 0.00 N ATOM 482 CZ ARG A 31 1.491 7.911 14.728 1.00 0.00 C ATOM 483 NH1 ARG A 31 1.297 8.032 16.036 1.00 0.00 N ATOM 484 NH2 ARG A 31 1.974 8.935 14.039 1.00 0.00 N ATOM 0 H ARG A 31 1.281 1.221 13.120 1.00 0.00 H new ATOM 0 HA ARG A 31 -0.603 3.082 11.916 1.00 0.00 H new ATOM 0 HB2 ARG A 31 1.532 3.121 13.887 1.00 0.00 H new ATOM 0 HB3 ARG A 31 1.807 4.354 12.673 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -0.536 5.186 13.050 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -0.715 4.009 14.335 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -0.059 5.897 15.531 1.00 0.00 H new ATOM 0 HD3 ARG A 31 1.473 5.077 15.310 1.00 0.00 H new ATOM 0 HE ARG A 31 1.368 6.714 13.103 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.926 7.247 16.571 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.519 8.910 16.505 1.00 0.00 H new ATOM 0 HH21 ARG A 31 2.126 8.847 13.034 1.00 0.00 H new ATOM 0 HH22 ARG A 31 2.194 9.811 14.514 1.00 0.00 H new ATOM 498 N ILE A 32 0.437 3.013 9.646 1.00 0.00 N ATOM 499 CA ILE A 32 1.037 3.153 8.328 1.00 0.00 C ATOM 500 C ILE A 32 0.677 4.489 7.692 1.00 0.00 C ATOM 501 O ILE A 32 -0.475 4.919 7.733 1.00 0.00 O ATOM 502 CB ILE A 32 0.599 2.002 7.402 1.00 0.00 C ATOM 503 CG1 ILE A 32 0.802 0.658 8.110 1.00 0.00 C ATOM 504 CG2 ILE A 32 1.375 2.046 6.094 1.00 0.00 C ATOM 505 CD1 ILE A 32 2.234 0.417 8.540 1.00 0.00 C ATOM 0 H ILE A 32 -0.581 2.942 9.644 1.00 0.00 H new ATOM 0 HA ILE A 32 2.118 3.113 8.459 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.460 2.117 7.170 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.155 0.616 8.986 1.00 0.00 H new ATOM 0 HG13 ILE A 32 0.490 -0.146 7.444 1.00 0.00 H new ATOM 0 HG21 ILE A 32 1.053 1.226 5.452 1.00 0.00 H new ATOM 0 HG22 ILE A 32 1.188 2.995 5.592 1.00 0.00 H new ATOM 0 HG23 ILE A 32 2.441 1.948 6.300 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.307 -0.552 9.034 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.883 0.428 7.665 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.543 1.201 9.231 1.00 0.00 H new ATOM 517 N GLY A 33 1.675 5.141 7.104 1.00 0.00 N ATOM 518 CA GLY A 33 1.450 6.423 6.466 1.00 0.00 C ATOM 519 C GLY A 33 1.420 6.316 4.957 1.00 0.00 C ATOM 520 O GLY A 33 2.438 6.023 4.330 1.00 0.00 O ATOM 0 H GLY A 33 2.636 4.803 7.059 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.506 6.840 6.817 1.00 0.00 H new ATOM 0 HA3 GLY A 33 2.236 7.117 6.763 1.00 0.00 H new ATOM 524 N VAL A 34 0.253 6.553 4.369 1.00 0.00 N ATOM 525 CA VAL A 34 0.107 6.479 2.924 1.00 0.00 C ATOM 526 C VAL A 34 0.188 7.863 2.293 1.00 0.00 C ATOM 527 O VAL A 34 -0.765 8.640 2.349 1.00 0.00 O ATOM 528 CB VAL A 34 -1.230 5.823 2.527 1.00 0.00 C ATOM 529 CG1 VAL A 34 -1.293 5.602 1.023 1.00 0.00 C ATOM 530 CG2 VAL A 34 -1.425 4.510 3.272 1.00 0.00 C ATOM 0 H VAL A 34 -0.601 6.797 4.870 1.00 0.00 H new ATOM 0 HA VAL A 34 0.928 5.865 2.554 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.039 6.498 2.807 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -2.244 5.138 0.763 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.204 6.560 0.510 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -0.475 4.950 0.717 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -2.374 4.062 2.978 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -0.611 3.828 3.027 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.430 4.698 4.346 1.00 0.00 H new ATOM 540 N ASN A 35 1.335 8.165 1.695 1.00 0.00 N ATOM 541 CA ASN A 35 1.538 9.459 1.057 1.00 0.00 C ATOM 542 C ASN A 35 1.128 9.405 -0.409 1.00 0.00 C ATOM 543 O ASN A 35 1.810 8.808 -1.238 1.00 0.00 O ATOM 544 CB ASN A 35 3.001 9.893 1.182 1.00 0.00 C ATOM 545 CG ASN A 35 3.155 11.197 1.940 1.00 0.00 C ATOM 546 OD1 ASN A 35 2.942 12.278 1.389 1.00 0.00 O ATOM 547 ND2 ASN A 35 3.527 11.102 3.211 1.00 0.00 N ATOM 0 H ASN A 35 2.135 7.534 1.639 1.00 0.00 H new ATOM 0 HA ASN A 35 0.911 10.192 1.564 1.00 0.00 H new ATOM 0 HB2 ASN A 35 3.567 9.112 1.690 1.00 0.00 H new ATOM 0 HB3 ASN A 35 3.431 10.002 0.186 1.00 0.00 H new ATOM 0 HD21 ASN A 35 3.647 11.946 3.772 1.00 0.00 H new ATOM 0 HD22 ASN A 35 3.693 10.185 3.627 1.00 0.00 H new ATOM 554 N ALA A 36 0.001 10.034 -0.713 1.00 0.00 N ATOM 555 CA ALA A 36 -0.519 10.062 -2.075 1.00 0.00 C ATOM 556 C ALA A 36 -0.960 11.468 -2.475 1.00 0.00 C ATOM 557 O ALA A 36 -1.461 12.231 -1.648 1.00 0.00 O ATOM 558 CB ALA A 36 -1.676 9.085 -2.216 1.00 0.00 C ATOM 0 H ALA A 36 -0.573 10.533 -0.033 1.00 0.00 H new ATOM 0 HA ALA A 36 0.285 9.761 -2.747 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.055 9.115 -3.237 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.331 8.077 -1.987 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.472 9.362 -1.525 1.00 0.00 H new ATOM 564 N PRO A 37 -0.782 11.828 -3.759 1.00 0.00 N ATOM 565 CA PRO A 37 -1.165 13.141 -4.277 1.00 0.00 C ATOM 566 C PRO A 37 -2.652 13.222 -4.600 1.00 0.00 C ATOM 567 O PRO A 37 -3.300 12.203 -4.840 1.00 0.00 O ATOM 568 CB PRO A 37 -0.335 13.256 -5.551 1.00 0.00 C ATOM 569 CG PRO A 37 -0.220 11.854 -6.041 1.00 0.00 C ATOM 570 CD PRO A 37 -0.195 10.977 -4.814 1.00 0.00 C ATOM 0 HA PRO A 37 -0.989 13.940 -3.557 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -0.822 13.896 -6.287 1.00 0.00 H new ATOM 0 HB3 PRO A 37 0.645 13.689 -5.350 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -1.061 11.597 -6.685 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.686 11.722 -6.632 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -0.775 10.066 -4.962 1.00 0.00 H new ATOM 0 HD3 PRO A 37 0.820 10.671 -4.562 1.00 0.00 H new ATOM 578 N LYS A 38 -3.189 14.438 -4.607 1.00 0.00 N ATOM 579 CA LYS A 38 -4.602 14.646 -4.903 1.00 0.00 C ATOM 580 C LYS A 38 -4.832 14.840 -6.401 1.00 0.00 C ATOM 581 O LYS A 38 -5.791 15.496 -6.808 1.00 0.00 O ATOM 582 CB LYS A 38 -5.129 15.860 -4.134 1.00 0.00 C ATOM 583 CG LYS A 38 -5.795 15.504 -2.815 1.00 0.00 C ATOM 584 CD LYS A 38 -5.968 16.727 -1.930 1.00 0.00 C ATOM 585 CE LYS A 38 -6.932 17.729 -2.545 1.00 0.00 C ATOM 586 NZ LYS A 38 -6.676 19.115 -2.064 1.00 0.00 N ATOM 0 H LYS A 38 -2.668 15.293 -4.411 1.00 0.00 H new ATOM 0 HA LYS A 38 -5.145 13.755 -4.588 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -4.302 16.544 -3.941 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.844 16.393 -4.760 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -6.768 15.053 -3.008 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -5.195 14.758 -2.293 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -6.337 16.420 -0.951 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -5.000 17.202 -1.771 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -6.842 17.699 -3.631 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -7.956 17.444 -2.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.354 19.767 -2.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -6.787 19.150 -1.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -5.708 19.397 -2.318 1.00 0.00 H new ATOM 600 N GLU A 39 -3.951 14.268 -7.220 1.00 0.00 N ATOM 601 CA GLU A 39 -4.069 14.385 -8.669 1.00 0.00 C ATOM 602 C GLU A 39 -4.394 13.035 -9.303 1.00 0.00 C ATOM 603 O GLU A 39 -5.158 12.959 -10.265 1.00 0.00 O ATOM 604 CB GLU A 39 -2.774 14.942 -9.264 1.00 0.00 C ATOM 605 CG GLU A 39 -2.438 16.344 -8.783 1.00 0.00 C ATOM 606 CD GLU A 39 -2.216 17.317 -9.925 1.00 0.00 C ATOM 607 OE1 GLU A 39 -1.626 16.908 -10.947 1.00 0.00 O ATOM 608 OE2 GLU A 39 -2.631 18.488 -9.797 1.00 0.00 O ATOM 0 H GLU A 39 -3.150 13.721 -6.904 1.00 0.00 H new ATOM 0 HA GLU A 39 -4.887 15.072 -8.886 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -1.951 14.273 -9.012 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -2.857 14.950 -10.351 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.247 16.710 -8.151 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.542 16.306 -8.164 1.00 0.00 H new ATOM 615 N VAL A 40 -3.811 11.970 -8.757 1.00 0.00 N ATOM 616 CA VAL A 40 -4.045 10.626 -9.273 1.00 0.00 C ATOM 617 C VAL A 40 -5.350 10.055 -8.726 1.00 0.00 C ATOM 618 O VAL A 40 -5.721 10.317 -7.582 1.00 0.00 O ATOM 619 CB VAL A 40 -2.884 9.670 -8.922 1.00 0.00 C ATOM 620 CG1 VAL A 40 -2.964 8.400 -9.756 1.00 0.00 C ATOM 621 CG2 VAL A 40 -1.541 10.358 -9.121 1.00 0.00 C ATOM 0 H VAL A 40 -3.176 12.013 -7.960 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.111 10.709 -10.358 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.974 9.396 -7.871 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.137 7.740 -9.494 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -3.909 7.894 -9.559 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.903 8.655 -10.814 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -0.737 9.667 -8.868 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.441 10.666 -10.162 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -1.482 11.235 -8.476 1.00 0.00 H new ATOM 631 N SER A 41 -6.046 9.280 -9.553 1.00 0.00 N ATOM 632 CA SER A 41 -7.315 8.679 -9.154 1.00 0.00 C ATOM 633 C SER A 41 -7.162 7.870 -7.870 1.00 0.00 C ATOM 634 O SER A 41 -6.692 6.733 -7.892 1.00 0.00 O ATOM 635 CB SER A 41 -7.851 7.785 -10.273 1.00 0.00 C ATOM 636 OG SER A 41 -8.856 6.909 -9.791 1.00 0.00 O ATOM 0 H SER A 41 -5.753 9.053 -10.503 1.00 0.00 H new ATOM 0 HA SER A 41 -8.025 9.485 -8.967 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.257 8.403 -11.073 1.00 0.00 H new ATOM 0 HB3 SER A 41 -7.034 7.205 -10.702 1.00 0.00 H new ATOM 0 HG SER A 41 -9.183 6.350 -10.526 1.00 0.00 H new ATOM 642 N VAL A 42 -7.564 8.464 -6.751 1.00 0.00 N ATOM 643 CA VAL A 42 -7.475 7.799 -5.458 1.00 0.00 C ATOM 644 C VAL A 42 -8.847 7.705 -4.793 1.00 0.00 C ATOM 645 O VAL A 42 -9.515 8.719 -4.588 1.00 0.00 O ATOM 646 CB VAL A 42 -6.505 8.536 -4.514 1.00 0.00 C ATOM 647 CG1 VAL A 42 -7.003 9.944 -4.221 1.00 0.00 C ATOM 648 CG2 VAL A 42 -6.311 7.751 -3.226 1.00 0.00 C ATOM 0 H VAL A 42 -7.955 9.405 -6.715 1.00 0.00 H new ATOM 0 HA VAL A 42 -7.095 6.794 -5.642 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.539 8.617 -5.012 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.303 10.446 -3.553 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -7.080 10.504 -5.153 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -7.983 9.892 -3.747 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.623 8.288 -2.573 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.271 7.633 -2.723 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -5.900 6.768 -3.457 1.00 0.00 H new ATOM 658 N HIS A 43 -9.259 6.488 -4.448 1.00 0.00 N ATOM 659 CA HIS A 43 -10.545 6.271 -3.798 1.00 0.00 C ATOM 660 C HIS A 43 -10.367 5.434 -2.534 1.00 0.00 C ATOM 661 O HIS A 43 -9.635 4.444 -2.536 1.00 0.00 O ATOM 662 CB HIS A 43 -11.516 5.578 -4.757 1.00 0.00 C ATOM 663 CG HIS A 43 -12.777 6.351 -4.991 1.00 0.00 C ATOM 664 ND1 HIS A 43 -13.057 6.994 -6.178 1.00 0.00 N ATOM 665 CD2 HIS A 43 -13.838 6.583 -4.182 1.00 0.00 C ATOM 666 CE1 HIS A 43 -14.232 7.590 -6.090 1.00 0.00 C ATOM 667 NE2 HIS A 43 -14.728 7.355 -4.889 1.00 0.00 N ATOM 0 H HIS A 43 -8.719 5.637 -4.609 1.00 0.00 H new ATOM 0 HA HIS A 43 -10.960 7.240 -3.520 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -11.017 5.415 -5.712 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -11.770 4.596 -4.358 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -13.962 6.227 -3.170 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -14.706 8.170 -6.867 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -15.626 7.692 -4.542 1.00 0.00 H new ATOM 675 N ARG A 44 -11.034 5.831 -1.456 1.00 0.00 N ATOM 676 CA ARG A 44 -10.941 5.107 -0.194 1.00 0.00 C ATOM 677 C ARG A 44 -12.218 5.280 0.619 1.00 0.00 C ATOM 678 O ARG A 44 -12.909 4.308 0.927 1.00 0.00 O ATOM 679 CB ARG A 44 -9.739 5.599 0.618 1.00 0.00 C ATOM 680 CG ARG A 44 -8.504 5.882 -0.223 1.00 0.00 C ATOM 681 CD ARG A 44 -7.347 6.368 0.635 1.00 0.00 C ATOM 682 NE ARG A 44 -6.540 7.375 -0.051 1.00 0.00 N ATOM 683 CZ ARG A 44 -6.872 8.662 -0.134 1.00 0.00 C ATOM 684 NH1 ARG A 44 -7.995 9.103 0.419 1.00 0.00 N ATOM 685 NH2 ARG A 44 -6.078 9.510 -0.772 1.00 0.00 N ATOM 0 H ARG A 44 -11.644 6.648 -1.431 1.00 0.00 H new ATOM 0 HA ARG A 44 -10.808 4.049 -0.419 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -10.020 6.507 1.151 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -9.491 4.851 1.371 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -8.209 4.977 -0.755 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -8.740 6.633 -0.977 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -7.735 6.786 1.564 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -6.716 5.521 0.906 1.00 0.00 H new ATOM 0 HE ARG A 44 -5.671 7.074 -0.492 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -8.610 8.455 0.911 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -8.243 10.090 0.352 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -5.214 9.177 -1.199 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -6.331 10.496 -0.836 1.00 0.00 H new ATOM 699 N GLU A 45 -12.527 6.527 0.962 1.00 0.00 N ATOM 700 CA GLU A 45 -13.721 6.839 1.738 1.00 0.00 C ATOM 701 C GLU A 45 -13.809 8.337 2.011 1.00 0.00 C ATOM 702 O GLU A 45 -12.793 8.998 2.229 1.00 0.00 O ATOM 703 CB GLU A 45 -13.717 6.068 3.061 1.00 0.00 C ATOM 704 CG GLU A 45 -15.089 5.558 3.471 1.00 0.00 C ATOM 705 CD GLU A 45 -15.410 5.848 4.924 1.00 0.00 C ATOM 706 OE1 GLU A 45 -14.570 5.533 5.793 1.00 0.00 O ATOM 707 OE2 GLU A 45 -16.502 6.391 5.194 1.00 0.00 O ATOM 0 H GLU A 45 -11.964 7.340 0.713 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.592 6.537 1.156 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.034 5.223 2.977 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -13.329 6.715 3.848 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.847 6.017 2.837 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.139 4.483 3.300 1.00 0.00 H new ATOM 714 N GLU A 46 -15.027 8.868 2.001 1.00 0.00 N ATOM 715 CA GLU A 46 -15.240 10.288 2.252 1.00 0.00 C ATOM 716 C GLU A 46 -14.834 10.648 3.676 1.00 0.00 C ATOM 717 O GLU A 46 -14.179 11.665 3.909 1.00 0.00 O ATOM 718 CB GLU A 46 -16.707 10.655 2.018 1.00 0.00 C ATOM 719 CG GLU A 46 -16.897 12.011 1.358 1.00 0.00 C ATOM 720 CD GLU A 46 -17.546 11.909 -0.009 1.00 0.00 C ATOM 721 OE1 GLU A 46 -16.813 11.716 -1.002 1.00 0.00 O ATOM 722 OE2 GLU A 46 -18.788 12.022 -0.087 1.00 0.00 O ATOM 0 H GLU A 46 -15.880 8.338 1.822 1.00 0.00 H new ATOM 0 HA GLU A 46 -14.619 10.855 1.559 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -17.170 9.889 1.395 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -17.231 10.649 2.974 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -17.511 12.641 2.001 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -15.929 12.502 1.261 1.00 0.00 H new ATOM 729 N ILE A 47 -15.226 9.805 4.624 1.00 0.00 N ATOM 730 CA ILE A 47 -14.905 10.024 6.029 1.00 0.00 C ATOM 731 C ILE A 47 -13.400 9.952 6.265 1.00 0.00 C ATOM 732 O ILE A 47 -12.819 10.827 6.906 1.00 0.00 O ATOM 733 CB ILE A 47 -15.607 8.988 6.929 1.00 0.00 C ATOM 734 CG1 ILE A 47 -17.106 8.949 6.627 1.00 0.00 C ATOM 735 CG2 ILE A 47 -15.366 9.304 8.398 1.00 0.00 C ATOM 736 CD1 ILE A 47 -17.791 10.287 6.795 1.00 0.00 C ATOM 0 H ILE A 47 -15.769 8.960 4.444 1.00 0.00 H new ATOM 0 HA ILE A 47 -15.262 11.021 6.287 1.00 0.00 H new ATOM 0 HB ILE A 47 -15.186 8.005 6.717 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -17.254 8.600 5.605 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -17.582 8.221 7.284 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -15.869 8.562 9.017 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -14.296 9.283 8.604 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.760 10.294 8.627 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -18.851 10.184 6.564 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -17.675 10.629 7.824 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -17.341 11.014 6.118 1.00 0.00 H new ATOM 748 N TYR A 48 -12.776 8.898 5.748 1.00 0.00 N ATOM 749 CA TYR A 48 -11.338 8.699 5.905 1.00 0.00 C ATOM 750 C TYR A 48 -10.552 9.949 5.511 1.00 0.00 C ATOM 751 O TYR A 48 -9.634 10.359 6.216 1.00 0.00 O ATOM 752 CB TYR A 48 -10.874 7.506 5.065 1.00 0.00 C ATOM 753 CG TYR A 48 -9.384 7.253 5.137 1.00 0.00 C ATOM 754 CD1 TYR A 48 -8.808 6.695 6.271 1.00 0.00 C ATOM 755 CD2 TYR A 48 -8.554 7.575 4.070 1.00 0.00 C ATOM 756 CE1 TYR A 48 -7.446 6.465 6.340 1.00 0.00 C ATOM 757 CE2 TYR A 48 -7.192 7.346 4.131 1.00 0.00 C ATOM 758 CZ TYR A 48 -6.644 6.792 5.267 1.00 0.00 C ATOM 759 OH TYR A 48 -5.288 6.564 5.332 1.00 0.00 O ATOM 0 H TYR A 48 -13.245 8.166 5.215 1.00 0.00 H new ATOM 0 HA TYR A 48 -11.145 8.497 6.959 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -11.402 6.612 5.397 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -11.155 7.674 4.025 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -9.434 6.437 7.112 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -8.980 8.011 3.179 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -7.013 6.032 7.229 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -6.561 7.600 3.292 1.00 0.00 H new ATOM 0 HH TYR A 48 -4.944 6.381 4.433 1.00 0.00 H new ATOM 769 N GLN A 49 -10.907 10.540 4.375 1.00 0.00 N ATOM 770 CA GLN A 49 -10.218 11.732 3.890 1.00 0.00 C ATOM 771 C GLN A 49 -10.624 12.978 4.674 1.00 0.00 C ATOM 772 O GLN A 49 -9.781 13.650 5.269 1.00 0.00 O ATOM 773 CB GLN A 49 -10.509 11.940 2.402 1.00 0.00 C ATOM 774 CG GLN A 49 -9.495 12.830 1.702 1.00 0.00 C ATOM 775 CD GLN A 49 -10.041 13.447 0.429 1.00 0.00 C ATOM 776 OE1 GLN A 49 -11.056 14.143 0.449 1.00 0.00 O ATOM 777 NE2 GLN A 49 -9.368 13.194 -0.687 1.00 0.00 N ATOM 0 H GLN A 49 -11.665 10.215 3.774 1.00 0.00 H new ATOM 0 HA GLN A 49 -9.149 11.576 4.036 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -10.532 10.970 1.906 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -11.501 12.378 2.292 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -9.183 13.623 2.381 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -8.606 12.245 1.466 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -8.531 12.611 -0.657 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -9.688 13.582 -1.574 1.00 0.00 H new ATOM 786 N ARG A 50 -11.918 13.290 4.653 1.00 0.00 N ATOM 787 CA ARG A 50 -12.445 14.468 5.342 1.00 0.00 C ATOM 788 C ARG A 50 -12.005 14.538 6.808 1.00 0.00 C ATOM 789 O ARG A 50 -12.089 15.597 7.430 1.00 0.00 O ATOM 790 CB ARG A 50 -13.974 14.492 5.253 1.00 0.00 C ATOM 791 CG ARG A 50 -14.657 13.439 6.113 1.00 0.00 C ATOM 792 CD ARG A 50 -15.526 14.075 7.187 1.00 0.00 C ATOM 793 NE ARG A 50 -16.140 13.076 8.058 1.00 0.00 N ATOM 794 CZ ARG A 50 -16.894 13.376 9.114 1.00 0.00 C ATOM 795 NH1 ARG A 50 -17.132 14.644 9.429 1.00 0.00 N ATOM 796 NH2 ARG A 50 -17.411 12.407 9.855 1.00 0.00 N ATOM 0 H ARG A 50 -12.625 12.741 4.164 1.00 0.00 H new ATOM 0 HA ARG A 50 -12.033 15.343 4.839 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -14.330 15.478 5.551 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -14.270 14.347 4.214 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -15.269 12.794 5.483 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -13.904 12.805 6.581 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -14.921 14.756 7.786 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -16.306 14.673 6.715 1.00 0.00 H new ATOM 0 HE ARG A 50 -15.982 12.091 7.845 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -16.737 15.393 8.861 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -17.710 14.868 10.239 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -17.231 11.432 9.617 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -17.989 12.636 10.664 1.00 0.00 H new ATOM 810 N ILE A 51 -11.541 13.420 7.359 1.00 0.00 N ATOM 811 CA ILE A 51 -11.098 13.386 8.750 1.00 0.00 C ATOM 812 C ILE A 51 -9.580 13.252 8.843 1.00 0.00 C ATOM 813 O ILE A 51 -8.915 14.062 9.489 1.00 0.00 O ATOM 814 CB ILE A 51 -11.758 12.229 9.528 1.00 0.00 C ATOM 815 CG1 ILE A 51 -13.283 12.355 9.473 1.00 0.00 C ATOM 816 CG2 ILE A 51 -11.274 12.211 10.972 1.00 0.00 C ATOM 817 CD1 ILE A 51 -14.010 11.328 10.316 1.00 0.00 C ATOM 0 H ILE A 51 -11.462 12.530 6.867 1.00 0.00 H new ATOM 0 HA ILE A 51 -11.403 14.331 9.199 1.00 0.00 H new ATOM 0 HB ILE A 51 -11.471 11.287 9.060 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -13.568 13.353 9.806 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -13.609 12.259 8.437 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -11.750 11.388 11.505 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -10.192 12.078 10.992 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -11.533 13.154 11.454 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -15.086 11.480 10.227 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -13.755 10.326 9.970 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -13.713 11.438 11.359 1.00 0.00 H new ATOM 829 N GLN A 52 -9.038 12.225 8.197 1.00 0.00 N ATOM 830 CA GLN A 52 -7.598 11.989 8.212 1.00 0.00 C ATOM 831 C GLN A 52 -6.862 13.065 7.423 1.00 0.00 C ATOM 832 O GLN A 52 -6.051 13.807 7.977 1.00 0.00 O ATOM 833 CB GLN A 52 -7.275 10.608 7.638 1.00 0.00 C ATOM 834 CG GLN A 52 -8.076 9.483 8.275 1.00 0.00 C ATOM 835 CD GLN A 52 -7.606 9.155 9.678 1.00 0.00 C ATOM 836 OE1 GLN A 52 -6.441 9.362 10.020 1.00 0.00 O ATOM 837 NE2 GLN A 52 -8.512 8.640 10.501 1.00 0.00 N ATOM 0 H GLN A 52 -9.572 11.544 7.658 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.262 12.029 9.248 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.465 10.616 6.565 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -6.212 10.407 7.772 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -9.129 9.763 8.305 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -8.001 8.591 7.653 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -9.466 8.485 10.176 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -8.254 8.400 11.458 1.00 0.00 H new ATOM 846 N ALA A 53 -7.149 13.149 6.127 1.00 0.00 N ATOM 847 CA ALA A 53 -6.512 14.139 5.270 1.00 0.00 C ATOM 848 C ALA A 53 -6.953 15.545 5.651 1.00 0.00 C ATOM 849 O ALA A 53 -6.183 16.500 5.551 1.00 0.00 O ATOM 850 CB ALA A 53 -6.831 13.858 3.810 1.00 0.00 C ATOM 0 H ALA A 53 -7.817 12.544 5.650 1.00 0.00 H new ATOM 0 HA ALA A 53 -5.433 14.071 5.410 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -6.348 14.606 3.182 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -6.464 12.867 3.542 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -7.910 13.899 3.659 1.00 0.00 H new ATOM 856 N GLU A 54 -8.200 15.662 6.093 1.00 0.00 N ATOM 857 CA GLU A 54 -8.752 16.948 6.497 1.00 0.00 C ATOM 858 C GLU A 54 -9.143 16.925 7.970 1.00 0.00 C ATOM 859 O GLU A 54 -9.916 16.073 8.406 1.00 0.00 O ATOM 860 CB GLU A 54 -9.965 17.302 5.634 1.00 0.00 C ATOM 861 CG GLU A 54 -10.132 18.795 5.402 1.00 0.00 C ATOM 862 CD GLU A 54 -8.904 19.430 4.780 1.00 0.00 C ATOM 863 OE1 GLU A 54 -7.975 19.789 5.533 1.00 0.00 O ATOM 864 OE2 GLU A 54 -8.872 19.568 3.539 1.00 0.00 O ATOM 0 H GLU A 54 -8.848 14.879 6.180 1.00 0.00 H new ATOM 0 HA GLU A 54 -7.986 17.710 6.354 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -9.873 16.801 4.670 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -10.865 16.914 6.111 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.992 18.964 4.754 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.348 19.284 6.352 1.00 0.00 H new ATOM 871 N LYS A 55 -8.593 17.862 8.733 1.00 0.00 N ATOM 872 CA LYS A 55 -8.868 17.956 10.155 1.00 0.00 C ATOM 873 C LYS A 55 -10.369 17.996 10.427 1.00 0.00 C ATOM 874 O LYS A 55 -11.039 18.981 10.118 1.00 0.00 O ATOM 875 CB LYS A 55 -8.199 19.200 10.743 1.00 0.00 C ATOM 876 CG LYS A 55 -7.711 19.012 12.171 1.00 0.00 C ATOM 877 CD LYS A 55 -6.366 18.305 12.211 1.00 0.00 C ATOM 878 CE LYS A 55 -5.786 18.292 13.617 1.00 0.00 C ATOM 879 NZ LYS A 55 -6.570 17.419 14.534 1.00 0.00 N ATOM 0 H LYS A 55 -7.949 18.572 8.383 1.00 0.00 H new ATOM 0 HA LYS A 55 -8.458 17.067 10.634 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -7.354 19.480 10.113 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -8.906 20.029 10.716 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -7.628 19.983 12.659 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -8.444 18.434 12.734 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -6.481 17.282 11.854 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -5.672 18.803 11.534 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -4.753 17.945 13.580 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -5.767 19.308 14.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -6.132 17.424 15.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -7.545 17.775 14.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -6.581 16.447 14.163 1.00 0.00 H new ATOM 983 N MET B 1 -1.241 13.769 3.398 1.00 0.00 N ATOM 984 CA MET B 1 -0.870 12.457 3.992 1.00 0.00 C ATOM 985 C MET B 1 -2.044 11.841 4.746 1.00 0.00 C ATOM 986 O MET B 1 -2.654 12.486 5.600 1.00 0.00 O ATOM 987 CB MET B 1 0.313 12.667 4.938 1.00 0.00 C ATOM 988 CG MET B 1 0.877 11.374 5.504 1.00 0.00 C ATOM 989 SD MET B 1 0.284 11.028 7.171 1.00 0.00 S ATOM 990 CE MET B 1 1.389 9.705 7.656 1.00 0.00 C ATOM 0 H1 MET B 1 -0.423 14.164 2.891 1.00 0.00 H new ATOM 0 H2 MET B 1 -2.030 13.638 2.733 1.00 0.00 H new ATOM 0 H3 MET B 1 -1.529 14.423 4.153 1.00 0.00 H new ATOM 0 HA MET B 1 -0.595 11.768 3.193 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.104 13.196 4.406 1.00 0.00 H new ATOM 0 HB3 MET B 1 -0.001 13.308 5.762 1.00 0.00 H new ATOM 0 HG2 MET B 1 0.607 10.547 4.848 1.00 0.00 H new ATOM 0 HG3 MET B 1 1.965 11.431 5.514 1.00 0.00 H new ATOM 0 HE1 MET B 1 0.805 8.846 7.986 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.008 9.418 6.806 1.00 0.00 H new ATOM 0 HE3 MET B 1 2.027 10.045 8.472 1.00 0.00 H new ATOM 1002 N LEU B 2 -2.356 10.590 4.425 1.00 0.00 N ATOM 1003 CA LEU B 2 -3.457 9.884 5.072 1.00 0.00 C ATOM 1004 C LEU B 2 -2.949 8.656 5.821 1.00 0.00 C ATOM 1005 O LEU B 2 -2.544 7.668 5.209 1.00 0.00 O ATOM 1006 CB LEU B 2 -4.502 9.468 4.036 1.00 0.00 C ATOM 1007 CG LEU B 2 -5.351 10.614 3.476 1.00 0.00 C ATOM 1008 CD1 LEU B 2 -5.236 10.678 1.960 1.00 0.00 C ATOM 1009 CD2 LEU B 2 -6.806 10.458 3.896 1.00 0.00 C ATOM 0 H LEU B 2 -1.862 10.043 3.720 1.00 0.00 H new ATOM 0 HA LEU B 2 -3.918 10.561 5.791 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -3.994 8.974 3.208 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -5.166 8.731 4.488 1.00 0.00 H new ATOM 0 HG LEU B 2 -4.973 11.550 3.887 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -5.847 11.499 1.583 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -4.195 10.842 1.681 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -5.584 9.739 1.529 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -7.393 11.281 3.489 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -7.195 9.513 3.517 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -6.874 10.468 4.984 1.00 0.00 H new ATOM 1021 N ILE B 3 -2.961 8.730 7.148 1.00 0.00 N ATOM 1022 CA ILE B 3 -2.487 7.629 7.977 1.00 0.00 C ATOM 1023 C ILE B 3 -3.578 6.586 8.200 1.00 0.00 C ATOM 1024 O ILE B 3 -4.597 6.860 8.832 1.00 0.00 O ATOM 1025 CB ILE B 3 -1.980 8.133 9.345 1.00 0.00 C ATOM 1026 CG1 ILE B 3 -1.350 6.985 10.137 1.00 0.00 C ATOM 1027 CG2 ILE B 3 -3.114 8.769 10.137 1.00 0.00 C ATOM 1028 CD1 ILE B 3 -0.216 7.423 11.038 1.00 0.00 C ATOM 0 H ILE B 3 -3.293 9.540 7.671 1.00 0.00 H new ATOM 0 HA ILE B 3 -1.660 7.166 7.438 1.00 0.00 H new ATOM 0 HB ILE B 3 -1.218 8.892 9.170 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -2.120 6.506 10.742 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -0.980 6.234 9.440 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -2.736 9.118 11.098 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -3.519 9.613 9.579 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -3.900 8.032 10.302 1.00 0.00 H new ATOM 0 HD11 ILE B 3 0.182 6.558 11.568 1.00 0.00 H new ATOM 0 HD12 ILE B 3 0.573 7.875 10.437 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -0.585 8.152 11.759 1.00 0.00 H new ATOM 1040 N LEU B 4 -3.347 5.385 7.676 1.00 0.00 N ATOM 1041 CA LEU B 4 -4.299 4.290 7.815 1.00 0.00 C ATOM 1042 C LEU B 4 -3.702 3.160 8.643 1.00 0.00 C ATOM 1043 O LEU B 4 -2.481 3.023 8.734 1.00 0.00 O ATOM 1044 CB LEU B 4 -4.720 3.769 6.439 1.00 0.00 C ATOM 1045 CG LEU B 4 -6.205 3.427 6.302 1.00 0.00 C ATOM 1046 CD1 LEU B 4 -6.684 3.690 4.882 1.00 0.00 C ATOM 1047 CD2 LEU B 4 -6.456 1.978 6.692 1.00 0.00 C ATOM 0 H LEU B 4 -2.506 5.147 7.150 1.00 0.00 H new ATOM 0 HA LEU B 4 -5.181 4.669 8.331 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -4.465 4.519 5.690 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -4.135 2.878 6.210 1.00 0.00 H new ATOM 0 HG LEU B 4 -6.770 4.068 6.979 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -7.742 3.441 4.803 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -6.540 4.743 4.638 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -6.114 3.075 4.186 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -7.517 1.752 6.589 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -5.880 1.321 6.041 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -6.151 1.822 7.727 1.00 0.00 H new ATOM 1059 N THR B 5 -4.565 2.355 9.252 1.00 0.00 N ATOM 1060 CA THR B 5 -4.110 1.244 10.076 1.00 0.00 C ATOM 1061 C THR B 5 -4.081 -0.058 9.288 1.00 0.00 C ATOM 1062 O THR B 5 -5.103 -0.510 8.772 1.00 0.00 O ATOM 1063 CB THR B 5 -5.000 1.078 11.306 1.00 0.00 C ATOM 1064 OG1 THR B 5 -5.799 2.230 11.512 1.00 0.00 O ATOM 1065 CG2 THR B 5 -4.212 0.830 12.574 1.00 0.00 C ATOM 0 H THR B 5 -5.579 2.451 9.191 1.00 0.00 H new ATOM 0 HA THR B 5 -3.095 1.477 10.398 1.00 0.00 H new ATOM 0 HB THR B 5 -5.621 0.206 11.101 1.00 0.00 H new ATOM 0 HG1 THR B 5 -6.362 2.100 12.304 1.00 0.00 H new ATOM 0 HG21 THR B 5 -4.899 0.720 13.413 1.00 0.00 H new ATOM 0 HG22 THR B 5 -3.624 -0.081 12.465 1.00 0.00 H new ATOM 0 HG23 THR B 5 -3.545 1.672 12.758 1.00 0.00 H new ATOM 1073 N ARG B 6 -2.903 -0.662 9.213 1.00 0.00 N ATOM 1074 CA ARG B 6 -2.734 -1.920 8.504 1.00 0.00 C ATOM 1075 C ARG B 6 -2.908 -3.093 9.452 1.00 0.00 C ATOM 1076 O ARG B 6 -2.615 -2.988 10.643 1.00 0.00 O ATOM 1077 CB ARG B 6 -1.363 -1.988 7.835 1.00 0.00 C ATOM 1078 CG ARG B 6 -1.427 -1.924 6.318 1.00 0.00 C ATOM 1079 CD ARG B 6 -1.770 -0.525 5.832 1.00 0.00 C ATOM 1080 NE ARG B 6 -3.162 -0.422 5.402 1.00 0.00 N ATOM 1081 CZ ARG B 6 -3.637 0.573 4.656 1.00 0.00 C ATOM 1082 NH1 ARG B 6 -2.836 1.554 4.260 1.00 0.00 N ATOM 1083 NH2 ARG B 6 -4.916 0.588 4.306 1.00 0.00 N ATOM 0 H ARG B 6 -2.049 -0.299 9.636 1.00 0.00 H new ATOM 0 HA ARG B 6 -3.500 -1.975 7.730 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -0.748 -1.166 8.200 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -0.868 -2.913 8.132 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -0.468 -2.231 5.899 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -2.174 -2.630 5.954 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -1.583 0.192 6.631 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -1.114 -0.258 5.004 1.00 0.00 H new ATOM 0 HE ARG B 6 -3.809 -1.156 5.690 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -1.852 1.548 4.527 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -3.205 2.314 3.688 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -5.536 -0.163 4.608 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -5.279 1.351 3.734 1.00 0.00 H new ATOM 1097 N ARG B 7 -3.404 -4.205 8.919 1.00 0.00 N ATOM 1098 CA ARG B 7 -3.634 -5.404 9.717 1.00 0.00 C ATOM 1099 C ARG B 7 -4.915 -5.243 10.529 1.00 0.00 C ATOM 1100 O ARG B 7 -4.889 -4.766 11.662 1.00 0.00 O ATOM 1101 CB ARG B 7 -2.432 -5.681 10.633 1.00 0.00 C ATOM 1102 CG ARG B 7 -1.727 -6.995 10.335 1.00 0.00 C ATOM 1103 CD ARG B 7 -0.682 -7.318 11.392 1.00 0.00 C ATOM 1104 NE ARG B 7 -1.290 -7.683 12.669 1.00 0.00 N ATOM 1105 CZ ARG B 7 -0.608 -7.811 13.805 1.00 0.00 C ATOM 1106 NH1 ARG B 7 0.704 -7.607 13.826 1.00 0.00 N ATOM 1107 NH2 ARG B 7 -1.238 -8.146 14.923 1.00 0.00 N ATOM 0 H ARG B 7 -3.655 -4.301 7.935 1.00 0.00 H new ATOM 0 HA ARG B 7 -3.749 -6.260 9.051 1.00 0.00 H new ATOM 0 HB2 ARG B 7 -1.716 -4.865 10.536 1.00 0.00 H new ATOM 0 HB3 ARG B 7 -2.770 -5.687 11.669 1.00 0.00 H new ATOM 0 HG2 ARG B 7 -2.460 -7.800 10.288 1.00 0.00 H new ATOM 0 HG3 ARG B 7 -1.251 -6.940 9.356 1.00 0.00 H new ATOM 0 HD2 ARG B 7 -0.054 -8.137 11.042 1.00 0.00 H new ATOM 0 HD3 ARG B 7 -0.031 -6.455 11.534 1.00 0.00 H new ATOM 0 HE ARG B 7 -2.296 -7.850 12.692 1.00 0.00 H new ATOM 0 HH11 ARG B 7 1.194 -7.351 12.969 1.00 0.00 H new ATOM 0 HH12 ARG B 7 1.222 -7.706 14.699 1.00 0.00 H new ATOM 0 HH21 ARG B 7 -2.245 -8.306 14.913 1.00 0.00 H new ATOM 0 HH22 ARG B 7 -0.715 -8.244 15.793 1.00 0.00 H new ATOM 1121 N VAL B 8 -6.036 -5.621 9.915 1.00 0.00 N ATOM 1122 CA VAL B 8 -7.354 -5.505 10.537 1.00 0.00 C ATOM 1123 C VAL B 8 -7.873 -4.073 10.410 1.00 0.00 C ATOM 1124 O VAL B 8 -8.211 -3.430 11.404 1.00 0.00 O ATOM 1125 CB VAL B 8 -7.349 -5.921 12.028 1.00 0.00 C ATOM 1126 CG1 VAL B 8 -8.750 -5.830 12.613 1.00 0.00 C ATOM 1127 CG2 VAL B 8 -6.794 -7.330 12.193 1.00 0.00 C ATOM 0 H VAL B 8 -6.056 -6.015 8.975 1.00 0.00 H new ATOM 0 HA VAL B 8 -8.013 -6.192 10.007 1.00 0.00 H new ATOM 0 HB VAL B 8 -6.702 -5.232 12.571 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -8.726 -6.126 13.662 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -9.112 -4.805 12.534 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -9.418 -6.494 12.063 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -6.800 -7.602 13.249 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -7.412 -8.032 11.634 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -5.772 -7.365 11.815 1.00 0.00 H new ATOM 1137 N GLY B 9 -7.931 -3.581 9.172 1.00 0.00 N ATOM 1138 CA GLY B 9 -8.405 -2.231 8.925 1.00 0.00 C ATOM 1139 C GLY B 9 -9.223 -2.124 7.650 1.00 0.00 C ATOM 1140 O GLY B 9 -9.909 -3.071 7.264 1.00 0.00 O ATOM 0 H GLY B 9 -7.657 -4.096 8.336 1.00 0.00 H new ATOM 0 HA2 GLY B 9 -9.011 -1.902 9.770 1.00 0.00 H new ATOM 0 HA3 GLY B 9 -7.552 -1.556 8.863 1.00 0.00 H new ATOM 1144 N GLU B 10 -9.157 -0.964 6.996 1.00 0.00 N ATOM 1145 CA GLU B 10 -9.905 -0.736 5.761 1.00 0.00 C ATOM 1146 C GLU B 10 -8.973 -0.578 4.559 1.00 0.00 C ATOM 1147 O GLU B 10 -8.119 0.308 4.534 1.00 0.00 O ATOM 1148 CB GLU B 10 -10.787 0.506 5.901 1.00 0.00 C ATOM 1149 CG GLU B 10 -12.225 0.192 6.276 1.00 0.00 C ATOM 1150 CD GLU B 10 -12.493 0.366 7.758 1.00 0.00 C ATOM 1151 OE1 GLU B 10 -12.073 -0.510 8.544 1.00 0.00 O ATOM 1152 OE2 GLU B 10 -13.122 1.377 8.133 1.00 0.00 O ATOM 0 H GLU B 10 -8.594 -0.170 7.301 1.00 0.00 H new ATOM 0 HA GLU B 10 -10.532 -1.610 5.588 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -10.358 1.162 6.658 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -10.778 1.056 4.960 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -12.894 0.841 5.711 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -12.456 -0.833 5.987 1.00 0.00 H new ATOM 1159 N THR B 11 -9.149 -1.445 3.566 1.00 0.00 N ATOM 1160 CA THR B 11 -8.334 -1.411 2.353 1.00 0.00 C ATOM 1161 C THR B 11 -8.446 -0.064 1.644 1.00 0.00 C ATOM 1162 O THR B 11 -9.490 0.587 1.681 1.00 0.00 O ATOM 1163 CB THR B 11 -8.761 -2.531 1.403 1.00 0.00 C ATOM 1164 OG1 THR B 11 -8.199 -2.342 0.116 1.00 0.00 O ATOM 1165 CG2 THR B 11 -10.262 -2.635 1.238 1.00 0.00 C ATOM 0 H THR B 11 -9.852 -2.184 3.577 1.00 0.00 H new ATOM 0 HA THR B 11 -7.294 -1.556 2.645 1.00 0.00 H new ATOM 0 HB THR B 11 -8.396 -3.451 1.860 1.00 0.00 H new ATOM 0 HG1 THR B 11 -7.274 -2.031 0.205 1.00 0.00 H new ATOM 0 HG21 THR B 11 -10.497 -3.449 0.552 1.00 0.00 H new ATOM 0 HG22 THR B 11 -10.722 -2.833 2.206 1.00 0.00 H new ATOM 0 HG23 THR B 11 -10.650 -1.699 0.837 1.00 0.00 H new ATOM 1173 N LEU B 12 -7.357 0.343 0.999 1.00 0.00 N ATOM 1174 CA LEU B 12 -7.316 1.610 0.276 1.00 0.00 C ATOM 1175 C LEU B 12 -7.070 1.375 -1.213 1.00 0.00 C ATOM 1176 O LEU B 12 -6.486 0.363 -1.601 1.00 0.00 O ATOM 1177 CB LEU B 12 -6.232 2.527 0.866 1.00 0.00 C ATOM 1178 CG LEU B 12 -4.843 2.417 0.225 1.00 0.00 C ATOM 1179 CD1 LEU B 12 -4.077 3.722 0.382 1.00 0.00 C ATOM 1180 CD2 LEU B 12 -4.061 1.264 0.831 1.00 0.00 C ATOM 0 H LEU B 12 -6.487 -0.189 0.962 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.283 2.101 0.386 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -6.570 3.560 0.780 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -6.139 2.310 1.930 1.00 0.00 H new ATOM 0 HG LEU B 12 -4.973 2.220 -0.839 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -3.094 3.625 -0.079 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -4.627 4.528 -0.104 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -3.960 3.950 1.441 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -3.079 1.204 0.362 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -3.942 1.428 1.902 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -4.600 0.331 0.664 1.00 0.00 H new ATOM 1192 N MET B 13 -7.508 2.317 -2.045 1.00 0.00 N ATOM 1193 CA MET B 13 -7.320 2.204 -3.486 1.00 0.00 C ATOM 1194 C MET B 13 -6.673 3.464 -4.047 1.00 0.00 C ATOM 1195 O MET B 13 -7.340 4.477 -4.255 1.00 0.00 O ATOM 1196 CB MET B 13 -8.658 1.952 -4.182 1.00 0.00 C ATOM 1197 CG MET B 13 -8.536 1.776 -5.687 1.00 0.00 C ATOM 1198 SD MET B 13 -10.097 2.049 -6.547 1.00 0.00 S ATOM 1199 CE MET B 13 -10.177 0.585 -7.576 1.00 0.00 C ATOM 0 H MET B 13 -7.993 3.163 -1.746 1.00 0.00 H new ATOM 0 HA MET B 13 -6.658 1.359 -3.675 1.00 0.00 H new ATOM 0 HB2 MET B 13 -9.118 1.060 -3.756 1.00 0.00 H new ATOM 0 HB3 MET B 13 -9.329 2.786 -3.975 1.00 0.00 H new ATOM 0 HG2 MET B 13 -7.788 2.470 -6.071 1.00 0.00 H new ATOM 0 HG3 MET B 13 -8.178 0.770 -5.903 1.00 0.00 H new ATOM 0 HE1 MET B 13 -10.892 0.746 -8.383 1.00 0.00 H new ATOM 0 HE2 MET B 13 -9.193 0.383 -7.999 1.00 0.00 H new ATOM 0 HE3 MET B 13 -10.495 -0.266 -6.974 1.00 0.00 H new ATOM 1209 N ILE B 14 -5.370 3.393 -4.288 1.00 0.00 N ATOM 1210 CA ILE B 14 -4.630 4.523 -4.823 1.00 0.00 C ATOM 1211 C ILE B 14 -4.082 4.208 -6.215 1.00 0.00 C ATOM 1212 O ILE B 14 -3.580 3.113 -6.459 1.00 0.00 O ATOM 1213 CB ILE B 14 -3.468 4.916 -3.886 1.00 0.00 C ATOM 1214 CG1 ILE B 14 -2.641 6.057 -4.487 1.00 0.00 C ATOM 1215 CG2 ILE B 14 -2.587 3.709 -3.599 1.00 0.00 C ATOM 1216 CD1 ILE B 14 -3.462 7.274 -4.851 1.00 0.00 C ATOM 0 H ILE B 14 -4.805 2.561 -4.120 1.00 0.00 H new ATOM 0 HA ILE B 14 -5.322 5.362 -4.897 1.00 0.00 H new ATOM 0 HB ILE B 14 -3.893 5.268 -2.946 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -1.869 6.349 -3.775 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -2.130 5.694 -5.379 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -1.772 4.002 -2.937 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -3.181 2.931 -3.120 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -2.176 3.328 -4.534 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -2.810 8.040 -5.270 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -4.217 6.997 -5.587 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -3.952 7.663 -3.958 1.00 0.00 H new ATOM 1228 N GLY B 15 -4.183 5.175 -7.122 1.00 0.00 N ATOM 1229 CA GLY B 15 -3.696 4.979 -8.477 1.00 0.00 C ATOM 1230 C GLY B 15 -4.754 5.287 -9.520 1.00 0.00 C ATOM 1231 O GLY B 15 -5.088 6.449 -9.754 1.00 0.00 O ATOM 0 H GLY B 15 -4.594 6.091 -6.943 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -2.828 5.616 -8.644 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -3.362 3.948 -8.595 1.00 0.00 H new ATOM 1235 N ASP B 16 -5.281 4.241 -10.147 1.00 0.00 N ATOM 1236 CA ASP B 16 -6.309 4.399 -11.173 1.00 0.00 C ATOM 1237 C ASP B 16 -7.202 3.158 -11.280 1.00 0.00 C ATOM 1238 O ASP B 16 -8.174 3.155 -12.035 1.00 0.00 O ATOM 1239 CB ASP B 16 -5.660 4.688 -12.528 1.00 0.00 C ATOM 1240 CG ASP B 16 -6.374 5.786 -13.290 1.00 0.00 C ATOM 1241 OD1 ASP B 16 -6.134 6.973 -12.986 1.00 0.00 O ATOM 1242 OD2 ASP B 16 -7.174 5.459 -14.193 1.00 0.00 O ATOM 0 H ASP B 16 -5.014 3.274 -9.964 1.00 0.00 H new ATOM 0 HA ASP B 16 -6.938 5.240 -10.881 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -4.619 4.974 -12.375 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -5.656 3.777 -13.127 1.00 0.00 H new ATOM 1247 N GLU B 17 -6.872 2.113 -10.518 1.00 0.00 N ATOM 1248 CA GLU B 17 -7.638 0.867 -10.521 1.00 0.00 C ATOM 1249 C GLU B 17 -6.894 -0.196 -9.721 1.00 0.00 C ATOM 1250 O GLU B 17 -6.565 -1.263 -10.240 1.00 0.00 O ATOM 1251 CB GLU B 17 -7.867 0.366 -11.951 1.00 0.00 C ATOM 1252 CG GLU B 17 -9.009 -0.631 -12.068 1.00 0.00 C ATOM 1253 CD GLU B 17 -10.229 -0.041 -12.747 1.00 0.00 C ATOM 1254 OE1 GLU B 17 -10.068 0.591 -13.812 1.00 0.00 O ATOM 1255 OE2 GLU B 17 -11.346 -0.212 -12.214 1.00 0.00 O ATOM 0 H GLU B 17 -6.072 2.107 -9.886 1.00 0.00 H new ATOM 0 HA GLU B 17 -8.608 1.061 -10.064 1.00 0.00 H new ATOM 0 HB2 GLU B 17 -8.072 1.219 -12.598 1.00 0.00 H new ATOM 0 HB3 GLU B 17 -6.951 -0.098 -12.316 1.00 0.00 H new ATOM 0 HG2 GLU B 17 -8.670 -1.502 -12.630 1.00 0.00 H new ATOM 0 HG3 GLU B 17 -9.285 -0.981 -11.073 1.00 0.00 H new ATOM 1262 N VAL B 18 -6.616 0.106 -8.457 1.00 0.00 N ATOM 1263 CA VAL B 18 -5.897 -0.810 -7.597 1.00 0.00 C ATOM 1264 C VAL B 18 -6.797 -1.368 -6.492 1.00 0.00 C ATOM 1265 O VAL B 18 -8.023 -1.351 -6.605 1.00 0.00 O ATOM 1266 CB VAL B 18 -4.674 -0.107 -6.976 1.00 0.00 C ATOM 1267 CG1 VAL B 18 -3.836 0.555 -8.059 1.00 0.00 C ATOM 1268 CG2 VAL B 18 -5.099 0.912 -5.926 1.00 0.00 C ATOM 0 H VAL B 18 -6.882 0.983 -8.010 1.00 0.00 H new ATOM 0 HA VAL B 18 -5.561 -1.646 -8.210 1.00 0.00 H new ATOM 0 HB VAL B 18 -4.066 -0.863 -6.479 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -2.976 1.047 -7.604 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -3.490 -0.201 -8.764 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -4.440 1.294 -8.586 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -4.215 1.392 -5.506 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -5.736 1.666 -6.388 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -5.650 0.408 -5.132 1.00 0.00 H new ATOM 1278 N THR B 19 -6.172 -1.862 -5.426 1.00 0.00 N ATOM 1279 CA THR B 19 -6.887 -2.428 -4.290 1.00 0.00 C ATOM 1280 C THR B 19 -5.889 -3.039 -3.314 1.00 0.00 C ATOM 1281 O THR B 19 -5.369 -4.129 -3.548 1.00 0.00 O ATOM 1282 CB THR B 19 -7.888 -3.491 -4.753 1.00 0.00 C ATOM 1283 OG1 THR B 19 -7.546 -3.978 -6.038 1.00 0.00 O ATOM 1284 CG2 THR B 19 -9.312 -2.983 -4.818 1.00 0.00 C ATOM 0 H THR B 19 -5.157 -1.880 -5.327 1.00 0.00 H new ATOM 0 HA THR B 19 -7.442 -1.632 -3.793 1.00 0.00 H new ATOM 0 HB THR B 19 -7.835 -4.282 -4.005 1.00 0.00 H new ATOM 0 HG1 THR B 19 -8.197 -4.657 -6.314 1.00 0.00 H new ATOM 0 HG21 THR B 19 -9.970 -3.785 -5.153 1.00 0.00 H new ATOM 0 HG22 THR B 19 -9.624 -2.647 -3.829 1.00 0.00 H new ATOM 0 HG23 THR B 19 -9.370 -2.150 -5.519 1.00 0.00 H new ATOM 1292 N VAL B 20 -5.614 -2.330 -2.227 1.00 0.00 N ATOM 1293 CA VAL B 20 -4.665 -2.810 -1.232 1.00 0.00 C ATOM 1294 C VAL B 20 -5.383 -3.367 -0.008 1.00 0.00 C ATOM 1295 O VAL B 20 -5.859 -2.613 0.842 1.00 0.00 O ATOM 1296 CB VAL B 20 -3.708 -1.689 -0.787 1.00 0.00 C ATOM 1297 CG1 VAL B 20 -2.652 -2.227 0.168 1.00 0.00 C ATOM 1298 CG2 VAL B 20 -3.059 -1.031 -1.995 1.00 0.00 C ATOM 0 H VAL B 20 -6.032 -1.425 -2.013 1.00 0.00 H new ATOM 0 HA VAL B 20 -4.088 -3.607 -1.702 1.00 0.00 H new ATOM 0 HB VAL B 20 -4.288 -0.934 -0.257 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -1.987 -1.417 0.469 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -3.138 -2.644 1.050 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -2.074 -3.005 -0.330 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -2.386 -0.241 -1.661 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -2.494 -1.776 -2.556 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -3.831 -0.604 -2.635 1.00 0.00 H new ATOM 1308 N THR B 21 -5.459 -4.690 0.070 1.00 0.00 N ATOM 1309 CA THR B 21 -6.122 -5.355 1.185 1.00 0.00 C ATOM 1310 C THR B 21 -5.129 -5.704 2.290 1.00 0.00 C ATOM 1311 O THR B 21 -3.928 -5.830 2.047 1.00 0.00 O ATOM 1312 CB THR B 21 -6.831 -6.620 0.701 1.00 0.00 C ATOM 1313 OG1 THR B 21 -7.399 -6.417 -0.581 1.00 0.00 O ATOM 1314 CG2 THR B 21 -7.939 -7.077 1.626 1.00 0.00 C ATOM 0 H THR B 21 -5.069 -5.325 -0.627 1.00 0.00 H new ATOM 0 HA THR B 21 -6.860 -4.665 1.596 1.00 0.00 H new ATOM 0 HB THR B 21 -6.060 -7.390 0.675 1.00 0.00 H new ATOM 0 HG1 THR B 21 -7.847 -7.238 -0.874 1.00 0.00 H new ATOM 0 HG21 THR B 21 -8.400 -7.979 1.224 1.00 0.00 H new ATOM 0 HG22 THR B 21 -7.525 -7.290 2.612 1.00 0.00 H new ATOM 0 HG23 THR B 21 -8.690 -6.292 1.710 1.00 0.00 H new ATOM 1322 N VAL B 22 -5.645 -5.868 3.503 1.00 0.00 N ATOM 1323 CA VAL B 22 -4.816 -6.213 4.653 1.00 0.00 C ATOM 1324 C VAL B 22 -5.038 -7.668 5.056 1.00 0.00 C ATOM 1325 O VAL B 22 -5.738 -8.408 4.365 1.00 0.00 O ATOM 1326 CB VAL B 22 -5.116 -5.299 5.858 1.00 0.00 C ATOM 1327 CG1 VAL B 22 -4.807 -3.849 5.517 1.00 0.00 C ATOM 1328 CG2 VAL B 22 -6.564 -5.451 6.303 1.00 0.00 C ATOM 0 H VAL B 22 -6.637 -5.767 3.716 1.00 0.00 H new ATOM 0 HA VAL B 22 -3.776 -6.071 4.358 1.00 0.00 H new ATOM 0 HB VAL B 22 -4.474 -5.601 6.685 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -5.025 -3.218 6.379 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -3.753 -3.754 5.254 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -5.421 -3.535 4.673 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -6.754 -4.797 7.154 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -7.227 -5.179 5.482 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -6.749 -6.486 6.592 1.00 0.00 H new ATOM 1338 N LEU B 23 -4.451 -8.076 6.177 1.00 0.00 N ATOM 1339 CA LEU B 23 -4.601 -9.443 6.661 1.00 0.00 C ATOM 1340 C LEU B 23 -5.067 -9.442 8.114 1.00 0.00 C ATOM 1341 O LEU B 23 -6.074 -10.064 8.454 1.00 0.00 O ATOM 1342 CB LEU B 23 -3.278 -10.202 6.531 1.00 0.00 C ATOM 1343 CG LEU B 23 -3.406 -11.723 6.418 1.00 0.00 C ATOM 1344 CD1 LEU B 23 -3.839 -12.324 7.745 1.00 0.00 C ATOM 1345 CD2 LEU B 23 -4.386 -12.098 5.315 1.00 0.00 C ATOM 0 H LEU B 23 -3.868 -7.481 6.766 1.00 0.00 H new ATOM 0 HA LEU B 23 -5.353 -9.946 6.053 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -2.750 -9.832 5.652 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -2.658 -9.969 7.397 1.00 0.00 H new ATOM 0 HG LEU B 23 -2.428 -12.130 6.161 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -3.924 -13.406 7.644 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -3.099 -12.088 8.510 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -4.805 -11.909 8.034 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -4.463 -13.183 5.250 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -5.366 -11.677 5.540 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -4.031 -11.702 4.363 1.00 0.00 H new ATOM 1357 N GLY B 24 -4.334 -8.728 8.964 1.00 0.00 N ATOM 1358 CA GLY B 24 -4.694 -8.644 10.368 1.00 0.00 C ATOM 1359 C GLY B 24 -3.992 -9.677 11.226 1.00 0.00 C ATOM 1360 O GLY B 24 -3.580 -9.387 12.349 1.00 0.00 O ATOM 0 H GLY B 24 -3.497 -8.206 8.705 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -4.453 -7.648 10.739 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -5.772 -8.769 10.468 1.00 0.00 H new ATOM 1364 N VAL B 25 -3.868 -10.887 10.701 1.00 0.00 N ATOM 1365 CA VAL B 25 -3.229 -11.977 11.420 1.00 0.00 C ATOM 1366 C VAL B 25 -1.716 -11.963 11.227 1.00 0.00 C ATOM 1367 O VAL B 25 -1.222 -11.522 10.190 1.00 0.00 O ATOM 1368 CB VAL B 25 -3.791 -13.339 10.976 1.00 0.00 C ATOM 1369 CG1 VAL B 25 -3.341 -14.440 11.925 1.00 0.00 C ATOM 1370 CG2 VAL B 25 -5.312 -13.282 10.888 1.00 0.00 C ATOM 0 H VAL B 25 -4.205 -11.139 9.772 1.00 0.00 H new ATOM 0 HA VAL B 25 -3.447 -11.830 12.478 1.00 0.00 H new ATOM 0 HB VAL B 25 -3.400 -13.570 9.985 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -3.749 -15.395 11.594 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -2.252 -14.493 11.931 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -3.699 -14.222 12.931 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -5.695 -14.253 10.573 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -5.724 -13.029 11.865 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -5.606 -12.523 10.163 1.00 0.00 H new ATOM 1380 N LYS B 26 -0.992 -12.445 12.245 1.00 0.00 N ATOM 1381 CA LYS B 26 0.475 -12.503 12.233 1.00 0.00 C ATOM 1382 C LYS B 26 1.069 -11.359 13.048 1.00 0.00 C ATOM 1383 O LYS B 26 0.888 -10.187 12.719 1.00 0.00 O ATOM 1384 CB LYS B 26 1.035 -12.476 10.808 1.00 0.00 C ATOM 1385 CG LYS B 26 2.449 -13.024 10.701 1.00 0.00 C ATOM 1386 CD LYS B 26 2.981 -12.922 9.281 1.00 0.00 C ATOM 1387 CE LYS B 26 3.789 -14.152 8.900 1.00 0.00 C ATOM 1388 NZ LYS B 26 2.929 -15.359 8.755 1.00 0.00 N ATOM 0 H LYS B 26 -1.409 -12.807 13.103 1.00 0.00 H new ATOM 0 HA LYS B 26 0.761 -13.451 12.689 1.00 0.00 H new ATOM 0 HB2 LYS B 26 0.379 -13.055 10.158 1.00 0.00 H new ATOM 0 HB3 LYS B 26 1.023 -11.450 10.441 1.00 0.00 H new ATOM 0 HG2 LYS B 26 3.105 -12.475 11.377 1.00 0.00 H new ATOM 0 HG3 LYS B 26 2.462 -14.066 11.021 1.00 0.00 H new ATOM 0 HD2 LYS B 26 2.149 -12.803 8.587 1.00 0.00 H new ATOM 0 HD3 LYS B 26 3.604 -12.033 9.188 1.00 0.00 H new ATOM 0 HE2 LYS B 26 4.314 -13.966 7.963 1.00 0.00 H new ATOM 0 HE3 LYS B 26 4.549 -14.337 9.659 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 3.425 -16.072 8.184 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 2.721 -15.752 9.695 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 2.039 -15.097 8.285 1.00 0.00 H new ATOM 1402 N GLY B 27 1.778 -11.712 14.118 1.00 0.00 N ATOM 1403 CA GLY B 27 2.388 -10.710 14.972 1.00 0.00 C ATOM 1404 C GLY B 27 3.763 -10.291 14.490 1.00 0.00 C ATOM 1405 O GLY B 27 4.288 -10.849 13.526 1.00 0.00 O ATOM 0 H GLY B 27 1.940 -12.676 14.408 1.00 0.00 H new ATOM 0 HA2 GLY B 27 1.741 -9.834 15.018 1.00 0.00 H new ATOM 0 HA3 GLY B 27 2.466 -11.102 15.986 1.00 0.00 H new ATOM 1409 N ASN B 28 4.345 -9.298 15.157 1.00 0.00 N ATOM 1410 CA ASN B 28 5.664 -8.796 14.788 1.00 0.00 C ATOM 1411 C ASN B 28 5.626 -8.183 13.390 1.00 0.00 C ATOM 1412 O ASN B 28 5.470 -6.971 13.240 1.00 0.00 O ATOM 1413 CB ASN B 28 6.703 -9.920 14.850 1.00 0.00 C ATOM 1414 CG ASN B 28 7.586 -9.825 16.079 1.00 0.00 C ATOM 1415 OD1 ASN B 28 8.625 -9.165 16.061 1.00 0.00 O ATOM 1416 ND2 ASN B 28 7.175 -10.486 17.156 1.00 0.00 N ATOM 0 H ASN B 28 3.923 -8.825 15.956 1.00 0.00 H new ATOM 0 HA ASN B 28 5.951 -8.022 15.500 1.00 0.00 H new ATOM 0 HB2 ASN B 28 6.193 -10.883 14.846 1.00 0.00 H new ATOM 0 HB3 ASN B 28 7.325 -9.886 13.956 1.00 0.00 H new ATOM 0 HD21 ASN B 28 7.728 -10.459 18.013 1.00 0.00 H new ATOM 0 HD22 ASN B 28 6.307 -11.021 17.126 1.00 0.00 H new ATOM 1423 N GLN B 29 5.760 -9.024 12.370 1.00 0.00 N ATOM 1424 CA GLN B 29 5.730 -8.564 10.988 1.00 0.00 C ATOM 1425 C GLN B 29 4.293 -8.463 10.492 1.00 0.00 C ATOM 1426 O GLN B 29 3.474 -9.344 10.754 1.00 0.00 O ATOM 1427 CB GLN B 29 6.528 -9.513 10.092 1.00 0.00 C ATOM 1428 CG GLN B 29 8.001 -9.157 9.988 1.00 0.00 C ATOM 1429 CD GLN B 29 8.884 -10.375 9.798 1.00 0.00 C ATOM 1430 OE1 GLN B 29 9.510 -10.856 10.742 1.00 0.00 O ATOM 1431 NE2 GLN B 29 8.937 -10.881 8.571 1.00 0.00 N ATOM 0 H GLN B 29 5.891 -10.030 12.476 1.00 0.00 H new ATOM 0 HA GLN B 29 6.186 -7.575 10.946 1.00 0.00 H new ATOM 0 HB2 GLN B 29 6.435 -10.528 10.478 1.00 0.00 H new ATOM 0 HB3 GLN B 29 6.091 -9.510 9.094 1.00 0.00 H new ATOM 0 HG2 GLN B 29 8.147 -8.473 9.152 1.00 0.00 H new ATOM 0 HG3 GLN B 29 8.308 -8.628 10.890 1.00 0.00 H new ATOM 0 HE21 GLN B 29 8.401 -10.450 7.818 1.00 0.00 H new ATOM 0 HE22 GLN B 29 9.514 -11.701 8.382 1.00 0.00 H new ATOM 1440 N VAL B 30 3.986 -7.384 9.782 1.00 0.00 N ATOM 1441 CA VAL B 30 2.641 -7.181 9.266 1.00 0.00 C ATOM 1442 C VAL B 30 2.514 -7.727 7.852 1.00 0.00 C ATOM 1443 O VAL B 30 3.151 -7.231 6.925 1.00 0.00 O ATOM 1444 CB VAL B 30 2.257 -5.691 9.263 1.00 0.00 C ATOM 1445 CG1 VAL B 30 0.789 -5.517 8.908 1.00 0.00 C ATOM 1446 CG2 VAL B 30 2.567 -5.057 10.611 1.00 0.00 C ATOM 0 H VAL B 30 4.646 -6.641 9.552 1.00 0.00 H new ATOM 0 HA VAL B 30 1.963 -7.720 9.928 1.00 0.00 H new ATOM 0 HB VAL B 30 2.852 -5.183 8.503 1.00 0.00 H new ATOM 0 HG11 VAL B 30 0.537 -4.457 8.911 1.00 0.00 H new ATOM 0 HG12 VAL B 30 0.603 -5.931 7.917 1.00 0.00 H new ATOM 0 HG13 VAL B 30 0.173 -6.038 9.641 1.00 0.00 H new ATOM 0 HG21 VAL B 30 2.289 -4.003 10.590 1.00 0.00 H new ATOM 0 HG22 VAL B 30 2.001 -5.566 11.391 1.00 0.00 H new ATOM 0 HG23 VAL B 30 3.633 -5.147 10.819 1.00 0.00 H new ATOM 1456 N ARG B 31 1.674 -8.744 7.689 1.00 0.00 N ATOM 1457 CA ARG B 31 1.452 -9.345 6.393 1.00 0.00 C ATOM 1458 C ARG B 31 0.365 -8.586 5.647 1.00 0.00 C ATOM 1459 O ARG B 31 -0.824 -8.778 5.902 1.00 0.00 O ATOM 1460 CB ARG B 31 1.062 -10.818 6.547 1.00 0.00 C ATOM 1461 CG ARG B 31 2.117 -11.784 6.033 1.00 0.00 C ATOM 1462 CD ARG B 31 1.638 -13.225 6.111 1.00 0.00 C ATOM 1463 NE ARG B 31 0.798 -13.586 4.971 1.00 0.00 N ATOM 1464 CZ ARG B 31 0.553 -14.840 4.598 1.00 0.00 C ATOM 1465 NH1 ARG B 31 1.080 -15.856 5.270 1.00 0.00 N ATOM 1466 NH2 ARG B 31 -0.222 -15.079 3.549 1.00 0.00 N ATOM 0 H ARG B 31 1.137 -9.166 8.447 1.00 0.00 H new ATOM 0 HA ARG B 31 2.377 -9.292 5.819 1.00 0.00 H new ATOM 0 HB2 ARG B 31 0.872 -11.027 7.600 1.00 0.00 H new ATOM 0 HB3 ARG B 31 0.128 -10.996 6.014 1.00 0.00 H new ATOM 0 HG2 ARG B 31 2.366 -11.537 5.001 1.00 0.00 H new ATOM 0 HG3 ARG B 31 3.031 -11.671 6.617 1.00 0.00 H new ATOM 0 HD2 ARG B 31 2.500 -13.892 6.152 1.00 0.00 H new ATOM 0 HD3 ARG B 31 1.078 -13.371 7.035 1.00 0.00 H new ATOM 0 HE ARG B 31 0.375 -12.833 4.429 1.00 0.00 H new ATOM 0 HH11 ARG B 31 1.677 -15.678 6.078 1.00 0.00 H new ATOM 0 HH12 ARG B 31 0.888 -16.814 4.979 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -0.630 -14.302 3.029 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -0.410 -16.040 3.262 1.00 0.00 H new ATOM 1480 N ILE B 32 0.774 -7.709 4.740 1.00 0.00 N ATOM 1481 CA ILE B 32 -0.175 -6.910 3.981 1.00 0.00 C ATOM 1482 C ILE B 32 -0.169 -7.292 2.507 1.00 0.00 C ATOM 1483 O ILE B 32 0.889 -7.468 1.902 1.00 0.00 O ATOM 1484 CB ILE B 32 0.132 -5.407 4.129 1.00 0.00 C ATOM 1485 CG1 ILE B 32 0.296 -5.053 5.611 1.00 0.00 C ATOM 1486 CG2 ILE B 32 -0.970 -4.572 3.495 1.00 0.00 C ATOM 1487 CD1 ILE B 32 -0.923 -5.384 6.446 1.00 0.00 C ATOM 0 H ILE B 32 1.753 -7.534 4.513 1.00 0.00 H new ATOM 0 HA ILE B 32 -1.166 -7.113 4.387 1.00 0.00 H new ATOM 0 HB ILE B 32 1.064 -5.184 3.610 1.00 0.00 H new ATOM 0 HG12 ILE B 32 1.158 -5.587 6.011 1.00 0.00 H new ATOM 0 HG13 ILE B 32 0.511 -3.988 5.701 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -0.736 -3.514 3.609 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -1.046 -4.814 2.435 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -1.919 -4.789 3.986 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -0.739 -5.108 7.484 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -1.783 -4.830 6.070 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -1.126 -6.453 6.385 1.00 0.00 H new ATOM 1499 N GLY B 33 -1.362 -7.419 1.933 1.00 0.00 N ATOM 1500 CA GLY B 33 -1.479 -7.780 0.535 1.00 0.00 C ATOM 1501 C GLY B 33 -1.849 -6.598 -0.334 1.00 0.00 C ATOM 1502 O GLY B 33 -2.956 -6.068 -0.232 1.00 0.00 O ATOM 0 H GLY B 33 -2.250 -7.278 2.414 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -0.534 -8.200 0.190 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -2.233 -8.559 0.425 1.00 0.00 H new ATOM 1506 N VAL B 34 -0.925 -6.181 -1.192 1.00 0.00 N ATOM 1507 CA VAL B 34 -1.171 -5.053 -2.077 1.00 0.00 C ATOM 1508 C VAL B 34 -1.590 -5.525 -3.463 1.00 0.00 C ATOM 1509 O VAL B 34 -0.761 -5.968 -4.258 1.00 0.00 O ATOM 1510 CB VAL B 34 0.077 -4.158 -2.207 1.00 0.00 C ATOM 1511 CG1 VAL B 34 -0.245 -2.900 -2.999 1.00 0.00 C ATOM 1512 CG2 VAL B 34 0.628 -3.804 -0.833 1.00 0.00 C ATOM 0 H VAL B 34 -0.003 -6.606 -1.292 1.00 0.00 H new ATOM 0 HA VAL B 34 -1.980 -4.473 -1.633 1.00 0.00 H new ATOM 0 HB VAL B 34 0.842 -4.714 -2.748 1.00 0.00 H new ATOM 0 HG11 VAL B 34 0.649 -2.282 -3.079 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -0.586 -3.176 -3.997 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -1.029 -2.340 -2.489 1.00 0.00 H new ATOM 0 HG21 VAL B 34 1.509 -3.172 -0.946 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -0.132 -3.269 -0.263 1.00 0.00 H new ATOM 0 HG23 VAL B 34 0.902 -4.717 -0.305 1.00 0.00 H new ATOM 1522 N ASN B 35 -2.885 -5.431 -3.745 1.00 0.00 N ATOM 1523 CA ASN B 35 -3.411 -5.853 -5.035 1.00 0.00 C ATOM 1524 C ASN B 35 -3.413 -4.691 -6.021 1.00 0.00 C ATOM 1525 O ASN B 35 -4.217 -3.768 -5.912 1.00 0.00 O ATOM 1526 CB ASN B 35 -4.827 -6.415 -4.878 1.00 0.00 C ATOM 1527 CG ASN B 35 -4.927 -7.862 -5.321 1.00 0.00 C ATOM 1528 OD1 ASN B 35 -5.007 -8.154 -6.514 1.00 0.00 O ATOM 1529 ND2 ASN B 35 -4.924 -8.777 -4.359 1.00 0.00 N ATOM 0 H ASN B 35 -3.586 -5.068 -3.099 1.00 0.00 H new ATOM 0 HA ASN B 35 -2.764 -6.638 -5.426 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -5.133 -6.335 -3.835 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -5.522 -5.810 -5.461 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -4.990 -9.767 -4.596 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -4.856 -8.490 -3.383 1.00 0.00 H new ATOM 1536 N ALA B 36 -2.498 -4.748 -6.978 1.00 0.00 N ATOM 1537 CA ALA B 36 -2.377 -3.704 -7.988 1.00 0.00 C ATOM 1538 C ALA B 36 -2.238 -4.295 -9.389 1.00 0.00 C ATOM 1539 O ALA B 36 -1.628 -5.349 -9.570 1.00 0.00 O ATOM 1540 CB ALA B 36 -1.192 -2.805 -7.674 1.00 0.00 C ATOM 0 H ALA B 36 -1.826 -5.509 -7.077 1.00 0.00 H new ATOM 0 HA ALA B 36 -3.291 -3.110 -7.967 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -1.112 -2.029 -8.435 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -1.335 -2.342 -6.698 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -0.278 -3.398 -7.663 1.00 0.00 H new ATOM 1546 N PRO B 37 -2.803 -3.615 -10.404 1.00 0.00 N ATOM 1547 CA PRO B 37 -2.741 -4.066 -11.794 1.00 0.00 C ATOM 1548 C PRO B 37 -1.420 -3.699 -12.460 1.00 0.00 C ATOM 1549 O PRO B 37 -0.741 -2.762 -12.039 1.00 0.00 O ATOM 1550 CB PRO B 37 -3.894 -3.311 -12.445 1.00 0.00 C ATOM 1551 CG PRO B 37 -3.965 -2.029 -11.690 1.00 0.00 C ATOM 1552 CD PRO B 37 -3.546 -2.345 -10.276 1.00 0.00 C ATOM 0 HA PRO B 37 -2.811 -5.150 -11.884 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.709 -3.139 -13.505 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -4.827 -3.869 -12.371 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -3.307 -1.281 -12.132 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -4.975 -1.620 -11.714 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -2.921 -1.556 -9.858 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -4.408 -2.451 -9.617 1.00 0.00 H new ATOM 1560 N LYS B 38 -1.058 -4.441 -13.501 1.00 0.00 N ATOM 1561 CA LYS B 38 0.184 -4.188 -14.224 1.00 0.00 C ATOM 1562 C LYS B 38 -0.029 -3.190 -15.362 1.00 0.00 C ATOM 1563 O LYS B 38 0.694 -3.212 -16.357 1.00 0.00 O ATOM 1564 CB LYS B 38 0.748 -5.498 -14.780 1.00 0.00 C ATOM 1565 CG LYS B 38 1.786 -6.146 -13.878 1.00 0.00 C ATOM 1566 CD LYS B 38 2.043 -7.591 -14.272 1.00 0.00 C ATOM 1567 CE LYS B 38 2.671 -7.690 -15.653 1.00 0.00 C ATOM 1568 NZ LYS B 38 2.388 -9.001 -16.300 1.00 0.00 N ATOM 0 H LYS B 38 -1.606 -5.222 -13.863 1.00 0.00 H new ATOM 0 HA LYS B 38 0.897 -3.757 -13.522 1.00 0.00 H new ATOM 0 HB2 LYS B 38 -0.072 -6.199 -14.938 1.00 0.00 H new ATOM 0 HB3 LYS B 38 1.196 -5.306 -15.755 1.00 0.00 H new ATOM 0 HG2 LYS B 38 2.718 -5.582 -13.930 1.00 0.00 H new ATOM 0 HG3 LYS B 38 1.446 -6.105 -12.843 1.00 0.00 H new ATOM 0 HD2 LYS B 38 2.700 -8.058 -13.538 1.00 0.00 H new ATOM 0 HD3 LYS B 38 1.105 -8.145 -14.258 1.00 0.00 H new ATOM 0 HE2 LYS B 38 2.292 -6.885 -16.283 1.00 0.00 H new ATOM 0 HE3 LYS B 38 3.749 -7.550 -15.572 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 2.834 -9.028 -17.239 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 2.772 -9.768 -15.712 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 1.360 -9.124 -16.401 1.00 0.00 H new ATOM 1582 N GLU B 39 -1.023 -2.316 -15.212 1.00 0.00 N ATOM 1583 CA GLU B 39 -1.320 -1.317 -16.232 1.00 0.00 C ATOM 1584 C GLU B 39 -1.017 0.090 -15.724 1.00 0.00 C ATOM 1585 O GLU B 39 -0.541 0.941 -16.475 1.00 0.00 O ATOM 1586 CB GLU B 39 -2.786 -1.413 -16.658 1.00 0.00 C ATOM 1587 CG GLU B 39 -3.148 -2.745 -17.296 1.00 0.00 C ATOM 1588 CD GLU B 39 -3.791 -2.584 -18.660 1.00 0.00 C ATOM 1589 OE1 GLU B 39 -4.582 -1.634 -18.835 1.00 0.00 O ATOM 1590 OE2 GLU B 39 -3.504 -3.409 -19.552 1.00 0.00 O ATOM 0 H GLU B 39 -1.634 -2.281 -14.396 1.00 0.00 H new ATOM 0 HA GLU B 39 -0.684 -1.516 -17.094 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -3.420 -1.253 -15.786 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -3.004 -0.611 -17.363 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -2.249 -3.354 -17.392 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -3.830 -3.285 -16.639 1.00 0.00 H new ATOM 1597 N VAL B 40 -1.294 0.330 -14.445 1.00 0.00 N ATOM 1598 CA VAL B 40 -1.046 1.635 -13.843 1.00 0.00 C ATOM 1599 C VAL B 40 0.419 1.777 -13.440 1.00 0.00 C ATOM 1600 O VAL B 40 1.053 0.809 -13.021 1.00 0.00 O ATOM 1601 CB VAL B 40 -1.940 1.873 -12.607 1.00 0.00 C ATOM 1602 CG1 VAL B 40 -1.935 3.343 -12.216 1.00 0.00 C ATOM 1603 CG2 VAL B 40 -3.360 1.393 -12.870 1.00 0.00 C ATOM 0 H VAL B 40 -1.689 -0.361 -13.807 1.00 0.00 H new ATOM 0 HA VAL B 40 -1.290 2.384 -14.597 1.00 0.00 H new ATOM 0 HB VAL B 40 -1.533 1.297 -11.776 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -2.571 3.489 -11.343 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -0.917 3.653 -11.980 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -2.313 3.941 -13.045 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -3.973 1.570 -11.987 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -3.777 1.938 -13.717 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -3.348 0.327 -13.096 1.00 0.00 H new ATOM 1613 N SER B 41 0.953 2.987 -13.575 1.00 0.00 N ATOM 1614 CA SER B 41 2.347 3.253 -13.232 1.00 0.00 C ATOM 1615 C SER B 41 2.650 2.833 -11.797 1.00 0.00 C ATOM 1616 O SER B 41 2.336 3.551 -10.849 1.00 0.00 O ATOM 1617 CB SER B 41 2.663 4.738 -13.418 1.00 0.00 C ATOM 1618 OG SER B 41 3.861 5.094 -12.750 1.00 0.00 O ATOM 0 H SER B 41 0.442 3.800 -13.920 1.00 0.00 H new ATOM 0 HA SER B 41 2.976 2.665 -13.901 1.00 0.00 H new ATOM 0 HB2 SER B 41 2.755 4.963 -14.481 1.00 0.00 H new ATOM 0 HB3 SER B 41 1.838 5.339 -13.036 1.00 0.00 H new ATOM 0 HG SER B 41 4.041 6.048 -12.886 1.00 0.00 H new ATOM 1624 N VAL B 42 3.266 1.665 -11.646 1.00 0.00 N ATOM 1625 CA VAL B 42 3.615 1.150 -10.329 1.00 0.00 C ATOM 1626 C VAL B 42 5.117 0.894 -10.220 1.00 0.00 C ATOM 1627 O VAL B 42 5.686 0.149 -11.018 1.00 0.00 O ATOM 1628 CB VAL B 42 2.856 -0.155 -10.018 1.00 0.00 C ATOM 1629 CG1 VAL B 42 3.239 -1.250 -11.004 1.00 0.00 C ATOM 1630 CG2 VAL B 42 3.119 -0.600 -8.587 1.00 0.00 C ATOM 0 H VAL B 42 3.533 1.058 -12.421 1.00 0.00 H new ATOM 0 HA VAL B 42 3.326 1.910 -9.603 1.00 0.00 H new ATOM 0 HB VAL B 42 1.788 0.037 -10.124 1.00 0.00 H new ATOM 0 HG11 VAL B 42 2.692 -2.162 -10.766 1.00 0.00 H new ATOM 0 HG12 VAL B 42 2.990 -0.931 -12.016 1.00 0.00 H new ATOM 0 HG13 VAL B 42 4.310 -1.442 -10.937 1.00 0.00 H new ATOM 0 HG21 VAL B 42 2.574 -1.523 -8.387 1.00 0.00 H new ATOM 0 HG22 VAL B 42 4.187 -0.772 -8.450 1.00 0.00 H new ATOM 0 HG23 VAL B 42 2.785 0.175 -7.898 1.00 0.00 H new ATOM 1640 N HIS B 43 5.754 1.506 -9.225 1.00 0.00 N ATOM 1641 CA HIS B 43 7.186 1.333 -9.010 1.00 0.00 C ATOM 1642 C HIS B 43 7.463 0.943 -7.562 1.00 0.00 C ATOM 1643 O HIS B 43 6.886 1.516 -6.637 1.00 0.00 O ATOM 1644 CB HIS B 43 7.936 2.620 -9.364 1.00 0.00 C ATOM 1645 CG HIS B 43 8.980 2.431 -10.420 1.00 0.00 C ATOM 1646 ND1 HIS B 43 8.844 2.906 -11.707 1.00 0.00 N ATOM 1647 CD2 HIS B 43 10.185 1.813 -10.376 1.00 0.00 C ATOM 1648 CE1 HIS B 43 9.916 2.589 -12.410 1.00 0.00 C ATOM 1649 NE2 HIS B 43 10.746 1.926 -11.625 1.00 0.00 N ATOM 0 H HIS B 43 5.300 2.126 -8.555 1.00 0.00 H new ATOM 0 HA HIS B 43 7.539 0.532 -9.660 1.00 0.00 H new ATOM 0 HB2 HIS B 43 7.219 3.368 -9.703 1.00 0.00 H new ATOM 0 HB3 HIS B 43 8.408 3.015 -8.464 1.00 0.00 H new ATOM 0 HD2 HIS B 43 10.623 1.323 -9.519 1.00 0.00 H new ATOM 0 HE1 HIS B 43 10.085 2.831 -13.449 1.00 0.00 H new ATOM 0 HE2 HIS B 43 11.656 1.558 -11.901 1.00 0.00 H new ATOM 1657 N ARG B 44 8.345 -0.030 -7.364 1.00 0.00 N ATOM 1658 CA ARG B 44 8.689 -0.484 -6.022 1.00 0.00 C ATOM 1659 C ARG B 44 10.109 -1.038 -5.990 1.00 0.00 C ATOM 1660 O ARG B 44 10.971 -0.529 -5.274 1.00 0.00 O ATOM 1661 CB ARG B 44 7.704 -1.557 -5.549 1.00 0.00 C ATOM 1662 CG ARG B 44 6.262 -1.282 -5.945 1.00 0.00 C ATOM 1663 CD ARG B 44 5.331 -2.378 -5.451 1.00 0.00 C ATOM 1664 NE ARG B 44 4.250 -2.648 -6.397 1.00 0.00 N ATOM 1665 CZ ARG B 44 4.386 -3.407 -7.483 1.00 0.00 C ATOM 1666 NH1 ARG B 44 5.555 -3.968 -7.769 1.00 0.00 N ATOM 1667 NH2 ARG B 44 3.350 -3.604 -8.287 1.00 0.00 N ATOM 0 H ARG B 44 8.834 -0.519 -8.114 1.00 0.00 H new ATOM 0 HA ARG B 44 8.630 0.372 -5.350 1.00 0.00 H new ATOM 0 HB2 ARG B 44 8.006 -2.521 -5.959 1.00 0.00 H new ATOM 0 HB3 ARG B 44 7.764 -1.639 -4.464 1.00 0.00 H new ATOM 0 HG2 ARG B 44 5.947 -0.323 -5.534 1.00 0.00 H new ATOM 0 HG3 ARG B 44 6.190 -1.203 -7.030 1.00 0.00 H new ATOM 0 HD2 ARG B 44 5.903 -3.291 -5.284 1.00 0.00 H new ATOM 0 HD3 ARG B 44 4.907 -2.087 -4.490 1.00 0.00 H new ATOM 0 HE ARG B 44 3.337 -2.230 -6.215 1.00 0.00 H new ATOM 0 HH11 ARG B 44 6.356 -3.819 -7.155 1.00 0.00 H new ATOM 0 HH12 ARG B 44 5.652 -4.548 -8.602 1.00 0.00 H new ATOM 0 HH21 ARG B 44 2.450 -3.174 -8.074 1.00 0.00 H new ATOM 0 HH22 ARG B 44 3.453 -4.185 -9.119 1.00 0.00 H new ATOM 1681 N GLU B 45 10.343 -2.085 -6.776 1.00 0.00 N ATOM 1682 CA GLU B 45 11.657 -2.715 -6.847 1.00 0.00 C ATOM 1683 C GLU B 45 11.631 -3.905 -7.800 1.00 0.00 C ATOM 1684 O GLU B 45 10.640 -4.632 -7.873 1.00 0.00 O ATOM 1685 CB GLU B 45 12.108 -3.170 -5.457 1.00 0.00 C ATOM 1686 CG GLU B 45 13.592 -2.960 -5.201 1.00 0.00 C ATOM 1687 CD GLU B 45 14.259 -4.181 -4.597 1.00 0.00 C ATOM 1688 OE1 GLU B 45 13.732 -4.711 -3.596 1.00 0.00 O ATOM 1689 OE2 GLU B 45 15.307 -4.607 -5.125 1.00 0.00 O ATOM 0 H GLU B 45 9.638 -2.516 -7.374 1.00 0.00 H new ATOM 0 HA GLU B 45 12.367 -1.979 -7.225 1.00 0.00 H new ATOM 0 HB2 GLU B 45 11.537 -2.628 -4.703 1.00 0.00 H new ATOM 0 HB3 GLU B 45 11.873 -4.227 -5.336 1.00 0.00 H new ATOM 0 HG2 GLU B 45 14.086 -2.707 -6.139 1.00 0.00 H new ATOM 0 HG3 GLU B 45 13.725 -2.110 -4.532 1.00 0.00 H new ATOM 1696 N GLU B 46 12.725 -4.102 -8.527 1.00 0.00 N ATOM 1697 CA GLU B 46 12.823 -5.209 -9.471 1.00 0.00 C ATOM 1698 C GLU B 46 12.779 -6.545 -8.738 1.00 0.00 C ATOM 1699 O GLU B 46 12.093 -7.476 -9.160 1.00 0.00 O ATOM 1700 CB GLU B 46 14.114 -5.101 -10.285 1.00 0.00 C ATOM 1701 CG GLU B 46 13.948 -5.499 -11.743 1.00 0.00 C ATOM 1702 CD GLU B 46 14.207 -4.348 -12.696 1.00 0.00 C ATOM 1703 OE1 GLU B 46 13.260 -3.582 -12.973 1.00 0.00 O ATOM 1704 OE2 GLU B 46 15.356 -4.214 -13.166 1.00 0.00 O ATOM 0 H GLU B 46 13.555 -3.511 -8.481 1.00 0.00 H new ATOM 0 HA GLU B 46 11.972 -5.156 -10.150 1.00 0.00 H new ATOM 0 HB2 GLU B 46 14.480 -4.075 -10.236 1.00 0.00 H new ATOM 0 HB3 GLU B 46 14.876 -5.733 -9.829 1.00 0.00 H new ATOM 0 HG2 GLU B 46 14.632 -6.316 -11.973 1.00 0.00 H new ATOM 0 HG3 GLU B 46 12.937 -5.875 -11.900 1.00 0.00 H new ATOM 1711 N ILE B 47 13.515 -6.628 -7.636 1.00 0.00 N ATOM 1712 CA ILE B 47 13.565 -7.844 -6.835 1.00 0.00 C ATOM 1713 C ILE B 47 12.202 -8.155 -6.225 1.00 0.00 C ATOM 1714 O ILE B 47 11.714 -9.282 -6.309 1.00 0.00 O ATOM 1715 CB ILE B 47 14.607 -7.725 -5.705 1.00 0.00 C ATOM 1716 CG1 ILE B 47 15.960 -7.292 -6.273 1.00 0.00 C ATOM 1717 CG2 ILE B 47 14.739 -9.044 -4.958 1.00 0.00 C ATOM 1718 CD1 ILE B 47 16.495 -8.226 -7.338 1.00 0.00 C ATOM 0 H ILE B 47 14.087 -5.864 -7.276 1.00 0.00 H new ATOM 0 HA ILE B 47 13.854 -8.655 -7.503 1.00 0.00 H new ATOM 0 HB ILE B 47 14.268 -6.966 -5.000 1.00 0.00 H new ATOM 0 HG12 ILE B 47 15.865 -6.291 -6.693 1.00 0.00 H new ATOM 0 HG13 ILE B 47 16.683 -7.229 -5.460 1.00 0.00 H new ATOM 0 HG21 ILE B 47 15.479 -8.940 -4.164 1.00 0.00 H new ATOM 0 HG22 ILE B 47 13.776 -9.314 -4.524 1.00 0.00 H new ATOM 0 HG23 ILE B 47 15.056 -9.824 -5.650 1.00 0.00 H new ATOM 0 HD11 ILE B 47 17.457 -7.857 -7.695 1.00 0.00 H new ATOM 0 HD12 ILE B 47 16.622 -9.223 -6.917 1.00 0.00 H new ATOM 0 HD13 ILE B 47 15.792 -8.271 -8.170 1.00 0.00 H new ATOM 1730 N TYR B 48 11.595 -7.148 -5.604 1.00 0.00 N ATOM 1731 CA TYR B 48 10.290 -7.308 -4.968 1.00 0.00 C ATOM 1732 C TYR B 48 9.279 -7.951 -5.916 1.00 0.00 C ATOM 1733 O TYR B 48 8.545 -8.858 -5.528 1.00 0.00 O ATOM 1734 CB TYR B 48 9.763 -5.951 -4.489 1.00 0.00 C ATOM 1735 CG TYR B 48 8.393 -6.020 -3.853 1.00 0.00 C ATOM 1736 CD1 TYR B 48 8.221 -6.551 -2.580 1.00 0.00 C ATOM 1737 CD2 TYR B 48 7.270 -5.555 -4.527 1.00 0.00 C ATOM 1738 CE1 TYR B 48 6.969 -6.616 -1.998 1.00 0.00 C ATOM 1739 CE2 TYR B 48 6.016 -5.617 -3.951 1.00 0.00 C ATOM 1740 CZ TYR B 48 5.871 -6.148 -2.687 1.00 0.00 C ATOM 1741 OH TYR B 48 4.623 -6.211 -2.111 1.00 0.00 O ATOM 0 H TYR B 48 11.987 -6.209 -5.527 1.00 0.00 H new ATOM 0 HA TYR B 48 10.419 -7.970 -4.111 1.00 0.00 H new ATOM 0 HB2 TYR B 48 10.467 -5.531 -3.770 1.00 0.00 H new ATOM 0 HB3 TYR B 48 9.726 -5.266 -5.336 1.00 0.00 H new ATOM 0 HD1 TYR B 48 9.079 -6.919 -2.037 1.00 0.00 H new ATOM 0 HD2 TYR B 48 7.380 -5.138 -5.517 1.00 0.00 H new ATOM 0 HE1 TYR B 48 6.852 -7.032 -1.008 1.00 0.00 H new ATOM 0 HE2 TYR B 48 5.153 -5.251 -4.488 1.00 0.00 H new ATOM 0 HH TYR B 48 4.072 -5.472 -2.444 1.00 0.00 H new ATOM 1751 N GLN B 49 9.235 -7.470 -7.154 1.00 0.00 N ATOM 1752 CA GLN B 49 8.299 -7.996 -8.143 1.00 0.00 C ATOM 1753 C GLN B 49 8.748 -9.354 -8.680 1.00 0.00 C ATOM 1754 O GLN B 49 8.024 -10.344 -8.571 1.00 0.00 O ATOM 1755 CB GLN B 49 8.145 -7.008 -9.301 1.00 0.00 C ATOM 1756 CG GLN B 49 6.877 -7.215 -10.113 1.00 0.00 C ATOM 1757 CD GLN B 49 6.975 -6.626 -11.507 1.00 0.00 C ATOM 1758 OE1 GLN B 49 7.864 -6.980 -12.282 1.00 0.00 O ATOM 1759 NE2 GLN B 49 6.060 -5.721 -11.833 1.00 0.00 N ATOM 0 H GLN B 49 9.834 -6.719 -7.496 1.00 0.00 H new ATOM 0 HA GLN B 49 7.338 -8.131 -7.647 1.00 0.00 H new ATOM 0 HB2 GLN B 49 8.151 -5.993 -8.905 1.00 0.00 H new ATOM 0 HB3 GLN B 49 9.008 -7.097 -9.961 1.00 0.00 H new ATOM 0 HG2 GLN B 49 6.668 -8.282 -10.187 1.00 0.00 H new ATOM 0 HG3 GLN B 49 6.036 -6.761 -9.589 1.00 0.00 H new ATOM 0 HE21 GLN B 49 5.341 -5.457 -11.159 1.00 0.00 H new ATOM 0 HE22 GLN B 49 6.076 -5.290 -12.757 1.00 0.00 H new ATOM 1768 N ARG B 50 9.938 -9.387 -9.274 1.00 0.00 N ATOM 1769 CA ARG B 50 10.484 -10.615 -9.853 1.00 0.00 C ATOM 1770 C ARG B 50 10.456 -11.791 -8.872 1.00 0.00 C ATOM 1771 O ARG B 50 10.577 -12.944 -9.285 1.00 0.00 O ATOM 1772 CB ARG B 50 11.916 -10.376 -10.343 1.00 0.00 C ATOM 1773 CG ARG B 50 12.932 -10.219 -9.222 1.00 0.00 C ATOM 1774 CD ARG B 50 13.976 -11.325 -9.256 1.00 0.00 C ATOM 1775 NE ARG B 50 14.922 -11.221 -8.147 1.00 0.00 N ATOM 1776 CZ ARG B 50 15.892 -12.102 -7.916 1.00 0.00 C ATOM 1777 NH1 ARG B 50 16.050 -13.151 -8.714 1.00 0.00 N ATOM 1778 NH2 ARG B 50 16.708 -11.934 -6.884 1.00 0.00 N ATOM 0 H ARG B 50 10.547 -8.574 -9.368 1.00 0.00 H new ATOM 0 HA ARG B 50 9.846 -10.882 -10.695 1.00 0.00 H new ATOM 0 HB2 ARG B 50 12.216 -11.209 -10.978 1.00 0.00 H new ATOM 0 HB3 ARG B 50 11.933 -9.480 -10.964 1.00 0.00 H new ATOM 0 HG2 ARG B 50 13.424 -9.250 -9.309 1.00 0.00 H new ATOM 0 HG3 ARG B 50 12.419 -10.231 -8.260 1.00 0.00 H new ATOM 0 HD2 ARG B 50 13.478 -12.294 -9.218 1.00 0.00 H new ATOM 0 HD3 ARG B 50 14.519 -11.282 -10.200 1.00 0.00 H new ATOM 0 HE ARG B 50 14.834 -10.427 -7.513 1.00 0.00 H new ATOM 0 HH11 ARG B 50 15.426 -13.285 -9.510 1.00 0.00 H new ATOM 0 HH12 ARG B 50 16.796 -13.823 -8.532 1.00 0.00 H new ATOM 0 HH21 ARG B 50 16.592 -11.130 -6.268 1.00 0.00 H new ATOM 0 HH22 ARG B 50 17.452 -12.609 -6.707 1.00 0.00 H new ATOM 1792 N ILE B 51 10.300 -11.506 -7.582 1.00 0.00 N ATOM 1793 CA ILE B 51 10.261 -12.559 -6.571 1.00 0.00 C ATOM 1794 C ILE B 51 8.855 -12.725 -6.000 1.00 0.00 C ATOM 1795 O ILE B 51 8.297 -13.823 -6.009 1.00 0.00 O ATOM 1796 CB ILE B 51 11.246 -12.273 -5.417 1.00 0.00 C ATOM 1797 CG1 ILE B 51 12.671 -12.129 -5.960 1.00 0.00 C ATOM 1798 CG2 ILE B 51 11.181 -13.381 -4.373 1.00 0.00 C ATOM 1799 CD1 ILE B 51 13.720 -11.972 -4.879 1.00 0.00 C ATOM 0 H ILE B 51 10.199 -10.560 -7.213 1.00 0.00 H new ATOM 0 HA ILE B 51 10.558 -13.483 -7.068 1.00 0.00 H new ATOM 0 HB ILE B 51 10.960 -11.336 -4.940 1.00 0.00 H new ATOM 0 HG12 ILE B 51 12.911 -13.005 -6.563 1.00 0.00 H new ATOM 0 HG13 ILE B 51 12.712 -11.265 -6.623 1.00 0.00 H new ATOM 0 HG21 ILE B 51 11.882 -13.163 -3.567 1.00 0.00 H new ATOM 0 HG22 ILE B 51 10.170 -13.441 -3.969 1.00 0.00 H new ATOM 0 HG23 ILE B 51 11.444 -14.332 -4.835 1.00 0.00 H new ATOM 0 HD11 ILE B 51 14.704 -11.875 -5.338 1.00 0.00 H new ATOM 0 HD12 ILE B 51 13.505 -11.080 -4.290 1.00 0.00 H new ATOM 0 HD13 ILE B 51 13.707 -12.847 -4.229 1.00 0.00 H new ATOM 1811 N GLN B 52 8.288 -11.632 -5.502 1.00 0.00 N ATOM 1812 CA GLN B 52 6.947 -11.662 -4.926 1.00 0.00 C ATOM 1813 C GLN B 52 5.897 -11.894 -6.007 1.00 0.00 C ATOM 1814 O GLN B 52 5.183 -12.897 -5.985 1.00 0.00 O ATOM 1815 CB GLN B 52 6.652 -10.358 -4.182 1.00 0.00 C ATOM 1816 CG GLN B 52 7.728 -9.974 -3.179 1.00 0.00 C ATOM 1817 CD GLN B 52 7.703 -10.843 -1.937 1.00 0.00 C ATOM 1818 OE1 GLN B 52 6.659 -11.376 -1.559 1.00 0.00 O ATOM 1819 NE2 GLN B 52 8.855 -10.990 -1.294 1.00 0.00 N ATOM 0 H GLN B 52 8.734 -10.715 -5.485 1.00 0.00 H new ATOM 0 HA GLN B 52 6.904 -12.489 -4.217 1.00 0.00 H new ATOM 0 HB2 GLN B 52 6.539 -9.553 -4.908 1.00 0.00 H new ATOM 0 HB3 GLN B 52 5.699 -10.454 -3.662 1.00 0.00 H new ATOM 0 HG2 GLN B 52 8.706 -10.052 -3.653 1.00 0.00 H new ATOM 0 HG3 GLN B 52 7.596 -8.931 -2.891 1.00 0.00 H new ATOM 0 HE21 GLN B 52 9.696 -10.530 -1.643 1.00 0.00 H new ATOM 0 HE22 GLN B 52 8.899 -11.563 -0.451 1.00 0.00 H new ATOM 1828 N ALA B 53 5.807 -10.964 -6.953 1.00 0.00 N ATOM 1829 CA ALA B 53 4.844 -11.077 -8.039 1.00 0.00 C ATOM 1830 C ALA B 53 5.197 -12.242 -8.955 1.00 0.00 C ATOM 1831 O ALA B 53 4.318 -12.899 -9.511 1.00 0.00 O ATOM 1832 CB ALA B 53 4.784 -9.778 -8.830 1.00 0.00 C ATOM 0 H ALA B 53 6.388 -10.127 -6.988 1.00 0.00 H new ATOM 0 HA ALA B 53 3.862 -11.268 -7.607 1.00 0.00 H new ATOM 0 HB1 ALA B 53 4.060 -9.878 -9.639 1.00 0.00 H new ATOM 0 HB2 ALA B 53 4.482 -8.964 -8.171 1.00 0.00 H new ATOM 0 HB3 ALA B 53 5.767 -9.561 -9.248 1.00 0.00 H new ATOM 1838 N GLU B 54 6.494 -12.491 -9.103 1.00 0.00 N ATOM 1839 CA GLU B 54 6.974 -13.577 -9.947 1.00 0.00 C ATOM 1840 C GLU B 54 7.769 -14.589 -9.129 1.00 0.00 C ATOM 1841 O GLU B 54 8.708 -14.228 -8.421 1.00 0.00 O ATOM 1842 CB GLU B 54 7.845 -13.027 -11.077 1.00 0.00 C ATOM 1843 CG GLU B 54 7.759 -13.836 -12.361 1.00 0.00 C ATOM 1844 CD GLU B 54 6.340 -13.956 -12.880 1.00 0.00 C ATOM 1845 OE1 GLU B 54 5.615 -14.864 -12.422 1.00 0.00 O ATOM 1846 OE2 GLU B 54 5.954 -13.143 -13.746 1.00 0.00 O ATOM 0 H GLU B 54 7.232 -11.954 -8.648 1.00 0.00 H new ATOM 0 HA GLU B 54 6.107 -14.080 -10.376 1.00 0.00 H new ATOM 0 HB2 GLU B 54 7.549 -11.999 -11.285 1.00 0.00 H new ATOM 0 HB3 GLU B 54 8.882 -12.999 -10.744 1.00 0.00 H new ATOM 0 HG2 GLU B 54 8.382 -13.368 -13.123 1.00 0.00 H new ATOM 0 HG3 GLU B 54 8.163 -14.833 -12.186 1.00 0.00 H new ATOM 1853 N LYS B 55 7.392 -15.856 -9.233 1.00 0.00 N ATOM 1854 CA LYS B 55 8.077 -16.916 -8.504 1.00 0.00 C ATOM 1855 C LYS B 55 9.532 -17.019 -8.951 1.00 0.00 C ATOM 1856 O LYS B 55 9.822 -17.515 -10.040 1.00 0.00 O ATOM 1857 CB LYS B 55 7.368 -18.255 -8.721 1.00 0.00 C ATOM 1858 CG LYS B 55 5.881 -18.215 -8.404 1.00 0.00 C ATOM 1859 CD LYS B 55 5.548 -19.047 -7.175 1.00 0.00 C ATOM 1860 CE LYS B 55 5.587 -18.209 -5.908 1.00 0.00 C ATOM 1861 NZ LYS B 55 4.359 -17.381 -5.751 1.00 0.00 N ATOM 0 H LYS B 55 6.617 -16.175 -9.814 1.00 0.00 H new ATOM 0 HA LYS B 55 8.054 -16.672 -7.442 1.00 0.00 H new ATOM 0 HB2 LYS B 55 7.502 -18.564 -9.758 1.00 0.00 H new ATOM 0 HB3 LYS B 55 7.843 -19.013 -8.099 1.00 0.00 H new ATOM 0 HG2 LYS B 55 5.571 -17.183 -8.240 1.00 0.00 H new ATOM 0 HG3 LYS B 55 5.316 -18.586 -9.259 1.00 0.00 H new ATOM 0 HD2 LYS B 55 4.558 -19.488 -7.290 1.00 0.00 H new ATOM 0 HD3 LYS B 55 6.256 -19.871 -7.089 1.00 0.00 H new ATOM 0 HE2 LYS B 55 5.696 -18.863 -5.043 1.00 0.00 H new ATOM 0 HE3 LYS B 55 6.462 -17.560 -5.929 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 4.425 -16.825 -4.875 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 4.268 -16.738 -6.563 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 3.526 -18.001 -5.705 1.00 0.00 H new