USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=15 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 Set 1.1: A 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 41 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 41 SER OG : rot 180:sc= 0 USER MOD Set 2.2: B 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 159:sc= 0 (180deg=-0.66) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.112 USER MOD Single : A 11 THR OG1 : rot 180:sc=-0.00861 USER MOD Single : A 19 THR OG1 : rot 180:sc= -1.05 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -0.322 K(o=-0.32,f=-2.7!) USER MOD Single : A 29 GLN : amide:sc= -0.101 K(o=-0.1,f=-1.3!) USER MOD Single : A 35 ASN : amide:sc= -1.48 K(o=-1.5,f=-0.19) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.312 K(o=-0.31,f=-0.86) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 GLN : amide:sc= -3.63 K(o=-3.6,f=-12!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 159:sc= 0 (180deg=-0.624) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.109 USER MOD Single : B 11 THR OG1 : rot 180:sc=-0.000973 USER MOD Single : B 19 THR OG1 : rot 180:sc= -1.06 USER MOD Single : B 21 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 ASN : amide:sc= -0.399 K(o=-0.4,f=-2.8!) USER MOD Single : B 29 GLN : amide:sc= -0.116 K(o=-0.12,f=-1.4!) USER MOD Single : B 35 ASN : amide:sc= -1.51 K(o=-1.5,f=-0.19) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 HIS : no HD1:sc= -0.358 K(o=-0.36,f=-1) USER MOD Single : B 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 52 GLN : amide:sc= -3.8 K(o=-3.8,f=-12!) USER MOD Single : B 55 LYS NZ :NH3+ -164:sc=-0.000448 (180deg=-0.0679) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.029 -11.964 -4.242 1.00 0.00 N ATOM 2 CA MET A 1 -2.687 -11.315 -2.949 1.00 0.00 C ATOM 3 C MET A 1 -1.199 -11.447 -2.642 1.00 0.00 C ATOM 4 O MET A 1 -0.604 -12.507 -2.841 1.00 0.00 O ATOM 5 CB MET A 1 -3.512 -11.973 -1.840 1.00 0.00 C ATOM 6 CG MET A 1 -4.847 -11.293 -1.584 1.00 0.00 C ATOM 7 SD MET A 1 -4.682 -9.783 -0.611 1.00 0.00 S ATOM 8 CE MET A 1 -5.349 -10.320 0.962 1.00 0.00 C ATOM 0 H1 MET A 1 -4.047 -11.858 -4.425 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.491 -11.513 -5.010 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.788 -12.975 -4.197 1.00 0.00 H new ATOM 0 HA MET A 1 -2.918 -10.252 -3.011 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.690 -13.016 -2.102 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.931 -11.971 -0.918 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.319 -11.056 -2.538 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.509 -11.985 -1.064 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.990 -9.662 1.753 1.00 0.00 H new ATOM 0 HE2 MET A 1 -6.438 -10.285 0.927 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.025 -11.341 1.165 1.00 0.00 H new ATOM 20 N LEU A 2 -0.603 -10.363 -2.159 1.00 0.00 N ATOM 21 CA LEU A 2 0.816 -10.350 -1.824 1.00 0.00 C ATOM 22 C LEU A 2 1.015 -10.109 -0.330 1.00 0.00 C ATOM 23 O LEU A 2 0.866 -8.985 0.148 1.00 0.00 O ATOM 24 CB LEU A 2 1.537 -9.265 -2.627 1.00 0.00 C ATOM 25 CG LEU A 2 1.603 -9.509 -4.138 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.204 -9.584 -4.730 1.00 0.00 C ATOM 27 CD2 LEU A 2 2.415 -8.415 -4.818 1.00 0.00 C ATOM 0 H LEU A 2 -1.082 -9.479 -1.990 1.00 0.00 H new ATOM 0 HA LEU A 2 1.237 -11.323 -2.078 1.00 0.00 H new ATOM 0 HB2 LEU A 2 1.038 -8.312 -2.450 1.00 0.00 H new ATOM 0 HB3 LEU A 2 2.554 -9.168 -2.246 1.00 0.00 H new ATOM 0 HG LEU A 2 2.098 -10.464 -4.312 1.00 0.00 H new ATOM 0 HD11 LEU A 2 0.272 -9.758 -5.804 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -0.345 -10.402 -4.264 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -0.319 -8.646 -4.547 1.00 0.00 H new ATOM 0 HD21 LEU A 2 2.452 -8.603 -5.891 1.00 0.00 H new ATOM 0 HD22 LEU A 2 1.947 -7.448 -4.635 1.00 0.00 H new ATOM 0 HD23 LEU A 2 3.428 -8.410 -4.415 1.00 0.00 H new ATOM 39 N ILE A 3 1.359 -11.165 0.404 1.00 0.00 N ATOM 40 CA ILE A 3 1.581 -11.050 1.841 1.00 0.00 C ATOM 41 C ILE A 3 3.067 -10.890 2.147 1.00 0.00 C ATOM 42 O ILE A 3 3.834 -11.850 2.081 1.00 0.00 O ATOM 43 CB ILE A 3 1.031 -12.278 2.598 1.00 0.00 C ATOM 44 CG1 ILE A 3 -0.472 -12.434 2.342 1.00 0.00 C ATOM 45 CG2 ILE A 3 1.312 -12.160 4.092 1.00 0.00 C ATOM 46 CD1 ILE A 3 -1.326 -11.407 3.061 1.00 0.00 C ATOM 0 H ILE A 3 1.489 -12.104 0.029 1.00 0.00 H new ATOM 0 HA ILE A 3 1.045 -10.164 2.180 1.00 0.00 H new ATOM 0 HB ILE A 3 1.539 -13.168 2.226 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.658 -12.361 1.270 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.782 -13.432 2.652 1.00 0.00 H new ATOM 0 HG21 ILE A 3 0.916 -13.035 4.607 1.00 0.00 H new ATOM 0 HG22 ILE A 3 2.388 -12.098 4.256 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.833 -11.262 4.483 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -2.377 -11.582 2.831 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.171 -11.493 4.136 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -1.045 -10.406 2.733 1.00 0.00 H new ATOM 58 N LEU A 4 3.458 -9.669 2.493 1.00 0.00 N ATOM 59 CA LEU A 4 4.844 -9.369 2.826 1.00 0.00 C ATOM 60 C LEU A 4 4.948 -8.733 4.208 1.00 0.00 C ATOM 61 O LEU A 4 4.427 -7.640 4.432 1.00 0.00 O ATOM 62 CB LEU A 4 5.452 -8.437 1.778 1.00 0.00 C ATOM 63 CG LEU A 4 6.966 -8.557 1.602 1.00 0.00 C ATOM 64 CD1 LEU A 4 7.690 -8.018 2.825 1.00 0.00 C ATOM 65 CD2 LEU A 4 7.360 -10.003 1.341 1.00 0.00 C ATOM 0 H LEU A 4 2.830 -8.867 2.550 1.00 0.00 H new ATOM 0 HA LEU A 4 5.399 -10.307 2.835 1.00 0.00 H new ATOM 0 HB2 LEU A 4 4.974 -8.634 0.818 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.214 -7.408 2.048 1.00 0.00 H new ATOM 0 HG LEU A 4 7.260 -7.960 0.739 1.00 0.00 H new ATOM 0 HD11 LEU A 4 8.766 -8.112 2.681 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.433 -6.968 2.967 1.00 0.00 H new ATOM 0 HD13 LEU A 4 7.391 -8.587 3.705 1.00 0.00 H new ATOM 0 HD21 LEU A 4 8.441 -10.069 1.218 1.00 0.00 H new ATOM 0 HD22 LEU A 4 7.052 -10.622 2.184 1.00 0.00 H new ATOM 0 HD23 LEU A 4 6.870 -10.356 0.434 1.00 0.00 H new ATOM 77 N THR A 5 5.621 -9.408 5.135 1.00 0.00 N ATOM 78 CA THR A 5 5.779 -8.875 6.483 1.00 0.00 C ATOM 79 C THR A 5 6.387 -7.479 6.434 1.00 0.00 C ATOM 80 O THR A 5 7.283 -7.211 5.633 1.00 0.00 O ATOM 81 CB THR A 5 6.648 -9.797 7.337 1.00 0.00 C ATOM 82 OG1 THR A 5 6.757 -11.079 6.745 1.00 0.00 O ATOM 83 CG2 THR A 5 6.110 -9.980 8.739 1.00 0.00 C ATOM 0 H THR A 5 6.061 -10.315 4.980 1.00 0.00 H new ATOM 0 HA THR A 5 4.791 -8.815 6.940 1.00 0.00 H new ATOM 0 HB THR A 5 7.622 -9.311 7.395 1.00 0.00 H new ATOM 0 HG1 THR A 5 7.319 -11.652 7.307 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.769 -10.645 9.298 1.00 0.00 H new ATOM 0 HG22 THR A 5 6.061 -9.013 9.239 1.00 0.00 H new ATOM 0 HG23 THR A 5 5.112 -10.415 8.692 1.00 0.00 H new ATOM 91 N ARG A 6 5.894 -6.593 7.290 1.00 0.00 N ATOM 92 CA ARG A 6 6.387 -5.224 7.334 1.00 0.00 C ATOM 93 C ARG A 6 6.164 -4.602 8.708 1.00 0.00 C ATOM 94 O ARG A 6 5.129 -4.821 9.339 1.00 0.00 O ATOM 95 CB ARG A 6 5.688 -4.382 6.266 1.00 0.00 C ATOM 96 CG ARG A 6 6.247 -4.580 4.865 1.00 0.00 C ATOM 97 CD ARG A 6 5.441 -3.814 3.827 1.00 0.00 C ATOM 98 NE ARG A 6 5.354 -4.537 2.560 1.00 0.00 N ATOM 99 CZ ARG A 6 5.056 -3.962 1.396 1.00 0.00 C ATOM 100 NH1 ARG A 6 4.809 -2.659 1.334 1.00 0.00 N ATOM 101 NH2 ARG A 6 5.003 -4.693 0.291 1.00 0.00 N ATOM 0 H ARG A 6 5.154 -6.798 7.962 1.00 0.00 H new ATOM 0 HA ARG A 6 7.459 -5.245 7.138 1.00 0.00 H new ATOM 0 HB2 ARG A 6 4.626 -4.627 6.261 1.00 0.00 H new ATOM 0 HB3 ARG A 6 5.771 -3.329 6.535 1.00 0.00 H new ATOM 0 HG2 ARG A 6 7.285 -4.249 4.837 1.00 0.00 H new ATOM 0 HG3 ARG A 6 6.244 -5.642 4.618 1.00 0.00 H new ATOM 0 HD2 ARG A 6 4.437 -3.631 4.210 1.00 0.00 H new ATOM 0 HD3 ARG A 6 5.900 -2.840 3.658 1.00 0.00 H new ATOM 0 HE ARG A 6 5.532 -5.541 2.567 1.00 0.00 H new ATOM 0 HH11 ARG A 6 4.847 -2.092 2.181 1.00 0.00 H new ATOM 0 HH12 ARG A 6 4.581 -2.225 0.439 1.00 0.00 H new ATOM 0 HH21 ARG A 6 5.190 -5.695 0.333 1.00 0.00 H new ATOM 0 HH22 ARG A 6 4.775 -4.254 -0.601 1.00 0.00 H new ATOM 115 N ARG A 7 7.142 -3.821 9.161 1.00 0.00 N ATOM 116 CA ARG A 7 7.055 -3.157 10.461 1.00 0.00 C ATOM 117 C ARG A 7 8.308 -2.329 10.777 1.00 0.00 C ATOM 118 O ARG A 7 8.426 -1.774 11.869 1.00 0.00 O ATOM 119 CB ARG A 7 6.828 -4.191 11.567 1.00 0.00 C ATOM 120 CG ARG A 7 6.592 -3.578 12.940 1.00 0.00 C ATOM 121 CD ARG A 7 7.621 -4.060 13.951 1.00 0.00 C ATOM 122 NE ARG A 7 8.789 -3.183 14.007 1.00 0.00 N ATOM 123 CZ ARG A 7 9.712 -3.238 14.965 1.00 0.00 C ATOM 124 NH1 ARG A 7 9.611 -4.128 15.943 1.00 0.00 N ATOM 125 NH2 ARG A 7 10.740 -2.401 14.942 1.00 0.00 N ATOM 0 H ARG A 7 8.003 -3.632 8.648 1.00 0.00 H new ATOM 0 HA ARG A 7 6.209 -2.471 10.415 1.00 0.00 H new ATOM 0 HB2 ARG A 7 5.970 -4.810 11.303 1.00 0.00 H new ATOM 0 HB3 ARG A 7 7.694 -4.851 11.618 1.00 0.00 H new ATOM 0 HG2 ARG A 7 6.634 -2.491 12.866 1.00 0.00 H new ATOM 0 HG3 ARG A 7 5.591 -3.835 13.287 1.00 0.00 H new ATOM 0 HD2 ARG A 7 7.161 -4.114 14.938 1.00 0.00 H new ATOM 0 HD3 ARG A 7 7.938 -5.070 13.691 1.00 0.00 H new ATOM 0 HE ARG A 7 8.904 -2.488 13.269 1.00 0.00 H new ATOM 0 HH11 ARG A 7 8.823 -4.775 15.964 1.00 0.00 H new ATOM 0 HH12 ARG A 7 10.321 -4.165 16.674 1.00 0.00 H new ATOM 0 HH21 ARG A 7 10.823 -1.716 14.191 1.00 0.00 H new ATOM 0 HH22 ARG A 7 11.448 -2.442 15.675 1.00 0.00 H new ATOM 139 N VAL A 8 9.244 -2.244 9.832 1.00 0.00 N ATOM 140 CA VAL A 8 10.469 -1.480 10.050 1.00 0.00 C ATOM 141 C VAL A 8 10.668 -0.419 8.968 1.00 0.00 C ATOM 142 O VAL A 8 10.441 0.767 9.205 1.00 0.00 O ATOM 143 CB VAL A 8 11.703 -2.403 10.097 1.00 0.00 C ATOM 144 CG1 VAL A 8 12.963 -1.605 10.401 1.00 0.00 C ATOM 145 CG2 VAL A 8 11.503 -3.504 11.128 1.00 0.00 C ATOM 0 H VAL A 8 9.178 -2.690 8.917 1.00 0.00 H new ATOM 0 HA VAL A 8 10.362 -0.982 11.013 1.00 0.00 H new ATOM 0 HB VAL A 8 11.823 -2.865 9.117 1.00 0.00 H new ATOM 0 HG11 VAL A 8 13.821 -2.277 10.429 1.00 0.00 H new ATOM 0 HG12 VAL A 8 13.115 -0.855 9.625 1.00 0.00 H new ATOM 0 HG13 VAL A 8 12.857 -1.111 11.367 1.00 0.00 H new ATOM 0 HG21 VAL A 8 12.383 -4.147 11.149 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.355 -3.059 12.112 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.627 -4.096 10.863 1.00 0.00 H new ATOM 155 N GLY A 9 11.097 -0.848 7.784 1.00 0.00 N ATOM 156 CA GLY A 9 11.322 0.087 6.696 1.00 0.00 C ATOM 157 C GLY A 9 10.580 -0.299 5.431 1.00 0.00 C ATOM 158 O GLY A 9 11.046 -1.139 4.661 1.00 0.00 O ATOM 0 H GLY A 9 11.292 -1.824 7.559 1.00 0.00 H new ATOM 0 HA2 GLY A 9 11.008 1.083 7.007 1.00 0.00 H new ATOM 0 HA3 GLY A 9 12.390 0.142 6.484 1.00 0.00 H new ATOM 162 N GLU A 10 9.422 0.318 5.216 1.00 0.00 N ATOM 163 CA GLU A 10 8.612 0.037 4.037 1.00 0.00 C ATOM 164 C GLU A 10 8.551 1.248 3.114 1.00 0.00 C ATOM 165 O GLU A 10 9.050 2.321 3.451 1.00 0.00 O ATOM 166 CB GLU A 10 7.201 -0.370 4.452 1.00 0.00 C ATOM 167 CG GLU A 10 7.166 -1.588 5.357 1.00 0.00 C ATOM 168 CD GLU A 10 7.614 -1.276 6.772 1.00 0.00 C ATOM 169 OE1 GLU A 10 6.938 -0.472 7.446 1.00 0.00 O ATOM 170 OE2 GLU A 10 8.643 -1.836 7.205 1.00 0.00 O ATOM 0 H GLU A 10 9.024 1.016 5.844 1.00 0.00 H new ATOM 0 HA GLU A 10 9.079 -0.785 3.495 1.00 0.00 H new ATOM 0 HB2 GLU A 10 6.725 0.467 4.963 1.00 0.00 H new ATOM 0 HB3 GLU A 10 6.612 -0.574 3.558 1.00 0.00 H new ATOM 0 HG2 GLU A 10 6.153 -1.989 5.381 1.00 0.00 H new ATOM 0 HG3 GLU A 10 7.807 -2.365 4.940 1.00 0.00 H new ATOM 177 N THR A 11 7.926 1.067 1.950 1.00 0.00 N ATOM 178 CA THR A 11 7.784 2.144 0.970 1.00 0.00 C ATOM 179 C THR A 11 7.376 1.596 -0.395 1.00 0.00 C ATOM 180 O THR A 11 8.230 1.254 -1.213 1.00 0.00 O ATOM 181 CB THR A 11 9.092 2.934 0.832 1.00 0.00 C ATOM 182 OG1 THR A 11 9.093 3.702 -0.358 1.00 0.00 O ATOM 183 CG2 THR A 11 10.324 2.056 0.812 1.00 0.00 C ATOM 0 H THR A 11 7.509 0.182 1.662 1.00 0.00 H new ATOM 0 HA THR A 11 7.001 2.810 1.331 1.00 0.00 H new ATOM 0 HB THR A 11 9.135 3.573 1.714 1.00 0.00 H new ATOM 0 HG1 THR A 11 9.935 4.199 -0.426 1.00 0.00 H new ATOM 0 HG21 THR A 11 11.213 2.679 0.712 1.00 0.00 H new ATOM 0 HG22 THR A 11 10.381 1.488 1.741 1.00 0.00 H new ATOM 0 HG23 THR A 11 10.267 1.368 -0.031 1.00 0.00 H new ATOM 191 N LEU A 12 6.071 1.532 -0.645 1.00 0.00 N ATOM 192 CA LEU A 12 5.569 1.045 -1.927 1.00 0.00 C ATOM 193 C LEU A 12 4.910 2.186 -2.695 1.00 0.00 C ATOM 194 O LEU A 12 4.441 3.153 -2.095 1.00 0.00 O ATOM 195 CB LEU A 12 4.589 -0.123 -1.722 1.00 0.00 C ATOM 196 CG LEU A 12 3.120 0.256 -1.497 1.00 0.00 C ATOM 197 CD1 LEU A 12 2.201 -0.758 -2.160 1.00 0.00 C ATOM 198 CD2 LEU A 12 2.820 0.354 -0.011 1.00 0.00 C ATOM 0 H LEU A 12 5.347 1.809 0.017 1.00 0.00 H new ATOM 0 HA LEU A 12 6.408 0.672 -2.514 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.645 -0.774 -2.594 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.927 -0.707 -0.866 1.00 0.00 H new ATOM 0 HG LEU A 12 2.941 1.231 -1.951 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.163 -0.473 -1.990 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.400 -0.783 -3.231 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.381 -1.745 -1.734 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.774 0.624 0.132 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.015 -0.608 0.464 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.456 1.116 0.439 1.00 0.00 H new ATOM 210 N MET A 13 4.881 2.083 -4.020 1.00 0.00 N ATOM 211 CA MET A 13 4.283 3.129 -4.837 1.00 0.00 C ATOM 212 C MET A 13 3.354 2.555 -5.897 1.00 0.00 C ATOM 213 O MET A 13 3.799 2.086 -6.945 1.00 0.00 O ATOM 214 CB MET A 13 5.376 3.970 -5.497 1.00 0.00 C ATOM 215 CG MET A 13 4.839 5.130 -6.321 1.00 0.00 C ATOM 216 SD MET A 13 5.888 5.521 -7.734 1.00 0.00 S ATOM 217 CE MET A 13 4.910 4.850 -9.077 1.00 0.00 C ATOM 0 H MET A 13 5.260 1.295 -4.545 1.00 0.00 H new ATOM 0 HA MET A 13 3.686 3.761 -4.180 1.00 0.00 H new ATOM 0 HB2 MET A 13 6.038 4.360 -4.724 1.00 0.00 H new ATOM 0 HB3 MET A 13 5.979 3.328 -6.139 1.00 0.00 H new ATOM 0 HG2 MET A 13 3.837 4.887 -6.674 1.00 0.00 H new ATOM 0 HG3 MET A 13 4.749 6.011 -5.686 1.00 0.00 H new ATOM 0 HE1 MET A 13 5.428 5.015 -10.022 1.00 0.00 H new ATOM 0 HE2 MET A 13 4.766 3.780 -8.923 1.00 0.00 H new ATOM 0 HE3 MET A 13 3.940 5.346 -9.104 1.00 0.00 H new ATOM 227 N ILE A 14 2.058 2.614 -5.620 1.00 0.00 N ATOM 228 CA ILE A 14 1.051 2.122 -6.543 1.00 0.00 C ATOM 229 C ILE A 14 0.195 3.279 -7.055 1.00 0.00 C ATOM 230 O ILE A 14 -0.444 3.981 -6.271 1.00 0.00 O ATOM 231 CB ILE A 14 0.148 1.066 -5.872 1.00 0.00 C ATOM 232 CG1 ILE A 14 -0.958 0.609 -6.828 1.00 0.00 C ATOM 233 CG2 ILE A 14 -0.450 1.620 -4.586 1.00 0.00 C ATOM 234 CD1 ILE A 14 -0.435 0.064 -8.137 1.00 0.00 C ATOM 0 H ILE A 14 1.680 3.002 -4.755 1.00 0.00 H new ATOM 0 HA ILE A 14 1.566 1.653 -7.381 1.00 0.00 H new ATOM 0 HB ILE A 14 0.760 0.199 -5.624 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.557 -0.158 -6.338 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.621 1.450 -7.032 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -1.084 0.863 -4.124 1.00 0.00 H new ATOM 0 HG22 ILE A 14 0.352 1.890 -3.899 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -1.046 2.504 -4.813 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -1.272 -0.241 -8.765 1.00 0.00 H new ATOM 0 HD12 ILE A 14 0.140 0.836 -8.649 1.00 0.00 H new ATOM 0 HD13 ILE A 14 0.205 -0.797 -7.943 1.00 0.00 H new ATOM 246 N GLY A 15 0.188 3.477 -8.368 1.00 0.00 N ATOM 247 CA GLY A 15 -0.589 4.556 -8.952 1.00 0.00 C ATOM 248 C GLY A 15 0.190 5.309 -10.014 1.00 0.00 C ATOM 249 O GLY A 15 0.405 4.796 -11.113 1.00 0.00 O ATOM 0 H GLY A 15 0.706 2.910 -9.039 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -1.500 4.150 -9.391 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -0.894 5.248 -8.167 1.00 0.00 H new ATOM 253 N ASP A 16 0.617 6.525 -9.688 1.00 0.00 N ATOM 254 CA ASP A 16 1.379 7.341 -10.629 1.00 0.00 C ATOM 255 C ASP A 16 2.310 8.327 -9.915 1.00 0.00 C ATOM 256 O ASP A 16 2.937 9.165 -10.561 1.00 0.00 O ATOM 257 CB ASP A 16 0.429 8.105 -11.554 1.00 0.00 C ATOM 258 CG ASP A 16 0.918 8.132 -12.989 1.00 0.00 C ATOM 259 OD1 ASP A 16 0.818 7.089 -13.669 1.00 0.00 O ATOM 260 OD2 ASP A 16 1.400 9.195 -13.432 1.00 0.00 O ATOM 0 H ASP A 16 0.450 6.966 -8.784 1.00 0.00 H new ATOM 0 HA ASP A 16 2.000 6.664 -11.216 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -0.558 7.644 -11.518 1.00 0.00 H new ATOM 0 HB3 ASP A 16 0.317 9.127 -11.192 1.00 0.00 H new ATOM 265 N GLU A 17 2.400 8.220 -8.585 1.00 0.00 N ATOM 266 CA GLU A 17 3.257 9.099 -7.782 1.00 0.00 C ATOM 267 C GLU A 17 2.793 9.106 -6.327 1.00 0.00 C ATOM 268 O GLU A 17 2.351 10.132 -5.809 1.00 0.00 O ATOM 269 CB GLU A 17 3.253 10.531 -8.336 1.00 0.00 C ATOM 270 CG GLU A 17 4.498 10.876 -9.138 1.00 0.00 C ATOM 271 CD GLU A 17 4.213 11.852 -10.263 1.00 0.00 C ATOM 272 OE1 GLU A 17 3.239 12.625 -10.145 1.00 0.00 O ATOM 273 OE2 GLU A 17 4.963 11.842 -11.261 1.00 0.00 O ATOM 0 H GLU A 17 1.886 7.529 -8.039 1.00 0.00 H new ATOM 0 HA GLU A 17 4.275 8.713 -7.833 1.00 0.00 H new ATOM 0 HB2 GLU A 17 2.375 10.665 -8.968 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.159 11.232 -7.507 1.00 0.00 H new ATOM 0 HG2 GLU A 17 5.248 11.303 -8.472 1.00 0.00 H new ATOM 0 HG3 GLU A 17 4.923 9.962 -9.553 1.00 0.00 H new ATOM 280 N VAL A 18 2.883 7.952 -5.676 1.00 0.00 N ATOM 281 CA VAL A 18 2.463 7.820 -4.296 1.00 0.00 C ATOM 282 C VAL A 18 3.631 7.408 -3.393 1.00 0.00 C ATOM 283 O VAL A 18 4.796 7.599 -3.743 1.00 0.00 O ATOM 284 CB VAL A 18 1.329 6.788 -4.187 1.00 0.00 C ATOM 285 CG1 VAL A 18 0.202 7.125 -5.153 1.00 0.00 C ATOM 286 CG2 VAL A 18 1.852 5.380 -4.436 1.00 0.00 C ATOM 0 H VAL A 18 3.246 7.093 -6.089 1.00 0.00 H new ATOM 0 HA VAL A 18 2.103 8.793 -3.961 1.00 0.00 H new ATOM 0 HB VAL A 18 0.931 6.825 -3.173 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.591 6.383 -5.060 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.196 8.112 -4.918 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.585 7.122 -6.174 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.031 4.667 -4.354 1.00 0.00 H new ATOM 0 HG22 VAL A 18 2.283 5.323 -5.436 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.617 5.140 -3.697 1.00 0.00 H new ATOM 296 N THR A 19 3.306 6.841 -2.232 1.00 0.00 N ATOM 297 CA THR A 19 4.306 6.393 -1.267 1.00 0.00 C ATOM 298 C THR A 19 3.621 6.020 0.042 1.00 0.00 C ATOM 299 O THR A 19 3.206 6.891 0.800 1.00 0.00 O ATOM 300 CB THR A 19 5.352 7.486 -1.014 1.00 0.00 C ATOM 301 OG1 THR A 19 4.853 8.757 -1.389 1.00 0.00 O ATOM 302 CG2 THR A 19 6.647 7.261 -1.764 1.00 0.00 C ATOM 0 H THR A 19 2.343 6.680 -1.935 1.00 0.00 H new ATOM 0 HA THR A 19 4.816 5.521 -1.676 1.00 0.00 H new ATOM 0 HB THR A 19 5.558 7.444 0.055 1.00 0.00 H new ATOM 0 HG1 THR A 19 5.535 9.440 -1.218 1.00 0.00 H new ATOM 0 HG21 THR A 19 7.342 8.070 -1.540 1.00 0.00 H new ATOM 0 HG22 THR A 19 7.085 6.311 -1.457 1.00 0.00 H new ATOM 0 HG23 THR A 19 6.448 7.240 -2.835 1.00 0.00 H new ATOM 310 N VAL A 20 3.488 4.726 0.302 1.00 0.00 N ATOM 311 CA VAL A 20 2.831 4.270 1.522 1.00 0.00 C ATOM 312 C VAL A 20 3.780 3.468 2.410 1.00 0.00 C ATOM 313 O VAL A 20 4.256 2.398 2.023 1.00 0.00 O ATOM 314 CB VAL A 20 1.598 3.404 1.201 1.00 0.00 C ATOM 315 CG1 VAL A 20 0.817 3.090 2.467 1.00 0.00 C ATOM 316 CG2 VAL A 20 0.712 4.095 0.176 1.00 0.00 C ATOM 0 H VAL A 20 3.822 3.980 -0.308 1.00 0.00 H new ATOM 0 HA VAL A 20 2.517 5.166 2.058 1.00 0.00 H new ATOM 0 HB VAL A 20 1.942 2.462 0.774 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -0.050 2.478 2.217 1.00 0.00 H new ATOM 0 HG12 VAL A 20 1.456 2.548 3.164 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.484 4.019 2.929 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -0.154 3.468 -0.038 1.00 0.00 H new ATOM 0 HG22 VAL A 20 0.377 5.054 0.572 1.00 0.00 H new ATOM 0 HG23 VAL A 20 1.277 4.259 -0.742 1.00 0.00 H new ATOM 326 N THR A 21 4.055 3.997 3.600 1.00 0.00 N ATOM 327 CA THR A 21 4.948 3.336 4.548 1.00 0.00 C ATOM 328 C THR A 21 4.192 2.907 5.805 1.00 0.00 C ATOM 329 O THR A 21 3.686 3.742 6.556 1.00 0.00 O ATOM 330 CB THR A 21 6.102 4.267 4.926 1.00 0.00 C ATOM 331 OG1 THR A 21 6.875 3.708 5.972 1.00 0.00 O ATOM 332 CG2 THR A 21 5.643 5.637 5.375 1.00 0.00 C ATOM 0 H THR A 21 3.672 4.882 3.931 1.00 0.00 H new ATOM 0 HA THR A 21 5.350 2.444 4.067 1.00 0.00 H new ATOM 0 HB THR A 21 6.692 4.380 4.016 1.00 0.00 H new ATOM 0 HG1 THR A 21 7.609 4.317 6.198 1.00 0.00 H new ATOM 0 HG21 THR A 21 6.510 6.247 5.628 1.00 0.00 H new ATOM 0 HG22 THR A 21 5.085 6.116 4.570 1.00 0.00 H new ATOM 0 HG23 THR A 21 5.002 5.537 6.251 1.00 0.00 H new ATOM 340 N VAL A 22 4.118 1.598 6.029 1.00 0.00 N ATOM 341 CA VAL A 22 3.421 1.063 7.194 1.00 0.00 C ATOM 342 C VAL A 22 4.296 1.126 8.444 1.00 0.00 C ATOM 343 O VAL A 22 4.792 0.106 8.922 1.00 0.00 O ATOM 344 CB VAL A 22 2.970 -0.394 6.963 1.00 0.00 C ATOM 345 CG1 VAL A 22 1.958 -0.469 5.829 1.00 0.00 C ATOM 346 CG2 VAL A 22 4.169 -1.288 6.680 1.00 0.00 C ATOM 0 H VAL A 22 4.531 0.890 5.421 1.00 0.00 H new ATOM 0 HA VAL A 22 2.540 1.687 7.345 1.00 0.00 H new ATOM 0 HB VAL A 22 2.487 -0.752 7.872 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.652 -1.505 5.682 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.086 0.135 6.079 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.410 -0.090 4.912 1.00 0.00 H new ATOM 0 HG21 VAL A 22 3.830 -2.311 6.520 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.685 -0.933 5.788 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.852 -1.261 7.529 1.00 0.00 H new ATOM 356 N LEU A 23 4.478 2.333 8.971 1.00 0.00 N ATOM 357 CA LEU A 23 5.290 2.531 10.167 1.00 0.00 C ATOM 358 C LEU A 23 4.428 2.394 11.430 1.00 0.00 C ATOM 359 O LEU A 23 3.612 1.477 11.523 1.00 0.00 O ATOM 360 CB LEU A 23 5.977 3.904 10.106 1.00 0.00 C ATOM 361 CG LEU A 23 7.231 4.079 10.984 1.00 0.00 C ATOM 362 CD1 LEU A 23 7.605 2.784 11.701 1.00 0.00 C ATOM 363 CD2 LEU A 23 8.401 4.575 10.146 1.00 0.00 C ATOM 0 H LEU A 23 4.074 3.188 8.589 1.00 0.00 H new ATOM 0 HA LEU A 23 6.061 1.762 10.209 1.00 0.00 H new ATOM 0 HB2 LEU A 23 6.254 4.102 9.071 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.250 4.664 10.393 1.00 0.00 H new ATOM 0 HG LEU A 23 6.997 4.823 11.745 1.00 0.00 H new ATOM 0 HD11 LEU A 23 8.494 2.949 12.310 1.00 0.00 H new ATOM 0 HD12 LEU A 23 6.780 2.471 12.341 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.808 2.006 10.965 1.00 0.00 H new ATOM 0 HD21 LEU A 23 9.279 4.693 10.781 1.00 0.00 H new ATOM 0 HD22 LEU A 23 8.617 3.852 9.359 1.00 0.00 H new ATOM 0 HD23 LEU A 23 8.146 5.535 9.697 1.00 0.00 H new ATOM 375 N GLY A 24 4.605 3.298 12.400 1.00 0.00 N ATOM 376 CA GLY A 24 3.827 3.239 13.628 1.00 0.00 C ATOM 377 C GLY A 24 3.754 1.842 14.215 1.00 0.00 C ATOM 378 O GLY A 24 2.723 1.177 14.120 1.00 0.00 O ATOM 0 H GLY A 24 5.273 4.067 12.354 1.00 0.00 H new ATOM 0 HA2 GLY A 24 4.266 3.914 14.363 1.00 0.00 H new ATOM 0 HA3 GLY A 24 2.817 3.597 13.430 1.00 0.00 H new ATOM 382 N VAL A 25 4.850 1.393 14.820 1.00 0.00 N ATOM 383 CA VAL A 25 4.896 0.068 15.414 1.00 0.00 C ATOM 384 C VAL A 25 4.362 0.078 16.843 1.00 0.00 C ATOM 385 O VAL A 25 5.007 0.595 17.756 1.00 0.00 O ATOM 386 CB VAL A 25 6.331 -0.493 15.422 1.00 0.00 C ATOM 387 CG1 VAL A 25 6.333 -1.950 15.855 1.00 0.00 C ATOM 388 CG2 VAL A 25 6.975 -0.334 14.052 1.00 0.00 C ATOM 0 H VAL A 25 5.714 1.928 14.910 1.00 0.00 H new ATOM 0 HA VAL A 25 4.262 -0.571 14.799 1.00 0.00 H new ATOM 0 HB VAL A 25 6.919 0.076 16.142 1.00 0.00 H new ATOM 0 HG11 VAL A 25 7.355 -2.328 15.854 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.916 -2.032 16.859 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.729 -2.536 15.163 1.00 0.00 H new ATOM 0 HG21 VAL A 25 7.988 -0.736 14.077 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.388 -0.875 13.309 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.010 0.723 13.787 1.00 0.00 H new ATOM 398 N LYS A 26 3.178 -0.495 17.027 1.00 0.00 N ATOM 399 CA LYS A 26 2.552 -0.552 18.344 1.00 0.00 C ATOM 400 C LYS A 26 1.871 -1.898 18.569 1.00 0.00 C ATOM 401 O LYS A 26 1.458 -2.563 17.619 1.00 0.00 O ATOM 402 CB LYS A 26 1.535 0.581 18.497 1.00 0.00 C ATOM 403 CG LYS A 26 2.111 1.831 19.142 1.00 0.00 C ATOM 404 CD LYS A 26 2.209 1.685 20.652 1.00 0.00 C ATOM 405 CE LYS A 26 3.438 2.391 21.201 1.00 0.00 C ATOM 406 NZ LYS A 26 3.264 2.779 22.628 1.00 0.00 N ATOM 0 H LYS A 26 2.632 -0.927 16.281 1.00 0.00 H new ATOM 0 HA LYS A 26 3.334 -0.434 19.094 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.139 0.838 17.514 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.696 0.227 19.096 1.00 0.00 H new ATOM 0 HG2 LYS A 26 3.100 2.031 18.730 1.00 0.00 H new ATOM 0 HG3 LYS A 26 1.484 2.689 18.898 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.313 2.097 21.117 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.248 0.628 20.915 1.00 0.00 H new ATOM 0 HE2 LYS A 26 4.305 1.737 21.106 1.00 0.00 H new ATOM 0 HE3 LYS A 26 3.642 3.281 20.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 4.124 3.258 22.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 2.452 3.423 22.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 3.095 1.928 23.201 1.00 0.00 H new ATOM 420 N GLY A 27 1.756 -2.291 19.834 1.00 0.00 N ATOM 421 CA GLY A 27 1.123 -3.554 20.164 1.00 0.00 C ATOM 422 C GLY A 27 -0.331 -3.602 19.737 1.00 0.00 C ATOM 423 O GLY A 27 -1.010 -2.576 19.704 1.00 0.00 O ATOM 0 H GLY A 27 2.090 -1.757 20.636 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.667 -4.366 19.682 1.00 0.00 H new ATOM 0 HA3 GLY A 27 1.189 -3.720 21.239 1.00 0.00 H new ATOM 427 N ASN A 28 -0.808 -4.798 19.405 1.00 0.00 N ATOM 428 CA ASN A 28 -2.189 -4.983 18.972 1.00 0.00 C ATOM 429 C ASN A 28 -2.415 -4.349 17.601 1.00 0.00 C ATOM 430 O ASN A 28 -2.350 -5.029 16.577 1.00 0.00 O ATOM 431 CB ASN A 28 -3.162 -4.393 20.000 1.00 0.00 C ATOM 432 CG ASN A 28 -3.894 -5.465 20.785 1.00 0.00 C ATOM 433 OD1 ASN A 28 -3.617 -6.655 20.640 1.00 0.00 O ATOM 434 ND2 ASN A 28 -4.834 -5.046 21.624 1.00 0.00 N ATOM 0 H ASN A 28 -0.257 -5.656 19.428 1.00 0.00 H new ATOM 0 HA ASN A 28 -2.378 -6.053 18.892 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -2.613 -3.752 20.690 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -3.888 -3.762 19.488 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -5.359 -5.721 22.180 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -5.031 -4.049 21.713 1.00 0.00 H new ATOM 441 N GLN A 29 -2.679 -3.045 17.584 1.00 0.00 N ATOM 442 CA GLN A 29 -2.910 -2.331 16.333 1.00 0.00 C ATOM 443 C GLN A 29 -1.724 -1.436 15.989 1.00 0.00 C ATOM 444 O GLN A 29 -1.303 -0.607 16.797 1.00 0.00 O ATOM 445 CB GLN A 29 -4.186 -1.493 16.428 1.00 0.00 C ATOM 446 CG GLN A 29 -5.439 -2.317 16.675 1.00 0.00 C ATOM 447 CD GLN A 29 -6.703 -1.602 16.240 1.00 0.00 C ATOM 448 OE1 GLN A 29 -6.695 -0.832 15.280 1.00 0.00 O ATOM 449 NE2 GLN A 29 -7.798 -1.853 16.948 1.00 0.00 N ATOM 0 H GLN A 29 -2.738 -2.463 18.420 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.026 -3.069 15.539 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -4.074 -0.767 17.233 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -4.309 -0.928 15.504 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.359 -3.263 16.139 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.508 -2.556 17.736 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -7.759 -2.499 17.736 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -8.679 -1.400 16.703 1.00 0.00 H new ATOM 458 N VAL A 30 -1.181 -1.620 14.790 1.00 0.00 N ATOM 459 CA VAL A 30 -0.032 -0.842 14.341 1.00 0.00 C ATOM 460 C VAL A 30 -0.470 0.390 13.558 1.00 0.00 C ATOM 461 O VAL A 30 -1.366 0.318 12.717 1.00 0.00 O ATOM 462 CB VAL A 30 0.909 -1.687 13.462 1.00 0.00 C ATOM 463 CG1 VAL A 30 1.636 -2.725 14.303 1.00 0.00 C ATOM 464 CG2 VAL A 30 0.133 -2.350 12.334 1.00 0.00 C ATOM 0 H VAL A 30 -1.519 -2.302 14.111 1.00 0.00 H new ATOM 0 HA VAL A 30 0.503 -0.526 15.237 1.00 0.00 H new ATOM 0 HB VAL A 30 1.654 -1.027 13.019 1.00 0.00 H new ATOM 0 HG11 VAL A 30 2.296 -3.313 13.665 1.00 0.00 H new ATOM 0 HG12 VAL A 30 2.225 -2.223 15.071 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.908 -3.384 14.777 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.814 -2.943 11.723 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.636 -2.998 12.754 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.336 -1.584 11.716 1.00 0.00 H new ATOM 474 N ARG A 31 0.174 1.521 13.835 1.00 0.00 N ATOM 475 CA ARG A 31 -0.138 2.763 13.157 1.00 0.00 C ATOM 476 C ARG A 31 0.442 2.762 11.749 1.00 0.00 C ATOM 477 O ARG A 31 1.648 2.918 11.564 1.00 0.00 O ATOM 478 CB ARG A 31 0.404 3.955 13.950 1.00 0.00 C ATOM 479 CG ARG A 31 -0.637 4.619 14.835 1.00 0.00 C ATOM 480 CD ARG A 31 -0.052 5.800 15.593 1.00 0.00 C ATOM 481 NE ARG A 31 -1.015 6.387 16.520 1.00 0.00 N ATOM 482 CZ ARG A 31 -1.290 5.884 17.722 1.00 0.00 C ATOM 483 NH1 ARG A 31 -0.679 4.785 18.145 1.00 0.00 N ATOM 484 NH2 ARG A 31 -2.180 6.482 18.502 1.00 0.00 N ATOM 0 H ARG A 31 0.918 1.596 14.529 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.222 2.853 13.087 1.00 0.00 H new ATOM 0 HB2 ARG A 31 1.236 3.621 14.570 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.802 4.693 13.254 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.474 4.956 14.224 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -1.032 3.891 15.543 1.00 0.00 H new ATOM 0 HD2 ARG A 31 0.830 5.475 16.144 1.00 0.00 H new ATOM 0 HD3 ARG A 31 0.277 6.559 14.883 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.506 7.232 16.230 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.006 4.320 17.549 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -0.894 4.405 19.067 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -2.653 7.327 18.181 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -2.391 6.097 19.423 1.00 0.00 H new ATOM 498 N ILE A 32 -0.420 2.568 10.759 1.00 0.00 N ATOM 499 CA ILE A 32 0.013 2.524 9.369 1.00 0.00 C ATOM 500 C ILE A 32 0.049 3.920 8.756 1.00 0.00 C ATOM 501 O ILE A 32 -0.903 4.688 8.880 1.00 0.00 O ATOM 502 CB ILE A 32 -0.918 1.622 8.538 1.00 0.00 C ATOM 503 CG1 ILE A 32 -1.120 0.280 9.251 1.00 0.00 C ATOM 504 CG2 ILE A 32 -0.351 1.412 7.144 1.00 0.00 C ATOM 505 CD1 ILE A 32 0.159 -0.512 9.418 1.00 0.00 C ATOM 0 H ILE A 32 -1.423 2.439 10.893 1.00 0.00 H new ATOM 0 HA ILE A 32 1.022 2.111 9.354 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.887 2.112 8.438 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.557 0.461 10.233 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.837 -0.317 8.688 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.022 0.772 6.571 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.252 2.375 6.643 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.628 0.938 7.217 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.058 -1.450 9.930 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.586 -0.724 8.438 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.871 0.067 10.007 1.00 0.00 H new ATOM 517 N GLY A 33 1.161 4.244 8.097 1.00 0.00 N ATOM 518 CA GLY A 33 1.304 5.551 7.483 1.00 0.00 C ATOM 519 C GLY A 33 1.166 5.508 5.976 1.00 0.00 C ATOM 520 O GLY A 33 1.873 4.761 5.300 1.00 0.00 O ATOM 0 H GLY A 33 1.963 3.625 7.979 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.552 6.225 7.893 1.00 0.00 H new ATOM 0 HA3 GLY A 33 2.278 5.965 7.743 1.00 0.00 H new ATOM 524 N VAL A 34 0.253 6.312 5.446 1.00 0.00 N ATOM 525 CA VAL A 34 0.027 6.365 4.010 1.00 0.00 C ATOM 526 C VAL A 34 0.325 7.754 3.458 1.00 0.00 C ATOM 527 O VAL A 34 -0.175 8.756 3.968 1.00 0.00 O ATOM 528 CB VAL A 34 -1.423 5.985 3.652 1.00 0.00 C ATOM 529 CG1 VAL A 34 -1.565 5.771 2.153 1.00 0.00 C ATOM 530 CG2 VAL A 34 -1.856 4.743 4.418 1.00 0.00 C ATOM 0 H VAL A 34 -0.342 6.936 5.990 1.00 0.00 H new ATOM 0 HA VAL A 34 0.706 5.642 3.558 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.076 6.808 3.942 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -2.596 5.503 1.920 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.301 6.689 1.628 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -0.901 4.967 1.836 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -2.882 4.491 4.152 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -1.200 3.911 4.163 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.796 4.937 5.489 1.00 0.00 H new ATOM 540 N ASN A 35 1.126 7.803 2.401 1.00 0.00 N ATOM 541 CA ASN A 35 1.473 9.067 1.764 1.00 0.00 C ATOM 542 C ASN A 35 1.089 9.034 0.289 1.00 0.00 C ATOM 543 O ASN A 35 1.726 8.357 -0.517 1.00 0.00 O ATOM 544 CB ASN A 35 2.968 9.363 1.911 1.00 0.00 C ATOM 545 CG ASN A 35 3.258 10.850 1.966 1.00 0.00 C ATOM 546 OD1 ASN A 35 3.470 11.492 0.937 1.00 0.00 O ATOM 547 ND2 ASN A 35 3.270 11.406 3.171 1.00 0.00 N ATOM 0 H ASN A 35 1.548 6.982 1.967 1.00 0.00 H new ATOM 0 HA ASN A 35 0.917 9.862 2.261 1.00 0.00 H new ATOM 0 HB2 ASN A 35 3.342 8.888 2.818 1.00 0.00 H new ATOM 0 HB3 ASN A 35 3.508 8.921 1.074 1.00 0.00 H new ATOM 0 HD21 ASN A 35 3.460 12.403 3.271 1.00 0.00 H new ATOM 0 HD22 ASN A 35 3.089 10.836 3.997 1.00 0.00 H new ATOM 554 N ALA A 36 0.037 9.762 -0.052 1.00 0.00 N ATOM 555 CA ALA A 36 -0.443 9.811 -1.428 1.00 0.00 C ATOM 556 C ALA A 36 -0.965 11.198 -1.796 1.00 0.00 C ATOM 557 O ALA A 36 -1.565 11.885 -0.969 1.00 0.00 O ATOM 558 CB ALA A 36 -1.528 8.766 -1.642 1.00 0.00 C ATOM 0 H ALA A 36 -0.502 10.328 0.604 1.00 0.00 H new ATOM 0 HA ALA A 36 0.401 9.592 -2.082 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -1.879 8.812 -2.673 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.123 7.774 -1.440 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.360 8.962 -0.966 1.00 0.00 H new ATOM 564 N PRO A 37 -0.748 11.623 -3.054 1.00 0.00 N ATOM 565 CA PRO A 37 -1.202 12.927 -3.538 1.00 0.00 C ATOM 566 C PRO A 37 -2.692 12.932 -3.859 1.00 0.00 C ATOM 567 O PRO A 37 -3.282 11.884 -4.123 1.00 0.00 O ATOM 568 CB PRO A 37 -0.382 13.128 -4.810 1.00 0.00 C ATOM 569 CG PRO A 37 -0.144 11.749 -5.320 1.00 0.00 C ATOM 570 CD PRO A 37 -0.045 10.861 -4.106 1.00 0.00 C ATOM 0 HA PRO A 37 -1.067 13.714 -2.796 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -0.921 13.733 -5.539 1.00 0.00 H new ATOM 0 HB3 PRO A 37 0.556 13.642 -4.601 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -0.958 11.429 -5.971 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.772 11.705 -5.910 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -0.514 9.892 -4.279 1.00 0.00 H new ATOM 0 HD3 PRO A 37 0.993 10.669 -3.835 1.00 0.00 H new ATOM 578 N LYS A 38 -3.297 14.114 -3.833 1.00 0.00 N ATOM 579 CA LYS A 38 -4.720 14.249 -4.121 1.00 0.00 C ATOM 580 C LYS A 38 -4.969 14.460 -5.613 1.00 0.00 C ATOM 581 O LYS A 38 -5.851 15.227 -6.001 1.00 0.00 O ATOM 582 CB LYS A 38 -5.310 15.416 -3.326 1.00 0.00 C ATOM 583 CG LYS A 38 -6.800 15.277 -3.059 1.00 0.00 C ATOM 584 CD LYS A 38 -7.497 16.629 -3.077 1.00 0.00 C ATOM 585 CE LYS A 38 -8.525 16.740 -1.962 1.00 0.00 C ATOM 586 NZ LYS A 38 -8.588 18.117 -1.401 1.00 0.00 N ATOM 0 H LYS A 38 -2.825 14.992 -3.616 1.00 0.00 H new ATOM 0 HA LYS A 38 -5.210 13.322 -3.823 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -4.785 15.499 -2.374 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.132 16.343 -3.871 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.246 14.626 -3.811 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -6.955 14.799 -2.091 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -6.757 17.423 -2.972 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -7.986 16.775 -4.040 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -9.506 16.458 -2.344 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -8.277 16.035 -1.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -9.300 18.151 -0.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -7.658 18.377 -1.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -8.849 18.786 -2.153 1.00 0.00 H new ATOM 600 N GLU A 39 -4.192 13.774 -6.450 1.00 0.00 N ATOM 601 CA GLU A 39 -4.338 13.891 -7.896 1.00 0.00 C ATOM 602 C GLU A 39 -4.824 12.576 -8.500 1.00 0.00 C ATOM 603 O GLU A 39 -5.642 12.570 -9.419 1.00 0.00 O ATOM 604 CB GLU A 39 -3.008 14.297 -8.534 1.00 0.00 C ATOM 605 CG GLU A 39 -2.337 15.474 -7.845 1.00 0.00 C ATOM 606 CD GLU A 39 -1.658 16.412 -8.823 1.00 0.00 C ATOM 607 OE1 GLU A 39 -1.027 15.917 -9.780 1.00 0.00 O ATOM 608 OE2 GLU A 39 -1.757 17.642 -8.632 1.00 0.00 O ATOM 0 H GLU A 39 -3.457 13.133 -6.150 1.00 0.00 H new ATOM 0 HA GLU A 39 -5.081 14.662 -8.100 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.331 13.443 -8.518 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.178 14.548 -9.581 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.081 16.028 -7.273 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.600 15.102 -7.133 1.00 0.00 H new ATOM 615 N VAL A 40 -4.317 11.464 -7.974 1.00 0.00 N ATOM 616 CA VAL A 40 -4.704 10.145 -8.460 1.00 0.00 C ATOM 617 C VAL A 40 -5.918 9.621 -7.701 1.00 0.00 C ATOM 618 O VAL A 40 -6.162 10.010 -6.559 1.00 0.00 O ATOM 619 CB VAL A 40 -3.550 9.129 -8.332 1.00 0.00 C ATOM 620 CG1 VAL A 40 -3.878 7.851 -9.087 1.00 0.00 C ATOM 621 CG2 VAL A 40 -2.247 9.734 -8.835 1.00 0.00 C ATOM 0 H VAL A 40 -3.638 11.451 -7.213 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.955 10.258 -9.515 1.00 0.00 H new ATOM 0 HB VAL A 40 -3.425 8.880 -7.278 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -3.053 7.146 -8.985 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -4.786 7.409 -8.676 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -4.031 8.081 -10.141 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.445 9.003 -8.737 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.356 10.014 -9.883 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.006 10.619 -8.246 1.00 0.00 H new ATOM 631 N SER A 41 -6.678 8.738 -8.341 1.00 0.00 N ATOM 632 CA SER A 41 -7.870 8.166 -7.723 1.00 0.00 C ATOM 633 C SER A 41 -7.523 7.469 -6.411 1.00 0.00 C ATOM 634 O SER A 41 -7.082 6.320 -6.405 1.00 0.00 O ATOM 635 CB SER A 41 -8.539 7.176 -8.678 1.00 0.00 C ATOM 636 OG SER A 41 -9.847 6.850 -8.241 1.00 0.00 O ATOM 0 H SER A 41 -6.490 8.403 -9.286 1.00 0.00 H new ATOM 0 HA SER A 41 -8.563 8.979 -7.508 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.583 7.605 -9.679 1.00 0.00 H new ATOM 0 HB3 SER A 41 -7.938 6.269 -8.746 1.00 0.00 H new ATOM 0 HG SER A 41 -10.254 6.217 -8.869 1.00 0.00 H new ATOM 642 N VAL A 42 -7.730 8.170 -5.300 1.00 0.00 N ATOM 643 CA VAL A 42 -7.445 7.617 -3.982 1.00 0.00 C ATOM 644 C VAL A 42 -8.694 7.631 -3.103 1.00 0.00 C ATOM 645 O VAL A 42 -9.266 8.691 -2.846 1.00 0.00 O ATOM 646 CB VAL A 42 -6.321 8.404 -3.278 1.00 0.00 C ATOM 647 CG1 VAL A 42 -6.754 9.838 -3.005 1.00 0.00 C ATOM 648 CG2 VAL A 42 -5.906 7.709 -1.991 1.00 0.00 C ATOM 0 H VAL A 42 -8.094 9.123 -5.287 1.00 0.00 H new ATOM 0 HA VAL A 42 -7.119 6.587 -4.128 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.457 8.434 -3.942 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -5.945 10.374 -2.508 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -6.991 10.332 -3.947 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -7.636 9.836 -2.364 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.112 8.280 -1.509 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -6.763 7.642 -1.321 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -5.545 6.706 -2.219 1.00 0.00 H new ATOM 658 N HIS A 43 -9.116 6.457 -2.641 1.00 0.00 N ATOM 659 CA HIS A 43 -10.297 6.351 -1.791 1.00 0.00 C ATOM 660 C HIS A 43 -9.984 5.559 -0.524 1.00 0.00 C ATOM 661 O HIS A 43 -9.331 4.517 -0.580 1.00 0.00 O ATOM 662 CB HIS A 43 -11.443 5.684 -2.556 1.00 0.00 C ATOM 663 CG HIS A 43 -12.479 6.650 -3.040 1.00 0.00 C ATOM 664 ND1 HIS A 43 -12.335 8.018 -2.951 1.00 0.00 N ATOM 665 CD2 HIS A 43 -13.684 6.439 -3.624 1.00 0.00 C ATOM 666 CE1 HIS A 43 -13.403 8.608 -3.456 1.00 0.00 C ATOM 667 NE2 HIS A 43 -14.237 7.672 -3.872 1.00 0.00 N ATOM 0 H HIS A 43 -8.658 5.568 -2.841 1.00 0.00 H new ATOM 0 HA HIS A 43 -10.600 7.357 -1.503 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -11.034 5.144 -3.410 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -11.919 4.946 -1.911 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -14.127 5.481 -3.852 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -13.567 9.674 -3.518 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -15.145 7.838 -4.307 1.00 0.00 H new ATOM 675 N ARG A 44 -10.459 6.053 0.616 1.00 0.00 N ATOM 676 CA ARG A 44 -10.234 5.385 1.893 1.00 0.00 C ATOM 677 C ARG A 44 -11.421 5.603 2.828 1.00 0.00 C ATOM 678 O ARG A 44 -12.446 6.153 2.424 1.00 0.00 O ATOM 679 CB ARG A 44 -8.953 5.904 2.551 1.00 0.00 C ATOM 680 CG ARG A 44 -7.716 5.761 1.680 1.00 0.00 C ATOM 681 CD ARG A 44 -7.454 7.022 0.874 1.00 0.00 C ATOM 682 NE ARG A 44 -6.294 7.758 1.372 1.00 0.00 N ATOM 683 CZ ARG A 44 -6.097 9.060 1.174 1.00 0.00 C ATOM 684 NH1 ARG A 44 -6.975 9.774 0.480 1.00 0.00 N ATOM 685 NH2 ARG A 44 -5.017 9.649 1.668 1.00 0.00 N ATOM 0 H ARG A 44 -11.002 6.914 0.681 1.00 0.00 H new ATOM 0 HA ARG A 44 -10.126 4.317 1.703 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -9.087 6.955 2.806 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -8.792 5.367 3.486 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.852 5.542 2.307 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -7.841 4.915 1.004 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -7.294 6.758 -0.171 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -8.334 7.664 0.910 1.00 0.00 H new ATOM 0 HE ARG A 44 -5.592 7.243 1.904 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -7.806 9.326 0.095 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -6.818 10.771 0.332 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -4.337 9.105 2.199 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -4.866 10.646 1.517 1.00 0.00 H new ATOM 699 N GLU A 45 -11.276 5.174 4.077 1.00 0.00 N ATOM 700 CA GLU A 45 -12.339 5.328 5.064 1.00 0.00 C ATOM 701 C GLU A 45 -12.629 6.804 5.321 1.00 0.00 C ATOM 702 O GLU A 45 -11.713 7.623 5.400 1.00 0.00 O ATOM 703 CB GLU A 45 -11.954 4.633 6.373 1.00 0.00 C ATOM 704 CG GLU A 45 -13.035 3.708 6.909 1.00 0.00 C ATOM 705 CD GLU A 45 -13.468 2.668 5.895 1.00 0.00 C ATOM 706 OE1 GLU A 45 -12.612 2.220 5.103 1.00 0.00 O ATOM 707 OE2 GLU A 45 -14.662 2.302 5.892 1.00 0.00 O ATOM 0 H GLU A 45 -10.435 4.718 4.430 1.00 0.00 H new ATOM 0 HA GLU A 45 -13.241 4.862 4.668 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -11.041 4.059 6.215 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -11.729 5.390 7.124 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -12.668 3.206 7.804 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -13.900 4.301 7.208 1.00 0.00 H new ATOM 714 N GLU A 46 -13.911 7.138 5.445 1.00 0.00 N ATOM 715 CA GLU A 46 -14.324 8.518 5.687 1.00 0.00 C ATOM 716 C GLU A 46 -13.570 9.126 6.868 1.00 0.00 C ATOM 717 O GLU A 46 -12.834 10.099 6.707 1.00 0.00 O ATOM 718 CB GLU A 46 -15.835 8.593 5.934 1.00 0.00 C ATOM 719 CG GLU A 46 -16.386 7.448 6.773 1.00 0.00 C ATOM 720 CD GLU A 46 -17.476 6.672 6.059 1.00 0.00 C ATOM 721 OE1 GLU A 46 -18.511 7.281 5.716 1.00 0.00 O ATOM 722 OE2 GLU A 46 -17.293 5.456 5.842 1.00 0.00 O ATOM 0 H GLU A 46 -14.681 6.473 5.382 1.00 0.00 H new ATOM 0 HA GLU A 46 -14.081 9.096 4.795 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -16.065 9.536 6.430 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -16.349 8.605 4.973 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -15.573 6.770 7.033 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -16.781 7.845 7.708 1.00 0.00 H new ATOM 729 N ILE A 47 -13.754 8.549 8.053 1.00 0.00 N ATOM 730 CA ILE A 47 -13.089 9.038 9.256 1.00 0.00 C ATOM 731 C ILE A 47 -11.572 9.053 9.080 1.00 0.00 C ATOM 732 O ILE A 47 -10.905 10.028 9.434 1.00 0.00 O ATOM 733 CB ILE A 47 -13.451 8.175 10.485 1.00 0.00 C ATOM 734 CG1 ILE A 47 -14.951 8.266 10.768 1.00 0.00 C ATOM 735 CG2 ILE A 47 -12.651 8.609 11.707 1.00 0.00 C ATOM 736 CD1 ILE A 47 -15.401 9.652 11.176 1.00 0.00 C ATOM 0 H ILE A 47 -14.359 7.742 8.205 1.00 0.00 H new ATOM 0 HA ILE A 47 -13.438 10.057 9.422 1.00 0.00 H new ATOM 0 HB ILE A 47 -13.197 7.138 10.265 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -15.501 7.961 9.878 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -15.208 7.561 11.559 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -12.923 7.987 12.560 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -11.586 8.499 11.503 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -12.871 9.652 11.934 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -16.475 9.646 11.362 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -14.878 9.952 12.084 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -15.175 10.358 10.377 1.00 0.00 H new ATOM 748 N TYR A 48 -11.037 7.963 8.536 1.00 0.00 N ATOM 749 CA TYR A 48 -9.598 7.831 8.313 1.00 0.00 C ATOM 750 C TYR A 48 -8.991 9.129 7.783 1.00 0.00 C ATOM 751 O TYR A 48 -8.292 9.839 8.505 1.00 0.00 O ATOM 752 CB TYR A 48 -9.319 6.691 7.330 1.00 0.00 C ATOM 753 CG TYR A 48 -9.396 5.309 7.948 1.00 0.00 C ATOM 754 CD1 TYR A 48 -10.204 5.057 9.052 1.00 0.00 C ATOM 755 CD2 TYR A 48 -8.658 4.255 7.423 1.00 0.00 C ATOM 756 CE1 TYR A 48 -10.273 3.796 9.613 1.00 0.00 C ATOM 757 CE2 TYR A 48 -8.722 2.992 7.979 1.00 0.00 C ATOM 758 CZ TYR A 48 -9.531 2.768 9.073 1.00 0.00 C ATOM 759 OH TYR A 48 -9.597 1.511 9.629 1.00 0.00 O ATOM 0 H TYR A 48 -11.582 7.153 8.240 1.00 0.00 H new ATOM 0 HA TYR A 48 -9.134 7.607 9.273 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -10.033 6.751 6.509 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -8.327 6.831 6.900 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -10.787 5.860 9.478 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -8.024 4.426 6.566 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -10.905 3.617 10.470 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -8.141 2.184 7.559 1.00 0.00 H new ATOM 0 HH TYR A 48 -9.015 0.901 9.129 1.00 0.00 H new ATOM 769 N GLN A 49 -9.262 9.432 6.520 1.00 0.00 N ATOM 770 CA GLN A 49 -8.739 10.643 5.895 1.00 0.00 C ATOM 771 C GLN A 49 -9.336 11.902 6.524 1.00 0.00 C ATOM 772 O GLN A 49 -8.784 12.991 6.385 1.00 0.00 O ATOM 773 CB GLN A 49 -9.032 10.627 4.393 1.00 0.00 C ATOM 774 CG GLN A 49 -10.494 10.380 4.058 1.00 0.00 C ATOM 775 CD GLN A 49 -10.788 10.531 2.579 1.00 0.00 C ATOM 776 OE1 GLN A 49 -10.885 11.645 2.064 1.00 0.00 O ATOM 777 NE2 GLN A 49 -10.932 9.407 1.886 1.00 0.00 N ATOM 0 H GLN A 49 -9.840 8.857 5.907 1.00 0.00 H new ATOM 0 HA GLN A 49 -7.661 10.662 6.058 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -8.726 11.580 3.962 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.425 9.854 3.922 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -10.772 9.376 4.379 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -11.114 11.077 4.621 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -10.843 8.505 2.353 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -11.131 9.446 0.886 1.00 0.00 H new ATOM 786 N ARG A 50 -10.467 11.751 7.208 1.00 0.00 N ATOM 787 CA ARG A 50 -11.133 12.884 7.843 1.00 0.00 C ATOM 788 C ARG A 50 -10.331 13.425 9.025 1.00 0.00 C ATOM 789 O ARG A 50 -10.534 14.563 9.449 1.00 0.00 O ATOM 790 CB ARG A 50 -12.534 12.484 8.309 1.00 0.00 C ATOM 791 CG ARG A 50 -13.636 12.891 7.345 1.00 0.00 C ATOM 792 CD ARG A 50 -14.967 13.060 8.059 1.00 0.00 C ATOM 793 NE ARG A 50 -15.750 11.826 8.058 1.00 0.00 N ATOM 794 CZ ARG A 50 -16.961 11.716 8.599 1.00 0.00 C ATOM 795 NH1 ARG A 50 -17.531 12.762 9.185 1.00 0.00 N ATOM 796 NH2 ARG A 50 -17.605 10.558 8.554 1.00 0.00 N ATOM 0 H ARG A 50 -10.941 10.857 7.336 1.00 0.00 H new ATOM 0 HA ARG A 50 -11.209 13.676 7.098 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -12.566 11.404 8.449 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -12.728 12.937 9.281 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -13.364 13.825 6.854 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -13.734 12.137 6.564 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -14.789 13.376 9.087 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -15.539 13.853 7.577 1.00 0.00 H new ATOM 0 HE ARG A 50 -15.345 11.001 7.617 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -17.041 13.656 9.222 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -18.459 12.672 9.598 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -17.172 9.751 8.105 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -18.533 10.474 8.969 1.00 0.00 H new ATOM 810 N ILE A 51 -9.428 12.611 9.563 1.00 0.00 N ATOM 811 CA ILE A 51 -8.615 13.032 10.700 1.00 0.00 C ATOM 812 C ILE A 51 -7.148 13.204 10.316 1.00 0.00 C ATOM 813 O ILE A 51 -6.412 13.941 10.974 1.00 0.00 O ATOM 814 CB ILE A 51 -8.718 12.036 11.872 1.00 0.00 C ATOM 815 CG1 ILE A 51 -8.532 10.602 11.374 1.00 0.00 C ATOM 816 CG2 ILE A 51 -10.055 12.188 12.582 1.00 0.00 C ATOM 817 CD1 ILE A 51 -7.895 9.686 12.396 1.00 0.00 C ATOM 0 H ILE A 51 -9.241 11.664 9.234 1.00 0.00 H new ATOM 0 HA ILE A 51 -9.011 13.997 11.017 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.923 12.257 12.585 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -9.503 10.196 11.089 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -7.915 10.615 10.475 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -10.112 11.478 13.407 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -10.148 13.202 12.970 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -10.865 11.993 11.879 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -7.794 8.686 11.975 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -6.910 10.069 12.664 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.522 9.643 13.287 1.00 0.00 H new ATOM 829 N GLN A 52 -6.720 12.524 9.256 1.00 0.00 N ATOM 830 CA GLN A 52 -5.331 12.618 8.808 1.00 0.00 C ATOM 831 C GLN A 52 -5.212 13.421 7.513 1.00 0.00 C ATOM 832 O GLN A 52 -4.423 14.362 7.429 1.00 0.00 O ATOM 833 CB GLN A 52 -4.728 11.222 8.621 1.00 0.00 C ATOM 834 CG GLN A 52 -5.499 10.340 7.652 1.00 0.00 C ATOM 835 CD GLN A 52 -5.487 8.880 8.055 1.00 0.00 C ATOM 836 OE1 GLN A 52 -5.014 8.527 9.135 1.00 0.00 O ATOM 837 NE2 GLN A 52 -6.009 8.022 7.186 1.00 0.00 N ATOM 0 H GLN A 52 -7.307 11.907 8.695 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.772 13.144 9.582 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -3.703 11.325 8.265 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -4.681 10.725 9.590 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -6.530 10.688 7.592 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -5.070 10.441 6.655 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -6.390 8.360 6.302 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -6.029 7.025 7.402 1.00 0.00 H new ATOM 846 N ALA A 53 -5.992 13.044 6.504 1.00 0.00 N ATOM 847 CA ALA A 53 -5.960 13.731 5.220 1.00 0.00 C ATOM 848 C ALA A 53 -6.567 15.126 5.325 1.00 0.00 C ATOM 849 O ALA A 53 -5.854 16.129 5.295 1.00 0.00 O ATOM 850 CB ALA A 53 -6.686 12.911 4.164 1.00 0.00 C ATOM 0 H ALA A 53 -6.652 12.268 6.552 1.00 0.00 H new ATOM 0 HA ALA A 53 -4.917 13.842 4.922 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -6.654 13.437 3.210 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -6.201 11.940 4.060 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -7.724 12.768 4.465 1.00 0.00 H new ATOM 856 N GLU A 54 -7.888 15.182 5.451 1.00 0.00 N ATOM 857 CA GLU A 54 -8.593 16.453 5.565 1.00 0.00 C ATOM 858 C GLU A 54 -9.100 16.663 6.987 1.00 0.00 C ATOM 859 O GLU A 54 -9.904 15.881 7.492 1.00 0.00 O ATOM 860 CB GLU A 54 -9.763 16.502 4.581 1.00 0.00 C ATOM 861 CG GLU A 54 -9.368 16.966 3.189 1.00 0.00 C ATOM 862 CD GLU A 54 -10.448 17.798 2.524 1.00 0.00 C ATOM 863 OE1 GLU A 54 -11.088 18.609 3.225 1.00 0.00 O ATOM 864 OE2 GLU A 54 -10.652 17.639 1.302 1.00 0.00 O ATOM 0 H GLU A 54 -8.493 14.361 5.477 1.00 0.00 H new ATOM 0 HA GLU A 54 -7.893 17.253 5.324 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.210 15.510 4.511 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -10.529 17.170 4.974 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -8.450 17.551 3.252 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -9.150 16.097 2.568 1.00 0.00 H new ATOM 871 N LYS A 55 -8.622 17.725 7.627 1.00 0.00 N ATOM 872 CA LYS A 55 -9.016 18.046 8.986 1.00 0.00 C ATOM 873 C LYS A 55 -10.530 18.196 9.099 1.00 0.00 C ATOM 874 O LYS A 55 -11.079 19.265 8.832 1.00 0.00 O ATOM 875 CB LYS A 55 -8.329 19.332 9.448 1.00 0.00 C ATOM 876 CG LYS A 55 -6.855 19.151 9.774 1.00 0.00 C ATOM 877 CD LYS A 55 -6.418 20.065 10.907 1.00 0.00 C ATOM 878 CE LYS A 55 -5.087 19.625 11.496 1.00 0.00 C ATOM 879 NZ LYS A 55 -4.253 20.785 11.915 1.00 0.00 N ATOM 0 H LYS A 55 -7.956 18.380 7.218 1.00 0.00 H new ATOM 0 HA LYS A 55 -8.704 17.223 9.629 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -8.430 20.088 8.669 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -8.844 19.712 10.330 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -6.667 18.113 10.049 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -6.257 19.359 8.887 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -6.334 21.088 10.539 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -7.179 20.068 11.687 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -5.266 18.978 12.355 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -4.542 19.034 10.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -3.355 20.442 12.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -4.060 21.389 11.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -4.761 21.335 12.636 1.00 0.00 H new ATOM 983 N MET B 1 1.607 13.189 5.599 1.00 0.00 N ATOM 984 CA MET B 1 1.576 11.786 6.088 1.00 0.00 C ATOM 985 C MET B 1 0.268 11.482 6.811 1.00 0.00 C ATOM 986 O MET B 1 -0.224 12.294 7.595 1.00 0.00 O ATOM 987 CB MET B 1 2.761 11.573 7.034 1.00 0.00 C ATOM 988 CG MET B 1 4.019 11.080 6.339 1.00 0.00 C ATOM 989 SD MET B 1 3.960 9.317 5.965 1.00 0.00 S ATOM 990 CE MET B 1 5.113 8.675 7.177 1.00 0.00 C ATOM 0 H1 MET B 1 2.508 13.367 5.111 1.00 0.00 H new ATOM 0 H2 MET B 1 0.819 13.344 4.938 1.00 0.00 H new ATOM 0 H3 MET B 1 1.515 13.840 6.405 1.00 0.00 H new ATOM 0 HA MET B 1 1.646 11.110 5.236 1.00 0.00 H new ATOM 0 HB2 MET B 1 2.982 12.512 7.542 1.00 0.00 H new ATOM 0 HB3 MET B 1 2.476 10.854 7.802 1.00 0.00 H new ATOM 0 HG2 MET B 1 4.161 11.639 5.414 1.00 0.00 H new ATOM 0 HG3 MET B 1 4.883 11.285 6.971 1.00 0.00 H new ATOM 0 HE1 MET B 1 4.921 7.614 7.336 1.00 0.00 H new ATOM 0 HE2 MET B 1 6.133 8.809 6.816 1.00 0.00 H new ATOM 0 HE3 MET B 1 4.988 9.211 8.118 1.00 0.00 H new ATOM 1002 N LEU B 2 -0.290 10.308 6.540 1.00 0.00 N ATOM 1003 CA LEU B 2 -1.542 9.891 7.160 1.00 0.00 C ATOM 1004 C LEU B 2 -1.329 8.651 8.024 1.00 0.00 C ATOM 1005 O LEU B 2 -1.187 7.543 7.507 1.00 0.00 O ATOM 1006 CB LEU B 2 -2.592 9.601 6.084 1.00 0.00 C ATOM 1007 CG LEU B 2 -3.061 10.822 5.287 1.00 0.00 C ATOM 1008 CD1 LEU B 2 -1.895 11.461 4.548 1.00 0.00 C ATOM 1009 CD2 LEU B 2 -4.163 10.430 4.312 1.00 0.00 C ATOM 0 H LEU B 2 0.106 9.626 5.893 1.00 0.00 H new ATOM 0 HA LEU B 2 -1.896 10.702 7.797 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -2.184 8.868 5.389 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -3.459 9.142 6.559 1.00 0.00 H new ATOM 0 HG LEU B 2 -3.464 11.555 5.986 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -2.249 12.326 3.988 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -1.139 11.778 5.266 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -1.460 10.737 3.859 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -4.485 11.309 3.754 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -3.785 9.678 3.619 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -5.009 10.021 4.864 1.00 0.00 H new ATOM 1021 N ILE B 3 -1.314 8.839 9.342 1.00 0.00 N ATOM 1022 CA ILE B 3 -1.123 7.724 10.264 1.00 0.00 C ATOM 1023 C ILE B 3 -2.465 7.215 10.781 1.00 0.00 C ATOM 1024 O ILE B 3 -3.096 7.843 11.632 1.00 0.00 O ATOM 1025 CB ILE B 3 -0.232 8.125 11.460 1.00 0.00 C ATOM 1026 CG1 ILE B 3 1.140 8.599 10.967 1.00 0.00 C ATOM 1027 CG2 ILE B 3 -0.082 6.962 12.433 1.00 0.00 C ATOM 1028 CD1 ILE B 3 2.033 7.477 10.470 1.00 0.00 C ATOM 0 H ILE B 3 -1.431 9.747 9.792 1.00 0.00 H new ATOM 0 HA ILE B 3 -0.624 6.929 9.710 1.00 0.00 H new ATOM 0 HB ILE B 3 -0.713 8.949 11.988 1.00 0.00 H new ATOM 0 HG12 ILE B 3 0.997 9.321 10.163 1.00 0.00 H new ATOM 0 HG13 ILE B 3 1.647 9.122 11.778 1.00 0.00 H new ATOM 0 HG21 ILE B 3 0.549 7.265 13.268 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -1.064 6.672 12.807 1.00 0.00 H new ATOM 0 HG23 ILE B 3 0.376 6.116 11.921 1.00 0.00 H new ATOM 0 HD11 ILE B 3 2.986 7.890 10.138 1.00 0.00 H new ATOM 0 HD12 ILE B 3 2.207 6.766 11.278 1.00 0.00 H new ATOM 0 HD13 ILE B 3 1.548 6.968 9.637 1.00 0.00 H new ATOM 1040 N LEU B 4 -2.886 6.066 10.266 1.00 0.00 N ATOM 1041 CA LEU B 4 -4.143 5.452 10.674 1.00 0.00 C ATOM 1042 C LEU B 4 -3.920 4.025 11.161 1.00 0.00 C ATOM 1043 O LEU B 4 -3.493 3.163 10.392 1.00 0.00 O ATOM 1044 CB LEU B 4 -5.137 5.455 9.512 1.00 0.00 C ATOM 1045 CG LEU B 4 -6.611 5.478 9.919 1.00 0.00 C ATOM 1046 CD1 LEU B 4 -7.010 4.154 10.550 1.00 0.00 C ATOM 1047 CD2 LEU B 4 -6.883 6.630 10.875 1.00 0.00 C ATOM 0 H LEU B 4 -2.371 5.538 9.561 1.00 0.00 H new ATOM 0 HA LEU B 4 -4.553 6.038 11.497 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -4.936 6.323 8.884 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -4.959 4.571 8.900 1.00 0.00 H new ATOM 0 HG LEU B 4 -7.213 5.627 9.023 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -8.062 4.188 10.833 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -6.853 3.348 9.834 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -6.401 3.975 11.436 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -7.937 6.630 11.154 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -6.271 6.513 11.769 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -6.636 7.573 10.388 1.00 0.00 H new ATOM 1059 N THR B 5 -4.208 3.769 12.434 1.00 0.00 N ATOM 1060 CA THR B 5 -4.033 2.430 12.986 1.00 0.00 C ATOM 1061 C THR B 5 -4.796 1.408 12.153 1.00 0.00 C ATOM 1062 O THR B 5 -5.911 1.669 11.702 1.00 0.00 O ATOM 1063 CB THR B 5 -4.499 2.375 14.440 1.00 0.00 C ATOM 1064 OG1 THR B 5 -4.617 3.678 14.983 1.00 0.00 O ATOM 1065 CG2 THR B 5 -3.561 1.588 15.329 1.00 0.00 C ATOM 0 H THR B 5 -4.559 4.462 13.095 1.00 0.00 H new ATOM 0 HA THR B 5 -2.971 2.188 12.956 1.00 0.00 H new ATOM 0 HB THR B 5 -5.467 1.874 14.418 1.00 0.00 H new ATOM 0 HG1 THR B 5 -4.918 3.619 15.914 1.00 0.00 H new ATOM 0 HG21 THR B 5 -3.944 1.584 16.349 1.00 0.00 H new ATOM 0 HG22 THR B 5 -3.489 0.563 14.965 1.00 0.00 H new ATOM 0 HG23 THR B 5 -2.573 2.049 15.314 1.00 0.00 H new ATOM 1073 N ARG B 6 -4.188 0.246 11.949 1.00 0.00 N ATOM 1074 CA ARG B 6 -4.811 -0.809 11.162 1.00 0.00 C ATOM 1075 C ARG B 6 -4.278 -2.181 11.559 1.00 0.00 C ATOM 1076 O ARG B 6 -3.086 -2.341 11.827 1.00 0.00 O ATOM 1077 CB ARG B 6 -4.560 -0.568 9.673 1.00 0.00 C ATOM 1078 CG ARG B 6 -5.471 0.484 9.058 1.00 0.00 C ATOM 1079 CD ARG B 6 -5.100 0.770 7.611 1.00 0.00 C ATOM 1080 NE ARG B 6 -5.295 2.176 7.265 1.00 0.00 N ATOM 1081 CZ ARG B 6 -5.419 2.623 6.017 1.00 0.00 C ATOM 1082 NH1 ARG B 6 -5.362 1.780 4.993 1.00 0.00 N ATOM 1083 NH2 ARG B 6 -5.599 3.917 5.791 1.00 0.00 N ATOM 0 H ARG B 6 -3.266 0.011 12.317 1.00 0.00 H new ATOM 0 HA ARG B 6 -5.883 -0.789 11.359 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -3.523 -0.263 9.534 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -4.691 -1.507 9.136 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -6.506 0.145 9.109 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -5.409 1.404 9.639 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -4.059 0.496 7.443 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -5.704 0.147 6.952 1.00 0.00 H new ATOM 0 HE ARG B 6 -5.339 2.855 8.025 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -5.223 0.783 5.160 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -5.458 2.129 4.039 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -5.642 4.570 6.573 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -5.694 4.259 4.835 1.00 0.00 H new ATOM 1097 N ARG B 7 -5.171 -3.167 11.591 1.00 0.00 N ATOM 1098 CA ARG B 7 -4.794 -4.534 11.950 1.00 0.00 C ATOM 1099 C ARG B 7 -5.994 -5.490 11.939 1.00 0.00 C ATOM 1100 O ARG B 7 -5.858 -6.660 12.298 1.00 0.00 O ATOM 1101 CB ARG B 7 -4.133 -4.553 13.331 1.00 0.00 C ATOM 1102 CG ARG B 7 -3.587 -5.916 13.730 1.00 0.00 C ATOM 1103 CD ARG B 7 -4.213 -6.411 15.025 1.00 0.00 C ATOM 1104 NE ARG B 7 -5.412 -7.210 14.786 1.00 0.00 N ATOM 1105 CZ ARG B 7 -6.005 -7.955 15.716 1.00 0.00 C ATOM 1106 NH1 ARG B 7 -5.517 -8.001 16.949 1.00 0.00 N ATOM 1107 NH2 ARG B 7 -7.090 -8.654 15.412 1.00 0.00 N ATOM 0 H ARG B 7 -6.160 -3.046 11.373 1.00 0.00 H new ATOM 0 HA ARG B 7 -4.088 -4.881 11.196 1.00 0.00 H new ATOM 0 HB2 ARG B 7 -3.320 -3.828 13.344 1.00 0.00 H new ATOM 0 HB3 ARG B 7 -4.860 -4.230 14.076 1.00 0.00 H new ATOM 0 HG2 ARG B 7 -3.781 -6.634 12.933 1.00 0.00 H new ATOM 0 HG3 ARG B 7 -2.505 -5.855 13.848 1.00 0.00 H new ATOM 0 HD2 ARG B 7 -3.484 -7.007 15.575 1.00 0.00 H new ATOM 0 HD3 ARG B 7 -4.466 -5.558 15.654 1.00 0.00 H new ATOM 0 HE ARG B 7 -5.819 -7.196 13.851 1.00 0.00 H new ATOM 0 HH11 ARG B 7 -4.684 -7.464 17.188 1.00 0.00 H new ATOM 0 HH12 ARG B 7 -5.975 -8.574 17.658 1.00 0.00 H new ATOM 0 HH21 ARG B 7 -7.470 -8.621 14.466 1.00 0.00 H new ATOM 0 HH22 ARG B 7 -7.545 -9.225 16.124 1.00 0.00 H new ATOM 1121 N VAL B 8 -7.167 -5.004 11.533 1.00 0.00 N ATOM 1122 CA VAL B 8 -8.360 -5.843 11.495 1.00 0.00 C ATOM 1123 C VAL B 8 -8.992 -5.857 10.104 1.00 0.00 C ATOM 1124 O VAL B 8 -8.854 -6.830 9.362 1.00 0.00 O ATOM 1125 CB VAL B 8 -9.405 -5.378 12.529 1.00 0.00 C ATOM 1126 CG1 VAL B 8 -10.611 -6.307 12.532 1.00 0.00 C ATOM 1127 CG2 VAL B 8 -8.783 -5.301 13.915 1.00 0.00 C ATOM 0 H VAL B 8 -7.314 -4.042 11.229 1.00 0.00 H new ATOM 0 HA VAL B 8 -8.041 -6.855 11.744 1.00 0.00 H new ATOM 0 HB VAL B 8 -9.746 -4.381 12.248 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -11.336 -5.960 13.269 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -11.071 -6.309 11.544 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -10.291 -7.318 12.786 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -9.534 -4.971 14.633 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -8.413 -6.285 14.203 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -7.956 -4.591 13.904 1.00 0.00 H new ATOM 1137 N GLY B 9 -9.689 -4.779 9.755 1.00 0.00 N ATOM 1138 CA GLY B 9 -10.332 -4.703 8.455 1.00 0.00 C ATOM 1139 C GLY B 9 -9.946 -3.455 7.684 1.00 0.00 C ATOM 1140 O GLY B 9 -10.508 -2.382 7.904 1.00 0.00 O ATOM 0 H GLY B 9 -9.820 -3.959 10.347 1.00 0.00 H new ATOM 0 HA2 GLY B 9 -10.066 -5.583 7.870 1.00 0.00 H new ATOM 0 HA3 GLY B 9 -11.414 -4.724 8.587 1.00 0.00 H new ATOM 1144 N GLU B 10 -8.984 -3.597 6.778 1.00 0.00 N ATOM 1145 CA GLU B 10 -8.521 -2.474 5.969 1.00 0.00 C ATOM 1146 C GLU B 10 -8.878 -2.673 4.501 1.00 0.00 C ATOM 1147 O GLU B 10 -9.385 -3.725 4.114 1.00 0.00 O ATOM 1148 CB GLU B 10 -7.011 -2.305 6.118 1.00 0.00 C ATOM 1149 CG GLU B 10 -6.568 -2.078 7.551 1.00 0.00 C ATOM 1150 CD GLU B 10 -6.622 -3.343 8.386 1.00 0.00 C ATOM 1151 OE1 GLU B 10 -5.884 -4.298 8.067 1.00 0.00 O ATOM 1152 OE2 GLU B 10 -7.405 -3.378 9.359 1.00 0.00 O ATOM 0 H GLU B 10 -8.509 -4.479 6.585 1.00 0.00 H new ATOM 0 HA GLU B 10 -9.021 -1.573 6.325 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -6.513 -3.193 5.728 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -6.685 -1.463 5.507 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -5.550 -1.688 7.555 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -7.203 -1.318 8.008 1.00 0.00 H new ATOM 1159 N THR B 11 -8.599 -1.655 3.687 1.00 0.00 N ATOM 1160 CA THR B 11 -8.879 -1.709 2.252 1.00 0.00 C ATOM 1161 C THR B 11 -8.820 -0.318 1.627 1.00 0.00 C ATOM 1162 O THR B 11 -9.825 0.391 1.579 1.00 0.00 O ATOM 1163 CB THR B 11 -10.257 -2.328 1.988 1.00 0.00 C ATOM 1164 OG1 THR B 11 -10.696 -2.035 0.673 1.00 0.00 O ATOM 1165 CG2 THR B 11 -11.326 -1.847 2.945 1.00 0.00 C ATOM 0 H THR B 11 -8.178 -0.780 3.998 1.00 0.00 H new ATOM 0 HA THR B 11 -8.112 -2.334 1.794 1.00 0.00 H new ATOM 0 HB THR B 11 -10.121 -3.400 2.131 1.00 0.00 H new ATOM 0 HG1 THR B 11 -11.576 -2.440 0.524 1.00 0.00 H new ATOM 0 HG21 THR B 11 -12.275 -2.325 2.701 1.00 0.00 H new ATOM 0 HG22 THR B 11 -11.043 -2.104 3.966 1.00 0.00 H new ATOM 0 HG23 THR B 11 -11.432 -0.766 2.859 1.00 0.00 H new ATOM 1173 N LEU B 12 -7.645 0.062 1.131 1.00 0.00 N ATOM 1174 CA LEU B 12 -7.478 1.363 0.490 1.00 0.00 C ATOM 1175 C LEU B 12 -7.215 1.179 -1.001 1.00 0.00 C ATOM 1176 O LEU B 12 -6.715 0.136 -1.422 1.00 0.00 O ATOM 1177 CB LEU B 12 -6.347 2.162 1.158 1.00 0.00 C ATOM 1178 CG LEU B 12 -4.933 1.917 0.615 1.00 0.00 C ATOM 1179 CD1 LEU B 12 -4.128 3.208 0.626 1.00 0.00 C ATOM 1180 CD2 LEU B 12 -4.230 0.845 1.430 1.00 0.00 C ATOM 0 H LEU B 12 -6.800 -0.508 1.160 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.399 1.934 0.611 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -6.573 3.224 1.059 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -6.349 1.934 2.224 1.00 0.00 H new ATOM 0 HG LEU B 12 -5.014 1.570 -0.415 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -3.128 3.016 0.238 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -4.624 3.951 0.001 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -4.055 3.583 1.647 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -3.228 0.683 1.032 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -4.160 1.166 2.469 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -4.797 -0.084 1.375 1.00 0.00 H new ATOM 1192 N MET B 13 -7.558 2.183 -1.802 1.00 0.00 N ATOM 1193 CA MET B 13 -7.355 2.092 -3.241 1.00 0.00 C ATOM 1194 C MET B 13 -6.708 3.351 -3.801 1.00 0.00 C ATOM 1195 O MET B 13 -7.376 4.360 -4.028 1.00 0.00 O ATOM 1196 CB MET B 13 -8.686 1.828 -3.945 1.00 0.00 C ATOM 1197 CG MET B 13 -8.556 1.654 -5.449 1.00 0.00 C ATOM 1198 SD MET B 13 -10.008 2.240 -6.344 1.00 0.00 S ATOM 1199 CE MET B 13 -9.386 3.772 -7.033 1.00 0.00 C ATOM 0 H MET B 13 -7.973 3.058 -1.483 1.00 0.00 H new ATOM 0 HA MET B 13 -6.676 1.260 -3.427 1.00 0.00 H new ATOM 0 HB2 MET B 13 -9.139 0.932 -3.522 1.00 0.00 H new ATOM 0 HB3 MET B 13 -9.366 2.655 -3.741 1.00 0.00 H new ATOM 0 HG2 MET B 13 -7.676 2.194 -5.799 1.00 0.00 H new ATOM 0 HG3 MET B 13 -8.395 0.600 -5.676 1.00 0.00 H new ATOM 0 HE1 MET B 13 -10.171 4.254 -7.616 1.00 0.00 H new ATOM 0 HE2 MET B 13 -9.075 4.435 -6.225 1.00 0.00 H new ATOM 0 HE3 MET B 13 -8.533 3.561 -7.678 1.00 0.00 H new ATOM 1209 N ILE B 14 -5.405 3.275 -4.035 1.00 0.00 N ATOM 1210 CA ILE B 14 -4.656 4.390 -4.584 1.00 0.00 C ATOM 1211 C ILE B 14 -4.132 4.039 -5.976 1.00 0.00 C ATOM 1212 O ILE B 14 -3.385 3.075 -6.141 1.00 0.00 O ATOM 1213 CB ILE B 14 -3.475 4.773 -3.668 1.00 0.00 C ATOM 1214 CG1 ILE B 14 -2.646 5.900 -4.292 1.00 0.00 C ATOM 1215 CG2 ILE B 14 -2.603 3.557 -3.389 1.00 0.00 C ATOM 1216 CD1 ILE B 14 -3.453 7.136 -4.614 1.00 0.00 C ATOM 0 H ILE B 14 -4.843 2.444 -3.850 1.00 0.00 H new ATOM 0 HA ILE B 14 -5.330 5.244 -4.654 1.00 0.00 H new ATOM 0 HB ILE B 14 -3.878 5.133 -2.722 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -1.841 6.169 -3.608 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -2.178 5.533 -5.206 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -1.775 3.844 -2.742 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -3.198 2.788 -2.897 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -2.211 3.167 -4.328 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -2.802 7.892 -5.053 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -4.242 6.881 -5.322 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -3.899 7.528 -3.700 1.00 0.00 H new ATOM 1228 N GLY B 15 -4.529 4.820 -6.975 1.00 0.00 N ATOM 1229 CA GLY B 15 -4.093 4.565 -8.336 1.00 0.00 C ATOM 1230 C GLY B 15 -5.231 4.684 -9.331 1.00 0.00 C ATOM 1231 O GLY B 15 -5.690 5.787 -9.628 1.00 0.00 O ATOM 0 H GLY B 15 -5.145 5.626 -6.867 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -3.305 5.269 -8.602 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -3.662 3.566 -8.397 1.00 0.00 H new ATOM 1235 N ASP B 16 -5.691 3.547 -9.846 1.00 0.00 N ATOM 1236 CA ASP B 16 -6.788 3.538 -10.811 1.00 0.00 C ATOM 1237 C ASP B 16 -7.585 2.231 -10.765 1.00 0.00 C ATOM 1238 O ASP B 16 -8.470 2.017 -11.593 1.00 0.00 O ATOM 1239 CB ASP B 16 -6.246 3.764 -12.224 1.00 0.00 C ATOM 1240 CG ASP B 16 -7.128 4.690 -13.039 1.00 0.00 C ATOM 1241 OD1 ASP B 16 -7.103 5.912 -12.782 1.00 0.00 O ATOM 1242 OD2 ASP B 16 -7.844 4.193 -13.933 1.00 0.00 O ATOM 0 H ASP B 16 -5.324 2.624 -9.613 1.00 0.00 H new ATOM 0 HA ASP B 16 -7.465 4.348 -10.541 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -5.242 4.184 -12.162 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -6.160 2.805 -12.735 1.00 0.00 H new ATOM 1247 N GLU B 17 -7.273 1.364 -9.796 1.00 0.00 N ATOM 1248 CA GLU B 17 -7.962 0.079 -9.640 1.00 0.00 C ATOM 1249 C GLU B 17 -7.102 -0.888 -8.829 1.00 0.00 C ATOM 1250 O GLU B 17 -6.658 -1.919 -9.336 1.00 0.00 O ATOM 1251 CB GLU B 17 -8.294 -0.541 -11.005 1.00 0.00 C ATOM 1252 CG GLU B 17 -9.750 -0.375 -11.411 1.00 0.00 C ATOM 1253 CD GLU B 17 -9.924 -0.239 -12.910 1.00 0.00 C ATOM 1254 OE1 GLU B 17 -9.060 -0.745 -13.657 1.00 0.00 O ATOM 1255 OE2 GLU B 17 -10.924 0.376 -13.339 1.00 0.00 O ATOM 0 H GLU B 17 -6.543 1.531 -9.104 1.00 0.00 H new ATOM 0 HA GLU B 17 -8.896 0.263 -9.109 1.00 0.00 H new ATOM 0 HB2 GLU B 17 -7.659 -0.086 -11.765 1.00 0.00 H new ATOM 0 HB3 GLU B 17 -8.051 -1.603 -10.981 1.00 0.00 H new ATOM 0 HG2 GLU B 17 -10.322 -1.233 -11.059 1.00 0.00 H new ATOM 0 HG3 GLU B 17 -10.162 0.506 -10.919 1.00 0.00 H new ATOM 1262 N VAL B 18 -6.857 -0.543 -7.570 1.00 0.00 N ATOM 1263 CA VAL B 18 -6.044 -1.364 -6.698 1.00 0.00 C ATOM 1264 C VAL B 18 -6.842 -1.850 -5.482 1.00 0.00 C ATOM 1265 O VAL B 18 -8.072 -1.882 -5.508 1.00 0.00 O ATOM 1266 CB VAL B 18 -4.809 -0.576 -6.232 1.00 0.00 C ATOM 1267 CG1 VAL B 18 -4.060 0.001 -7.424 1.00 0.00 C ATOM 1268 CG2 VAL B 18 -5.206 0.525 -5.258 1.00 0.00 C ATOM 0 H VAL B 18 -7.215 0.307 -7.134 1.00 0.00 H new ATOM 0 HA VAL B 18 -5.724 -2.239 -7.264 1.00 0.00 H new ATOM 0 HB VAL B 18 -4.143 -1.263 -5.711 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -3.189 0.555 -7.073 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -3.736 -0.809 -8.077 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -4.718 0.671 -7.977 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -4.316 1.069 -4.942 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -5.897 1.212 -5.747 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -5.690 0.083 -4.387 1.00 0.00 H new ATOM 1278 N THR B 19 -6.128 -2.224 -4.421 1.00 0.00 N ATOM 1279 CA THR B 19 -6.744 -2.707 -3.188 1.00 0.00 C ATOM 1280 C THR B 19 -5.669 -3.277 -2.270 1.00 0.00 C ATOM 1281 O THR B 19 -5.163 -4.369 -2.504 1.00 0.00 O ATOM 1282 CB THR B 19 -7.797 -3.780 -3.485 1.00 0.00 C ATOM 1283 OG1 THR B 19 -7.588 -4.351 -4.764 1.00 0.00 O ATOM 1284 CG2 THR B 19 -9.216 -3.256 -3.443 1.00 0.00 C ATOM 0 H THR B 19 -5.109 -2.200 -4.393 1.00 0.00 H new ATOM 0 HA THR B 19 -7.240 -1.869 -2.697 1.00 0.00 H new ATOM 0 HB THR B 19 -7.678 -4.524 -2.697 1.00 0.00 H new ATOM 0 HG1 THR B 19 -8.270 -5.034 -4.933 1.00 0.00 H new ATOM 0 HG21 THR B 19 -9.910 -4.067 -3.662 1.00 0.00 H new ATOM 0 HG22 THR B 19 -9.427 -2.856 -2.451 1.00 0.00 H new ATOM 0 HG23 THR B 19 -9.335 -2.467 -4.185 1.00 0.00 H new ATOM 1292 N VAL B 20 -5.309 -2.532 -1.233 1.00 0.00 N ATOM 1293 CA VAL B 20 -4.277 -2.984 -0.307 1.00 0.00 C ATOM 1294 C VAL B 20 -4.824 -3.158 1.109 1.00 0.00 C ATOM 1295 O VAL B 20 -5.256 -2.193 1.742 1.00 0.00 O ATOM 1296 CB VAL B 20 -3.094 -1.999 -0.266 1.00 0.00 C ATOM 1297 CG1 VAL B 20 -1.947 -2.569 0.554 1.00 0.00 C ATOM 1298 CG2 VAL B 20 -2.632 -1.659 -1.675 1.00 0.00 C ATOM 0 H VAL B 20 -5.711 -1.621 -1.012 1.00 0.00 H new ATOM 0 HA VAL B 20 -3.933 -3.951 -0.675 1.00 0.00 H new ATOM 0 HB VAL B 20 -3.430 -1.080 0.214 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -1.122 -1.857 0.570 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -2.286 -2.755 1.573 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -1.610 -3.505 0.107 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -1.796 -0.962 -1.625 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -2.316 -2.570 -2.184 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -3.453 -1.202 -2.227 1.00 0.00 H new ATOM 1308 N THR B 21 -4.806 -4.397 1.595 1.00 0.00 N ATOM 1309 CA THR B 21 -5.299 -4.705 2.935 1.00 0.00 C ATOM 1310 C THR B 21 -4.165 -5.190 3.838 1.00 0.00 C ATOM 1311 O THR B 21 -3.569 -6.242 3.597 1.00 0.00 O ATOM 1312 CB THR B 21 -6.398 -5.765 2.863 1.00 0.00 C ATOM 1313 OG1 THR B 21 -6.762 -6.199 4.162 1.00 0.00 O ATOM 1314 CG2 THR B 21 -6.000 -6.988 2.065 1.00 0.00 C ATOM 0 H THR B 21 -4.455 -5.205 1.080 1.00 0.00 H new ATOM 0 HA THR B 21 -5.711 -3.791 3.362 1.00 0.00 H new ATOM 0 HB THR B 21 -7.234 -5.280 2.360 1.00 0.00 H new ATOM 0 HG1 THR B 21 -7.467 -6.876 4.095 1.00 0.00 H new ATOM 0 HG21 THR B 21 -6.825 -7.700 2.054 1.00 0.00 H new ATOM 0 HG22 THR B 21 -5.761 -6.694 1.043 1.00 0.00 H new ATOM 0 HG23 THR B 21 -5.126 -7.452 2.522 1.00 0.00 H new ATOM 1322 N VAL B 22 -3.869 -4.418 4.879 1.00 0.00 N ATOM 1323 CA VAL B 22 -2.805 -4.771 5.813 1.00 0.00 C ATOM 1324 C VAL B 22 -3.283 -5.797 6.838 1.00 0.00 C ATOM 1325 O VAL B 22 -3.491 -5.475 8.008 1.00 0.00 O ATOM 1326 CB VAL B 22 -2.266 -3.529 6.551 1.00 0.00 C ATOM 1327 CG1 VAL B 22 -1.624 -2.559 5.571 1.00 0.00 C ATOM 1328 CG2 VAL B 22 -3.376 -2.849 7.338 1.00 0.00 C ATOM 0 H VAL B 22 -4.350 -3.545 5.097 1.00 0.00 H new ATOM 0 HA VAL B 22 -2.000 -5.207 5.221 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.501 -3.854 7.256 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -1.250 -1.690 6.112 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -0.797 -3.052 5.060 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -2.364 -2.239 4.838 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -2.975 -1.975 7.851 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -4.168 -2.538 6.656 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -3.782 -3.546 8.071 1.00 0.00 H new ATOM 1338 N LEU B 23 -3.451 -7.037 6.390 1.00 0.00 N ATOM 1339 CA LEU B 23 -3.900 -8.113 7.267 1.00 0.00 C ATOM 1340 C LEU B 23 -2.699 -8.796 7.938 1.00 0.00 C ATOM 1341 O LEU B 23 -1.785 -8.116 8.405 1.00 0.00 O ATOM 1342 CB LEU B 23 -4.739 -9.121 6.465 1.00 0.00 C ATOM 1343 CG LEU B 23 -5.697 -10.012 7.278 1.00 0.00 C ATOM 1344 CD1 LEU B 23 -5.685 -9.649 8.760 1.00 0.00 C ATOM 1345 CD2 LEU B 23 -7.110 -9.918 6.722 1.00 0.00 C ATOM 0 H LEU B 23 -3.283 -7.322 5.425 1.00 0.00 H new ATOM 0 HA LEU B 23 -4.526 -7.696 8.056 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -5.326 -8.570 5.730 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -4.059 -9.767 5.910 1.00 0.00 H new ATOM 0 HG LEU B 23 -5.347 -11.040 7.187 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -6.373 -10.300 9.300 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -4.678 -9.776 9.158 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -5.995 -8.611 8.883 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -7.774 -10.553 7.308 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -7.454 -8.885 6.776 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -7.115 -10.248 5.683 1.00 0.00 H new ATOM 1357 N GLY B 24 -2.698 -10.132 7.990 1.00 0.00 N ATOM 1358 CA GLY B 24 -1.598 -10.855 8.608 1.00 0.00 C ATOM 1359 C GLY B 24 -1.187 -10.275 9.949 1.00 0.00 C ATOM 1360 O GLY B 24 -0.155 -9.614 10.054 1.00 0.00 O ATOM 0 H GLY B 24 -3.440 -10.723 7.615 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -1.886 -11.898 8.742 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -0.740 -10.845 7.936 1.00 0.00 H new ATOM 1364 N VAL B 25 -1.997 -10.516 10.974 1.00 0.00 N ATOM 1365 CA VAL B 25 -1.708 -10.006 12.303 1.00 0.00 C ATOM 1366 C VAL B 25 -0.789 -10.948 13.075 1.00 0.00 C ATOM 1367 O VAL B 25 -1.201 -12.029 13.496 1.00 0.00 O ATOM 1368 CB VAL B 25 -2.999 -9.792 13.115 1.00 0.00 C ATOM 1369 CG1 VAL B 25 -2.697 -9.069 14.419 1.00 0.00 C ATOM 1370 CG2 VAL B 25 -4.026 -9.024 12.296 1.00 0.00 C ATOM 0 H VAL B 25 -2.857 -11.061 10.907 1.00 0.00 H new ATOM 0 HA VAL B 25 -1.206 -9.048 12.166 1.00 0.00 H new ATOM 0 HB VAL B 25 -3.419 -10.768 13.357 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -3.621 -8.927 14.979 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -2.001 -9.663 15.012 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -2.251 -8.098 14.202 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -4.931 -8.883 12.887 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -3.618 -8.052 12.020 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -4.266 -9.586 11.394 1.00 0.00 H new ATOM 1380 N LYS B 26 0.459 -10.528 13.254 1.00 0.00 N ATOM 1381 CA LYS B 26 1.441 -11.333 13.973 1.00 0.00 C ATOM 1382 C LYS B 26 2.318 -10.460 14.865 1.00 0.00 C ATOM 1383 O LYS B 26 2.517 -9.277 14.591 1.00 0.00 O ATOM 1384 CB LYS B 26 2.312 -12.113 12.986 1.00 0.00 C ATOM 1385 CG LYS B 26 1.799 -13.514 12.698 1.00 0.00 C ATOM 1386 CD LYS B 26 2.160 -14.480 13.815 1.00 0.00 C ATOM 1387 CE LYS B 26 1.065 -15.512 14.035 1.00 0.00 C ATOM 1388 NZ LYS B 26 1.595 -16.763 14.645 1.00 0.00 N ATOM 0 H LYS B 26 0.815 -9.635 12.911 1.00 0.00 H new ATOM 0 HA LYS B 26 0.901 -12.037 14.607 1.00 0.00 H new ATOM 0 HB2 LYS B 26 2.372 -11.558 12.050 1.00 0.00 H new ATOM 0 HB3 LYS B 26 3.325 -12.180 13.383 1.00 0.00 H new ATOM 0 HG2 LYS B 26 0.716 -13.488 12.574 1.00 0.00 H new ATOM 0 HG3 LYS B 26 2.219 -13.870 11.757 1.00 0.00 H new ATOM 0 HD2 LYS B 26 3.095 -14.986 13.572 1.00 0.00 H new ATOM 0 HD3 LYS B 26 2.329 -13.924 14.738 1.00 0.00 H new ATOM 0 HE2 LYS B 26 0.294 -15.091 14.681 1.00 0.00 H new ATOM 0 HE3 LYS B 26 0.590 -15.746 13.082 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 0.817 -17.441 14.779 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 2.312 -17.179 14.017 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 2.026 -16.545 15.566 1.00 0.00 H new ATOM 1402 N GLY B 27 2.840 -11.055 15.933 1.00 0.00 N ATOM 1403 CA GLY B 27 3.691 -10.320 16.850 1.00 0.00 C ATOM 1404 C GLY B 27 4.954 -9.809 16.185 1.00 0.00 C ATOM 1405 O GLY B 27 5.463 -10.425 15.249 1.00 0.00 O ATOM 0 H GLY B 27 2.689 -12.033 16.180 1.00 0.00 H new ATOM 0 HA2 GLY B 27 3.135 -9.478 17.262 1.00 0.00 H new ATOM 0 HA3 GLY B 27 3.960 -10.964 17.687 1.00 0.00 H new ATOM 1409 N ASN B 28 5.457 -8.677 16.668 1.00 0.00 N ATOM 1410 CA ASN B 28 6.666 -8.074 16.115 1.00 0.00 C ATOM 1411 C ASN B 28 6.406 -7.534 14.710 1.00 0.00 C ATOM 1412 O ASN B 28 6.132 -6.346 14.537 1.00 0.00 O ATOM 1413 CB ASN B 28 7.815 -9.090 16.092 1.00 0.00 C ATOM 1414 CG ASN B 28 8.867 -8.796 17.143 1.00 0.00 C ATOM 1415 OD1 ASN B 28 8.709 -7.891 17.962 1.00 0.00 O ATOM 1416 ND2 ASN B 28 9.951 -9.563 17.126 1.00 0.00 N ATOM 0 H ASN B 28 5.045 -8.157 17.443 1.00 0.00 H new ATOM 0 HA ASN B 28 6.954 -7.241 16.757 1.00 0.00 H new ATOM 0 HB2 ASN B 28 7.415 -10.091 16.253 1.00 0.00 H new ATOM 0 HB3 ASN B 28 8.280 -9.087 15.106 1.00 0.00 H new ATOM 0 HD21 ASN B 28 10.693 -9.413 17.810 1.00 0.00 H new ATOM 0 HD22 ASN B 28 10.042 -10.303 16.429 1.00 0.00 H new ATOM 1423 N GLN B 29 6.492 -8.407 13.710 1.00 0.00 N ATOM 1424 CA GLN B 29 6.263 -8.005 12.327 1.00 0.00 C ATOM 1425 C GLN B 29 4.928 -8.539 11.818 1.00 0.00 C ATOM 1426 O GLN B 29 4.660 -9.739 11.888 1.00 0.00 O ATOM 1427 CB GLN B 29 7.400 -8.505 11.433 1.00 0.00 C ATOM 1428 CG GLN B 29 8.762 -7.945 11.809 1.00 0.00 C ATOM 1429 CD GLN B 29 9.748 -7.989 10.659 1.00 0.00 C ATOM 1430 OE1 GLN B 29 9.369 -7.859 9.495 1.00 0.00 O ATOM 1431 NE2 GLN B 29 11.024 -8.173 10.980 1.00 0.00 N ATOM 0 H GLN B 29 6.718 -9.394 13.832 1.00 0.00 H new ATOM 0 HA GLN B 29 6.235 -6.916 12.292 1.00 0.00 H new ATOM 0 HB2 GLN B 29 7.438 -9.593 11.482 1.00 0.00 H new ATOM 0 HB3 GLN B 29 7.181 -8.240 10.399 1.00 0.00 H new ATOM 0 HG2 GLN B 29 8.647 -6.914 12.145 1.00 0.00 H new ATOM 0 HG3 GLN B 29 9.164 -8.511 12.649 1.00 0.00 H new ATOM 0 HE21 GLN B 29 11.294 -8.276 11.958 1.00 0.00 H new ATOM 0 HE22 GLN B 29 11.734 -8.211 10.248 1.00 0.00 H new ATOM 1440 N VAL B 30 4.089 -7.637 11.321 1.00 0.00 N ATOM 1441 CA VAL B 30 2.773 -8.011 10.815 1.00 0.00 C ATOM 1442 C VAL B 30 2.811 -8.276 9.315 1.00 0.00 C ATOM 1443 O VAL B 30 3.428 -7.526 8.557 1.00 0.00 O ATOM 1444 CB VAL B 30 1.729 -6.916 11.104 1.00 0.00 C ATOM 1445 CG1 VAL B 30 1.409 -6.863 12.590 1.00 0.00 C ATOM 1446 CG2 VAL B 30 2.220 -5.565 10.608 1.00 0.00 C ATOM 0 H VAL B 30 4.297 -6.640 11.258 1.00 0.00 H new ATOM 0 HA VAL B 30 2.486 -8.926 11.334 1.00 0.00 H new ATOM 0 HB VAL B 30 0.813 -7.162 10.567 1.00 0.00 H new ATOM 0 HG11 VAL B 30 0.670 -6.084 12.775 1.00 0.00 H new ATOM 0 HG12 VAL B 30 1.010 -7.825 12.911 1.00 0.00 H new ATOM 0 HG13 VAL B 30 2.318 -6.642 13.150 1.00 0.00 H new ATOM 0 HG21 VAL B 30 1.469 -4.804 10.821 1.00 0.00 H new ATOM 0 HG22 VAL B 30 3.151 -5.308 11.114 1.00 0.00 H new ATOM 0 HG23 VAL B 30 2.393 -5.613 9.533 1.00 0.00 H new ATOM 1456 N ARG B 31 2.141 -9.344 8.890 1.00 0.00 N ATOM 1457 CA ARG B 31 2.090 -9.706 7.488 1.00 0.00 C ATOM 1458 C ARG B 31 1.132 -8.790 6.736 1.00 0.00 C ATOM 1459 O ARG B 31 -0.085 -8.918 6.856 1.00 0.00 O ATOM 1460 CB ARG B 31 1.658 -11.165 7.328 1.00 0.00 C ATOM 1461 CG ARG B 31 2.821 -12.125 7.140 1.00 0.00 C ATOM 1462 CD ARG B 31 2.340 -13.557 6.978 1.00 0.00 C ATOM 1463 NE ARG B 31 3.451 -14.502 6.894 1.00 0.00 N ATOM 1464 CZ ARG B 31 4.122 -14.955 7.951 1.00 0.00 C ATOM 1465 NH1 ARG B 31 3.798 -14.552 9.174 1.00 0.00 N ATOM 1466 NH2 ARG B 31 5.119 -15.813 7.785 1.00 0.00 N ATOM 0 H ARG B 31 1.625 -9.973 9.505 1.00 0.00 H new ATOM 0 HA ARG B 31 3.088 -9.589 7.067 1.00 0.00 H new ATOM 0 HB2 ARG B 31 1.088 -11.465 8.207 1.00 0.00 H new ATOM 0 HB3 ARG B 31 0.989 -11.246 6.471 1.00 0.00 H new ATOM 0 HG2 ARG B 31 3.398 -11.832 6.263 1.00 0.00 H new ATOM 0 HG3 ARG B 31 3.490 -12.060 7.998 1.00 0.00 H new ATOM 0 HD2 ARG B 31 1.701 -13.822 7.821 1.00 0.00 H new ATOM 0 HD3 ARG B 31 1.729 -13.635 6.078 1.00 0.00 H new ATOM 0 HE ARG B 31 3.729 -14.834 5.971 1.00 0.00 H new ATOM 0 HH11 ARG B 31 3.032 -13.892 9.307 1.00 0.00 H new ATOM 0 HH12 ARG B 31 4.315 -14.902 9.980 1.00 0.00 H new ATOM 0 HH21 ARG B 31 5.372 -16.126 6.848 1.00 0.00 H new ATOM 0 HH22 ARG B 31 5.633 -16.160 8.595 1.00 0.00 H new ATOM 1480 N ILE B 32 1.688 -7.855 5.977 1.00 0.00 N ATOM 1481 CA ILE B 32 0.880 -6.904 5.225 1.00 0.00 C ATOM 1482 C ILE B 32 0.498 -7.461 3.858 1.00 0.00 C ATOM 1483 O ILE B 32 1.344 -7.972 3.126 1.00 0.00 O ATOM 1484 CB ILE B 32 1.634 -5.574 5.046 1.00 0.00 C ATOM 1485 CG1 ILE B 32 2.196 -5.104 6.391 1.00 0.00 C ATOM 1486 CG2 ILE B 32 0.719 -4.519 4.445 1.00 0.00 C ATOM 1487 CD1 ILE B 32 1.128 -4.820 7.425 1.00 0.00 C ATOM 0 H ILE B 32 2.695 -7.735 5.866 1.00 0.00 H new ATOM 0 HA ILE B 32 -0.032 -6.727 5.795 1.00 0.00 H new ATOM 0 HB ILE B 32 2.465 -5.731 4.359 1.00 0.00 H new ATOM 0 HG12 ILE B 32 2.873 -5.865 6.779 1.00 0.00 H new ATOM 0 HG13 ILE B 32 2.787 -4.202 6.234 1.00 0.00 H new ATOM 0 HG21 ILE B 32 1.269 -3.586 4.326 1.00 0.00 H new ATOM 0 HG22 ILE B 32 0.363 -4.858 3.472 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -0.132 -4.357 5.106 1.00 0.00 H new ATOM 0 HD11 ILE B 32 1.597 -4.492 8.352 1.00 0.00 H new ATOM 0 HD12 ILE B 32 0.465 -4.037 7.057 1.00 0.00 H new ATOM 0 HD13 ILE B 32 0.552 -5.726 7.611 1.00 0.00 H new ATOM 1499 N GLY B 33 -0.788 -7.365 3.522 1.00 0.00 N ATOM 1500 CA GLY B 33 -1.260 -7.871 2.248 1.00 0.00 C ATOM 1501 C GLY B 33 -1.560 -6.769 1.254 1.00 0.00 C ATOM 1502 O GLY B 33 -2.336 -5.857 1.539 1.00 0.00 O ATOM 0 H GLY B 33 -1.508 -6.946 4.110 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -0.509 -8.539 1.827 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -2.160 -8.464 2.409 1.00 0.00 H new ATOM 1506 N VAL B 34 -0.945 -6.853 0.081 1.00 0.00 N ATOM 1507 CA VAL B 34 -1.152 -5.856 -0.959 1.00 0.00 C ATOM 1508 C VAL B 34 -1.765 -6.484 -2.206 1.00 0.00 C ATOM 1509 O VAL B 34 -1.265 -7.485 -2.719 1.00 0.00 O ATOM 1510 CB VAL B 34 0.168 -5.161 -1.346 1.00 0.00 C ATOM 1511 CG1 VAL B 34 -0.104 -3.944 -2.216 1.00 0.00 C ATOM 1512 CG2 VAL B 34 0.952 -4.771 -0.102 1.00 0.00 C ATOM 0 H VAL B 34 -0.300 -7.601 -0.173 1.00 0.00 H new ATOM 0 HA VAL B 34 -1.838 -5.113 -0.552 1.00 0.00 H new ATOM 0 HB VAL B 34 0.771 -5.863 -1.922 1.00 0.00 H new ATOM 0 HG11 VAL B 34 0.840 -3.467 -2.479 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -0.619 -4.254 -3.125 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -0.728 -3.237 -1.668 1.00 0.00 H new ATOM 0 HG21 VAL B 34 1.881 -4.282 -0.396 1.00 0.00 H new ATOM 0 HG22 VAL B 34 0.357 -4.087 0.503 1.00 0.00 H new ATOM 0 HG23 VAL B 34 1.181 -5.664 0.479 1.00 0.00 H new ATOM 1522 N ASN B 35 -2.837 -5.876 -2.699 1.00 0.00 N ATOM 1523 CA ASN B 35 -3.505 -6.363 -3.900 1.00 0.00 C ATOM 1524 C ASN B 35 -3.563 -5.260 -4.950 1.00 0.00 C ATOM 1525 O ASN B 35 -4.318 -4.298 -4.818 1.00 0.00 O ATOM 1526 CB ASN B 35 -4.918 -6.857 -3.578 1.00 0.00 C ATOM 1527 CG ASN B 35 -5.359 -7.978 -4.499 1.00 0.00 C ATOM 1528 OD1 ASN B 35 -5.936 -7.734 -5.559 1.00 0.00 O ATOM 1529 ND2 ASN B 35 -5.090 -9.214 -4.098 1.00 0.00 N ATOM 0 H ASN B 35 -3.262 -5.046 -2.286 1.00 0.00 H new ATOM 0 HA ASN B 35 -2.931 -7.202 -4.294 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -4.953 -7.203 -2.545 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -5.619 -6.026 -3.659 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -5.364 -10.009 -4.676 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -4.610 -9.369 -3.212 1.00 0.00 H new ATOM 1536 N ALA B 36 -2.752 -5.405 -5.986 1.00 0.00 N ATOM 1537 CA ALA B 36 -2.700 -4.417 -7.058 1.00 0.00 C ATOM 1538 C ALA B 36 -2.480 -5.071 -8.420 1.00 0.00 C ATOM 1539 O ALA B 36 -1.755 -6.060 -8.535 1.00 0.00 O ATOM 1540 CB ALA B 36 -1.603 -3.399 -6.780 1.00 0.00 C ATOM 0 H ALA B 36 -2.120 -6.196 -6.110 1.00 0.00 H new ATOM 0 HA ALA B 36 -3.664 -3.909 -7.088 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -1.573 -2.667 -7.587 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -1.807 -2.892 -5.837 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -0.641 -3.908 -6.717 1.00 0.00 H new ATOM 1546 N PRO B 37 -3.102 -4.517 -9.477 1.00 0.00 N ATOM 1547 CA PRO B 37 -2.970 -5.039 -10.837 1.00 0.00 C ATOM 1548 C PRO B 37 -1.649 -4.636 -11.480 1.00 0.00 C ATOM 1549 O PRO B 37 -1.036 -3.642 -11.090 1.00 0.00 O ATOM 1550 CB PRO B 37 -4.141 -4.391 -11.571 1.00 0.00 C ATOM 1551 CG PRO B 37 -4.345 -3.093 -10.870 1.00 0.00 C ATOM 1552 CD PRO B 37 -3.980 -3.330 -9.427 1.00 0.00 C ATOM 0 HA PRO B 37 -2.980 -6.129 -10.865 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.914 -4.241 -12.627 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -5.034 -5.014 -11.522 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -3.721 -2.313 -11.306 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -5.379 -2.761 -10.960 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -3.466 -2.470 -8.998 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -4.864 -3.511 -8.815 1.00 0.00 H new ATOM 1560 N LYS B 38 -1.212 -5.412 -12.466 1.00 0.00 N ATOM 1561 CA LYS B 38 0.040 -5.131 -13.160 1.00 0.00 C ATOM 1562 C LYS B 38 -0.181 -4.204 -14.354 1.00 0.00 C ATOM 1563 O LYS B 38 0.451 -4.365 -15.398 1.00 0.00 O ATOM 1564 CB LYS B 38 0.688 -6.436 -13.628 1.00 0.00 C ATOM 1565 CG LYS B 38 2.196 -6.343 -13.788 1.00 0.00 C ATOM 1566 CD LYS B 38 2.687 -7.196 -14.946 1.00 0.00 C ATOM 1567 CE LYS B 38 3.971 -7.928 -14.593 1.00 0.00 C ATOM 1568 NZ LYS B 38 4.026 -9.282 -15.210 1.00 0.00 N ATOM 0 H LYS B 38 -1.705 -6.239 -12.802 1.00 0.00 H new ATOM 0 HA LYS B 38 0.705 -4.628 -12.458 1.00 0.00 H new ATOM 0 HB2 LYS B 38 0.455 -7.225 -12.913 1.00 0.00 H new ATOM 0 HB3 LYS B 38 0.247 -6.729 -14.581 1.00 0.00 H new ATOM 0 HG2 LYS B 38 2.482 -5.304 -13.953 1.00 0.00 H new ATOM 0 HG3 LYS B 38 2.681 -6.665 -12.866 1.00 0.00 H new ATOM 0 HD2 LYS B 38 1.918 -7.919 -15.219 1.00 0.00 H new ATOM 0 HD3 LYS B 38 2.855 -6.565 -15.819 1.00 0.00 H new ATOM 0 HE2 LYS B 38 4.827 -7.342 -14.927 1.00 0.00 H new ATOM 0 HE3 LYS B 38 4.051 -8.019 -13.510 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 4.917 -9.748 -14.945 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 3.224 -9.851 -14.871 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 3.976 -9.194 -16.245 1.00 0.00 H new ATOM 1582 N GLU B 39 -1.076 -3.231 -14.196 1.00 0.00 N ATOM 1583 CA GLU B 39 -1.370 -2.283 -15.264 1.00 0.00 C ATOM 1584 C GLU B 39 -0.923 -0.876 -14.878 1.00 0.00 C ATOM 1585 O GLU B 39 -0.411 -0.127 -15.710 1.00 0.00 O ATOM 1586 CB GLU B 39 -2.867 -2.285 -15.580 1.00 0.00 C ATOM 1587 CG GLU B 39 -3.449 -3.678 -15.760 1.00 0.00 C ATOM 1588 CD GLU B 39 -4.491 -3.736 -16.860 1.00 0.00 C ATOM 1589 OE1 GLU B 39 -5.307 -2.795 -16.956 1.00 0.00 O ATOM 1590 OE2 GLU B 39 -4.492 -4.723 -17.626 1.00 0.00 O ATOM 0 H GLU B 39 -1.609 -3.080 -13.339 1.00 0.00 H new ATOM 0 HA GLU B 39 -0.818 -2.591 -16.152 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -3.400 -1.779 -14.776 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -3.039 -1.708 -16.489 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -2.645 -4.377 -15.989 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -3.898 -4.005 -14.822 1.00 0.00 H new ATOM 1597 N VAL B 40 -1.116 -0.524 -13.610 1.00 0.00 N ATOM 1598 CA VAL B 40 -0.727 0.793 -13.116 1.00 0.00 C ATOM 1599 C VAL B 40 0.709 0.778 -12.604 1.00 0.00 C ATOM 1600 O VAL B 40 1.223 -0.265 -12.201 1.00 0.00 O ATOM 1601 CB VAL B 40 -1.662 1.276 -11.987 1.00 0.00 C ATOM 1602 CG1 VAL B 40 -1.413 2.744 -11.680 1.00 0.00 C ATOM 1603 CG2 VAL B 40 -3.118 1.043 -12.362 1.00 0.00 C ATOM 0 H VAL B 40 -1.538 -1.131 -12.907 1.00 0.00 H new ATOM 0 HA VAL B 40 -0.807 1.483 -13.956 1.00 0.00 H new ATOM 0 HB VAL B 40 -1.445 0.698 -11.089 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -2.081 3.067 -10.882 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -0.378 2.879 -11.364 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -1.601 3.339 -12.573 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -3.762 1.390 -11.554 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -3.351 1.593 -13.273 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -3.285 -0.021 -12.528 1.00 0.00 H new ATOM 1613 N SER B 41 1.354 1.940 -12.624 1.00 0.00 N ATOM 1614 CA SER B 41 2.733 2.056 -12.164 1.00 0.00 C ATOM 1615 C SER B 41 2.869 1.586 -10.720 1.00 0.00 C ATOM 1616 O SER B 41 2.592 2.336 -9.784 1.00 0.00 O ATOM 1617 CB SER B 41 3.214 3.503 -12.288 1.00 0.00 C ATOM 1618 OG SER B 41 4.622 3.587 -12.153 1.00 0.00 O ATOM 0 H SER B 41 0.944 2.814 -12.954 1.00 0.00 H new ATOM 0 HA SER B 41 3.353 1.418 -12.794 1.00 0.00 H new ATOM 0 HB2 SER B 41 2.914 3.908 -13.255 1.00 0.00 H new ATOM 0 HB3 SER B 41 2.735 4.115 -11.524 1.00 0.00 H new ATOM 0 HG SER B 41 4.904 4.522 -12.238 1.00 0.00 H new ATOM 1624 N VAL B 42 3.301 0.340 -10.545 1.00 0.00 N ATOM 1625 CA VAL B 42 3.479 -0.228 -9.214 1.00 0.00 C ATOM 1626 C VAL B 42 4.918 -0.701 -9.011 1.00 0.00 C ATOM 1627 O VAL B 42 5.405 -1.555 -9.751 1.00 0.00 O ATOM 1628 CB VAL B 42 2.519 -1.412 -8.981 1.00 0.00 C ATOM 1629 CG1 VAL B 42 2.833 -2.559 -9.930 1.00 0.00 C ATOM 1630 CG2 VAL B 42 2.582 -1.875 -7.534 1.00 0.00 C ATOM 0 H VAL B 42 3.534 -0.295 -11.309 1.00 0.00 H new ATOM 0 HA VAL B 42 3.254 0.559 -8.494 1.00 0.00 H new ATOM 0 HB VAL B 42 1.504 -1.073 -9.187 1.00 0.00 H new ATOM 0 HG11 VAL B 42 2.143 -3.382 -9.747 1.00 0.00 H new ATOM 0 HG12 VAL B 42 2.726 -2.219 -10.960 1.00 0.00 H new ATOM 0 HG13 VAL B 42 3.855 -2.899 -9.764 1.00 0.00 H new ATOM 0 HG21 VAL B 42 1.898 -2.711 -7.389 1.00 0.00 H new ATOM 0 HG22 VAL B 42 3.598 -2.192 -7.297 1.00 0.00 H new ATOM 0 HG23 VAL B 42 2.296 -1.054 -6.877 1.00 0.00 H new ATOM 1640 N HIS B 43 5.595 -0.146 -8.009 1.00 0.00 N ATOM 1641 CA HIS B 43 6.975 -0.522 -7.721 1.00 0.00 C ATOM 1642 C HIS B 43 7.141 -0.890 -6.249 1.00 0.00 C ATOM 1643 O HIS B 43 6.632 -0.198 -5.368 1.00 0.00 O ATOM 1644 CB HIS B 43 7.923 0.623 -8.085 1.00 0.00 C ATOM 1645 CG HIS B 43 8.649 0.410 -9.377 1.00 0.00 C ATOM 1646 ND1 HIS B 43 8.371 -0.633 -10.235 1.00 0.00 N ATOM 1647 CD2 HIS B 43 9.650 1.114 -9.959 1.00 0.00 C ATOM 1648 CE1 HIS B 43 9.167 -0.564 -11.287 1.00 0.00 C ATOM 1649 NE2 HIS B 43 9.952 0.488 -11.144 1.00 0.00 N ATOM 0 H HIS B 43 5.211 0.564 -7.385 1.00 0.00 H new ATOM 0 HA HIS B 43 7.223 -1.395 -8.325 1.00 0.00 H new ATOM 0 HB2 HIS B 43 7.353 1.550 -8.146 1.00 0.00 H new ATOM 0 HB3 HIS B 43 8.652 0.749 -7.284 1.00 0.00 H new ATOM 0 HD2 HIS B 43 10.122 2.002 -9.565 1.00 0.00 H new ATOM 0 HE1 HIS B 43 9.174 -1.250 -12.121 1.00 0.00 H new ATOM 0 HE2 HIS B 43 10.667 0.788 -11.807 1.00 0.00 H new ATOM 1657 N ARG B 44 7.861 -1.977 -5.988 1.00 0.00 N ATOM 1658 CA ARG B 44 8.099 -2.429 -4.621 1.00 0.00 C ATOM 1659 C ARG B 44 9.468 -3.091 -4.507 1.00 0.00 C ATOM 1660 O ARG B 44 10.258 -3.070 -5.451 1.00 0.00 O ATOM 1661 CB ARG B 44 7.009 -3.411 -4.184 1.00 0.00 C ATOM 1662 CG ARG B 44 5.600 -2.852 -4.296 1.00 0.00 C ATOM 1663 CD ARG B 44 4.963 -3.207 -5.630 1.00 0.00 C ATOM 1664 NE ARG B 44 3.917 -4.216 -5.483 1.00 0.00 N ATOM 1665 CZ ARG B 44 3.513 -5.017 -6.468 1.00 0.00 C ATOM 1666 NH1 ARG B 44 4.059 -4.927 -7.675 1.00 0.00 N ATOM 1667 NH2 ARG B 44 2.559 -5.910 -6.245 1.00 0.00 N ATOM 0 H ARG B 44 8.290 -2.561 -6.706 1.00 0.00 H new ATOM 0 HA ARG B 44 8.073 -1.558 -3.966 1.00 0.00 H new ATOM 0 HB2 ARG B 44 7.081 -4.313 -4.791 1.00 0.00 H new ATOM 0 HB3 ARG B 44 7.192 -3.706 -3.151 1.00 0.00 H new ATOM 0 HG2 ARG B 44 4.987 -3.243 -3.484 1.00 0.00 H new ATOM 0 HG3 ARG B 44 5.627 -1.768 -4.182 1.00 0.00 H new ATOM 0 HD2 ARG B 44 4.540 -2.309 -6.081 1.00 0.00 H new ATOM 0 HD3 ARG B 44 5.730 -3.575 -6.312 1.00 0.00 H new ATOM 0 HE ARG B 44 3.469 -4.313 -4.572 1.00 0.00 H new ATOM 0 HH11 ARG B 44 4.793 -4.241 -7.853 1.00 0.00 H new ATOM 0 HH12 ARG B 44 3.745 -5.544 -8.424 1.00 0.00 H new ATOM 0 HH21 ARG B 44 2.135 -5.983 -5.320 1.00 0.00 H new ATOM 0 HH22 ARG B 44 2.249 -6.524 -6.998 1.00 0.00 H new ATOM 1681 N GLU B 45 9.745 -3.681 -3.348 1.00 0.00 N ATOM 1682 CA GLU B 45 11.020 -4.351 -3.119 1.00 0.00 C ATOM 1683 C GLU B 45 11.190 -5.533 -4.069 1.00 0.00 C ATOM 1684 O GLU B 45 10.242 -6.277 -4.326 1.00 0.00 O ATOM 1685 CB GLU B 45 11.119 -4.825 -1.667 1.00 0.00 C ATOM 1686 CG GLU B 45 12.413 -4.417 -0.982 1.00 0.00 C ATOM 1687 CD GLU B 45 12.658 -2.922 -1.041 1.00 0.00 C ATOM 1688 OE1 GLU B 45 11.672 -2.157 -0.997 1.00 0.00 O ATOM 1689 OE2 GLU B 45 13.836 -2.517 -1.131 1.00 0.00 O ATOM 0 H GLU B 45 9.105 -3.709 -2.554 1.00 0.00 H new ATOM 0 HA GLU B 45 11.819 -3.636 -3.313 1.00 0.00 H new ATOM 0 HB2 GLU B 45 10.277 -4.423 -1.104 1.00 0.00 H new ATOM 0 HB3 GLU B 45 11.030 -5.911 -1.641 1.00 0.00 H new ATOM 0 HG2 GLU B 45 12.384 -4.736 0.060 1.00 0.00 H new ATOM 0 HG3 GLU B 45 13.248 -4.937 -1.452 1.00 0.00 H new ATOM 1696 N GLU B 46 12.402 -5.698 -4.592 1.00 0.00 N ATOM 1697 CA GLU B 46 12.695 -6.788 -5.519 1.00 0.00 C ATOM 1698 C GLU B 46 12.246 -8.135 -4.956 1.00 0.00 C ATOM 1699 O GLU B 46 11.382 -8.797 -5.529 1.00 0.00 O ATOM 1700 CB GLU B 46 14.192 -6.829 -5.847 1.00 0.00 C ATOM 1701 CG GLU B 46 15.098 -6.543 -4.657 1.00 0.00 C ATOM 1702 CD GLU B 46 16.021 -5.363 -4.895 1.00 0.00 C ATOM 1703 OE1 GLU B 46 16.830 -5.425 -5.844 1.00 0.00 O ATOM 1704 OE2 GLU B 46 15.934 -4.378 -4.132 1.00 0.00 O ATOM 0 H GLU B 46 13.197 -5.091 -4.390 1.00 0.00 H new ATOM 0 HA GLU B 46 12.136 -6.600 -6.435 1.00 0.00 H new ATOM 0 HB2 GLU B 46 14.438 -7.812 -6.249 1.00 0.00 H new ATOM 0 HB3 GLU B 46 14.401 -6.102 -6.632 1.00 0.00 H new ATOM 0 HG2 GLU B 46 14.485 -6.348 -3.777 1.00 0.00 H new ATOM 0 HG3 GLU B 46 15.695 -7.428 -4.439 1.00 0.00 H new ATOM 1711 N ILE B 47 12.834 -8.535 -3.831 1.00 0.00 N ATOM 1712 CA ILE B 47 12.490 -9.804 -3.195 1.00 0.00 C ATOM 1713 C ILE B 47 10.997 -9.877 -2.882 1.00 0.00 C ATOM 1714 O ILE B 47 10.347 -10.892 -3.141 1.00 0.00 O ATOM 1715 CB ILE B 47 13.295 -10.012 -1.894 1.00 0.00 C ATOM 1716 CG1 ILE B 47 14.790 -10.091 -2.206 1.00 0.00 C ATOM 1717 CG2 ILE B 47 12.835 -11.270 -1.168 1.00 0.00 C ATOM 1718 CD1 ILE B 47 15.166 -11.296 -3.040 1.00 0.00 C ATOM 0 H ILE B 47 13.550 -7.999 -3.341 1.00 0.00 H new ATOM 0 HA ILE B 47 12.744 -10.595 -3.900 1.00 0.00 H new ATOM 0 HB ILE B 47 13.118 -9.159 -1.239 1.00 0.00 H new ATOM 0 HG12 ILE B 47 15.092 -9.185 -2.732 1.00 0.00 H new ATOM 0 HG13 ILE B 47 15.348 -10.117 -1.270 1.00 0.00 H new ATOM 0 HG21 ILE B 47 13.416 -11.396 -0.255 1.00 0.00 H new ATOM 0 HG22 ILE B 47 11.778 -11.179 -0.916 1.00 0.00 H new ATOM 0 HG23 ILE B 47 12.981 -12.136 -1.813 1.00 0.00 H new ATOM 0 HD11 ILE B 47 16.240 -11.290 -3.224 1.00 0.00 H new ATOM 0 HD12 ILE B 47 14.894 -12.207 -2.506 1.00 0.00 H new ATOM 0 HD13 ILE B 47 14.635 -11.260 -3.991 1.00 0.00 H new ATOM 1730 N TYR B 48 10.465 -8.794 -2.320 1.00 0.00 N ATOM 1731 CA TYR B 48 9.051 -8.722 -1.958 1.00 0.00 C ATOM 1732 C TYR B 48 8.163 -9.339 -3.037 1.00 0.00 C ATOM 1733 O TYR B 48 7.621 -10.429 -2.860 1.00 0.00 O ATOM 1734 CB TYR B 48 8.641 -7.265 -1.721 1.00 0.00 C ATOM 1735 CG TYR B 48 9.062 -6.717 -0.372 1.00 0.00 C ATOM 1736 CD1 TYR B 48 10.179 -7.213 0.291 1.00 0.00 C ATOM 1737 CD2 TYR B 48 8.338 -5.698 0.236 1.00 0.00 C ATOM 1738 CE1 TYR B 48 10.561 -6.710 1.521 1.00 0.00 C ATOM 1739 CE2 TYR B 48 8.715 -5.191 1.465 1.00 0.00 C ATOM 1740 CZ TYR B 48 9.826 -5.700 2.103 1.00 0.00 C ATOM 1741 OH TYR B 48 10.204 -5.196 3.327 1.00 0.00 O ATOM 0 H TYR B 48 10.995 -7.950 -2.104 1.00 0.00 H new ATOM 0 HA TYR B 48 8.915 -9.294 -1.040 1.00 0.00 H new ATOM 0 HB2 TYR B 48 9.075 -6.644 -2.505 1.00 0.00 H new ATOM 0 HB3 TYR B 48 7.558 -7.184 -1.813 1.00 0.00 H new ATOM 0 HD1 TYR B 48 10.758 -8.004 -0.162 1.00 0.00 H new ATOM 0 HD2 TYR B 48 7.467 -5.296 -0.260 1.00 0.00 H new ATOM 0 HE1 TYR B 48 11.431 -7.107 2.023 1.00 0.00 H new ATOM 0 HE2 TYR B 48 8.142 -4.399 1.924 1.00 0.00 H new ATOM 0 HH TYR B 48 9.581 -4.489 3.596 1.00 0.00 H new ATOM 1751 N GLN B 49 8.018 -8.634 -4.153 1.00 0.00 N ATOM 1752 CA GLN B 49 7.193 -9.112 -5.256 1.00 0.00 C ATOM 1753 C GLN B 49 7.787 -10.365 -5.899 1.00 0.00 C ATOM 1754 O GLN B 49 7.089 -11.102 -6.594 1.00 0.00 O ATOM 1755 CB GLN B 49 7.038 -8.014 -6.311 1.00 0.00 C ATOM 1756 CG GLN B 49 8.361 -7.427 -6.779 1.00 0.00 C ATOM 1757 CD GLN B 49 8.193 -6.461 -7.936 1.00 0.00 C ATOM 1758 OE1 GLN B 49 8.000 -6.873 -9.080 1.00 0.00 O ATOM 1759 NE2 GLN B 49 8.267 -5.168 -7.643 1.00 0.00 N ATOM 0 H GLN B 49 8.461 -7.730 -4.318 1.00 0.00 H new ATOM 0 HA GLN B 49 6.215 -9.371 -4.851 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.506 -8.421 -7.171 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.420 -7.215 -5.903 1.00 0.00 H new ATOM 0 HG2 GLN B 49 8.840 -6.912 -5.947 1.00 0.00 H new ATOM 0 HG3 GLN B 49 9.027 -8.236 -7.079 1.00 0.00 H new ATOM 0 HE21 GLN B 49 8.428 -4.872 -6.680 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.162 -4.471 -8.380 1.00 0.00 H new ATOM 1768 N ARG B 50 9.077 -10.600 -5.674 1.00 0.00 N ATOM 1769 CA ARG B 50 9.755 -11.760 -6.245 1.00 0.00 C ATOM 1770 C ARG B 50 9.269 -13.066 -5.620 1.00 0.00 C ATOM 1771 O ARG B 50 9.446 -14.139 -6.197 1.00 0.00 O ATOM 1772 CB ARG B 50 11.269 -11.633 -6.065 1.00 0.00 C ATOM 1773 CG ARG B 50 11.986 -11.109 -7.298 1.00 0.00 C ATOM 1774 CD ARG B 50 13.436 -11.565 -7.334 1.00 0.00 C ATOM 1775 NE ARG B 50 14.330 -10.600 -6.698 1.00 0.00 N ATOM 1776 CZ ARG B 50 15.650 -10.753 -6.618 1.00 0.00 C ATOM 1777 NH1 ARG B 50 16.232 -11.830 -7.131 1.00 0.00 N ATOM 1778 NH2 ARG B 50 16.389 -9.828 -6.023 1.00 0.00 N ATOM 0 H ARG B 50 9.673 -10.003 -5.101 1.00 0.00 H new ATOM 0 HA ARG B 50 9.515 -11.786 -7.308 1.00 0.00 H new ATOM 0 HB2 ARG B 50 11.472 -10.967 -5.226 1.00 0.00 H new ATOM 0 HB3 ARG B 50 11.679 -12.609 -5.804 1.00 0.00 H new ATOM 0 HG2 ARG B 50 11.472 -11.456 -8.194 1.00 0.00 H new ATOM 0 HG3 ARG B 50 11.945 -10.020 -7.309 1.00 0.00 H new ATOM 0 HD2 ARG B 50 13.526 -12.528 -6.831 1.00 0.00 H new ATOM 0 HD3 ARG B 50 13.743 -11.716 -8.369 1.00 0.00 H new ATOM 0 HE ARG B 50 13.919 -9.760 -6.291 1.00 0.00 H new ATOM 0 HH11 ARG B 50 15.667 -12.545 -7.589 1.00 0.00 H new ATOM 0 HH12 ARG B 50 17.244 -11.942 -7.067 1.00 0.00 H new ATOM 0 HH21 ARG B 50 15.946 -8.999 -5.626 1.00 0.00 H new ATOM 0 HH22 ARG B 50 17.400 -9.945 -5.962 1.00 0.00 H new ATOM 1792 N ILE B 51 8.665 -12.981 -4.439 1.00 0.00 N ATOM 1793 CA ILE B 51 8.172 -14.173 -3.756 1.00 0.00 C ATOM 1794 C ILE B 51 6.646 -14.205 -3.702 1.00 0.00 C ATOM 1795 O ILE B 51 6.048 -15.273 -3.574 1.00 0.00 O ATOM 1796 CB ILE B 51 8.730 -14.279 -2.322 1.00 0.00 C ATOM 1797 CG1 ILE B 51 8.585 -12.945 -1.590 1.00 0.00 C ATOM 1798 CG2 ILE B 51 10.187 -14.719 -2.352 1.00 0.00 C ATOM 1799 CD1 ILE B 51 8.387 -13.093 -0.097 1.00 0.00 C ATOM 0 H ILE B 51 8.506 -12.107 -3.938 1.00 0.00 H new ATOM 0 HA ILE B 51 8.523 -15.025 -4.338 1.00 0.00 H new ATOM 0 HB ILE B 51 8.154 -15.030 -1.781 1.00 0.00 H new ATOM 0 HG12 ILE B 51 9.474 -12.341 -1.772 1.00 0.00 H new ATOM 0 HG13 ILE B 51 7.739 -12.400 -2.008 1.00 0.00 H new ATOM 0 HG21 ILE B 51 10.567 -14.789 -1.333 1.00 0.00 H new ATOM 0 HG22 ILE B 51 10.263 -15.693 -2.836 1.00 0.00 H new ATOM 0 HG23 ILE B 51 10.776 -13.990 -2.909 1.00 0.00 H new ATOM 0 HD11 ILE B 51 8.292 -12.107 0.357 1.00 0.00 H new ATOM 0 HD12 ILE B 51 7.482 -13.670 0.095 1.00 0.00 H new ATOM 0 HD13 ILE B 51 9.244 -13.610 0.334 1.00 0.00 H new ATOM 1811 N GLN B 52 6.017 -13.036 -3.796 1.00 0.00 N ATOM 1812 CA GLN B 52 4.558 -12.959 -3.752 1.00 0.00 C ATOM 1813 C GLN B 52 3.971 -12.631 -5.125 1.00 0.00 C ATOM 1814 O GLN B 52 3.083 -13.331 -5.610 1.00 0.00 O ATOM 1815 CB GLN B 52 4.102 -11.919 -2.723 1.00 0.00 C ATOM 1816 CG GLN B 52 4.661 -10.526 -2.961 1.00 0.00 C ATOM 1817 CD GLN B 52 4.945 -9.783 -1.672 1.00 0.00 C ATOM 1818 OE1 GLN B 52 4.851 -10.348 -0.582 1.00 0.00 O ATOM 1819 NE2 GLN B 52 5.294 -8.506 -1.790 1.00 0.00 N ATOM 0 H GLN B 52 6.488 -12.138 -3.902 1.00 0.00 H new ATOM 0 HA GLN B 52 4.189 -13.940 -3.452 1.00 0.00 H new ATOM 0 HB2 GLN B 52 3.013 -11.868 -2.731 1.00 0.00 H new ATOM 0 HB3 GLN B 52 4.398 -12.253 -1.729 1.00 0.00 H new ATOM 0 HG2 GLN B 52 5.580 -10.602 -3.542 1.00 0.00 H new ATOM 0 HG3 GLN B 52 3.953 -9.952 -3.558 1.00 0.00 H new ATOM 0 HE21 GLN B 52 5.359 -8.078 -2.714 1.00 0.00 H new ATOM 0 HE22 GLN B 52 5.496 -7.954 -0.957 1.00 0.00 H new ATOM 1828 N ALA B 53 4.466 -11.565 -5.746 1.00 0.00 N ATOM 1829 CA ALA B 53 3.980 -11.153 -7.056 1.00 0.00 C ATOM 1830 C ALA B 53 4.417 -12.133 -8.139 1.00 0.00 C ATOM 1831 O ALA B 53 3.608 -12.906 -8.654 1.00 0.00 O ATOM 1832 CB ALA B 53 4.464 -9.747 -7.381 1.00 0.00 C ATOM 0 H ALA B 53 5.202 -10.972 -5.363 1.00 0.00 H new ATOM 0 HA ALA B 53 2.890 -11.151 -7.027 1.00 0.00 H new ATOM 0 HB1 ALA B 53 4.093 -9.452 -8.363 1.00 0.00 H new ATOM 0 HB2 ALA B 53 4.092 -9.051 -6.629 1.00 0.00 H new ATOM 0 HB3 ALA B 53 5.554 -9.729 -7.384 1.00 0.00 H new ATOM 1838 N GLU B 54 5.701 -12.098 -8.478 1.00 0.00 N ATOM 1839 CA GLU B 54 6.248 -12.985 -9.496 1.00 0.00 C ATOM 1840 C GLU B 54 7.117 -14.063 -8.858 1.00 0.00 C ATOM 1841 O GLU B 54 8.117 -13.763 -8.209 1.00 0.00 O ATOM 1842 CB GLU B 54 7.068 -12.188 -10.512 1.00 0.00 C ATOM 1843 CG GLU B 54 6.234 -11.590 -11.632 1.00 0.00 C ATOM 1844 CD GLU B 54 6.965 -11.578 -12.961 1.00 0.00 C ATOM 1845 OE1 GLU B 54 7.676 -12.561 -13.256 1.00 0.00 O ATOM 1846 OE2 GLU B 54 6.825 -10.585 -13.706 1.00 0.00 O ATOM 0 H GLU B 54 6.383 -11.464 -8.062 1.00 0.00 H new ATOM 0 HA GLU B 54 5.417 -13.466 -10.011 1.00 0.00 H new ATOM 0 HB2 GLU B 54 7.593 -11.386 -9.993 1.00 0.00 H new ATOM 0 HB3 GLU B 54 7.828 -12.839 -10.944 1.00 0.00 H new ATOM 0 HG2 GLU B 54 5.310 -12.158 -11.735 1.00 0.00 H new ATOM 0 HG3 GLU B 54 5.953 -10.571 -11.367 1.00 0.00 H new ATOM 1853 N LYS B 55 6.731 -15.318 -9.051 1.00 0.00 N ATOM 1854 CA LYS B 55 7.478 -16.441 -8.497 1.00 0.00 C ATOM 1855 C LYS B 55 8.871 -16.520 -9.114 1.00 0.00 C ATOM 1856 O LYS B 55 9.060 -17.131 -10.166 1.00 0.00 O ATOM 1857 CB LYS B 55 6.723 -17.751 -8.735 1.00 0.00 C ATOM 1858 CG LYS B 55 5.951 -18.236 -7.519 1.00 0.00 C ATOM 1859 CD LYS B 55 4.551 -17.645 -7.476 1.00 0.00 C ATOM 1860 CE LYS B 55 3.526 -18.673 -7.023 1.00 0.00 C ATOM 1861 NZ LYS B 55 3.271 -19.701 -8.069 1.00 0.00 N ATOM 0 H LYS B 55 5.905 -15.584 -9.587 1.00 0.00 H new ATOM 0 HA LYS B 55 7.584 -16.284 -7.424 1.00 0.00 H new ATOM 0 HB2 LYS B 55 6.030 -17.616 -9.565 1.00 0.00 H new ATOM 0 HB3 LYS B 55 7.434 -18.521 -9.035 1.00 0.00 H new ATOM 0 HG2 LYS B 55 5.887 -19.324 -7.537 1.00 0.00 H new ATOM 0 HG3 LYS B 55 6.490 -17.963 -6.612 1.00 0.00 H new ATOM 0 HD2 LYS B 55 4.536 -16.791 -6.798 1.00 0.00 H new ATOM 0 HD3 LYS B 55 4.282 -17.272 -8.464 1.00 0.00 H new ATOM 0 HE2 LYS B 55 3.878 -19.160 -6.114 1.00 0.00 H new ATOM 0 HE3 LYS B 55 2.592 -18.169 -6.774 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 2.394 -20.213 -7.846 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 3.176 -19.238 -8.995 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 4.065 -20.372 -8.097 1.00 0.00 H new