USER MOD reduce.3.24.130724 H: found=0, std=0, add=1097, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1095 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 124 MET CE :methyl -145:sc= -4.77! (180deg=-8.26!) USER MOD Set 1.2: A 144 MET CE :methyl -127:sc=-0.00642 (180deg=-0.808) USER MOD Set 2.1: A 94 LYS NZ :NH3+ 138:sc= -0.965 (180deg=0) USER MOD Set 2.2: A 107 HIS : no HD1:sc= -1.01 K(o=-2.2,f=0.56) USER MOD Set 2.3: A 111 ASN : amide:sc= -0.229 K(o=-2.2,f=0.56) USER MOD Set 3.1: A 60 ASN : amide:sc= -3.05! C(o=-2.7!,f=-5.9!) USER MOD Set 3.2: A 62 THR OG1 : rot 180:sc= 0.399 USER MOD Set 4.1: A 36 MET CE :methyl 159:sc= -1.37 (180deg=-1.91!) USER MOD Set 4.2: A 51 MET CE :methyl -149:sc= -0.174 (180deg=-1.52) USER MOD Single : A 1 ALA N :NH3+ 170:sc= -0.0282 (180deg=-0.238) USER MOD Single : A 3 GLN : amide:sc= -0.7 X(o=-0.7,f=-0.27) USER MOD Single : A 5 THR OG1 : rot 180:sc= -2.89! USER MOD Single : A 8 GLN : amide:sc= -0.356 X(o=-0.36,f=-0.1) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -97:sc= 1.2 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.221 USER MOD Single : A 29 THR OG1 : rot 180:sc=-0.00785 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= -0.0421 USER MOD Single : A 41 GLN : amide:sc= -0.791 K(o=-0.79,f=-1.7!) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.233 USER MOD Single : A 49 GLN : amide:sc= -0.602 K(o=-0.6,f=0) USER MOD Single : A 53 ASN : amide:sc= 0.493 X(o=0.49,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl -129:sc= -1.43 (180deg=-2.34) USER MOD Single : A 72 MET CE :methyl 160:sc= -0.0157 (180deg=-0.225) USER MOD Single : A 75 LYS NZ :NH3+ -126:sc= -0.499 (180deg=-1.97!) USER MOD Single : A 76 MET CE :methyl 147:sc= -0.353 (180deg=-1.02) USER MOD Single : A 77 LYS NZ :NH3+ 165:sc=-0.000208 (180deg=-0.15) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= -2.24 K(o=-2.2,f=-5.3!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= -0.151 USER MOD Single : A 109 MET CE :methyl -146:sc= -0.186 (180deg=-2.68!) USER MOD Single : A 110 THR OG1 : rot 81:sc= 0.026 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 ASN : amide:sc= -8.57! C(o=-8.6!,f=-10!) USER MOD Single : A 138 TYR OH : rot -80:sc= -1.49 USER MOD Single : A 143 GLN : amide:sc= -0.667 K(o=-0.67,f=-2!) USER MOD Single : A 145 MET CE :methyl -162:sc= -0.124 (180deg=-0.561) USER MOD Single : A 146 THR OG1 : rot 2:sc= 0.0386 USER MOD Single : A 148 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0518) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 11.626 -2.451 10.818 1.00 0.00 N ATOM 2 CA ALA A 1 11.879 -3.389 9.731 1.00 0.00 C ATOM 3 C ALA A 1 11.430 -4.797 10.105 1.00 0.00 C ATOM 4 O ALA A 1 11.983 -5.785 9.622 1.00 0.00 O ATOM 5 CB ALA A 1 13.356 -3.384 9.364 1.00 0.00 C ATOM 0 H1 ALA A 1 12.090 -1.544 10.609 1.00 0.00 H new ATOM 0 H2 ALA A 1 10.601 -2.302 10.916 1.00 0.00 H new ATOM 0 H3 ALA A 1 12.006 -2.837 11.706 1.00 0.00 H new ATOM 0 HA ALA A 1 11.299 -3.069 8.865 1.00 0.00 H new ATOM 0 HB1 ALA A 1 13.531 -4.089 8.551 1.00 0.00 H new ATOM 0 HB2 ALA A 1 13.649 -2.383 9.046 1.00 0.00 H new ATOM 0 HB3 ALA A 1 13.947 -3.676 10.232 1.00 0.00 H new ATOM 11 N ASP A 2 10.423 -4.882 10.968 1.00 0.00 N ATOM 12 CA ASP A 2 9.899 -6.170 11.407 1.00 0.00 C ATOM 13 C ASP A 2 8.991 -6.778 10.343 1.00 0.00 C ATOM 14 O ASP A 2 8.867 -7.998 10.243 1.00 0.00 O ATOM 15 CB ASP A 2 9.132 -6.012 12.721 1.00 0.00 C ATOM 16 CG ASP A 2 10.042 -5.674 13.886 1.00 0.00 C ATOM 17 OD1 ASP A 2 11.228 -6.062 13.843 1.00 0.00 O ATOM 18 OD2 ASP A 2 9.567 -5.022 14.840 1.00 0.00 O ATOM 0 H ASP A 2 9.954 -4.074 11.377 1.00 0.00 H new ATOM 0 HA ASP A 2 10.742 -6.842 11.567 1.00 0.00 H new ATOM 0 HB2 ASP A 2 8.383 -5.228 12.609 1.00 0.00 H new ATOM 0 HB3 ASP A 2 8.596 -6.936 12.939 1.00 0.00 H new ATOM 23 N GLN A 3 8.356 -5.918 9.552 1.00 0.00 N ATOM 24 CA GLN A 3 7.458 -6.371 8.497 1.00 0.00 C ATOM 25 C GLN A 3 8.215 -6.584 7.191 1.00 0.00 C ATOM 26 O GLN A 3 7.673 -6.375 6.105 1.00 0.00 O ATOM 27 CB GLN A 3 6.331 -5.358 8.288 1.00 0.00 C ATOM 28 CG GLN A 3 5.236 -5.441 9.340 1.00 0.00 C ATOM 29 CD GLN A 3 4.471 -6.748 9.285 1.00 0.00 C ATOM 30 OE1 GLN A 3 3.461 -6.862 8.591 1.00 0.00 O ATOM 31 NE2 GLN A 3 4.951 -7.746 10.018 1.00 0.00 N ATOM 0 H GLN A 3 8.447 -4.905 9.622 1.00 0.00 H new ATOM 0 HA GLN A 3 7.028 -7.324 8.805 1.00 0.00 H new ATOM 0 HB2 GLN A 3 6.752 -4.353 8.292 1.00 0.00 H new ATOM 0 HB3 GLN A 3 5.890 -5.515 7.304 1.00 0.00 H new ATOM 0 HG2 GLN A 3 5.679 -5.325 10.329 1.00 0.00 H new ATOM 0 HG3 GLN A 3 4.542 -4.612 9.202 1.00 0.00 H new ATOM 0 HE21 GLN A 3 5.792 -7.608 10.579 1.00 0.00 H new ATOM 0 HE22 GLN A 3 4.479 -8.650 10.020 1.00 0.00 H new ATOM 40 N LEU A 4 9.472 -6.999 7.303 1.00 0.00 N ATOM 41 CA LEU A 4 10.305 -7.240 6.130 1.00 0.00 C ATOM 42 C LEU A 4 11.067 -8.555 6.263 1.00 0.00 C ATOM 43 O LEU A 4 12.286 -8.599 6.093 1.00 0.00 O ATOM 44 CB LEU A 4 11.289 -6.085 5.933 1.00 0.00 C ATOM 45 CG LEU A 4 10.669 -4.711 5.677 1.00 0.00 C ATOM 46 CD1 LEU A 4 11.533 -3.614 6.279 1.00 0.00 C ATOM 47 CD2 LEU A 4 10.477 -4.483 4.184 1.00 0.00 C ATOM 0 H LEU A 4 9.937 -7.176 8.194 1.00 0.00 H new ATOM 0 HA LEU A 4 9.652 -7.306 5.259 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.920 -6.017 6.819 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.941 -6.329 5.095 1.00 0.00 H new ATOM 0 HG LEU A 4 9.692 -4.679 6.158 1.00 0.00 H new ATOM 0 HD11 LEU A 4 11.075 -2.644 6.086 1.00 0.00 H new ATOM 0 HD12 LEU A 4 11.619 -3.768 7.355 1.00 0.00 H new ATOM 0 HD13 LEU A 4 12.525 -3.643 5.828 1.00 0.00 H new ATOM 0 HD21 LEU A 4 10.035 -3.500 4.020 1.00 0.00 H new ATOM 0 HD22 LEU A 4 11.443 -4.535 3.681 1.00 0.00 H new ATOM 0 HD23 LEU A 4 9.816 -5.250 3.781 1.00 0.00 H new ATOM 59 N THR A 5 10.340 -9.626 6.567 1.00 0.00 N ATOM 60 CA THR A 5 10.947 -10.942 6.722 1.00 0.00 C ATOM 61 C THR A 5 11.266 -11.564 5.368 1.00 0.00 C ATOM 62 O THR A 5 11.099 -10.927 4.328 1.00 0.00 O ATOM 63 CB THR A 5 10.027 -11.895 7.508 1.00 0.00 C ATOM 64 OG1 THR A 5 8.658 -11.510 7.333 1.00 0.00 O ATOM 65 CG2 THR A 5 10.376 -11.886 8.989 1.00 0.00 C ATOM 0 H THR A 5 9.330 -9.608 6.711 1.00 0.00 H new ATOM 0 HA THR A 5 11.873 -10.799 7.280 1.00 0.00 H new ATOM 0 HB THR A 5 10.172 -12.904 7.123 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.079 -12.122 7.834 1.00 0.00 H new ATOM 0 HG21 THR A 5 9.713 -12.566 9.523 1.00 0.00 H new ATOM 0 HG22 THR A 5 11.409 -12.208 9.121 1.00 0.00 H new ATOM 0 HG23 THR A 5 10.256 -10.877 9.385 1.00 0.00 H new ATOM 73 N GLU A 6 11.724 -12.811 5.387 1.00 0.00 N ATOM 74 CA GLU A 6 12.066 -13.518 4.159 1.00 0.00 C ATOM 75 C GLU A 6 11.158 -13.085 3.011 1.00 0.00 C ATOM 76 O GLU A 6 11.595 -12.985 1.865 1.00 0.00 O ATOM 77 CB GLU A 6 11.958 -15.030 4.367 1.00 0.00 C ATOM 78 CG GLU A 6 13.048 -15.602 5.257 1.00 0.00 C ATOM 79 CD GLU A 6 14.434 -15.427 4.667 1.00 0.00 C ATOM 80 OE1 GLU A 6 14.610 -15.720 3.466 1.00 0.00 O ATOM 81 OE2 GLU A 6 15.344 -14.996 5.407 1.00 0.00 O ATOM 0 H GLU A 6 11.867 -13.353 6.239 1.00 0.00 H new ATOM 0 HA GLU A 6 13.095 -13.267 3.900 1.00 0.00 H new ATOM 0 HB2 GLU A 6 10.986 -15.259 4.804 1.00 0.00 H new ATOM 0 HB3 GLU A 6 11.996 -15.525 3.397 1.00 0.00 H new ATOM 0 HG2 GLU A 6 13.008 -15.116 6.232 1.00 0.00 H new ATOM 0 HG3 GLU A 6 12.858 -16.663 5.421 1.00 0.00 H new ATOM 88 N GLU A 7 9.893 -12.831 3.329 1.00 0.00 N ATOM 89 CA GLU A 7 8.923 -12.411 2.325 1.00 0.00 C ATOM 90 C GLU A 7 9.420 -11.181 1.570 1.00 0.00 C ATOM 91 O GLU A 7 9.495 -11.183 0.342 1.00 0.00 O ATOM 92 CB GLU A 7 7.574 -12.110 2.981 1.00 0.00 C ATOM 93 CG GLU A 7 7.686 -11.676 4.432 1.00 0.00 C ATOM 94 CD GLU A 7 7.585 -12.840 5.399 1.00 0.00 C ATOM 95 OE1 GLU A 7 8.615 -13.505 5.635 1.00 0.00 O ATOM 96 OE2 GLU A 7 6.476 -13.086 5.918 1.00 0.00 O ATOM 0 H GLU A 7 9.516 -12.909 4.274 1.00 0.00 H new ATOM 0 HA GLU A 7 8.798 -13.227 1.613 1.00 0.00 H new ATOM 0 HB2 GLU A 7 7.071 -11.327 2.414 1.00 0.00 H new ATOM 0 HB3 GLU A 7 6.945 -12.999 2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 7 8.637 -11.165 4.582 1.00 0.00 H new ATOM 0 HG3 GLU A 7 6.899 -10.955 4.653 1.00 0.00 H new ATOM 103 N GLN A 8 9.756 -10.133 2.315 1.00 0.00 N ATOM 104 CA GLN A 8 10.244 -8.896 1.716 1.00 0.00 C ATOM 105 C GLN A 8 11.713 -9.024 1.324 1.00 0.00 C ATOM 106 O GLN A 8 12.104 -8.651 0.218 1.00 0.00 O ATOM 107 CB GLN A 8 10.063 -7.728 2.688 1.00 0.00 C ATOM 108 CG GLN A 8 8.608 -7.366 2.939 1.00 0.00 C ATOM 109 CD GLN A 8 7.931 -6.787 1.713 1.00 0.00 C ATOM 110 OE1 GLN A 8 7.925 -5.573 1.508 1.00 0.00 O ATOM 111 NE2 GLN A 8 7.355 -7.655 0.889 1.00 0.00 N ATOM 0 H GLN A 8 9.699 -10.115 3.333 1.00 0.00 H new ATOM 0 HA GLN A 8 9.662 -8.703 0.815 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.535 -7.980 3.638 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.584 -6.855 2.295 1.00 0.00 H new ATOM 0 HG2 GLN A 8 8.067 -8.255 3.262 1.00 0.00 H new ATOM 0 HG3 GLN A 8 8.552 -6.645 3.755 1.00 0.00 H new ATOM 0 HE21 GLN A 8 7.384 -8.653 1.098 1.00 0.00 H new ATOM 0 HE22 GLN A 8 6.884 -7.324 0.047 1.00 0.00 H new ATOM 120 N ILE A 9 12.520 -9.551 2.238 1.00 0.00 N ATOM 121 CA ILE A 9 13.945 -9.728 1.987 1.00 0.00 C ATOM 122 C ILE A 9 14.192 -10.281 0.587 1.00 0.00 C ATOM 123 O ILE A 9 15.094 -9.830 -0.119 1.00 0.00 O ATOM 124 CB ILE A 9 14.586 -10.673 3.020 1.00 0.00 C ATOM 125 CG1 ILE A 9 14.422 -10.106 4.432 1.00 0.00 C ATOM 126 CG2 ILE A 9 16.057 -10.890 2.698 1.00 0.00 C ATOM 127 CD1 ILE A 9 14.817 -11.078 5.522 1.00 0.00 C ATOM 0 H ILE A 9 12.212 -9.863 3.159 1.00 0.00 H new ATOM 0 HA ILE A 9 14.405 -8.744 2.073 1.00 0.00 H new ATOM 0 HB ILE A 9 14.078 -11.636 2.974 1.00 0.00 H new ATOM 0 HG12 ILE A 9 15.026 -9.203 4.525 1.00 0.00 H new ATOM 0 HG13 ILE A 9 13.383 -9.811 4.578 1.00 0.00 H new ATOM 0 HG21 ILE A 9 16.496 -11.560 3.437 1.00 0.00 H new ATOM 0 HG22 ILE A 9 16.151 -11.332 1.706 1.00 0.00 H new ATOM 0 HG23 ILE A 9 16.579 -9.933 2.720 1.00 0.00 H new ATOM 0 HD11 ILE A 9 14.675 -10.610 6.496 1.00 0.00 H new ATOM 0 HD12 ILE A 9 14.196 -11.971 5.455 1.00 0.00 H new ATOM 0 HD13 ILE A 9 15.864 -11.354 5.401 1.00 0.00 H new ATOM 139 N ALA A 10 13.383 -11.259 0.192 1.00 0.00 N ATOM 140 CA ALA A 10 13.511 -11.871 -1.125 1.00 0.00 C ATOM 141 C ALA A 10 13.264 -10.850 -2.231 1.00 0.00 C ATOM 142 O ALA A 10 13.993 -10.807 -3.221 1.00 0.00 O ATOM 143 CB ALA A 10 12.548 -13.041 -1.258 1.00 0.00 C ATOM 0 H ALA A 10 12.632 -11.644 0.765 1.00 0.00 H new ATOM 0 HA ALA A 10 14.531 -12.241 -1.230 1.00 0.00 H new ATOM 0 HB1 ALA A 10 12.654 -13.489 -2.246 1.00 0.00 H new ATOM 0 HB2 ALA A 10 12.774 -13.787 -0.496 1.00 0.00 H new ATOM 0 HB3 ALA A 10 11.525 -12.687 -1.128 1.00 0.00 H new ATOM 149 N GLU A 11 12.232 -10.032 -2.054 1.00 0.00 N ATOM 150 CA GLU A 11 11.889 -9.013 -3.039 1.00 0.00 C ATOM 151 C GLU A 11 13.000 -7.974 -3.157 1.00 0.00 C ATOM 152 O GLU A 11 13.539 -7.745 -4.240 1.00 0.00 O ATOM 153 CB GLU A 11 10.573 -8.328 -2.661 1.00 0.00 C ATOM 154 CG GLU A 11 9.339 -9.095 -3.106 1.00 0.00 C ATOM 155 CD GLU A 11 9.052 -8.931 -4.585 1.00 0.00 C ATOM 156 OE1 GLU A 11 9.606 -9.712 -5.387 1.00 0.00 O ATOM 157 OE2 GLU A 11 8.274 -8.022 -4.942 1.00 0.00 O ATOM 0 H GLU A 11 11.619 -10.055 -1.239 1.00 0.00 H new ATOM 0 HA GLU A 11 11.770 -9.504 -4.005 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.539 -8.197 -1.579 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.551 -7.332 -3.104 1.00 0.00 H new ATOM 0 HG2 GLU A 11 9.473 -10.153 -2.881 1.00 0.00 H new ATOM 0 HG3 GLU A 11 8.477 -8.754 -2.533 1.00 0.00 H new ATOM 164 N PHE A 12 13.337 -7.347 -2.034 1.00 0.00 N ATOM 165 CA PHE A 12 14.383 -6.331 -2.011 1.00 0.00 C ATOM 166 C PHE A 12 15.711 -6.906 -2.495 1.00 0.00 C ATOM 167 O PHE A 12 16.553 -6.186 -3.032 1.00 0.00 O ATOM 168 CB PHE A 12 14.543 -5.767 -0.598 1.00 0.00 C ATOM 169 CG PHE A 12 13.498 -4.752 -0.235 1.00 0.00 C ATOM 170 CD1 PHE A 12 13.699 -3.406 -0.498 1.00 0.00 C ATOM 171 CD2 PHE A 12 12.313 -5.143 0.369 1.00 0.00 C ATOM 172 CE1 PHE A 12 12.739 -2.470 -0.164 1.00 0.00 C ATOM 173 CE2 PHE A 12 11.349 -4.211 0.704 1.00 0.00 C ATOM 174 CZ PHE A 12 11.562 -2.873 0.436 1.00 0.00 C ATOM 0 H PHE A 12 12.901 -7.525 -1.129 1.00 0.00 H new ATOM 0 HA PHE A 12 14.089 -5.527 -2.685 1.00 0.00 H new ATOM 0 HB2 PHE A 12 14.505 -6.588 0.118 1.00 0.00 H new ATOM 0 HB3 PHE A 12 15.528 -5.310 -0.507 1.00 0.00 H new ATOM 0 HD1 PHE A 12 14.616 -3.085 -0.969 1.00 0.00 H new ATOM 0 HD2 PHE A 12 12.141 -6.188 0.580 1.00 0.00 H new ATOM 0 HE1 PHE A 12 12.909 -1.424 -0.372 1.00 0.00 H new ATOM 0 HE2 PHE A 12 10.430 -4.529 1.175 1.00 0.00 H new ATOM 0 HZ PHE A 12 10.809 -2.143 0.695 1.00 0.00 H new ATOM 184 N LYS A 13 15.891 -8.208 -2.301 1.00 0.00 N ATOM 185 CA LYS A 13 17.115 -8.882 -2.717 1.00 0.00 C ATOM 186 C LYS A 13 17.445 -8.562 -4.172 1.00 0.00 C ATOM 187 O LYS A 13 18.537 -8.085 -4.479 1.00 0.00 O ATOM 188 CB LYS A 13 16.975 -10.395 -2.537 1.00 0.00 C ATOM 189 CG LYS A 13 18.287 -11.148 -2.677 1.00 0.00 C ATOM 190 CD LYS A 13 18.228 -12.503 -1.991 1.00 0.00 C ATOM 191 CE LYS A 13 17.540 -13.540 -2.865 1.00 0.00 C ATOM 192 NZ LYS A 13 17.337 -14.827 -2.142 1.00 0.00 N ATOM 0 H LYS A 13 15.204 -8.818 -1.858 1.00 0.00 H new ATOM 0 HA LYS A 13 17.930 -8.521 -2.089 1.00 0.00 H new ATOM 0 HB2 LYS A 13 16.553 -10.598 -1.553 1.00 0.00 H new ATOM 0 HB3 LYS A 13 16.267 -10.776 -3.273 1.00 0.00 H new ATOM 0 HG2 LYS A 13 18.519 -11.284 -3.733 1.00 0.00 H new ATOM 0 HG3 LYS A 13 19.095 -10.556 -2.247 1.00 0.00 H new ATOM 0 HD2 LYS A 13 19.238 -12.837 -1.755 1.00 0.00 H new ATOM 0 HD3 LYS A 13 17.694 -12.410 -1.045 1.00 0.00 H new ATOM 0 HE2 LYS A 13 16.576 -13.154 -3.197 1.00 0.00 H new ATOM 0 HE3 LYS A 13 18.138 -13.716 -3.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 16.865 -15.508 -2.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 18.258 -15.209 -1.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 16.745 -14.664 -1.302 1.00 0.00 H new ATOM 206 N GLU A 14 16.493 -8.825 -5.062 1.00 0.00 N ATOM 207 CA GLU A 14 16.683 -8.563 -6.484 1.00 0.00 C ATOM 208 C GLU A 14 17.142 -7.126 -6.716 1.00 0.00 C ATOM 209 O GLU A 14 18.061 -6.875 -7.495 1.00 0.00 O ATOM 210 CB GLU A 14 15.386 -8.826 -7.252 1.00 0.00 C ATOM 211 CG GLU A 14 14.856 -10.240 -7.085 1.00 0.00 C ATOM 212 CD GLU A 14 15.848 -11.293 -7.542 1.00 0.00 C ATOM 213 OE1 GLU A 14 16.397 -11.146 -8.654 1.00 0.00 O ATOM 214 OE2 GLU A 14 16.074 -12.262 -6.788 1.00 0.00 O ATOM 0 H GLU A 14 15.583 -9.219 -4.824 1.00 0.00 H new ATOM 0 HA GLU A 14 17.457 -9.237 -6.851 1.00 0.00 H new ATOM 0 HB2 GLU A 14 14.626 -8.120 -6.917 1.00 0.00 H new ATOM 0 HB3 GLU A 14 15.555 -8.633 -8.311 1.00 0.00 H new ATOM 0 HG2 GLU A 14 14.609 -10.410 -6.037 1.00 0.00 H new ATOM 0 HG3 GLU A 14 13.931 -10.347 -7.652 1.00 0.00 H new ATOM 221 N ALA A 15 16.496 -6.187 -6.033 1.00 0.00 N ATOM 222 CA ALA A 15 16.838 -4.776 -6.163 1.00 0.00 C ATOM 223 C ALA A 15 18.224 -4.493 -5.595 1.00 0.00 C ATOM 224 O ALA A 15 18.804 -3.435 -5.843 1.00 0.00 O ATOM 225 CB ALA A 15 15.794 -3.914 -5.468 1.00 0.00 C ATOM 0 H ALA A 15 15.733 -6.378 -5.384 1.00 0.00 H new ATOM 0 HA ALA A 15 16.851 -4.527 -7.224 1.00 0.00 H new ATOM 0 HB1 ALA A 15 16.062 -2.863 -5.573 1.00 0.00 H new ATOM 0 HB2 ALA A 15 14.818 -4.087 -5.922 1.00 0.00 H new ATOM 0 HB3 ALA A 15 15.753 -4.174 -4.410 1.00 0.00 H new ATOM 231 N PHE A 16 18.751 -5.444 -4.830 1.00 0.00 N ATOM 232 CA PHE A 16 20.069 -5.295 -4.225 1.00 0.00 C ATOM 233 C PHE A 16 21.082 -6.221 -4.892 1.00 0.00 C ATOM 234 O PHE A 16 22.278 -6.158 -4.609 1.00 0.00 O ATOM 235 CB PHE A 16 20.002 -5.591 -2.725 1.00 0.00 C ATOM 236 CG PHE A 16 21.318 -5.423 -2.021 1.00 0.00 C ATOM 237 CD1 PHE A 16 21.737 -4.172 -1.598 1.00 0.00 C ATOM 238 CD2 PHE A 16 22.135 -6.516 -1.781 1.00 0.00 C ATOM 239 CE1 PHE A 16 22.948 -4.014 -0.951 1.00 0.00 C ATOM 240 CE2 PHE A 16 23.347 -6.364 -1.134 1.00 0.00 C ATOM 241 CZ PHE A 16 23.753 -5.112 -0.717 1.00 0.00 C ATOM 0 H PHE A 16 18.285 -6.326 -4.615 1.00 0.00 H new ATOM 0 HA PHE A 16 20.393 -4.265 -4.371 1.00 0.00 H new ATOM 0 HB2 PHE A 16 19.266 -4.931 -2.265 1.00 0.00 H new ATOM 0 HB3 PHE A 16 19.649 -6.612 -2.580 1.00 0.00 H new ATOM 0 HD1 PHE A 16 21.110 -3.311 -1.776 1.00 0.00 H new ATOM 0 HD2 PHE A 16 21.821 -7.498 -2.103 1.00 0.00 H new ATOM 0 HE1 PHE A 16 23.265 -3.033 -0.629 1.00 0.00 H new ATOM 0 HE2 PHE A 16 23.976 -7.224 -0.955 1.00 0.00 H new ATOM 0 HZ PHE A 16 24.698 -4.991 -0.209 1.00 0.00 H new ATOM 251 N SER A 17 20.592 -7.082 -5.779 1.00 0.00 N ATOM 252 CA SER A 17 21.453 -8.025 -6.484 1.00 0.00 C ATOM 253 C SER A 17 21.970 -7.420 -7.786 1.00 0.00 C ATOM 254 O SER A 17 23.075 -7.730 -8.232 1.00 0.00 O ATOM 255 CB SER A 17 20.693 -9.321 -6.777 1.00 0.00 C ATOM 256 OG SER A 17 20.841 -10.249 -5.717 1.00 0.00 O ATOM 0 H SER A 17 19.604 -7.146 -6.026 1.00 0.00 H new ATOM 0 HA SER A 17 22.306 -8.249 -5.844 1.00 0.00 H new ATOM 0 HB2 SER A 17 19.636 -9.101 -6.927 1.00 0.00 H new ATOM 0 HB3 SER A 17 21.061 -9.761 -7.704 1.00 0.00 H new ATOM 0 HG SER A 17 20.345 -11.068 -5.927 1.00 0.00 H new ATOM 262 N LEU A 18 21.163 -6.556 -8.390 1.00 0.00 N ATOM 263 CA LEU A 18 21.537 -5.906 -9.642 1.00 0.00 C ATOM 264 C LEU A 18 22.588 -4.827 -9.402 1.00 0.00 C ATOM 265 O LEU A 18 23.518 -4.665 -10.192 1.00 0.00 O ATOM 266 CB LEU A 18 20.304 -5.294 -10.310 1.00 0.00 C ATOM 267 CG LEU A 18 19.949 -3.869 -9.885 1.00 0.00 C ATOM 268 CD1 LEU A 18 19.179 -3.159 -10.989 1.00 0.00 C ATOM 269 CD2 LEU A 18 19.143 -3.882 -8.594 1.00 0.00 C ATOM 0 H LEU A 18 20.245 -6.289 -8.034 1.00 0.00 H new ATOM 0 HA LEU A 18 21.963 -6.661 -10.302 1.00 0.00 H new ATOM 0 HB2 LEU A 18 20.458 -5.302 -11.389 1.00 0.00 H new ATOM 0 HB3 LEU A 18 19.448 -5.937 -10.105 1.00 0.00 H new ATOM 0 HG LEU A 18 20.875 -3.323 -9.706 1.00 0.00 H new ATOM 0 HD11 LEU A 18 18.935 -2.146 -10.669 1.00 0.00 H new ATOM 0 HD12 LEU A 18 19.791 -3.117 -11.890 1.00 0.00 H new ATOM 0 HD13 LEU A 18 18.259 -3.705 -11.200 1.00 0.00 H new ATOM 0 HD21 LEU A 18 18.899 -2.859 -8.307 1.00 0.00 H new ATOM 0 HD22 LEU A 18 18.222 -4.445 -8.746 1.00 0.00 H new ATOM 0 HD23 LEU A 18 19.729 -4.351 -7.804 1.00 0.00 H new ATOM 281 N PHE A 19 22.435 -4.093 -8.305 1.00 0.00 N ATOM 282 CA PHE A 19 23.371 -3.030 -7.959 1.00 0.00 C ATOM 283 C PHE A 19 24.741 -3.604 -7.608 1.00 0.00 C ATOM 284 O PHE A 19 25.768 -3.125 -8.088 1.00 0.00 O ATOM 285 CB PHE A 19 22.834 -2.209 -6.785 1.00 0.00 C ATOM 286 CG PHE A 19 22.023 -1.018 -7.208 1.00 0.00 C ATOM 287 CD1 PHE A 19 22.638 0.096 -7.758 1.00 0.00 C ATOM 288 CD2 PHE A 19 20.646 -1.011 -7.056 1.00 0.00 C ATOM 289 CE1 PHE A 19 21.895 1.194 -8.148 1.00 0.00 C ATOM 290 CE2 PHE A 19 19.897 0.084 -7.446 1.00 0.00 C ATOM 291 CZ PHE A 19 20.523 1.188 -7.991 1.00 0.00 C ATOM 0 H PHE A 19 21.671 -4.215 -7.640 1.00 0.00 H new ATOM 0 HA PHE A 19 23.480 -2.380 -8.827 1.00 0.00 H new ATOM 0 HB2 PHE A 19 22.220 -2.851 -6.154 1.00 0.00 H new ATOM 0 HB3 PHE A 19 23.672 -1.870 -6.176 1.00 0.00 H new ATOM 0 HD1 PHE A 19 23.711 0.106 -7.883 1.00 0.00 H new ATOM 0 HD2 PHE A 19 20.152 -1.871 -6.628 1.00 0.00 H new ATOM 0 HE1 PHE A 19 22.387 2.056 -8.575 1.00 0.00 H new ATOM 0 HE2 PHE A 19 18.824 0.076 -7.325 1.00 0.00 H new ATOM 0 HZ PHE A 19 19.940 2.045 -8.294 1.00 0.00 H new ATOM 301 N ASP A 20 24.746 -4.633 -6.768 1.00 0.00 N ATOM 302 CA ASP A 20 25.988 -5.274 -6.352 1.00 0.00 C ATOM 303 C ASP A 20 26.627 -6.027 -7.515 1.00 0.00 C ATOM 304 O ASP A 20 26.364 -7.211 -7.722 1.00 0.00 O ATOM 305 CB ASP A 20 25.727 -6.233 -5.190 1.00 0.00 C ATOM 306 CG ASP A 20 26.950 -7.056 -4.833 1.00 0.00 C ATOM 307 OD1 ASP A 20 28.057 -6.481 -4.781 1.00 0.00 O ATOM 308 OD2 ASP A 20 26.800 -8.275 -4.606 1.00 0.00 O ATOM 0 H ASP A 20 23.904 -5.041 -6.362 1.00 0.00 H new ATOM 0 HA ASP A 20 26.677 -4.496 -6.024 1.00 0.00 H new ATOM 0 HB2 ASP A 20 25.408 -5.663 -4.317 1.00 0.00 H new ATOM 0 HB3 ASP A 20 24.906 -6.901 -5.451 1.00 0.00 H new ATOM 313 N LYS A 21 27.468 -5.330 -8.273 1.00 0.00 N ATOM 314 CA LYS A 21 28.146 -5.931 -9.415 1.00 0.00 C ATOM 315 C LYS A 21 29.288 -6.834 -8.958 1.00 0.00 C ATOM 316 O LYS A 21 29.499 -7.912 -9.512 1.00 0.00 O ATOM 317 CB LYS A 21 28.684 -4.842 -10.346 1.00 0.00 C ATOM 318 CG LYS A 21 27.619 -3.872 -10.827 1.00 0.00 C ATOM 319 CD LYS A 21 26.636 -4.547 -11.769 1.00 0.00 C ATOM 320 CE LYS A 21 26.046 -3.557 -12.762 1.00 0.00 C ATOM 321 NZ LYS A 21 25.366 -4.245 -13.894 1.00 0.00 N ATOM 0 H LYS A 21 27.696 -4.348 -8.116 1.00 0.00 H new ATOM 0 HA LYS A 21 27.421 -6.539 -9.957 1.00 0.00 H new ATOM 0 HB2 LYS A 21 29.463 -4.284 -9.827 1.00 0.00 H new ATOM 0 HB3 LYS A 21 29.151 -5.313 -11.211 1.00 0.00 H new ATOM 0 HG2 LYS A 21 27.082 -3.465 -9.970 1.00 0.00 H new ATOM 0 HG3 LYS A 21 28.093 -3.032 -11.335 1.00 0.00 H new ATOM 0 HD2 LYS A 21 27.140 -5.349 -12.309 1.00 0.00 H new ATOM 0 HD3 LYS A 21 25.834 -5.006 -11.191 1.00 0.00 H new ATOM 0 HE2 LYS A 21 25.334 -2.910 -12.250 1.00 0.00 H new ATOM 0 HE3 LYS A 21 26.838 -2.916 -13.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 24.978 -3.536 -14.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 26.051 -4.843 -14.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 24.594 -4.837 -13.527 1.00 0.00 H new ATOM 335 N ASP A 22 30.020 -6.386 -7.944 1.00 0.00 N ATOM 336 CA ASP A 22 31.138 -7.155 -7.410 1.00 0.00 C ATOM 337 C ASP A 22 30.685 -8.546 -6.979 1.00 0.00 C ATOM 338 O ASP A 22 31.364 -9.539 -7.238 1.00 0.00 O ATOM 339 CB ASP A 22 31.770 -6.421 -6.226 1.00 0.00 C ATOM 340 CG ASP A 22 31.962 -4.942 -6.497 1.00 0.00 C ATOM 341 OD1 ASP A 22 32.186 -4.578 -7.670 1.00 0.00 O ATOM 342 OD2 ASP A 22 31.889 -4.148 -5.536 1.00 0.00 O ATOM 0 H ASP A 22 29.859 -5.494 -7.475 1.00 0.00 H new ATOM 0 HA ASP A 22 31.882 -7.264 -8.199 1.00 0.00 H new ATOM 0 HB2 ASP A 22 31.140 -6.547 -5.346 1.00 0.00 H new ATOM 0 HB3 ASP A 22 32.734 -6.873 -5.995 1.00 0.00 H new ATOM 347 N GLY A 23 29.532 -8.610 -6.320 1.00 0.00 N ATOM 348 CA GLY A 23 29.009 -9.884 -5.862 1.00 0.00 C ATOM 349 C GLY A 23 29.483 -10.238 -4.467 1.00 0.00 C ATOM 350 O GLY A 23 29.927 -11.360 -4.221 1.00 0.00 O ATOM 0 H GLY A 23 28.951 -7.802 -6.095 1.00 0.00 H new ATOM 0 HA2 GLY A 23 27.920 -9.852 -5.875 1.00 0.00 H new ATOM 0 HA3 GLY A 23 29.313 -10.668 -6.555 1.00 0.00 H new ATOM 354 N ASP A 24 29.390 -9.280 -3.551 1.00 0.00 N ATOM 355 CA ASP A 24 29.814 -9.496 -2.173 1.00 0.00 C ATOM 356 C ASP A 24 28.677 -9.194 -1.201 1.00 0.00 C ATOM 357 O ASP A 24 28.416 -9.962 -0.277 1.00 0.00 O ATOM 358 CB ASP A 24 31.026 -8.623 -1.846 1.00 0.00 C ATOM 359 CG ASP A 24 30.757 -7.149 -2.078 1.00 0.00 C ATOM 360 OD1 ASP A 24 30.266 -6.801 -3.172 1.00 0.00 O ATOM 361 OD2 ASP A 24 31.038 -6.343 -1.166 1.00 0.00 O ATOM 0 H ASP A 24 29.025 -8.346 -3.738 1.00 0.00 H new ATOM 0 HA ASP A 24 30.092 -10.544 -2.065 1.00 0.00 H new ATOM 0 HB2 ASP A 24 31.312 -8.778 -0.806 1.00 0.00 H new ATOM 0 HB3 ASP A 24 31.871 -8.936 -2.459 1.00 0.00 H new ATOM 366 N GLY A 25 28.004 -8.068 -1.417 1.00 0.00 N ATOM 367 CA GLY A 25 26.904 -7.683 -0.552 1.00 0.00 C ATOM 368 C GLY A 25 26.965 -6.222 -0.152 1.00 0.00 C ATOM 369 O GLY A 25 26.494 -5.844 0.921 1.00 0.00 O ATOM 0 H GLY A 25 28.201 -7.415 -2.176 1.00 0.00 H new ATOM 0 HA2 GLY A 25 25.960 -7.878 -1.061 1.00 0.00 H new ATOM 0 HA3 GLY A 25 26.917 -8.303 0.345 1.00 0.00 H new ATOM 373 N THR A 26 27.547 -5.397 -1.017 1.00 0.00 N ATOM 374 CA THR A 26 27.671 -3.970 -0.747 1.00 0.00 C ATOM 375 C THR A 26 27.522 -3.154 -2.026 1.00 0.00 C ATOM 376 O THR A 26 27.501 -3.706 -3.127 1.00 0.00 O ATOM 377 CB THR A 26 29.025 -3.637 -0.094 1.00 0.00 C ATOM 378 OG1 THR A 26 30.096 -4.008 -0.969 1.00 0.00 O ATOM 379 CG2 THR A 26 29.176 -4.359 1.237 1.00 0.00 C ATOM 0 H THR A 26 27.940 -5.693 -1.911 1.00 0.00 H new ATOM 0 HA THR A 26 26.869 -3.708 -0.056 1.00 0.00 H new ATOM 0 HB THR A 26 29.061 -2.563 0.088 1.00 0.00 H new ATOM 0 HG1 THR A 26 30.434 -4.892 -0.715 1.00 0.00 H new ATOM 0 HG21 THR A 26 30.140 -4.108 1.680 1.00 0.00 H new ATOM 0 HG22 THR A 26 28.376 -4.051 1.911 1.00 0.00 H new ATOM 0 HG23 THR A 26 29.120 -5.435 1.075 1.00 0.00 H new ATOM 387 N ILE A 27 27.419 -1.838 -1.874 1.00 0.00 N ATOM 388 CA ILE A 27 27.274 -0.946 -3.018 1.00 0.00 C ATOM 389 C ILE A 27 28.110 0.317 -2.840 1.00 0.00 C ATOM 390 O ILE A 27 28.131 0.914 -1.763 1.00 0.00 O ATOM 391 CB ILE A 27 25.803 -0.548 -3.239 1.00 0.00 C ATOM 392 CG1 ILE A 27 24.924 -1.796 -3.342 1.00 0.00 C ATOM 393 CG2 ILE A 27 25.668 0.307 -4.490 1.00 0.00 C ATOM 394 CD1 ILE A 27 23.471 -1.541 -3.010 1.00 0.00 C ATOM 0 H ILE A 27 27.433 -1.366 -0.970 1.00 0.00 H new ATOM 0 HA ILE A 27 27.629 -1.493 -3.891 1.00 0.00 H new ATOM 0 HB ILE A 27 25.468 0.039 -2.384 1.00 0.00 H new ATOM 0 HG12 ILE A 27 24.992 -2.196 -4.354 1.00 0.00 H new ATOM 0 HG13 ILE A 27 25.313 -2.561 -2.670 1.00 0.00 H new ATOM 0 HG21 ILE A 27 24.623 0.580 -4.633 1.00 0.00 H new ATOM 0 HG22 ILE A 27 26.268 1.211 -4.380 1.00 0.00 H new ATOM 0 HG23 ILE A 27 26.017 -0.257 -5.355 1.00 0.00 H new ATOM 0 HD11 ILE A 27 22.908 -2.470 -3.104 1.00 0.00 H new ATOM 0 HD12 ILE A 27 23.391 -1.170 -1.988 1.00 0.00 H new ATOM 0 HD13 ILE A 27 23.065 -0.799 -3.698 1.00 0.00 H new ATOM 406 N THR A 28 28.797 0.720 -3.904 1.00 0.00 N ATOM 407 CA THR A 28 29.634 1.913 -3.866 1.00 0.00 C ATOM 408 C THR A 28 29.411 2.780 -5.100 1.00 0.00 C ATOM 409 O THR A 28 28.665 2.409 -6.007 1.00 0.00 O ATOM 410 CB THR A 28 31.128 1.548 -3.772 1.00 0.00 C ATOM 411 OG1 THR A 28 31.914 2.737 -3.633 1.00 0.00 O ATOM 412 CG2 THR A 28 31.576 0.780 -5.006 1.00 0.00 C ATOM 0 H THR A 28 28.790 0.238 -4.803 1.00 0.00 H new ATOM 0 HA THR A 28 29.347 2.472 -2.975 1.00 0.00 H new ATOM 0 HB THR A 28 31.270 0.914 -2.897 1.00 0.00 H new ATOM 0 HG1 THR A 28 32.862 2.497 -3.572 1.00 0.00 H new ATOM 0 HG21 THR A 28 32.634 0.533 -4.917 1.00 0.00 H new ATOM 0 HG22 THR A 28 30.995 -0.138 -5.094 1.00 0.00 H new ATOM 0 HG23 THR A 28 31.420 1.394 -5.893 1.00 0.00 H new ATOM 420 N THR A 29 30.063 3.939 -5.129 1.00 0.00 N ATOM 421 CA THR A 29 29.936 4.860 -6.251 1.00 0.00 C ATOM 422 C THR A 29 30.103 4.133 -7.580 1.00 0.00 C ATOM 423 O THR A 29 29.427 4.446 -8.561 1.00 0.00 O ATOM 424 CB THR A 29 30.972 5.996 -6.166 1.00 0.00 C ATOM 425 OG1 THR A 29 32.290 5.472 -6.359 1.00 0.00 O ATOM 426 CG2 THR A 29 30.893 6.701 -4.820 1.00 0.00 C ATOM 0 H THR A 29 30.685 4.262 -4.387 1.00 0.00 H new ATOM 0 HA THR A 29 28.935 5.288 -6.197 1.00 0.00 H new ATOM 0 HB THR A 29 30.751 6.719 -6.951 1.00 0.00 H new ATOM 0 HG1 THR A 29 32.943 6.201 -6.305 1.00 0.00 H new ATOM 0 HG21 THR A 29 31.634 7.499 -4.783 1.00 0.00 H new ATOM 0 HG22 THR A 29 29.897 7.124 -4.689 1.00 0.00 H new ATOM 0 HG23 THR A 29 31.091 5.985 -4.022 1.00 0.00 H new ATOM 434 N LYS A 30 31.008 3.160 -7.607 1.00 0.00 N ATOM 435 CA LYS A 30 31.264 2.386 -8.816 1.00 0.00 C ATOM 436 C LYS A 30 30.017 1.621 -9.247 1.00 0.00 C ATOM 437 O LYS A 30 29.653 1.621 -10.422 1.00 0.00 O ATOM 438 CB LYS A 30 32.420 1.410 -8.586 1.00 0.00 C ATOM 439 CG LYS A 30 32.656 0.462 -9.749 1.00 0.00 C ATOM 440 CD LYS A 30 33.439 1.132 -10.865 1.00 0.00 C ATOM 441 CE LYS A 30 34.936 1.085 -10.602 1.00 0.00 C ATOM 442 NZ LYS A 30 35.687 2.002 -11.504 1.00 0.00 N ATOM 0 H LYS A 30 31.577 2.889 -6.805 1.00 0.00 H new ATOM 0 HA LYS A 30 31.535 3.080 -9.611 1.00 0.00 H new ATOM 0 HB2 LYS A 30 33.332 1.977 -8.400 1.00 0.00 H new ATOM 0 HB3 LYS A 30 32.219 0.827 -7.688 1.00 0.00 H new ATOM 0 HG2 LYS A 30 33.199 -0.416 -9.399 1.00 0.00 H new ATOM 0 HG3 LYS A 30 31.698 0.112 -10.135 1.00 0.00 H new ATOM 0 HD2 LYS A 30 33.219 0.639 -11.812 1.00 0.00 H new ATOM 0 HD3 LYS A 30 33.118 2.169 -10.964 1.00 0.00 H new ATOM 0 HE2 LYS A 30 35.131 1.356 -9.564 1.00 0.00 H new ATOM 0 HE3 LYS A 30 35.297 0.066 -10.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 36.704 1.941 -11.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 35.522 1.728 -12.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 35.361 2.978 -11.356 1.00 0.00 H new ATOM 456 N GLU A 31 29.365 0.972 -8.287 1.00 0.00 N ATOM 457 CA GLU A 31 28.158 0.204 -8.569 1.00 0.00 C ATOM 458 C GLU A 31 26.947 1.123 -8.699 1.00 0.00 C ATOM 459 O GLU A 31 26.337 1.219 -9.766 1.00 0.00 O ATOM 460 CB GLU A 31 27.913 -0.826 -7.464 1.00 0.00 C ATOM 461 CG GLU A 31 28.968 -1.918 -7.406 1.00 0.00 C ATOM 462 CD GLU A 31 29.144 -2.484 -6.010 1.00 0.00 C ATOM 463 OE1 GLU A 31 29.769 -1.805 -5.169 1.00 0.00 O ATOM 464 OE2 GLU A 31 28.658 -3.607 -5.759 1.00 0.00 O ATOM 0 H GLU A 31 29.652 0.963 -7.308 1.00 0.00 H new ATOM 0 HA GLU A 31 28.302 -0.316 -9.516 1.00 0.00 H new ATOM 0 HB2 GLU A 31 27.879 -0.314 -6.502 1.00 0.00 H new ATOM 0 HB3 GLU A 31 26.936 -1.284 -7.616 1.00 0.00 H new ATOM 0 HG2 GLU A 31 28.692 -2.722 -8.088 1.00 0.00 H new ATOM 0 HG3 GLU A 31 29.920 -1.518 -7.755 1.00 0.00 H new ATOM 471 N LEU A 32 26.602 1.798 -7.608 1.00 0.00 N ATOM 472 CA LEU A 32 25.463 2.709 -7.599 1.00 0.00 C ATOM 473 C LEU A 32 25.541 3.688 -8.766 1.00 0.00 C ATOM 474 O LEU A 32 24.530 4.004 -9.392 1.00 0.00 O ATOM 475 CB LEU A 32 25.410 3.477 -6.277 1.00 0.00 C ATOM 476 CG LEU A 32 24.306 4.528 -6.155 1.00 0.00 C ATOM 477 CD1 LEU A 32 22.936 3.869 -6.185 1.00 0.00 C ATOM 478 CD2 LEU A 32 24.481 5.340 -4.880 1.00 0.00 C ATOM 0 H LEU A 32 27.095 1.731 -6.718 1.00 0.00 H new ATOM 0 HA LEU A 32 24.554 2.117 -7.705 1.00 0.00 H new ATOM 0 HB2 LEU A 32 25.290 2.758 -5.467 1.00 0.00 H new ATOM 0 HB3 LEU A 32 26.371 3.969 -6.127 1.00 0.00 H new ATOM 0 HG LEU A 32 24.380 5.205 -7.006 1.00 0.00 H new ATOM 0 HD11 LEU A 32 22.163 4.632 -6.097 1.00 0.00 H new ATOM 0 HD12 LEU A 32 22.811 3.333 -7.126 1.00 0.00 H new ATOM 0 HD13 LEU A 32 22.851 3.169 -5.354 1.00 0.00 H new ATOM 0 HD21 LEU A 32 23.687 6.083 -4.810 1.00 0.00 H new ATOM 0 HD22 LEU A 32 24.434 4.676 -4.017 1.00 0.00 H new ATOM 0 HD23 LEU A 32 25.448 5.843 -4.899 1.00 0.00 H new ATOM 490 N GLY A 33 26.748 4.164 -9.054 1.00 0.00 N ATOM 491 CA GLY A 33 26.935 5.101 -10.147 1.00 0.00 C ATOM 492 C GLY A 33 26.767 4.448 -11.505 1.00 0.00 C ATOM 493 O GLY A 33 26.554 5.130 -12.508 1.00 0.00 O ATOM 0 H GLY A 33 27.600 3.918 -8.550 1.00 0.00 H new ATOM 0 HA2 GLY A 33 26.219 5.917 -10.049 1.00 0.00 H new ATOM 0 HA3 GLY A 33 27.930 5.540 -10.079 1.00 0.00 H new ATOM 497 N THR A 34 26.863 3.123 -11.539 1.00 0.00 N ATOM 498 CA THR A 34 26.723 2.378 -12.784 1.00 0.00 C ATOM 499 C THR A 34 25.255 2.185 -13.146 1.00 0.00 C ATOM 500 O THR A 34 24.908 2.043 -14.319 1.00 0.00 O ATOM 501 CB THR A 34 27.404 0.999 -12.694 1.00 0.00 C ATOM 502 OG1 THR A 34 27.964 0.645 -13.963 1.00 0.00 O ATOM 503 CG2 THR A 34 26.411 -0.067 -12.256 1.00 0.00 C ATOM 0 H THR A 34 27.037 2.543 -10.718 1.00 0.00 H new ATOM 0 HA THR A 34 27.212 2.966 -13.561 1.00 0.00 H new ATOM 0 HB THR A 34 28.199 1.059 -11.951 1.00 0.00 H new ATOM 0 HG1 THR A 34 28.396 -0.232 -13.897 1.00 0.00 H new ATOM 0 HG21 THR A 34 26.915 -1.032 -12.200 1.00 0.00 H new ATOM 0 HG22 THR A 34 26.009 0.191 -11.276 1.00 0.00 H new ATOM 0 HG23 THR A 34 25.597 -0.124 -12.978 1.00 0.00 H new ATOM 511 N VAL A 35 24.396 2.180 -12.132 1.00 0.00 N ATOM 512 CA VAL A 35 22.964 2.006 -12.345 1.00 0.00 C ATOM 513 C VAL A 35 22.237 3.345 -12.318 1.00 0.00 C ATOM 514 O VAL A 35 21.282 3.560 -13.064 1.00 0.00 O ATOM 515 CB VAL A 35 22.347 1.079 -11.280 1.00 0.00 C ATOM 516 CG1 VAL A 35 20.879 1.413 -11.066 1.00 0.00 C ATOM 517 CG2 VAL A 35 22.518 -0.379 -11.681 1.00 0.00 C ATOM 0 H VAL A 35 24.666 2.294 -11.155 1.00 0.00 H new ATOM 0 HA VAL A 35 22.844 1.550 -13.328 1.00 0.00 H new ATOM 0 HB VAL A 35 22.871 1.237 -10.337 1.00 0.00 H new ATOM 0 HG11 VAL A 35 20.461 0.748 -10.311 1.00 0.00 H new ATOM 0 HG12 VAL A 35 20.786 2.446 -10.731 1.00 0.00 H new ATOM 0 HG13 VAL A 35 20.336 1.285 -12.003 1.00 0.00 H new ATOM 0 HG21 VAL A 35 22.077 -1.020 -10.918 1.00 0.00 H new ATOM 0 HG22 VAL A 35 22.021 -0.555 -12.635 1.00 0.00 H new ATOM 0 HG23 VAL A 35 23.579 -0.608 -11.778 1.00 0.00 H new ATOM 527 N MET A 36 22.697 4.245 -11.454 1.00 0.00 N ATOM 528 CA MET A 36 22.091 5.566 -11.332 1.00 0.00 C ATOM 529 C MET A 36 22.157 6.319 -12.657 1.00 0.00 C ATOM 530 O MET A 36 21.200 6.987 -13.050 1.00 0.00 O ATOM 531 CB MET A 36 22.793 6.373 -10.238 1.00 0.00 C ATOM 532 CG MET A 36 22.334 6.019 -8.833 1.00 0.00 C ATOM 533 SD MET A 36 22.448 7.412 -7.694 1.00 0.00 S ATOM 534 CE MET A 36 21.316 8.569 -8.460 1.00 0.00 C ATOM 0 H MET A 36 23.487 4.084 -10.829 1.00 0.00 H new ATOM 0 HA MET A 36 21.043 5.434 -11.061 1.00 0.00 H new ATOM 0 HB2 MET A 36 23.868 6.211 -10.312 1.00 0.00 H new ATOM 0 HB3 MET A 36 22.618 7.435 -10.412 1.00 0.00 H new ATOM 0 HG2 MET A 36 21.303 5.668 -8.869 1.00 0.00 H new ATOM 0 HG3 MET A 36 22.938 5.195 -8.454 1.00 0.00 H new ATOM 0 HE1 MET A 36 20.987 9.300 -7.721 1.00 0.00 H new ATOM 0 HE2 MET A 36 21.819 9.082 -9.279 1.00 0.00 H new ATOM 0 HE3 MET A 36 20.451 8.030 -8.847 1.00 0.00 H new ATOM 544 N ARG A 37 23.291 6.206 -13.341 1.00 0.00 N ATOM 545 CA ARG A 37 23.481 6.878 -14.621 1.00 0.00 C ATOM 546 C ARG A 37 22.646 6.214 -15.712 1.00 0.00 C ATOM 547 O ARG A 37 22.398 6.805 -16.763 1.00 0.00 O ATOM 548 CB ARG A 37 24.959 6.864 -15.014 1.00 0.00 C ATOM 549 CG ARG A 37 25.563 5.470 -15.060 1.00 0.00 C ATOM 550 CD ARG A 37 25.286 4.787 -16.390 1.00 0.00 C ATOM 551 NE ARG A 37 26.352 3.859 -16.761 1.00 0.00 N ATOM 552 CZ ARG A 37 26.628 3.521 -18.016 1.00 0.00 C ATOM 553 NH1 ARG A 37 25.921 4.032 -19.015 1.00 0.00 N ATOM 554 NH2 ARG A 37 27.613 2.670 -18.274 1.00 0.00 N ATOM 0 H ARG A 37 24.092 5.656 -13.030 1.00 0.00 H new ATOM 0 HA ARG A 37 23.151 7.911 -14.514 1.00 0.00 H new ATOM 0 HB2 ARG A 37 25.071 7.332 -15.992 1.00 0.00 H new ATOM 0 HB3 ARG A 37 25.521 7.471 -14.304 1.00 0.00 H new ATOM 0 HG2 ARG A 37 26.639 5.533 -14.899 1.00 0.00 H new ATOM 0 HG3 ARG A 37 25.154 4.868 -14.248 1.00 0.00 H new ATOM 0 HD2 ARG A 37 24.340 4.248 -16.331 1.00 0.00 H new ATOM 0 HD3 ARG A 37 25.175 5.541 -17.169 1.00 0.00 H new ATOM 0 HE ARG A 37 26.915 3.448 -16.016 1.00 0.00 H new ATOM 0 HH11 ARG A 37 25.163 4.686 -18.821 1.00 0.00 H new ATOM 0 HH12 ARG A 37 26.135 3.771 -19.977 1.00 0.00 H new ATOM 0 HH21 ARG A 37 28.159 2.275 -17.509 1.00 0.00 H new ATOM 0 HH22 ARG A 37 27.824 2.411 -19.238 1.00 0.00 H new ATOM 568 N SER A 38 22.218 4.982 -15.456 1.00 0.00 N ATOM 569 CA SER A 38 21.415 4.236 -16.418 1.00 0.00 C ATOM 570 C SER A 38 20.049 4.887 -16.606 1.00 0.00 C ATOM 571 O SER A 38 19.463 4.828 -17.688 1.00 0.00 O ATOM 572 CB SER A 38 21.244 2.788 -15.956 1.00 0.00 C ATOM 573 OG SER A 38 22.500 2.174 -15.724 1.00 0.00 O ATOM 0 H SER A 38 22.414 4.479 -14.590 1.00 0.00 H new ATOM 0 HA SER A 38 21.937 4.245 -17.375 1.00 0.00 H new ATOM 0 HB2 SER A 38 20.649 2.762 -15.043 1.00 0.00 H new ATOM 0 HB3 SER A 38 20.694 2.225 -16.710 1.00 0.00 H new ATOM 0 HG SER A 38 22.363 1.250 -15.428 1.00 0.00 H new ATOM 579 N LEU A 39 19.545 5.508 -15.545 1.00 0.00 N ATOM 580 CA LEU A 39 18.247 6.172 -15.592 1.00 0.00 C ATOM 581 C LEU A 39 18.376 7.583 -16.156 1.00 0.00 C ATOM 582 O LEU A 39 17.528 8.036 -16.924 1.00 0.00 O ATOM 583 CB LEU A 39 17.628 6.223 -14.194 1.00 0.00 C ATOM 584 CG LEU A 39 17.090 4.900 -13.648 1.00 0.00 C ATOM 585 CD1 LEU A 39 16.690 5.048 -12.188 1.00 0.00 C ATOM 586 CD2 LEU A 39 15.909 4.421 -14.480 1.00 0.00 C ATOM 0 H LEU A 39 20.015 5.566 -14.642 1.00 0.00 H new ATOM 0 HA LEU A 39 17.596 5.597 -16.250 1.00 0.00 H new ATOM 0 HB2 LEU A 39 18.379 6.601 -13.500 1.00 0.00 H new ATOM 0 HB3 LEU A 39 16.813 6.946 -14.206 1.00 0.00 H new ATOM 0 HG LEU A 39 17.882 4.154 -13.713 1.00 0.00 H new ATOM 0 HD11 LEU A 39 16.310 4.096 -11.817 1.00 0.00 H new ATOM 0 HD12 LEU A 39 17.559 5.345 -11.601 1.00 0.00 H new ATOM 0 HD13 LEU A 39 15.914 5.809 -12.099 1.00 0.00 H new ATOM 0 HD21 LEU A 39 15.539 3.478 -14.077 1.00 0.00 H new ATOM 0 HD22 LEU A 39 15.115 5.167 -14.447 1.00 0.00 H new ATOM 0 HD23 LEU A 39 16.227 4.275 -15.512 1.00 0.00 H new ATOM 598 N GLY A 40 19.445 8.273 -15.770 1.00 0.00 N ATOM 599 CA GLY A 40 19.667 9.625 -16.249 1.00 0.00 C ATOM 600 C GLY A 40 19.994 10.591 -15.127 1.00 0.00 C ATOM 601 O GLY A 40 19.583 11.751 -15.160 1.00 0.00 O ATOM 0 H GLY A 40 20.161 7.920 -15.135 1.00 0.00 H new ATOM 0 HA2 GLY A 40 20.483 9.622 -16.971 1.00 0.00 H new ATOM 0 HA3 GLY A 40 18.777 9.972 -16.775 1.00 0.00 H new ATOM 605 N GLN A 41 20.733 10.111 -14.132 1.00 0.00 N ATOM 606 CA GLN A 41 21.112 10.941 -12.994 1.00 0.00 C ATOM 607 C GLN A 41 22.543 11.447 -13.142 1.00 0.00 C ATOM 608 O GLN A 41 22.834 12.606 -12.851 1.00 0.00 O ATOM 609 CB GLN A 41 20.969 10.152 -11.691 1.00 0.00 C ATOM 610 CG GLN A 41 19.525 9.882 -11.299 1.00 0.00 C ATOM 611 CD GLN A 41 18.652 11.117 -11.399 1.00 0.00 C ATOM 612 OE1 GLN A 41 19.117 12.238 -11.190 1.00 0.00 O ATOM 613 NE2 GLN A 41 17.379 10.918 -11.719 1.00 0.00 N ATOM 0 H GLN A 41 21.081 9.153 -14.091 1.00 0.00 H new ATOM 0 HA GLN A 41 20.443 11.801 -12.965 1.00 0.00 H new ATOM 0 HB2 GLN A 41 21.493 9.202 -11.792 1.00 0.00 H new ATOM 0 HB3 GLN A 41 21.458 10.702 -10.887 1.00 0.00 H new ATOM 0 HG2 GLN A 41 19.118 9.101 -11.942 1.00 0.00 H new ATOM 0 HG3 GLN A 41 19.495 9.502 -10.278 1.00 0.00 H new ATOM 0 HE21 GLN A 41 17.036 9.971 -11.884 1.00 0.00 H new ATOM 0 HE22 GLN A 41 16.743 11.712 -11.800 1.00 0.00 H new ATOM 622 N ASN A 42 23.431 10.569 -13.596 1.00 0.00 N ATOM 623 CA ASN A 42 24.833 10.927 -13.781 1.00 0.00 C ATOM 624 C ASN A 42 25.335 11.778 -12.619 1.00 0.00 C ATOM 625 O ASN A 42 25.908 12.852 -12.806 1.00 0.00 O ATOM 626 CB ASN A 42 25.018 11.682 -15.099 1.00 0.00 C ATOM 627 CG ASN A 42 25.279 10.752 -16.267 1.00 0.00 C ATOM 628 OD1 ASN A 42 26.336 10.126 -16.353 1.00 0.00 O ATOM 629 ND2 ASN A 42 24.314 10.656 -17.175 1.00 0.00 N ATOM 0 H ASN A 42 23.205 9.605 -13.842 1.00 0.00 H new ATOM 0 HA ASN A 42 25.416 10.007 -13.812 1.00 0.00 H new ATOM 0 HB2 ASN A 42 24.127 12.275 -15.303 1.00 0.00 H new ATOM 0 HB3 ASN A 42 25.850 12.380 -15.001 1.00 0.00 H new ATOM 0 HD21 ASN A 42 24.433 10.045 -17.983 1.00 0.00 H new ATOM 0 HD22 ASN A 42 23.454 11.193 -17.064 1.00 0.00 H new ATOM 636 N PRO A 43 25.117 11.289 -11.390 1.00 0.00 N ATOM 637 CA PRO A 43 25.541 11.988 -10.173 1.00 0.00 C ATOM 638 C PRO A 43 27.057 11.996 -10.007 1.00 0.00 C ATOM 639 O PRO A 43 27.729 11.004 -10.290 1.00 0.00 O ATOM 640 CB PRO A 43 24.885 11.178 -9.052 1.00 0.00 C ATOM 641 CG PRO A 43 24.703 9.815 -9.626 1.00 0.00 C ATOM 642 CD PRO A 43 24.441 10.015 -11.093 1.00 0.00 C ATOM 0 HA PRO A 43 25.251 13.039 -10.185 1.00 0.00 H new ATOM 0 HB2 PRO A 43 25.514 11.152 -8.162 1.00 0.00 H new ATOM 0 HB3 PRO A 43 23.931 11.613 -8.755 1.00 0.00 H new ATOM 0 HG2 PRO A 43 25.591 9.203 -9.468 1.00 0.00 H new ATOM 0 HG3 PRO A 43 23.871 9.298 -9.148 1.00 0.00 H new ATOM 0 HD2 PRO A 43 24.846 9.197 -11.689 1.00 0.00 H new ATOM 0 HD3 PRO A 43 23.373 10.067 -11.307 1.00 0.00 H new ATOM 650 N THR A 44 27.591 13.123 -9.547 1.00 0.00 N ATOM 651 CA THR A 44 29.028 13.261 -9.344 1.00 0.00 C ATOM 652 C THR A 44 29.474 12.553 -8.070 1.00 0.00 C ATOM 653 O THR A 44 28.656 12.239 -7.205 1.00 0.00 O ATOM 654 CB THR A 44 29.445 14.742 -9.268 1.00 0.00 C ATOM 655 OG1 THR A 44 28.747 15.393 -8.201 1.00 0.00 O ATOM 656 CG2 THR A 44 29.155 15.454 -10.581 1.00 0.00 C ATOM 0 H THR A 44 27.050 13.954 -9.308 1.00 0.00 H new ATOM 0 HA THR A 44 29.514 12.798 -10.203 1.00 0.00 H new ATOM 0 HB THR A 44 30.518 14.786 -9.079 1.00 0.00 H new ATOM 0 HG1 THR A 44 29.019 16.334 -8.158 1.00 0.00 H new ATOM 0 HG21 THR A 44 29.458 16.498 -10.503 1.00 0.00 H new ATOM 0 HG22 THR A 44 29.711 14.974 -11.386 1.00 0.00 H new ATOM 0 HG23 THR A 44 28.088 15.401 -10.796 1.00 0.00 H new ATOM 664 N GLU A 45 30.775 12.305 -7.960 1.00 0.00 N ATOM 665 CA GLU A 45 31.328 11.634 -6.790 1.00 0.00 C ATOM 666 C GLU A 45 30.704 12.174 -5.507 1.00 0.00 C ATOM 667 O GLU A 45 30.127 11.423 -4.721 1.00 0.00 O ATOM 668 CB GLU A 45 32.848 11.810 -6.744 1.00 0.00 C ATOM 669 CG GLU A 45 33.610 10.712 -7.466 1.00 0.00 C ATOM 670 CD GLU A 45 35.089 10.712 -7.134 1.00 0.00 C ATOM 671 OE1 GLU A 45 35.776 11.695 -7.483 1.00 0.00 O ATOM 672 OE2 GLU A 45 35.560 9.729 -6.524 1.00 0.00 O ATOM 0 H GLU A 45 31.465 12.559 -8.667 1.00 0.00 H new ATOM 0 HA GLU A 45 31.094 10.572 -6.868 1.00 0.00 H new ATOM 0 HB2 GLU A 45 33.107 12.772 -7.186 1.00 0.00 H new ATOM 0 HB3 GLU A 45 33.170 11.840 -5.703 1.00 0.00 H new ATOM 0 HG2 GLU A 45 33.182 9.745 -7.202 1.00 0.00 H new ATOM 0 HG3 GLU A 45 33.483 10.834 -8.542 1.00 0.00 H new ATOM 679 N ALA A 46 30.825 13.481 -5.302 1.00 0.00 N ATOM 680 CA ALA A 46 30.271 14.123 -4.115 1.00 0.00 C ATOM 681 C ALA A 46 28.823 13.703 -3.889 1.00 0.00 C ATOM 682 O ALA A 46 28.398 13.499 -2.752 1.00 0.00 O ATOM 683 CB ALA A 46 30.370 15.636 -4.239 1.00 0.00 C ATOM 0 H ALA A 46 31.301 14.117 -5.942 1.00 0.00 H new ATOM 0 HA ALA A 46 30.854 13.801 -3.252 1.00 0.00 H new ATOM 0 HB1 ALA A 46 29.953 16.102 -3.346 1.00 0.00 H new ATOM 0 HB2 ALA A 46 31.416 15.925 -4.344 1.00 0.00 H new ATOM 0 HB3 ALA A 46 29.812 15.967 -5.115 1.00 0.00 H new ATOM 689 N GLU A 47 28.071 13.575 -4.978 1.00 0.00 N ATOM 690 CA GLU A 47 26.670 13.181 -4.896 1.00 0.00 C ATOM 691 C GLU A 47 26.538 11.743 -4.401 1.00 0.00 C ATOM 692 O GLU A 47 25.836 11.472 -3.426 1.00 0.00 O ATOM 693 CB GLU A 47 25.996 13.325 -6.262 1.00 0.00 C ATOM 694 CG GLU A 47 26.006 14.747 -6.798 1.00 0.00 C ATOM 695 CD GLU A 47 24.905 15.603 -6.202 1.00 0.00 C ATOM 696 OE1 GLU A 47 25.080 16.087 -5.064 1.00 0.00 O ATOM 697 OE2 GLU A 47 23.869 15.790 -6.874 1.00 0.00 O ATOM 0 H GLU A 47 28.409 13.738 -5.927 1.00 0.00 H new ATOM 0 HA GLU A 47 26.175 13.840 -4.183 1.00 0.00 H new ATOM 0 HB2 GLU A 47 26.498 12.673 -6.976 1.00 0.00 H new ATOM 0 HB3 GLU A 47 24.964 12.981 -6.187 1.00 0.00 H new ATOM 0 HG2 GLU A 47 26.972 15.205 -6.585 1.00 0.00 H new ATOM 0 HG3 GLU A 47 25.896 14.723 -7.882 1.00 0.00 H new ATOM 704 N LEU A 48 27.217 10.825 -5.081 1.00 0.00 N ATOM 705 CA LEU A 48 27.176 9.414 -4.712 1.00 0.00 C ATOM 706 C LEU A 48 27.616 9.217 -3.265 1.00 0.00 C ATOM 707 O LEU A 48 26.961 8.512 -2.498 1.00 0.00 O ATOM 708 CB LEU A 48 28.070 8.597 -5.645 1.00 0.00 C ATOM 709 CG LEU A 48 27.664 8.580 -7.119 1.00 0.00 C ATOM 710 CD1 LEU A 48 28.872 8.311 -8.003 1.00 0.00 C ATOM 711 CD2 LEU A 48 26.581 7.539 -7.362 1.00 0.00 C ATOM 0 H LEU A 48 27.802 11.032 -5.890 1.00 0.00 H new ATOM 0 HA LEU A 48 26.147 9.068 -4.810 1.00 0.00 H new ATOM 0 HB2 LEU A 48 29.086 8.985 -5.573 1.00 0.00 H new ATOM 0 HB3 LEU A 48 28.095 7.569 -5.284 1.00 0.00 H new ATOM 0 HG LEU A 48 27.263 9.560 -7.376 1.00 0.00 H new ATOM 0 HD11 LEU A 48 28.563 8.303 -9.048 1.00 0.00 H new ATOM 0 HD12 LEU A 48 29.616 9.093 -7.851 1.00 0.00 H new ATOM 0 HD13 LEU A 48 29.304 7.344 -7.745 1.00 0.00 H new ATOM 0 HD21 LEU A 48 26.304 7.541 -8.416 1.00 0.00 H new ATOM 0 HD22 LEU A 48 26.956 6.553 -7.087 1.00 0.00 H new ATOM 0 HD23 LEU A 48 25.706 7.776 -6.757 1.00 0.00 H new ATOM 723 N GLN A 49 28.729 9.846 -2.899 1.00 0.00 N ATOM 724 CA GLN A 49 29.255 9.740 -1.544 1.00 0.00 C ATOM 725 C GLN A 49 28.221 10.198 -0.521 1.00 0.00 C ATOM 726 O GLN A 49 28.008 9.541 0.498 1.00 0.00 O ATOM 727 CB GLN A 49 30.532 10.571 -1.403 1.00 0.00 C ATOM 728 CG GLN A 49 31.763 9.899 -1.990 1.00 0.00 C ATOM 729 CD GLN A 49 32.500 9.045 -0.976 1.00 0.00 C ATOM 730 OE1 GLN A 49 33.580 9.410 -0.509 1.00 0.00 O ATOM 731 NE2 GLN A 49 31.920 7.902 -0.630 1.00 0.00 N ATOM 0 H GLN A 49 29.283 10.434 -3.522 1.00 0.00 H new ATOM 0 HA GLN A 49 29.489 8.693 -1.353 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.385 11.533 -1.893 1.00 0.00 H new ATOM 0 HB3 GLN A 49 30.708 10.775 -0.347 1.00 0.00 H new ATOM 0 HG2 GLN A 49 31.465 9.278 -2.835 1.00 0.00 H new ATOM 0 HG3 GLN A 49 32.439 10.661 -2.377 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.025 7.639 -1.042 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.370 7.287 0.048 1.00 0.00 H new ATOM 740 N ASP A 50 27.582 11.329 -0.799 1.00 0.00 N ATOM 741 CA ASP A 50 26.569 11.875 0.097 1.00 0.00 C ATOM 742 C ASP A 50 25.405 10.903 0.258 1.00 0.00 C ATOM 743 O ASP A 50 24.887 10.717 1.359 1.00 0.00 O ATOM 744 CB ASP A 50 26.060 13.217 -0.432 1.00 0.00 C ATOM 745 CG ASP A 50 26.899 14.385 0.049 1.00 0.00 C ATOM 746 OD1 ASP A 50 27.047 14.541 1.279 1.00 0.00 O ATOM 747 OD2 ASP A 50 27.406 15.142 -0.804 1.00 0.00 O ATOM 0 H ASP A 50 27.747 11.886 -1.638 1.00 0.00 H new ATOM 0 HA ASP A 50 27.028 12.029 1.074 1.00 0.00 H new ATOM 0 HB2 ASP A 50 26.060 13.198 -1.522 1.00 0.00 H new ATOM 0 HB3 ASP A 50 25.027 13.361 -0.115 1.00 0.00 H new ATOM 752 N MET A 51 24.999 10.286 -0.847 1.00 0.00 N ATOM 753 CA MET A 51 23.896 9.332 -0.827 1.00 0.00 C ATOM 754 C MET A 51 24.297 8.052 -0.102 1.00 0.00 C ATOM 755 O MET A 51 23.498 7.467 0.631 1.00 0.00 O ATOM 756 CB MET A 51 23.450 9.006 -2.254 1.00 0.00 C ATOM 757 CG MET A 51 22.654 10.122 -2.912 1.00 0.00 C ATOM 758 SD MET A 51 22.027 9.662 -4.539 1.00 0.00 S ATOM 759 CE MET A 51 23.419 10.102 -5.576 1.00 0.00 C ATOM 0 H MET A 51 25.417 10.429 -1.766 1.00 0.00 H new ATOM 0 HA MET A 51 23.064 9.787 -0.289 1.00 0.00 H new ATOM 0 HB2 MET A 51 24.330 8.792 -2.861 1.00 0.00 H new ATOM 0 HB3 MET A 51 22.845 8.100 -2.239 1.00 0.00 H new ATOM 0 HG2 MET A 51 21.818 10.395 -2.268 1.00 0.00 H new ATOM 0 HG3 MET A 51 23.285 11.006 -3.007 1.00 0.00 H new ATOM 0 HE1 MET A 51 23.059 10.407 -6.558 1.00 0.00 H new ATOM 0 HE2 MET A 51 23.968 10.925 -5.119 1.00 0.00 H new ATOM 0 HE3 MET A 51 24.079 9.241 -5.683 1.00 0.00 H new ATOM 769 N ILE A 52 25.536 7.621 -0.312 1.00 0.00 N ATOM 770 CA ILE A 52 26.042 6.411 0.323 1.00 0.00 C ATOM 771 C ILE A 52 26.170 6.593 1.831 1.00 0.00 C ATOM 772 O ILE A 52 25.759 5.732 2.608 1.00 0.00 O ATOM 773 CB ILE A 52 27.411 6.003 -0.252 1.00 0.00 C ATOM 774 CG1 ILE A 52 27.269 5.583 -1.717 1.00 0.00 C ATOM 775 CG2 ILE A 52 28.018 4.877 0.571 1.00 0.00 C ATOM 776 CD1 ILE A 52 28.559 5.683 -2.501 1.00 0.00 C ATOM 0 H ILE A 52 26.208 8.092 -0.917 1.00 0.00 H new ATOM 0 HA ILE A 52 25.320 5.621 0.115 1.00 0.00 H new ATOM 0 HB ILE A 52 28.079 6.863 -0.203 1.00 0.00 H new ATOM 0 HG12 ILE A 52 26.906 4.556 -1.759 1.00 0.00 H new ATOM 0 HG13 ILE A 52 26.514 6.207 -2.194 1.00 0.00 H new ATOM 0 HG21 ILE A 52 28.985 4.600 0.152 1.00 0.00 H new ATOM 0 HG22 ILE A 52 28.151 5.210 1.601 1.00 0.00 H new ATOM 0 HG23 ILE A 52 27.354 4.013 0.552 1.00 0.00 H new ATOM 0 HD11 ILE A 52 28.384 5.370 -3.530 1.00 0.00 H new ATOM 0 HD12 ILE A 52 28.912 6.714 -2.490 1.00 0.00 H new ATOM 0 HD13 ILE A 52 29.311 5.037 -2.048 1.00 0.00 H new ATOM 788 N ASN A 53 26.742 7.721 2.239 1.00 0.00 N ATOM 789 CA ASN A 53 26.924 8.018 3.655 1.00 0.00 C ATOM 790 C ASN A 53 25.577 8.198 4.350 1.00 0.00 C ATOM 791 O ASN A 53 25.404 7.800 5.501 1.00 0.00 O ATOM 792 CB ASN A 53 27.772 9.280 3.829 1.00 0.00 C ATOM 793 CG ASN A 53 29.256 9.004 3.678 1.00 0.00 C ATOM 794 OD1 ASN A 53 29.864 8.342 4.519 1.00 0.00 O ATOM 795 ND2 ASN A 53 29.845 9.511 2.602 1.00 0.00 N ATOM 0 H ASN A 53 27.088 8.445 1.609 1.00 0.00 H new ATOM 0 HA ASN A 53 27.441 7.175 4.114 1.00 0.00 H new ATOM 0 HB2 ASN A 53 27.467 10.024 3.093 1.00 0.00 H new ATOM 0 HB3 ASN A 53 27.583 9.709 4.813 1.00 0.00 H new ATOM 0 HD21 ASN A 53 30.841 9.358 2.446 1.00 0.00 H new ATOM 0 HD22 ASN A 53 29.301 10.054 1.931 1.00 0.00 H new ATOM 802 N GLU A 54 24.627 8.800 3.641 1.00 0.00 N ATOM 803 CA GLU A 54 23.297 9.032 4.191 1.00 0.00 C ATOM 804 C GLU A 54 22.630 7.715 4.576 1.00 0.00 C ATOM 805 O GLU A 54 21.962 7.622 5.606 1.00 0.00 O ATOM 806 CB GLU A 54 22.426 9.780 3.179 1.00 0.00 C ATOM 807 CG GLU A 54 22.610 11.288 3.216 1.00 0.00 C ATOM 808 CD GLU A 54 21.894 11.935 4.386 1.00 0.00 C ATOM 809 OE1 GLU A 54 21.975 11.388 5.506 1.00 0.00 O ATOM 810 OE2 GLU A 54 21.253 12.986 4.182 1.00 0.00 O ATOM 0 H GLU A 54 24.754 9.135 2.686 1.00 0.00 H new ATOM 0 HA GLU A 54 23.404 9.641 5.088 1.00 0.00 H new ATOM 0 HB2 GLU A 54 22.656 9.419 2.177 1.00 0.00 H new ATOM 0 HB3 GLU A 54 21.379 9.545 3.370 1.00 0.00 H new ATOM 0 HG2 GLU A 54 23.674 11.519 3.273 1.00 0.00 H new ATOM 0 HG3 GLU A 54 22.240 11.718 2.285 1.00 0.00 H new ATOM 817 N VAL A 55 22.815 6.698 3.740 1.00 0.00 N ATOM 818 CA VAL A 55 22.232 5.385 3.993 1.00 0.00 C ATOM 819 C VAL A 55 23.137 4.545 4.886 1.00 0.00 C ATOM 820 O VAL A 55 22.661 3.758 5.705 1.00 0.00 O ATOM 821 CB VAL A 55 21.976 4.623 2.679 1.00 0.00 C ATOM 822 CG1 VAL A 55 21.491 3.210 2.966 1.00 0.00 C ATOM 823 CG2 VAL A 55 20.974 5.374 1.815 1.00 0.00 C ATOM 0 H VAL A 55 23.364 6.758 2.882 1.00 0.00 H new ATOM 0 HA VAL A 55 21.281 5.553 4.499 1.00 0.00 H new ATOM 0 HB VAL A 55 22.915 4.554 2.130 1.00 0.00 H new ATOM 0 HG11 VAL A 55 21.316 2.687 2.026 1.00 0.00 H new ATOM 0 HG12 VAL A 55 22.246 2.676 3.542 1.00 0.00 H new ATOM 0 HG13 VAL A 55 20.563 3.253 3.536 1.00 0.00 H new ATOM 0 HG21 VAL A 55 20.805 4.822 0.891 1.00 0.00 H new ATOM 0 HG22 VAL A 55 20.032 5.476 2.355 1.00 0.00 H new ATOM 0 HG23 VAL A 55 21.366 6.364 1.580 1.00 0.00 H new ATOM 833 N ASP A 56 24.444 4.717 4.724 1.00 0.00 N ATOM 834 CA ASP A 56 25.418 3.975 5.518 1.00 0.00 C ATOM 835 C ASP A 56 25.087 4.063 7.004 1.00 0.00 C ATOM 836 O ASP A 56 25.093 5.146 7.588 1.00 0.00 O ATOM 837 CB ASP A 56 26.828 4.509 5.264 1.00 0.00 C ATOM 838 CG ASP A 56 27.900 3.481 5.567 1.00 0.00 C ATOM 839 OD1 ASP A 56 27.936 2.441 4.877 1.00 0.00 O ATOM 840 OD2 ASP A 56 28.702 3.716 6.495 1.00 0.00 O ATOM 0 H ASP A 56 24.854 5.364 4.050 1.00 0.00 H new ATOM 0 HA ASP A 56 25.375 2.929 5.216 1.00 0.00 H new ATOM 0 HB2 ASP A 56 26.913 4.822 4.223 1.00 0.00 H new ATOM 0 HB3 ASP A 56 26.994 5.394 5.878 1.00 0.00 H new ATOM 845 N ALA A 57 24.797 2.916 7.610 1.00 0.00 N ATOM 846 CA ALA A 57 24.464 2.864 9.028 1.00 0.00 C ATOM 847 C ALA A 57 25.520 2.090 9.811 1.00 0.00 C ATOM 848 O ALA A 57 26.070 2.591 10.792 1.00 0.00 O ATOM 849 CB ALA A 57 23.092 2.237 9.226 1.00 0.00 C ATOM 0 H ALA A 57 24.786 2.010 7.141 1.00 0.00 H new ATOM 0 HA ALA A 57 24.442 3.885 9.409 1.00 0.00 H new ATOM 0 HB1 ALA A 57 22.857 2.205 10.290 1.00 0.00 H new ATOM 0 HB2 ALA A 57 22.341 2.832 8.706 1.00 0.00 H new ATOM 0 HB3 ALA A 57 23.094 1.224 8.824 1.00 0.00 H new ATOM 855 N ASP A 58 25.796 0.867 9.373 1.00 0.00 N ATOM 856 CA ASP A 58 26.786 0.023 10.033 1.00 0.00 C ATOM 857 C ASP A 58 27.998 0.843 10.462 1.00 0.00 C ATOM 858 O ASP A 58 28.494 0.699 11.578 1.00 0.00 O ATOM 859 CB ASP A 58 27.223 -1.109 9.103 1.00 0.00 C ATOM 860 CG ASP A 58 28.122 -0.624 7.982 1.00 0.00 C ATOM 861 OD1 ASP A 58 27.866 0.477 7.452 1.00 0.00 O ATOM 862 OD2 ASP A 58 29.079 -1.347 7.634 1.00 0.00 O ATOM 0 H ASP A 58 25.348 0.437 8.564 1.00 0.00 H new ATOM 0 HA ASP A 58 26.327 -0.406 10.923 1.00 0.00 H new ATOM 0 HB2 ASP A 58 27.747 -1.869 9.682 1.00 0.00 H new ATOM 0 HB3 ASP A 58 26.341 -1.586 8.676 1.00 0.00 H new ATOM 867 N GLY A 59 28.473 1.703 9.565 1.00 0.00 N ATOM 868 CA GLY A 59 29.624 2.532 9.869 1.00 0.00 C ATOM 869 C GLY A 59 30.879 2.065 9.158 1.00 0.00 C ATOM 870 O GLY A 59 31.970 2.093 9.727 1.00 0.00 O ATOM 0 H GLY A 59 28.081 1.840 8.633 1.00 0.00 H new ATOM 0 HA2 GLY A 59 29.411 3.562 9.584 1.00 0.00 H new ATOM 0 HA3 GLY A 59 29.797 2.528 10.945 1.00 0.00 H new ATOM 874 N ASN A 60 30.724 1.632 7.911 1.00 0.00 N ATOM 875 CA ASN A 60 31.854 1.154 7.122 1.00 0.00 C ATOM 876 C ASN A 60 32.098 2.059 5.918 1.00 0.00 C ATOM 877 O ASN A 60 33.231 2.454 5.645 1.00 0.00 O ATOM 878 CB ASN A 60 31.605 -0.281 6.654 1.00 0.00 C ATOM 879 CG ASN A 60 30.611 -0.351 5.510 1.00 0.00 C ATOM 880 OD1 ASN A 60 29.486 0.138 5.619 1.00 0.00 O ATOM 881 ND2 ASN A 60 31.023 -0.963 4.405 1.00 0.00 N ATOM 0 H ASN A 60 29.828 1.602 7.425 1.00 0.00 H new ATOM 0 HA ASN A 60 32.741 1.174 7.755 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.549 -0.727 6.340 1.00 0.00 H new ATOM 0 HB3 ASN A 60 31.235 -0.874 7.490 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.398 -1.042 3.603 1.00 0.00 H new ATOM 0 HD22 ASN A 60 31.964 -1.354 4.359 1.00 0.00 H new ATOM 888 N GLY A 61 31.026 2.384 5.202 1.00 0.00 N ATOM 889 CA GLY A 61 31.145 3.240 4.036 1.00 0.00 C ATOM 890 C GLY A 61 30.246 2.799 2.898 1.00 0.00 C ATOM 891 O GLY A 61 29.440 3.581 2.394 1.00 0.00 O ATOM 0 H GLY A 61 30.078 2.070 5.408 1.00 0.00 H new ATOM 0 HA2 GLY A 61 30.897 4.264 4.314 1.00 0.00 H new ATOM 0 HA3 GLY A 61 32.181 3.244 3.696 1.00 0.00 H new ATOM 895 N THR A 62 30.385 1.541 2.490 1.00 0.00 N ATOM 896 CA THR A 62 29.581 0.997 1.403 1.00 0.00 C ATOM 897 C THR A 62 28.246 0.470 1.917 1.00 0.00 C ATOM 898 O THR A 62 28.195 -0.250 2.915 1.00 0.00 O ATOM 899 CB THR A 62 30.320 -0.138 0.671 1.00 0.00 C ATOM 900 OG1 THR A 62 30.636 -1.190 1.590 1.00 0.00 O ATOM 901 CG2 THR A 62 31.598 0.377 0.025 1.00 0.00 C ATOM 0 H THR A 62 31.047 0.880 2.896 1.00 0.00 H new ATOM 0 HA THR A 62 29.401 1.814 0.704 1.00 0.00 H new ATOM 0 HB THR A 62 29.665 -0.523 -0.111 1.00 0.00 H new ATOM 0 HG1 THR A 62 31.104 -1.909 1.116 1.00 0.00 H new ATOM 0 HG21 THR A 62 32.103 -0.443 -0.486 1.00 0.00 H new ATOM 0 HG22 THR A 62 31.353 1.158 -0.695 1.00 0.00 H new ATOM 0 HG23 THR A 62 32.255 0.785 0.793 1.00 0.00 H new ATOM 909 N ILE A 63 27.168 0.831 1.229 1.00 0.00 N ATOM 910 CA ILE A 63 25.833 0.392 1.616 1.00 0.00 C ATOM 911 C ILE A 63 25.770 -1.125 1.749 1.00 0.00 C ATOM 912 O ILE A 63 26.481 -1.850 1.052 1.00 0.00 O ATOM 913 CB ILE A 63 24.772 0.852 0.598 1.00 0.00 C ATOM 914 CG1 ILE A 63 24.779 2.377 0.475 1.00 0.00 C ATOM 915 CG2 ILE A 63 23.395 0.353 1.008 1.00 0.00 C ATOM 916 CD1 ILE A 63 25.510 2.881 -0.750 1.00 0.00 C ATOM 0 H ILE A 63 27.193 1.426 0.401 1.00 0.00 H new ATOM 0 HA ILE A 63 25.619 0.848 2.583 1.00 0.00 H new ATOM 0 HB ILE A 63 25.015 0.428 -0.376 1.00 0.00 H new ATOM 0 HG12 ILE A 63 23.750 2.736 0.448 1.00 0.00 H new ATOM 0 HG13 ILE A 63 25.242 2.803 1.365 1.00 0.00 H new ATOM 0 HG21 ILE A 63 22.656 0.686 0.279 1.00 0.00 H new ATOM 0 HG22 ILE A 63 23.400 -0.736 1.049 1.00 0.00 H new ATOM 0 HG23 ILE A 63 23.141 0.751 1.990 1.00 0.00 H new ATOM 0 HD11 ILE A 63 25.475 3.970 -0.772 1.00 0.00 H new ATOM 0 HD12 ILE A 63 26.549 2.552 -0.715 1.00 0.00 H new ATOM 0 HD13 ILE A 63 25.034 2.484 -1.647 1.00 0.00 H new ATOM 928 N ASP A 64 24.914 -1.600 2.647 1.00 0.00 N ATOM 929 CA ASP A 64 24.756 -3.033 2.870 1.00 0.00 C ATOM 930 C ASP A 64 23.357 -3.493 2.472 1.00 0.00 C ATOM 931 O ASP A 64 22.562 -2.714 1.947 1.00 0.00 O ATOM 932 CB ASP A 64 25.021 -3.375 4.337 1.00 0.00 C ATOM 933 CG ASP A 64 26.327 -2.793 4.840 1.00 0.00 C ATOM 934 OD1 ASP A 64 27.122 -2.311 4.006 1.00 0.00 O ATOM 935 OD2 ASP A 64 26.556 -2.822 6.068 1.00 0.00 O ATOM 0 H ASP A 64 24.319 -1.014 3.232 1.00 0.00 H new ATOM 0 HA ASP A 64 25.482 -3.555 2.247 1.00 0.00 H new ATOM 0 HB2 ASP A 64 24.200 -3.000 4.948 1.00 0.00 H new ATOM 0 HB3 ASP A 64 25.039 -4.458 4.457 1.00 0.00 H new ATOM 940 N PHE A 65 23.064 -4.764 2.724 1.00 0.00 N ATOM 941 CA PHE A 65 21.762 -5.330 2.390 1.00 0.00 C ATOM 942 C PHE A 65 20.649 -4.626 3.163 1.00 0.00 C ATOM 943 O PHE A 65 19.640 -4.202 2.599 1.00 0.00 O ATOM 944 CB PHE A 65 21.740 -6.829 2.695 1.00 0.00 C ATOM 945 CG PHE A 65 20.823 -7.610 1.797 1.00 0.00 C ATOM 946 CD1 PHE A 65 19.502 -7.227 1.632 1.00 0.00 C ATOM 947 CD2 PHE A 65 21.283 -8.726 1.116 1.00 0.00 C ATOM 948 CE1 PHE A 65 18.656 -7.944 0.807 1.00 0.00 C ATOM 949 CE2 PHE A 65 20.442 -9.446 0.289 1.00 0.00 C ATOM 950 CZ PHE A 65 19.127 -9.054 0.134 1.00 0.00 C ATOM 0 H PHE A 65 23.711 -5.422 3.159 1.00 0.00 H new ATOM 0 HA PHE A 65 21.591 -5.181 1.324 1.00 0.00 H new ATOM 0 HB2 PHE A 65 22.751 -7.225 2.602 1.00 0.00 H new ATOM 0 HB3 PHE A 65 21.434 -6.977 3.731 1.00 0.00 H new ATOM 0 HD1 PHE A 65 19.129 -6.358 2.154 1.00 0.00 H new ATOM 0 HD2 PHE A 65 22.311 -9.037 1.233 1.00 0.00 H new ATOM 0 HE1 PHE A 65 17.628 -7.636 0.689 1.00 0.00 H new ATOM 0 HE2 PHE A 65 20.813 -10.314 -0.235 1.00 0.00 H new ATOM 0 HZ PHE A 65 18.468 -9.615 -0.512 1.00 0.00 H new ATOM 960 N PRO A 66 20.837 -4.499 4.485 1.00 0.00 N ATOM 961 CA PRO A 66 19.861 -3.848 5.363 1.00 0.00 C ATOM 962 C PRO A 66 19.785 -2.343 5.130 1.00 0.00 C ATOM 963 O PRO A 66 18.701 -1.789 4.945 1.00 0.00 O ATOM 964 CB PRO A 66 20.393 -4.146 6.767 1.00 0.00 C ATOM 965 CG PRO A 66 21.857 -4.354 6.581 1.00 0.00 C ATOM 966 CD PRO A 66 22.016 -4.981 5.223 1.00 0.00 C ATOM 0 HA PRO A 66 18.849 -4.214 5.189 1.00 0.00 H new ATOM 0 HB2 PRO A 66 20.194 -3.320 7.449 1.00 0.00 H new ATOM 0 HB3 PRO A 66 19.918 -5.031 7.191 1.00 0.00 H new ATOM 0 HG2 PRO A 66 22.396 -3.409 6.640 1.00 0.00 H new ATOM 0 HG3 PRO A 66 22.261 -5.001 7.359 1.00 0.00 H new ATOM 0 HD2 PRO A 66 22.945 -4.671 4.744 1.00 0.00 H new ATOM 0 HD3 PRO A 66 22.036 -6.069 5.283 1.00 0.00 H new ATOM 974 N GLU A 67 20.941 -1.688 5.141 1.00 0.00 N ATOM 975 CA GLU A 67 21.004 -0.246 4.931 1.00 0.00 C ATOM 976 C GLU A 67 20.374 0.137 3.595 1.00 0.00 C ATOM 977 O GLU A 67 19.581 1.075 3.515 1.00 0.00 O ATOM 978 CB GLU A 67 22.455 0.236 4.980 1.00 0.00 C ATOM 979 CG GLU A 67 23.204 -0.214 6.223 1.00 0.00 C ATOM 980 CD GLU A 67 24.703 -0.014 6.105 1.00 0.00 C ATOM 981 OE1 GLU A 67 25.130 0.755 5.218 1.00 0.00 O ATOM 982 OE2 GLU A 67 25.448 -0.625 6.899 1.00 0.00 O ATOM 0 H GLU A 67 21.847 -2.132 5.293 1.00 0.00 H new ATOM 0 HA GLU A 67 20.441 0.237 5.730 1.00 0.00 H new ATOM 0 HB2 GLU A 67 22.980 -0.129 4.097 1.00 0.00 H new ATOM 0 HB3 GLU A 67 22.469 1.325 4.932 1.00 0.00 H new ATOM 0 HG2 GLU A 67 22.834 0.340 7.086 1.00 0.00 H new ATOM 0 HG3 GLU A 67 22.995 -1.268 6.407 1.00 0.00 H new ATOM 989 N PHE A 68 20.734 -0.596 2.546 1.00 0.00 N ATOM 990 CA PHE A 68 20.206 -0.333 1.212 1.00 0.00 C ATOM 991 C PHE A 68 18.692 -0.147 1.253 1.00 0.00 C ATOM 992 O PHE A 68 18.155 0.793 0.667 1.00 0.00 O ATOM 993 CB PHE A 68 20.566 -1.478 0.264 1.00 0.00 C ATOM 994 CG PHE A 68 19.813 -1.439 -1.036 1.00 0.00 C ATOM 995 CD1 PHE A 68 20.154 -0.526 -2.022 1.00 0.00 C ATOM 996 CD2 PHE A 68 18.765 -2.313 -1.272 1.00 0.00 C ATOM 997 CE1 PHE A 68 19.465 -0.487 -3.219 1.00 0.00 C ATOM 998 CE2 PHE A 68 18.072 -2.280 -2.467 1.00 0.00 C ATOM 999 CZ PHE A 68 18.421 -1.365 -3.441 1.00 0.00 C ATOM 0 H PHE A 68 21.389 -1.376 2.594 1.00 0.00 H new ATOM 0 HA PHE A 68 20.657 0.589 0.845 1.00 0.00 H new ATOM 0 HB2 PHE A 68 21.636 -1.445 0.056 1.00 0.00 H new ATOM 0 HB3 PHE A 68 20.367 -2.427 0.762 1.00 0.00 H new ATOM 0 HD1 PHE A 68 20.968 0.163 -1.852 1.00 0.00 H new ATOM 0 HD2 PHE A 68 18.486 -3.029 -0.513 1.00 0.00 H new ATOM 0 HE1 PHE A 68 19.742 0.228 -3.980 1.00 0.00 H new ATOM 0 HE2 PHE A 68 17.258 -2.969 -2.639 1.00 0.00 H new ATOM 0 HZ PHE A 68 17.879 -1.336 -4.375 1.00 0.00 H new ATOM 1009 N LEU A 69 18.010 -1.050 1.949 1.00 0.00 N ATOM 1010 CA LEU A 69 16.558 -0.988 2.067 1.00 0.00 C ATOM 1011 C LEU A 69 16.101 0.424 2.422 1.00 0.00 C ATOM 1012 O LEU A 69 15.011 0.851 2.038 1.00 0.00 O ATOM 1013 CB LEU A 69 16.069 -1.976 3.127 1.00 0.00 C ATOM 1014 CG LEU A 69 16.545 -3.421 2.967 1.00 0.00 C ATOM 1015 CD1 LEU A 69 16.070 -4.272 4.135 1.00 0.00 C ATOM 1016 CD2 LEU A 69 16.055 -4.001 1.648 1.00 0.00 C ATOM 0 H LEU A 69 18.440 -1.834 2.440 1.00 0.00 H new ATOM 0 HA LEU A 69 16.128 -1.258 1.103 1.00 0.00 H new ATOM 0 HB2 LEU A 69 16.387 -1.616 4.105 1.00 0.00 H new ATOM 0 HB3 LEU A 69 14.979 -1.971 3.125 1.00 0.00 H new ATOM 0 HG LEU A 69 17.635 -3.426 2.960 1.00 0.00 H new ATOM 0 HD11 LEU A 69 16.418 -5.297 4.004 1.00 0.00 H new ATOM 0 HD12 LEU A 69 16.470 -3.869 5.065 1.00 0.00 H new ATOM 0 HD13 LEU A 69 14.981 -4.261 4.174 1.00 0.00 H new ATOM 0 HD21 LEU A 69 16.403 -5.029 1.551 1.00 0.00 H new ATOM 0 HD22 LEU A 69 14.965 -3.983 1.625 1.00 0.00 H new ATOM 0 HD23 LEU A 69 16.445 -3.407 0.822 1.00 0.00 H new ATOM 1028 N THR A 70 16.942 1.145 3.157 1.00 0.00 N ATOM 1029 CA THR A 70 16.625 2.508 3.564 1.00 0.00 C ATOM 1030 C THR A 70 16.525 3.433 2.356 1.00 0.00 C ATOM 1031 O THR A 70 15.575 4.206 2.231 1.00 0.00 O ATOM 1032 CB THR A 70 17.682 3.064 4.536 1.00 0.00 C ATOM 1033 OG1 THR A 70 17.730 2.261 5.720 1.00 0.00 O ATOM 1034 CG2 THR A 70 17.370 4.506 4.908 1.00 0.00 C ATOM 0 H THR A 70 17.848 0.807 3.482 1.00 0.00 H new ATOM 0 HA THR A 70 15.661 2.471 4.071 1.00 0.00 H new ATOM 0 HB THR A 70 18.651 3.035 4.038 1.00 0.00 H new ATOM 0 HG1 THR A 70 18.406 2.620 6.332 1.00 0.00 H new ATOM 0 HG21 THR A 70 18.130 4.877 5.595 1.00 0.00 H new ATOM 0 HG22 THR A 70 17.363 5.121 4.008 1.00 0.00 H new ATOM 0 HG23 THR A 70 16.392 4.555 5.388 1.00 0.00 H new ATOM 1042 N MET A 71 17.511 3.349 1.469 1.00 0.00 N ATOM 1043 CA MET A 71 17.532 4.178 0.269 1.00 0.00 C ATOM 1044 C MET A 71 16.328 3.881 -0.618 1.00 0.00 C ATOM 1045 O MET A 71 15.537 4.773 -0.925 1.00 0.00 O ATOM 1046 CB MET A 71 18.826 3.946 -0.513 1.00 0.00 C ATOM 1047 CG MET A 71 18.921 4.769 -1.788 1.00 0.00 C ATOM 1048 SD MET A 71 20.362 4.343 -2.785 1.00 0.00 S ATOM 1049 CE MET A 71 19.924 2.692 -3.325 1.00 0.00 C ATOM 0 H MET A 71 18.306 2.716 1.558 1.00 0.00 H new ATOM 0 HA MET A 71 17.484 5.222 0.578 1.00 0.00 H new ATOM 0 HB2 MET A 71 19.676 4.184 0.127 1.00 0.00 H new ATOM 0 HB3 MET A 71 18.903 2.889 -0.766 1.00 0.00 H new ATOM 0 HG2 MET A 71 18.018 4.620 -2.380 1.00 0.00 H new ATOM 0 HG3 MET A 71 18.962 5.827 -1.530 1.00 0.00 H new ATOM 0 HE1 MET A 71 20.748 2.010 -3.115 1.00 0.00 H new ATOM 0 HE2 MET A 71 19.033 2.359 -2.792 1.00 0.00 H new ATOM 0 HE3 MET A 71 19.724 2.701 -4.396 1.00 0.00 H new ATOM 1059 N MET A 72 16.195 2.624 -1.026 1.00 0.00 N ATOM 1060 CA MET A 72 15.085 2.211 -1.878 1.00 0.00 C ATOM 1061 C MET A 72 13.793 2.906 -1.462 1.00 0.00 C ATOM 1062 O MET A 72 12.870 3.051 -2.263 1.00 0.00 O ATOM 1063 CB MET A 72 14.904 0.693 -1.815 1.00 0.00 C ATOM 1064 CG MET A 72 15.851 -0.070 -2.727 1.00 0.00 C ATOM 1065 SD MET A 72 15.143 -1.617 -3.325 1.00 0.00 S ATOM 1066 CE MET A 72 13.937 -1.006 -4.500 1.00 0.00 C ATOM 0 H MET A 72 16.841 1.874 -0.781 1.00 0.00 H new ATOM 0 HA MET A 72 15.319 2.500 -2.903 1.00 0.00 H new ATOM 0 HB2 MET A 72 15.054 0.360 -0.788 1.00 0.00 H new ATOM 0 HB3 MET A 72 13.877 0.446 -2.083 1.00 0.00 H new ATOM 0 HG2 MET A 72 16.114 0.558 -3.578 1.00 0.00 H new ATOM 0 HG3 MET A 72 16.775 -0.282 -2.189 1.00 0.00 H new ATOM 0 HE1 MET A 72 13.673 -1.801 -5.197 1.00 0.00 H new ATOM 0 HE2 MET A 72 13.044 -0.679 -3.968 1.00 0.00 H new ATOM 0 HE3 MET A 72 14.359 -0.166 -5.051 1.00 0.00 H new ATOM 1076 N ALA A 73 13.734 3.335 -0.206 1.00 0.00 N ATOM 1077 CA ALA A 73 12.556 4.016 0.315 1.00 0.00 C ATOM 1078 C ALA A 73 12.569 5.496 -0.054 1.00 0.00 C ATOM 1079 O ALA A 73 11.574 6.033 -0.541 1.00 0.00 O ATOM 1080 CB ALA A 73 12.472 3.848 1.825 1.00 0.00 C ATOM 0 H ALA A 73 14.489 3.223 0.470 1.00 0.00 H new ATOM 0 HA ALA A 73 11.675 3.562 -0.139 1.00 0.00 H new ATOM 0 HB1 ALA A 73 11.587 4.362 2.200 1.00 0.00 H new ATOM 0 HB2 ALA A 73 12.407 2.788 2.070 1.00 0.00 H new ATOM 0 HB3 ALA A 73 13.362 4.273 2.288 1.00 0.00 H new ATOM 1086 N ARG A 74 13.702 6.149 0.181 1.00 0.00 N ATOM 1087 CA ARG A 74 13.844 7.568 -0.126 1.00 0.00 C ATOM 1088 C ARG A 74 14.046 7.783 -1.623 1.00 0.00 C ATOM 1089 O ARG A 74 13.575 8.770 -2.189 1.00 0.00 O ATOM 1090 CB ARG A 74 15.021 8.163 0.649 1.00 0.00 C ATOM 1091 CG ARG A 74 14.934 7.947 2.151 1.00 0.00 C ATOM 1092 CD ARG A 74 16.313 7.811 2.775 1.00 0.00 C ATOM 1093 NE ARG A 74 16.831 9.093 3.244 1.00 0.00 N ATOM 1094 CZ ARG A 74 16.564 9.600 4.443 1.00 0.00 C ATOM 1095 NH1 ARG A 74 15.790 8.936 5.289 1.00 0.00 N ATOM 1096 NH2 ARG A 74 17.073 10.774 4.796 1.00 0.00 N ATOM 0 H ARG A 74 14.535 5.719 0.583 1.00 0.00 H new ATOM 0 HA ARG A 74 12.926 8.073 0.175 1.00 0.00 H new ATOM 0 HB2 ARG A 74 15.947 7.723 0.280 1.00 0.00 H new ATOM 0 HB3 ARG A 74 15.074 9.233 0.447 1.00 0.00 H new ATOM 0 HG2 ARG A 74 14.407 8.783 2.610 1.00 0.00 H new ATOM 0 HG3 ARG A 74 14.350 7.050 2.357 1.00 0.00 H new ATOM 0 HD2 ARG A 74 16.266 7.112 3.610 1.00 0.00 H new ATOM 0 HD3 ARG A 74 17.002 7.388 2.044 1.00 0.00 H new ATOM 0 HE ARG A 74 17.431 9.629 2.617 1.00 0.00 H new ATOM 0 HH11 ARG A 74 15.398 8.034 5.021 1.00 0.00 H new ATOM 0 HH12 ARG A 74 15.587 9.327 6.209 1.00 0.00 H new ATOM 0 HH21 ARG A 74 17.669 11.287 4.147 1.00 0.00 H new ATOM 0 HH22 ARG A 74 16.868 11.163 5.716 1.00 0.00 H new ATOM 1110 N LYS A 75 14.750 6.853 -2.260 1.00 0.00 N ATOM 1111 CA LYS A 75 15.014 6.939 -3.691 1.00 0.00 C ATOM 1112 C LYS A 75 13.728 6.767 -4.493 1.00 0.00 C ATOM 1113 O LYS A 75 13.684 7.071 -5.685 1.00 0.00 O ATOM 1114 CB LYS A 75 16.033 5.875 -4.107 1.00 0.00 C ATOM 1115 CG LYS A 75 16.442 5.964 -5.567 1.00 0.00 C ATOM 1116 CD LYS A 75 17.161 7.269 -5.866 1.00 0.00 C ATOM 1117 CE LYS A 75 18.525 7.321 -5.197 1.00 0.00 C ATOM 1118 NZ LYS A 75 18.451 7.916 -3.833 1.00 0.00 N ATOM 0 H LYS A 75 15.148 6.030 -1.807 1.00 0.00 H new ATOM 0 HA LYS A 75 15.423 7.927 -3.901 1.00 0.00 H new ATOM 0 HB2 LYS A 75 16.921 5.971 -3.483 1.00 0.00 H new ATOM 0 HB3 LYS A 75 15.614 4.887 -3.915 1.00 0.00 H new ATOM 0 HG2 LYS A 75 17.091 5.125 -5.816 1.00 0.00 H new ATOM 0 HG3 LYS A 75 15.558 5.881 -6.199 1.00 0.00 H new ATOM 0 HD2 LYS A 75 17.279 7.382 -6.944 1.00 0.00 H new ATOM 0 HD3 LYS A 75 16.554 8.107 -5.522 1.00 0.00 H new ATOM 0 HE2 LYS A 75 18.936 6.314 -5.132 1.00 0.00 H new ATOM 0 HE3 LYS A 75 19.209 7.906 -5.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 19.126 8.704 -3.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 17.488 8.268 -3.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 18.688 7.192 -3.125 1.00 0.00 H new ATOM 1132 N MET A 76 12.684 6.281 -3.831 1.00 0.00 N ATOM 1133 CA MET A 76 11.396 6.072 -4.483 1.00 0.00 C ATOM 1134 C MET A 76 10.723 7.404 -4.796 1.00 0.00 C ATOM 1135 O MET A 76 9.991 7.526 -5.779 1.00 0.00 O ATOM 1136 CB MET A 76 10.483 5.222 -3.596 1.00 0.00 C ATOM 1137 CG MET A 76 10.497 3.744 -3.950 1.00 0.00 C ATOM 1138 SD MET A 76 9.790 3.412 -5.575 1.00 0.00 S ATOM 1139 CE MET A 76 11.268 3.050 -6.520 1.00 0.00 C ATOM 0 H MET A 76 12.704 6.024 -2.844 1.00 0.00 H new ATOM 0 HA MET A 76 11.573 5.545 -5.421 1.00 0.00 H new ATOM 0 HB2 MET A 76 10.787 5.341 -2.556 1.00 0.00 H new ATOM 0 HB3 MET A 76 9.462 5.596 -3.675 1.00 0.00 H new ATOM 0 HG2 MET A 76 11.523 3.378 -3.923 1.00 0.00 H new ATOM 0 HG3 MET A 76 9.940 3.188 -3.195 1.00 0.00 H new ATOM 0 HE1 MET A 76 11.039 2.307 -7.284 1.00 0.00 H new ATOM 0 HE2 MET A 76 11.627 3.962 -6.997 1.00 0.00 H new ATOM 0 HE3 MET A 76 12.039 2.661 -5.855 1.00 0.00 H new ATOM 1149 N LYS A 77 10.974 8.402 -3.955 1.00 0.00 N ATOM 1150 CA LYS A 77 10.394 9.726 -4.142 1.00 0.00 C ATOM 1151 C LYS A 77 11.280 10.587 -5.037 1.00 0.00 C ATOM 1152 O LYS A 77 10.788 11.433 -5.784 1.00 0.00 O ATOM 1153 CB LYS A 77 10.196 10.414 -2.789 1.00 0.00 C ATOM 1154 CG LYS A 77 11.450 11.089 -2.261 1.00 0.00 C ATOM 1155 CD LYS A 77 11.547 12.531 -2.732 1.00 0.00 C ATOM 1156 CE LYS A 77 10.612 13.438 -1.946 1.00 0.00 C ATOM 1157 NZ LYS A 77 11.088 13.650 -0.551 1.00 0.00 N ATOM 0 H LYS A 77 11.576 8.318 -3.136 1.00 0.00 H new ATOM 0 HA LYS A 77 9.425 9.606 -4.627 1.00 0.00 H new ATOM 0 HB2 LYS A 77 9.405 11.158 -2.881 1.00 0.00 H new ATOM 0 HB3 LYS A 77 9.857 9.676 -2.062 1.00 0.00 H new ATOM 0 HG2 LYS A 77 11.449 11.060 -1.171 1.00 0.00 H new ATOM 0 HG3 LYS A 77 12.329 10.537 -2.593 1.00 0.00 H new ATOM 0 HD2 LYS A 77 12.573 12.882 -2.623 1.00 0.00 H new ATOM 0 HD3 LYS A 77 11.302 12.586 -3.793 1.00 0.00 H new ATOM 0 HE2 LYS A 77 10.529 14.400 -2.452 1.00 0.00 H new ATOM 0 HE3 LYS A 77 9.614 13.001 -1.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 10.583 14.456 -0.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 10.905 12.795 0.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 12.109 13.847 -0.559 1.00 0.00 H new ATOM 1171 N ASP A 78 12.587 10.364 -4.958 1.00 0.00 N ATOM 1172 CA ASP A 78 13.541 11.117 -5.763 1.00 0.00 C ATOM 1173 C ASP A 78 13.192 11.028 -7.245 1.00 0.00 C ATOM 1174 O ASP A 78 13.422 11.968 -8.007 1.00 0.00 O ATOM 1175 CB ASP A 78 14.961 10.598 -5.529 1.00 0.00 C ATOM 1176 CG ASP A 78 15.614 11.226 -4.313 1.00 0.00 C ATOM 1177 OD1 ASP A 78 14.889 11.536 -3.344 1.00 0.00 O ATOM 1178 OD2 ASP A 78 16.849 11.408 -4.331 1.00 0.00 O ATOM 0 H ASP A 78 13.010 9.668 -4.344 1.00 0.00 H new ATOM 0 HA ASP A 78 13.490 12.162 -5.458 1.00 0.00 H new ATOM 0 HB2 ASP A 78 14.933 9.515 -5.404 1.00 0.00 H new ATOM 0 HB3 ASP A 78 15.569 10.802 -6.410 1.00 0.00 H new ATOM 1183 N THR A 79 12.634 9.890 -7.649 1.00 0.00 N ATOM 1184 CA THR A 79 12.255 9.677 -9.040 1.00 0.00 C ATOM 1185 C THR A 79 10.884 10.275 -9.334 1.00 0.00 C ATOM 1186 O THR A 79 10.534 10.511 -10.491 1.00 0.00 O ATOM 1187 CB THR A 79 12.235 8.177 -9.393 1.00 0.00 C ATOM 1188 OG1 THR A 79 13.530 7.606 -9.175 1.00 0.00 O ATOM 1189 CG2 THR A 79 11.819 7.968 -10.841 1.00 0.00 C ATOM 0 H THR A 79 12.435 9.102 -7.032 1.00 0.00 H new ATOM 0 HA THR A 79 13.005 10.177 -9.652 1.00 0.00 H new ATOM 0 HB THR A 79 11.508 7.683 -8.748 1.00 0.00 H new ATOM 0 HG1 THR A 79 13.509 6.652 -9.400 1.00 0.00 H new ATOM 0 HG21 THR A 79 11.812 6.902 -11.067 1.00 0.00 H new ATOM 0 HG22 THR A 79 10.821 8.378 -10.996 1.00 0.00 H new ATOM 0 HG23 THR A 79 12.525 8.474 -11.499 1.00 0.00 H new ATOM 1197 N ASP A 80 10.112 10.519 -8.281 1.00 0.00 N ATOM 1198 CA ASP A 80 8.779 11.091 -8.427 1.00 0.00 C ATOM 1199 C ASP A 80 8.773 12.194 -9.481 1.00 0.00 C ATOM 1200 O ASP A 80 7.782 12.390 -10.183 1.00 0.00 O ATOM 1201 CB ASP A 80 8.290 11.646 -7.088 1.00 0.00 C ATOM 1202 CG ASP A 80 6.777 11.714 -7.007 1.00 0.00 C ATOM 1203 OD1 ASP A 80 6.201 12.714 -7.484 1.00 0.00 O ATOM 1204 OD2 ASP A 80 6.170 10.766 -6.467 1.00 0.00 O ATOM 0 H ASP A 80 10.386 10.330 -7.317 1.00 0.00 H new ATOM 0 HA ASP A 80 8.104 10.299 -8.752 1.00 0.00 H new ATOM 0 HB2 ASP A 80 8.666 11.020 -6.279 1.00 0.00 H new ATOM 0 HB3 ASP A 80 8.704 12.643 -6.938 1.00 0.00 H new ATOM 1209 N SER A 81 9.887 12.912 -9.585 1.00 0.00 N ATOM 1210 CA SER A 81 10.009 13.998 -10.550 1.00 0.00 C ATOM 1211 C SER A 81 9.319 13.639 -11.862 1.00 0.00 C ATOM 1212 O SER A 81 8.825 14.512 -12.575 1.00 0.00 O ATOM 1213 CB SER A 81 11.483 14.318 -10.806 1.00 0.00 C ATOM 1214 OG SER A 81 12.129 14.735 -9.615 1.00 0.00 O ATOM 0 H SER A 81 10.718 12.761 -9.013 1.00 0.00 H new ATOM 0 HA SER A 81 9.521 14.879 -10.132 1.00 0.00 H new ATOM 0 HB2 SER A 81 11.985 13.437 -11.207 1.00 0.00 H new ATOM 0 HB3 SER A 81 11.563 15.101 -11.560 1.00 0.00 H new ATOM 0 HG SER A 81 13.070 14.932 -9.805 1.00 0.00 H new ATOM 1220 N GLU A 82 9.291 12.347 -12.175 1.00 0.00 N ATOM 1221 CA GLU A 82 8.663 11.872 -13.402 1.00 0.00 C ATOM 1222 C GLU A 82 7.463 12.740 -13.770 1.00 0.00 C ATOM 1223 O GLU A 82 7.373 13.249 -14.887 1.00 0.00 O ATOM 1224 CB GLU A 82 8.223 10.415 -13.245 1.00 0.00 C ATOM 1225 CG GLU A 82 7.529 9.853 -14.474 1.00 0.00 C ATOM 1226 CD GLU A 82 6.883 8.506 -14.214 1.00 0.00 C ATOM 1227 OE1 GLU A 82 6.498 8.245 -13.055 1.00 0.00 O ATOM 1228 OE2 GLU A 82 6.762 7.713 -15.171 1.00 0.00 O ATOM 0 H GLU A 82 9.696 11.611 -11.596 1.00 0.00 H new ATOM 0 HA GLU A 82 9.397 11.938 -14.205 1.00 0.00 H new ATOM 0 HB2 GLU A 82 9.096 9.803 -13.020 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.550 10.337 -12.391 1.00 0.00 H new ATOM 0 HG2 GLU A 82 6.769 10.557 -14.811 1.00 0.00 H new ATOM 0 HG3 GLU A 82 8.253 9.754 -15.283 1.00 0.00 H new ATOM 1235 N GLU A 83 6.545 12.902 -12.823 1.00 0.00 N ATOM 1236 CA GLU A 83 5.350 13.707 -13.049 1.00 0.00 C ATOM 1237 C GLU A 83 5.721 15.130 -13.458 1.00 0.00 C ATOM 1238 O GLU A 83 5.253 15.636 -14.477 1.00 0.00 O ATOM 1239 CB GLU A 83 4.482 13.737 -11.789 1.00 0.00 C ATOM 1240 CG GLU A 83 4.016 12.363 -11.339 1.00 0.00 C ATOM 1241 CD GLU A 83 2.687 12.408 -10.609 1.00 0.00 C ATOM 1242 OE1 GLU A 83 2.475 13.353 -9.820 1.00 0.00 O ATOM 1243 OE2 GLU A 83 1.860 11.498 -10.827 1.00 0.00 O ATOM 0 H GLU A 83 6.605 12.487 -11.893 1.00 0.00 H new ATOM 0 HA GLU A 83 4.784 13.250 -13.861 1.00 0.00 H new ATOM 0 HB2 GLU A 83 5.045 14.203 -10.981 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.610 14.365 -11.973 1.00 0.00 H new ATOM 0 HG2 GLU A 83 3.927 11.711 -12.208 1.00 0.00 H new ATOM 0 HG3 GLU A 83 4.770 11.923 -10.686 1.00 0.00 H new ATOM 1250 N GLU A 84 6.566 15.768 -12.655 1.00 0.00 N ATOM 1251 CA GLU A 84 7.000 17.133 -12.932 1.00 0.00 C ATOM 1252 C GLU A 84 7.237 17.335 -14.426 1.00 0.00 C ATOM 1253 O GLU A 84 7.105 18.446 -14.941 1.00 0.00 O ATOM 1254 CB GLU A 84 8.277 17.455 -12.153 1.00 0.00 C ATOM 1255 CG GLU A 84 8.067 17.550 -10.652 1.00 0.00 C ATOM 1256 CD GLU A 84 7.339 18.817 -10.244 1.00 0.00 C ATOM 1257 OE1 GLU A 84 8.013 19.849 -10.043 1.00 0.00 O ATOM 1258 OE2 GLU A 84 6.097 18.776 -10.125 1.00 0.00 O ATOM 0 H GLU A 84 6.964 15.362 -11.808 1.00 0.00 H new ATOM 0 HA GLU A 84 6.209 17.811 -12.612 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.022 16.686 -12.359 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.685 18.399 -12.515 1.00 0.00 H new ATOM 0 HG2 GLU A 84 7.499 16.684 -10.313 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.034 17.513 -10.150 1.00 0.00 H new ATOM 1265 N ILE A 85 7.588 16.255 -15.115 1.00 0.00 N ATOM 1266 CA ILE A 85 7.844 16.313 -16.549 1.00 0.00 C ATOM 1267 C ILE A 85 6.559 16.108 -17.344 1.00 0.00 C ATOM 1268 O ILE A 85 6.357 16.729 -18.388 1.00 0.00 O ATOM 1269 CB ILE A 85 8.877 15.255 -16.980 1.00 0.00 C ATOM 1270 CG1 ILE A 85 10.152 15.386 -16.145 1.00 0.00 C ATOM 1271 CG2 ILE A 85 9.190 15.395 -18.462 1.00 0.00 C ATOM 1272 CD1 ILE A 85 11.164 14.294 -16.413 1.00 0.00 C ATOM 0 H ILE A 85 7.702 15.329 -14.703 1.00 0.00 H new ATOM 0 HA ILE A 85 8.244 17.305 -16.759 1.00 0.00 H new ATOM 0 HB ILE A 85 8.455 14.265 -16.810 1.00 0.00 H new ATOM 0 HG12 ILE A 85 10.611 16.354 -16.347 1.00 0.00 H new ATOM 0 HG13 ILE A 85 9.887 15.373 -15.088 1.00 0.00 H new ATOM 0 HG21 ILE A 85 9.921 14.641 -18.752 1.00 0.00 H new ATOM 0 HG22 ILE A 85 8.277 15.257 -19.041 1.00 0.00 H new ATOM 0 HG23 ILE A 85 9.596 16.388 -18.656 1.00 0.00 H new ATOM 0 HD11 ILE A 85 12.042 14.450 -15.787 1.00 0.00 H new ATOM 0 HD12 ILE A 85 10.722 13.324 -16.183 1.00 0.00 H new ATOM 0 HD13 ILE A 85 11.458 14.320 -17.462 1.00 0.00 H new ATOM 1284 N ARG A 86 5.693 15.232 -16.844 1.00 0.00 N ATOM 1285 CA ARG A 86 4.428 14.945 -17.508 1.00 0.00 C ATOM 1286 C ARG A 86 3.799 16.223 -18.056 1.00 0.00 C ATOM 1287 O ARG A 86 3.543 16.335 -19.254 1.00 0.00 O ATOM 1288 CB ARG A 86 3.461 14.264 -16.537 1.00 0.00 C ATOM 1289 CG ARG A 86 3.791 12.804 -16.274 1.00 0.00 C ATOM 1290 CD ARG A 86 3.063 11.885 -17.242 1.00 0.00 C ATOM 1291 NE ARG A 86 1.613 11.965 -17.088 1.00 0.00 N ATOM 1292 CZ ARG A 86 0.782 10.988 -17.433 1.00 0.00 C ATOM 1293 NH1 ARG A 86 1.255 9.862 -17.948 1.00 0.00 N ATOM 1294 NH2 ARG A 86 -0.526 11.136 -17.262 1.00 0.00 N ATOM 0 H ARG A 86 5.845 14.709 -15.981 1.00 0.00 H new ATOM 0 HA ARG A 86 4.629 14.273 -18.342 1.00 0.00 H new ATOM 0 HB2 ARG A 86 3.468 14.805 -15.591 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.449 14.333 -16.937 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.866 12.651 -16.364 1.00 0.00 H new ATOM 0 HG3 ARG A 86 3.517 12.547 -15.251 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.334 12.148 -18.265 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.388 10.857 -17.080 1.00 0.00 H new ATOM 0 HE ARG A 86 1.217 12.818 -16.694 1.00 0.00 H new ATOM 0 HH11 ARG A 86 2.259 9.744 -18.080 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.614 9.113 -18.212 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.894 12.001 -16.865 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.163 10.385 -17.527 1.00 0.00 H new ATOM 1308 N GLU A 87 3.552 17.182 -17.169 1.00 0.00 N ATOM 1309 CA GLU A 87 2.952 18.451 -17.565 1.00 0.00 C ATOM 1310 C GLU A 87 3.445 18.879 -18.944 1.00 0.00 C ATOM 1311 O GLU A 87 2.650 19.185 -19.832 1.00 0.00 O ATOM 1312 CB GLU A 87 3.275 19.536 -16.536 1.00 0.00 C ATOM 1313 CG GLU A 87 2.646 19.291 -15.175 1.00 0.00 C ATOM 1314 CD GLU A 87 1.187 19.701 -15.125 1.00 0.00 C ATOM 1315 OE1 GLU A 87 0.908 20.915 -15.214 1.00 0.00 O ATOM 1316 OE2 GLU A 87 0.324 18.807 -14.996 1.00 0.00 O ATOM 0 H GLU A 87 3.758 17.105 -16.173 1.00 0.00 H new ATOM 0 HA GLU A 87 1.872 18.314 -17.611 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.357 19.604 -16.420 1.00 0.00 H new ATOM 0 HB3 GLU A 87 2.934 20.499 -16.916 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.731 18.234 -14.924 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.201 19.844 -14.417 1.00 0.00 H new ATOM 1323 N ALA A 88 4.763 18.899 -19.115 1.00 0.00 N ATOM 1324 CA ALA A 88 5.362 19.288 -20.386 1.00 0.00 C ATOM 1325 C ALA A 88 4.822 18.439 -21.531 1.00 0.00 C ATOM 1326 O ALA A 88 4.404 18.964 -22.563 1.00 0.00 O ATOM 1327 CB ALA A 88 6.878 19.174 -20.311 1.00 0.00 C ATOM 0 H ALA A 88 5.436 18.651 -18.390 1.00 0.00 H new ATOM 0 HA ALA A 88 5.095 20.326 -20.582 1.00 0.00 H new ATOM 0 HB1 ALA A 88 7.313 19.467 -21.267 1.00 0.00 H new ATOM 0 HB2 ALA A 88 7.254 19.829 -19.525 1.00 0.00 H new ATOM 0 HB3 ALA A 88 7.155 18.144 -20.088 1.00 0.00 H new ATOM 1333 N PHE A 89 4.833 17.123 -21.343 1.00 0.00 N ATOM 1334 CA PHE A 89 4.346 16.201 -22.361 1.00 0.00 C ATOM 1335 C PHE A 89 2.950 16.600 -22.833 1.00 0.00 C ATOM 1336 O PHE A 89 2.659 16.582 -24.029 1.00 0.00 O ATOM 1337 CB PHE A 89 4.322 14.771 -21.816 1.00 0.00 C ATOM 1338 CG PHE A 89 3.339 13.878 -22.517 1.00 0.00 C ATOM 1339 CD1 PHE A 89 3.653 13.305 -23.738 1.00 0.00 C ATOM 1340 CD2 PHE A 89 2.101 13.612 -21.954 1.00 0.00 C ATOM 1341 CE1 PHE A 89 2.749 12.483 -24.386 1.00 0.00 C ATOM 1342 CE2 PHE A 89 1.194 12.791 -22.596 1.00 0.00 C ATOM 1343 CZ PHE A 89 1.519 12.225 -23.813 1.00 0.00 C ATOM 0 H PHE A 89 5.174 16.672 -20.494 1.00 0.00 H new ATOM 0 HA PHE A 89 5.026 16.247 -23.212 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.319 14.340 -21.905 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.081 14.800 -20.753 1.00 0.00 H new ATOM 0 HD1 PHE A 89 4.614 13.502 -24.189 1.00 0.00 H new ATOM 0 HD2 PHE A 89 1.842 14.052 -21.002 1.00 0.00 H new ATOM 0 HE1 PHE A 89 3.005 12.043 -25.339 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.232 12.592 -22.147 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.812 11.582 -24.316 1.00 0.00 H new ATOM 1353 N ARG A 90 2.092 16.959 -21.884 1.00 0.00 N ATOM 1354 CA ARG A 90 0.727 17.361 -22.202 1.00 0.00 C ATOM 1355 C ARG A 90 0.718 18.539 -23.172 1.00 0.00 C ATOM 1356 O ARG A 90 0.063 18.494 -24.213 1.00 0.00 O ATOM 1357 CB ARG A 90 -0.028 17.733 -20.924 1.00 0.00 C ATOM 1358 CG ARG A 90 -0.364 16.540 -20.045 1.00 0.00 C ATOM 1359 CD ARG A 90 -0.595 16.959 -18.602 1.00 0.00 C ATOM 1360 NE ARG A 90 -1.328 15.944 -17.848 1.00 0.00 N ATOM 1361 CZ ARG A 90 -2.652 15.841 -17.850 1.00 0.00 C ATOM 1362 NH1 ARG A 90 -3.385 16.686 -18.562 1.00 0.00 N ATOM 1363 NH2 ARG A 90 -3.246 14.891 -17.139 1.00 0.00 N ATOM 0 H ARG A 90 2.317 16.980 -20.889 1.00 0.00 H new ATOM 0 HA ARG A 90 0.228 16.517 -22.679 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.573 18.439 -20.350 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -0.951 18.246 -21.194 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -1.256 16.044 -20.428 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.448 15.814 -20.089 1.00 0.00 H new ATOM 0 HD2 ARG A 90 0.365 17.145 -18.121 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.150 17.897 -18.581 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.793 15.278 -17.290 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -2.932 17.417 -19.110 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -4.402 16.605 -18.562 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -2.686 14.239 -16.590 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -4.263 14.813 -17.141 1.00 0.00 H new ATOM 1377 N VAL A 91 1.450 19.592 -22.823 1.00 0.00 N ATOM 1378 CA VAL A 91 1.527 20.782 -23.662 1.00 0.00 C ATOM 1379 C VAL A 91 1.718 20.408 -25.128 1.00 0.00 C ATOM 1380 O VAL A 91 0.952 20.832 -25.993 1.00 0.00 O ATOM 1381 CB VAL A 91 2.680 21.704 -23.224 1.00 0.00 C ATOM 1382 CG1 VAL A 91 2.780 22.909 -24.146 1.00 0.00 C ATOM 1383 CG2 VAL A 91 2.493 22.141 -21.779 1.00 0.00 C ATOM 0 H VAL A 91 1.998 19.645 -21.965 1.00 0.00 H new ATOM 0 HA VAL A 91 0.583 21.314 -23.545 1.00 0.00 H new ATOM 0 HB VAL A 91 3.614 21.146 -23.293 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.600 23.549 -23.821 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.965 22.572 -25.166 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.847 23.471 -24.113 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.317 22.792 -21.486 1.00 0.00 H new ATOM 0 HG22 VAL A 91 1.551 22.681 -21.681 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.477 21.263 -21.133 1.00 0.00 H new ATOM 1393 N PHE A 92 2.747 19.612 -25.400 1.00 0.00 N ATOM 1394 CA PHE A 92 3.040 19.181 -26.762 1.00 0.00 C ATOM 1395 C PHE A 92 1.851 18.438 -27.365 1.00 0.00 C ATOM 1396 O PHE A 92 1.430 18.724 -28.486 1.00 0.00 O ATOM 1397 CB PHE A 92 4.279 18.284 -26.780 1.00 0.00 C ATOM 1398 CG PHE A 92 5.571 19.043 -26.677 1.00 0.00 C ATOM 1399 CD1 PHE A 92 6.086 19.394 -25.439 1.00 0.00 C ATOM 1400 CD2 PHE A 92 6.270 19.406 -27.816 1.00 0.00 C ATOM 1401 CE1 PHE A 92 7.274 20.093 -25.341 1.00 0.00 C ATOM 1402 CE2 PHE A 92 7.459 20.106 -27.724 1.00 0.00 C ATOM 1403 CZ PHE A 92 7.962 20.448 -26.485 1.00 0.00 C ATOM 0 H PHE A 92 3.391 19.253 -24.696 1.00 0.00 H new ATOM 0 HA PHE A 92 3.234 20.069 -27.364 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.217 17.575 -25.954 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.282 17.701 -27.701 1.00 0.00 H new ATOM 0 HD1 PHE A 92 5.553 19.118 -24.541 1.00 0.00 H new ATOM 0 HD2 PHE A 92 5.882 19.139 -28.788 1.00 0.00 H new ATOM 0 HE1 PHE A 92 7.664 20.362 -24.370 1.00 0.00 H new ATOM 0 HE2 PHE A 92 7.993 20.385 -28.620 1.00 0.00 H new ATOM 0 HZ PHE A 92 8.892 20.992 -26.410 1.00 0.00 H new ATOM 1413 N ASP A 93 1.316 17.482 -26.614 1.00 0.00 N ATOM 1414 CA ASP A 93 0.176 16.697 -27.073 1.00 0.00 C ATOM 1415 C ASP A 93 -1.076 17.564 -27.173 1.00 0.00 C ATOM 1416 O ASP A 93 -1.764 17.797 -26.179 1.00 0.00 O ATOM 1417 CB ASP A 93 -0.077 15.523 -26.126 1.00 0.00 C ATOM 1418 CG ASP A 93 -0.866 14.408 -26.784 1.00 0.00 C ATOM 1419 OD1 ASP A 93 -0.726 14.227 -28.011 1.00 0.00 O ATOM 1420 OD2 ASP A 93 -1.624 13.717 -26.071 1.00 0.00 O ATOM 0 H ASP A 93 1.653 17.232 -25.685 1.00 0.00 H new ATOM 0 HA ASP A 93 0.409 16.310 -28.065 1.00 0.00 H new ATOM 0 HB2 ASP A 93 0.878 15.131 -25.775 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -0.618 15.878 -25.248 1.00 0.00 H new ATOM 1425 N LYS A 94 -1.364 18.041 -28.380 1.00 0.00 N ATOM 1426 CA LYS A 94 -2.532 18.882 -28.611 1.00 0.00 C ATOM 1427 C LYS A 94 -3.820 18.081 -28.449 1.00 0.00 C ATOM 1428 O LYS A 94 -4.628 18.360 -27.562 1.00 0.00 O ATOM 1429 CB LYS A 94 -2.474 19.496 -30.012 1.00 0.00 C ATOM 1430 CG LYS A 94 -1.700 20.802 -30.072 1.00 0.00 C ATOM 1431 CD LYS A 94 -2.218 21.706 -31.177 1.00 0.00 C ATOM 1432 CE LYS A 94 -1.486 21.460 -32.488 1.00 0.00 C ATOM 1433 NZ LYS A 94 -1.654 22.593 -33.439 1.00 0.00 N ATOM 0 H LYS A 94 -0.804 17.859 -29.213 1.00 0.00 H new ATOM 0 HA LYS A 94 -2.526 19.681 -27.870 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.016 18.780 -30.695 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.490 19.669 -30.366 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.777 21.316 -29.114 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -0.643 20.593 -30.237 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.285 21.536 -31.318 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.098 22.748 -30.882 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.425 21.308 -32.288 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.859 20.544 -32.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -0.746 22.793 -33.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.363 22.341 -34.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.971 23.437 -32.921 1.00 0.00 H new ATOM 1447 N ASP A 95 -4.005 17.085 -29.309 1.00 0.00 N ATOM 1448 CA ASP A 95 -5.194 16.242 -29.259 1.00 0.00 C ATOM 1449 C ASP A 95 -5.407 15.686 -27.854 1.00 0.00 C ATOM 1450 O ASP A 95 -6.526 15.672 -27.344 1.00 0.00 O ATOM 1451 CB ASP A 95 -5.074 15.095 -30.263 1.00 0.00 C ATOM 1452 CG ASP A 95 -3.943 14.145 -29.924 1.00 0.00 C ATOM 1453 OD1 ASP A 95 -2.939 14.603 -29.339 1.00 0.00 O ATOM 1454 OD2 ASP A 95 -4.061 12.943 -30.244 1.00 0.00 O ATOM 0 H ASP A 95 -3.347 16.842 -30.049 1.00 0.00 H new ATOM 0 HA ASP A 95 -6.056 16.855 -29.522 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -6.013 14.542 -30.292 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -4.914 15.504 -31.260 1.00 0.00 H new ATOM 1459 N GLY A 96 -4.323 15.226 -27.235 1.00 0.00 N ATOM 1460 CA GLY A 96 -4.413 14.674 -25.896 1.00 0.00 C ATOM 1461 C GLY A 96 -4.783 13.204 -25.899 1.00 0.00 C ATOM 1462 O GLY A 96 -5.637 12.770 -25.127 1.00 0.00 O ATOM 0 H GLY A 96 -3.385 15.226 -27.637 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.458 14.804 -25.388 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.156 15.231 -25.326 1.00 0.00 H new ATOM 1466 N ASN A 97 -4.140 12.435 -26.772 1.00 0.00 N ATOM 1467 CA ASN A 97 -4.408 11.005 -26.874 1.00 0.00 C ATOM 1468 C ASN A 97 -3.296 10.195 -26.213 1.00 0.00 C ATOM 1469 O ASN A 97 -3.560 9.244 -25.478 1.00 0.00 O ATOM 1470 CB ASN A 97 -4.550 10.595 -28.341 1.00 0.00 C ATOM 1471 CG ASN A 97 -3.208 10.452 -29.034 1.00 0.00 C ATOM 1472 OD1 ASN A 97 -2.456 11.418 -29.160 1.00 0.00 O ATOM 1473 ND2 ASN A 97 -2.903 9.242 -29.487 1.00 0.00 N ATOM 0 H ASN A 97 -3.430 12.778 -27.419 1.00 0.00 H new ATOM 0 HA ASN A 97 -5.343 10.798 -26.354 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -5.089 9.650 -28.401 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -5.150 11.338 -28.867 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -2.014 9.084 -29.962 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -3.557 8.470 -29.360 1.00 0.00 H new ATOM 1480 N GLY A 98 -2.052 10.580 -26.480 1.00 0.00 N ATOM 1481 CA GLY A 98 -0.919 9.879 -25.904 1.00 0.00 C ATOM 1482 C GLY A 98 0.341 10.034 -26.732 1.00 0.00 C ATOM 1483 O GLY A 98 1.432 10.206 -26.189 1.00 0.00 O ATOM 0 H GLY A 98 -1.808 11.365 -27.085 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -0.737 10.255 -24.897 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.160 8.820 -25.810 1.00 0.00 H new ATOM 1487 N TYR A 99 0.192 9.972 -28.051 1.00 0.00 N ATOM 1488 CA TYR A 99 1.327 10.103 -28.956 1.00 0.00 C ATOM 1489 C TYR A 99 1.403 11.512 -29.535 1.00 0.00 C ATOM 1490 O TYR A 99 0.394 12.076 -29.959 1.00 0.00 O ATOM 1491 CB TYR A 99 1.225 9.079 -30.087 1.00 0.00 C ATOM 1492 CG TYR A 99 1.562 7.668 -29.660 1.00 0.00 C ATOM 1493 CD1 TYR A 99 0.848 7.039 -28.648 1.00 0.00 C ATOM 1494 CD2 TYR A 99 2.593 6.965 -30.269 1.00 0.00 C ATOM 1495 CE1 TYR A 99 1.153 5.751 -28.253 1.00 0.00 C ATOM 1496 CE2 TYR A 99 2.904 5.675 -29.883 1.00 0.00 C ATOM 1497 CZ TYR A 99 2.181 5.073 -28.874 1.00 0.00 C ATOM 1498 OH TYR A 99 2.487 3.789 -28.485 1.00 0.00 O ATOM 0 H TYR A 99 -0.704 9.832 -28.517 1.00 0.00 H new ATOM 0 HA TYR A 99 2.237 9.915 -28.386 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.212 9.095 -30.490 1.00 0.00 H new ATOM 0 HB3 TYR A 99 1.894 9.375 -30.895 1.00 0.00 H new ATOM 0 HD1 TYR A 99 0.041 7.566 -28.162 1.00 0.00 H new ATOM 0 HD2 TYR A 99 3.162 7.434 -31.058 1.00 0.00 H new ATOM 0 HE1 TYR A 99 0.590 5.278 -27.462 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.708 5.142 -30.368 1.00 0.00 H new ATOM 0 HH TYR A 99 3.235 3.454 -29.022 1.00 0.00 H new ATOM 1508 N ILE A 100 2.607 12.075 -29.550 1.00 0.00 N ATOM 1509 CA ILE A 100 2.816 13.417 -30.078 1.00 0.00 C ATOM 1510 C ILE A 100 3.332 13.369 -31.512 1.00 0.00 C ATOM 1511 O ILE A 100 4.523 13.168 -31.748 1.00 0.00 O ATOM 1512 CB ILE A 100 3.809 14.215 -29.213 1.00 0.00 C ATOM 1513 CG1 ILE A 100 3.295 14.325 -27.777 1.00 0.00 C ATOM 1514 CG2 ILE A 100 4.038 15.597 -29.807 1.00 0.00 C ATOM 1515 CD1 ILE A 100 4.354 14.754 -26.786 1.00 0.00 C ATOM 0 H ILE A 100 3.452 11.622 -29.202 1.00 0.00 H new ATOM 0 HA ILE A 100 1.848 13.917 -30.059 1.00 0.00 H new ATOM 0 HB ILE A 100 4.761 13.685 -29.198 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.472 15.039 -27.748 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.891 13.360 -27.470 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.742 16.149 -29.184 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.444 15.498 -30.813 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.092 16.136 -29.849 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.918 14.811 -25.789 1.00 0.00 H new ATOM 0 HD12 ILE A 100 5.167 14.028 -26.786 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.741 15.733 -27.068 1.00 0.00 H new ATOM 1527 N SER A 101 2.427 13.557 -32.468 1.00 0.00 N ATOM 1528 CA SER A 101 2.790 13.533 -33.880 1.00 0.00 C ATOM 1529 C SER A 101 3.728 14.687 -34.219 1.00 0.00 C ATOM 1530 O SER A 101 3.906 15.611 -33.425 1.00 0.00 O ATOM 1531 CB SER A 101 1.535 13.608 -34.752 1.00 0.00 C ATOM 1532 OG SER A 101 0.786 14.777 -34.468 1.00 0.00 O ATOM 0 H SER A 101 1.437 13.728 -32.290 1.00 0.00 H new ATOM 0 HA SER A 101 3.308 12.595 -34.081 1.00 0.00 H new ATOM 0 HB2 SER A 101 1.819 13.601 -35.804 1.00 0.00 H new ATOM 0 HB3 SER A 101 0.917 12.726 -34.582 1.00 0.00 H new ATOM 0 HG SER A 101 -0.010 14.802 -35.039 1.00 0.00 H new ATOM 1538 N ALA A 102 4.328 14.626 -35.404 1.00 0.00 N ATOM 1539 CA ALA A 102 5.247 15.665 -35.850 1.00 0.00 C ATOM 1540 C ALA A 102 4.543 17.014 -35.950 1.00 0.00 C ATOM 1541 O ALA A 102 5.082 18.039 -35.533 1.00 0.00 O ATOM 1542 CB ALA A 102 5.861 15.288 -37.190 1.00 0.00 C ATOM 0 H ALA A 102 4.193 13.867 -36.072 1.00 0.00 H new ATOM 0 HA ALA A 102 6.043 15.753 -35.110 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.545 16.074 -37.511 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.407 14.350 -37.089 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.071 15.170 -37.932 1.00 0.00 H new ATOM 1548 N ALA A 103 3.335 17.007 -36.505 1.00 0.00 N ATOM 1549 CA ALA A 103 2.557 18.230 -36.658 1.00 0.00 C ATOM 1550 C ALA A 103 2.201 18.827 -35.301 1.00 0.00 C ATOM 1551 O ALA A 103 2.394 20.020 -35.069 1.00 0.00 O ATOM 1552 CB ALA A 103 1.296 17.956 -37.465 1.00 0.00 C ATOM 0 H ALA A 103 2.874 16.167 -36.856 1.00 0.00 H new ATOM 0 HA ALA A 103 3.168 18.956 -37.195 1.00 0.00 H new ATOM 0 HB1 ALA A 103 0.725 18.878 -37.571 1.00 0.00 H new ATOM 0 HB2 ALA A 103 1.570 17.583 -38.452 1.00 0.00 H new ATOM 0 HB3 ALA A 103 0.689 17.211 -36.950 1.00 0.00 H new ATOM 1558 N GLU A 104 1.678 17.990 -34.410 1.00 0.00 N ATOM 1559 CA GLU A 104 1.293 18.438 -33.077 1.00 0.00 C ATOM 1560 C GLU A 104 2.443 19.175 -32.397 1.00 0.00 C ATOM 1561 O GLU A 104 2.297 20.323 -31.974 1.00 0.00 O ATOM 1562 CB GLU A 104 0.860 17.247 -32.220 1.00 0.00 C ATOM 1563 CG GLU A 104 -0.581 16.823 -32.452 1.00 0.00 C ATOM 1564 CD GLU A 104 -1.041 15.760 -31.473 1.00 0.00 C ATOM 1565 OE1 GLU A 104 -0.845 15.953 -30.254 1.00 0.00 O ATOM 1566 OE2 GLU A 104 -1.596 14.737 -31.924 1.00 0.00 O ATOM 0 H GLU A 104 1.511 16.999 -34.587 1.00 0.00 H new ATOM 0 HA GLU A 104 0.454 19.126 -33.182 1.00 0.00 H new ATOM 0 HB2 GLU A 104 1.517 16.402 -32.428 1.00 0.00 H new ATOM 0 HB3 GLU A 104 0.991 17.500 -31.168 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -1.230 17.694 -32.368 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.685 16.445 -33.469 1.00 0.00 H new ATOM 1573 N LEU A 105 3.588 18.508 -32.295 1.00 0.00 N ATOM 1574 CA LEU A 105 4.764 19.099 -31.667 1.00 0.00 C ATOM 1575 C LEU A 105 5.283 20.279 -32.482 1.00 0.00 C ATOM 1576 O LEU A 105 5.592 21.337 -31.934 1.00 0.00 O ATOM 1577 CB LEU A 105 5.865 18.049 -31.512 1.00 0.00 C ATOM 1578 CG LEU A 105 7.255 18.580 -31.161 1.00 0.00 C ATOM 1579 CD1 LEU A 105 8.033 17.550 -30.356 1.00 0.00 C ATOM 1580 CD2 LEU A 105 8.016 18.959 -32.423 1.00 0.00 C ATOM 0 H LEU A 105 3.726 17.558 -32.639 1.00 0.00 H new ATOM 0 HA LEU A 105 4.474 19.462 -30.681 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.561 17.345 -30.738 1.00 0.00 H new ATOM 0 HB3 LEU A 105 5.937 17.487 -32.443 1.00 0.00 H new ATOM 0 HG LEU A 105 7.137 19.475 -30.550 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.020 17.946 -30.116 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.496 17.328 -29.434 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.141 16.637 -30.941 1.00 0.00 H new ATOM 0 HD21 LEU A 105 9.003 19.335 -32.154 1.00 0.00 H new ATOM 0 HD22 LEU A 105 8.123 18.081 -33.060 1.00 0.00 H new ATOM 0 HD23 LEU A 105 7.467 19.733 -32.960 1.00 0.00 H new ATOM 1592 N ARG A 106 5.373 20.091 -33.795 1.00 0.00 N ATOM 1593 CA ARG A 106 5.853 21.140 -34.686 1.00 0.00 C ATOM 1594 C ARG A 106 5.252 22.491 -34.308 1.00 0.00 C ATOM 1595 O ARG A 106 5.973 23.474 -34.128 1.00 0.00 O ATOM 1596 CB ARG A 106 5.505 20.804 -36.137 1.00 0.00 C ATOM 1597 CG ARG A 106 5.972 21.853 -37.134 1.00 0.00 C ATOM 1598 CD ARG A 106 5.227 21.737 -38.454 1.00 0.00 C ATOM 1599 NE ARG A 106 5.471 22.886 -39.323 1.00 0.00 N ATOM 1600 CZ ARG A 106 5.330 22.852 -40.643 1.00 0.00 C ATOM 1601 NH1 ARG A 106 4.948 21.733 -41.244 1.00 0.00 N ATOM 1602 NH2 ARG A 106 5.570 23.939 -41.365 1.00 0.00 N ATOM 0 H ARG A 106 5.120 19.222 -34.265 1.00 0.00 H new ATOM 0 HA ARG A 106 6.936 21.202 -34.584 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.952 19.844 -36.396 1.00 0.00 H new ATOM 0 HB3 ARG A 106 4.425 20.687 -36.225 1.00 0.00 H new ATOM 0 HG2 ARG A 106 5.820 22.848 -36.715 1.00 0.00 H new ATOM 0 HG3 ARG A 106 7.042 21.741 -37.308 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.534 20.824 -38.965 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.158 21.649 -38.260 1.00 0.00 H new ATOM 0 HE ARG A 106 5.766 23.762 -38.892 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.762 20.896 -40.692 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.841 21.710 -42.258 1.00 0.00 H new ATOM 0 HH21 ARG A 106 5.863 24.802 -40.906 1.00 0.00 H new ATOM 0 HH22 ARG A 106 5.461 23.912 -42.379 1.00 0.00 H new ATOM 1616 N HIS A 107 3.929 22.533 -34.189 1.00 0.00 N ATOM 1617 CA HIS A 107 3.232 23.763 -33.832 1.00 0.00 C ATOM 1618 C HIS A 107 3.744 24.312 -32.504 1.00 0.00 C ATOM 1619 O HIS A 107 4.093 25.488 -32.400 1.00 0.00 O ATOM 1620 CB HIS A 107 1.726 23.515 -33.748 1.00 0.00 C ATOM 1621 CG HIS A 107 1.006 24.489 -32.867 1.00 0.00 C ATOM 1622 ND1 HIS A 107 1.074 25.855 -33.042 1.00 0.00 N ATOM 1623 CD2 HIS A 107 0.198 24.288 -31.799 1.00 0.00 C ATOM 1624 CE1 HIS A 107 0.341 26.452 -32.120 1.00 0.00 C ATOM 1625 NE2 HIS A 107 -0.201 25.523 -31.353 1.00 0.00 N ATOM 0 H HIS A 107 3.318 21.729 -34.335 1.00 0.00 H new ATOM 0 HA HIS A 107 3.428 24.501 -34.610 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.302 23.563 -34.751 1.00 0.00 H new ATOM 0 HB3 HIS A 107 1.553 22.505 -33.377 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -0.080 23.334 -31.377 1.00 0.00 H new ATOM 0 HE1 HIS A 107 0.207 27.518 -32.011 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -0.816 25.696 -30.558 1.00 0.00 H new ATOM 1634 N VAL A 108 3.785 23.453 -31.490 1.00 0.00 N ATOM 1635 CA VAL A 108 4.255 23.852 -30.169 1.00 0.00 C ATOM 1636 C VAL A 108 5.596 24.571 -30.256 1.00 0.00 C ATOM 1637 O VAL A 108 5.741 25.696 -29.779 1.00 0.00 O ATOM 1638 CB VAL A 108 4.396 22.637 -29.233 1.00 0.00 C ATOM 1639 CG1 VAL A 108 4.943 23.065 -27.880 1.00 0.00 C ATOM 1640 CG2 VAL A 108 3.059 21.927 -29.077 1.00 0.00 C ATOM 0 H VAL A 108 3.498 22.477 -31.558 1.00 0.00 H new ATOM 0 HA VAL A 108 3.508 24.532 -29.760 1.00 0.00 H new ATOM 0 HB VAL A 108 5.103 21.937 -29.678 1.00 0.00 H new ATOM 0 HG11 VAL A 108 5.036 22.193 -27.233 1.00 0.00 H new ATOM 0 HG12 VAL A 108 5.923 23.524 -28.012 1.00 0.00 H new ATOM 0 HG13 VAL A 108 4.263 23.785 -27.424 1.00 0.00 H new ATOM 0 HG21 VAL A 108 3.177 21.071 -28.413 1.00 0.00 H new ATOM 0 HG22 VAL A 108 2.328 22.616 -28.654 1.00 0.00 H new ATOM 0 HG23 VAL A 108 2.713 21.584 -30.052 1.00 0.00 H new ATOM 1650 N MET A 109 6.575 23.913 -30.869 1.00 0.00 N ATOM 1651 CA MET A 109 7.905 24.491 -31.021 1.00 0.00 C ATOM 1652 C MET A 109 7.819 25.931 -31.516 1.00 0.00 C ATOM 1653 O MET A 109 8.500 26.818 -30.999 1.00 0.00 O ATOM 1654 CB MET A 109 8.740 23.654 -31.992 1.00 0.00 C ATOM 1655 CG MET A 109 9.094 22.276 -31.458 1.00 0.00 C ATOM 1656 SD MET A 109 10.644 22.265 -30.537 1.00 0.00 S ATOM 1657 CE MET A 109 10.037 22.226 -28.852 1.00 0.00 C ATOM 0 H MET A 109 6.472 22.980 -31.268 1.00 0.00 H new ATOM 0 HA MET A 109 8.388 24.490 -30.044 1.00 0.00 H new ATOM 0 HB2 MET A 109 8.191 23.542 -32.927 1.00 0.00 H new ATOM 0 HB3 MET A 109 9.659 24.192 -32.224 1.00 0.00 H new ATOM 0 HG2 MET A 109 8.290 21.923 -30.812 1.00 0.00 H new ATOM 0 HG3 MET A 109 9.165 21.575 -32.290 1.00 0.00 H new ATOM 0 HE1 MET A 109 10.712 22.791 -28.209 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.042 22.670 -28.813 1.00 0.00 H new ATOM 0 HE3 MET A 109 9.987 21.193 -28.507 1.00 0.00 H new ATOM 1667 N THR A 110 6.979 26.158 -32.521 1.00 0.00 N ATOM 1668 CA THR A 110 6.806 27.490 -33.087 1.00 0.00 C ATOM 1669 C THR A 110 6.546 28.521 -31.995 1.00 0.00 C ATOM 1670 O THR A 110 7.272 29.508 -31.875 1.00 0.00 O ATOM 1671 CB THR A 110 5.642 27.524 -34.096 1.00 0.00 C ATOM 1672 OG1 THR A 110 5.840 26.528 -35.105 1.00 0.00 O ATOM 1673 CG2 THR A 110 5.529 28.896 -34.745 1.00 0.00 C ATOM 0 H THR A 110 6.408 25.436 -32.960 1.00 0.00 H new ATOM 0 HA THR A 110 7.733 27.737 -33.604 1.00 0.00 H new ATOM 0 HB THR A 110 4.717 27.317 -33.558 1.00 0.00 H new ATOM 0 HG1 THR A 110 5.549 25.656 -34.765 1.00 0.00 H new ATOM 0 HG21 THR A 110 4.701 28.896 -35.453 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.350 29.648 -33.977 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.456 29.127 -35.270 1.00 0.00 H new ATOM 1681 N ASN A 111 5.508 28.286 -31.199 1.00 0.00 N ATOM 1682 CA ASN A 111 5.154 29.196 -30.116 1.00 0.00 C ATOM 1683 C ASN A 111 6.404 29.764 -29.451 1.00 0.00 C ATOM 1684 O ASN A 111 6.524 30.975 -29.261 1.00 0.00 O ATOM 1685 CB ASN A 111 4.294 28.474 -29.076 1.00 0.00 C ATOM 1686 CG ASN A 111 2.859 28.299 -29.534 1.00 0.00 C ATOM 1687 OD1 ASN A 111 2.216 29.251 -29.977 1.00 0.00 O ATOM 1688 ND2 ASN A 111 2.350 27.076 -29.430 1.00 0.00 N ATOM 0 H ASN A 111 4.897 27.473 -31.284 1.00 0.00 H new ATOM 0 HA ASN A 111 4.583 30.022 -30.541 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.727 27.496 -28.866 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.309 29.037 -28.143 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.390 26.897 -29.723 1.00 0.00 H new ATOM 0 HD22 ASN A 111 2.920 26.317 -29.057 1.00 0.00 H new ATOM 1695 N LEU A 112 7.334 28.882 -29.102 1.00 0.00 N ATOM 1696 CA LEU A 112 8.577 29.295 -28.459 1.00 0.00 C ATOM 1697 C LEU A 112 9.090 30.602 -29.055 1.00 0.00 C ATOM 1698 O LEU A 112 9.499 31.509 -28.330 1.00 0.00 O ATOM 1699 CB LEU A 112 9.638 28.203 -28.607 1.00 0.00 C ATOM 1700 CG LEU A 112 9.327 26.869 -27.928 1.00 0.00 C ATOM 1701 CD1 LEU A 112 10.405 25.844 -28.246 1.00 0.00 C ATOM 1702 CD2 LEU A 112 9.193 27.055 -26.424 1.00 0.00 C ATOM 0 H LEU A 112 7.251 27.877 -29.253 1.00 0.00 H new ATOM 0 HA LEU A 112 8.374 29.455 -27.400 1.00 0.00 H new ATOM 0 HB2 LEU A 112 9.795 28.019 -29.670 1.00 0.00 H new ATOM 0 HB3 LEU A 112 10.578 28.581 -28.206 1.00 0.00 H new ATOM 0 HG LEU A 112 8.377 26.499 -28.315 1.00 0.00 H new ATOM 0 HD11 LEU A 112 10.167 24.901 -27.754 1.00 0.00 H new ATOM 0 HD12 LEU A 112 10.453 25.689 -29.324 1.00 0.00 H new ATOM 0 HD13 LEU A 112 11.369 26.206 -27.888 1.00 0.00 H new ATOM 0 HD21 LEU A 112 8.972 26.095 -25.957 1.00 0.00 H new ATOM 0 HD22 LEU A 112 10.127 27.448 -26.021 1.00 0.00 H new ATOM 0 HD23 LEU A 112 8.385 27.755 -26.215 1.00 0.00 H new ATOM 1714 N GLY A 113 9.064 30.693 -30.381 1.00 0.00 N ATOM 1715 CA GLY A 113 9.527 31.894 -31.052 1.00 0.00 C ATOM 1716 C GLY A 113 10.432 31.588 -32.228 1.00 0.00 C ATOM 1717 O GLY A 113 11.446 32.256 -32.428 1.00 0.00 O ATOM 0 H GLY A 113 8.731 29.956 -31.003 1.00 0.00 H new ATOM 0 HA2 GLY A 113 8.667 32.467 -31.399 1.00 0.00 H new ATOM 0 HA3 GLY A 113 10.062 32.521 -30.339 1.00 0.00 H new ATOM 1721 N GLU A 114 10.067 30.575 -33.007 1.00 0.00 N ATOM 1722 CA GLU A 114 10.856 30.181 -34.168 1.00 0.00 C ATOM 1723 C GLU A 114 9.972 29.546 -35.237 1.00 0.00 C ATOM 1724 O GLU A 114 8.832 29.166 -34.971 1.00 0.00 O ATOM 1725 CB GLU A 114 11.959 29.204 -33.756 1.00 0.00 C ATOM 1726 CG GLU A 114 12.988 29.809 -32.816 1.00 0.00 C ATOM 1727 CD GLU A 114 13.889 30.814 -33.506 1.00 0.00 C ATOM 1728 OE1 GLU A 114 14.005 30.751 -34.748 1.00 0.00 O ATOM 1729 OE2 GLU A 114 14.478 31.664 -32.806 1.00 0.00 O ATOM 0 H GLU A 114 9.230 30.012 -32.855 1.00 0.00 H new ATOM 0 HA GLU A 114 11.313 31.078 -34.585 1.00 0.00 H new ATOM 0 HB2 GLU A 114 11.504 28.338 -33.275 1.00 0.00 H new ATOM 0 HB3 GLU A 114 12.465 28.842 -34.651 1.00 0.00 H new ATOM 0 HG2 GLU A 114 12.475 30.296 -31.987 1.00 0.00 H new ATOM 0 HG3 GLU A 114 13.598 29.012 -32.390 1.00 0.00 H new ATOM 1736 N LYS A 115 10.506 29.434 -36.449 1.00 0.00 N ATOM 1737 CA LYS A 115 9.768 28.845 -37.560 1.00 0.00 C ATOM 1738 C LYS A 115 10.478 27.600 -38.084 1.00 0.00 C ATOM 1739 O LYS A 115 11.456 27.697 -38.826 1.00 0.00 O ATOM 1740 CB LYS A 115 9.604 29.865 -38.688 1.00 0.00 C ATOM 1741 CG LYS A 115 8.647 30.995 -38.351 1.00 0.00 C ATOM 1742 CD LYS A 115 8.948 32.242 -39.165 1.00 0.00 C ATOM 1743 CE LYS A 115 7.856 33.289 -39.006 1.00 0.00 C ATOM 1744 NZ LYS A 115 8.111 34.184 -37.843 1.00 0.00 N ATOM 0 H LYS A 115 11.448 29.744 -36.687 1.00 0.00 H new ATOM 0 HA LYS A 115 8.782 28.554 -37.196 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.580 30.286 -38.930 1.00 0.00 H new ATOM 0 HB3 LYS A 115 9.247 29.352 -39.581 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.623 30.674 -38.541 1.00 0.00 H new ATOM 0 HG3 LYS A 115 8.717 31.227 -37.288 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.904 32.661 -38.850 1.00 0.00 H new ATOM 0 HD3 LYS A 115 9.048 31.976 -40.217 1.00 0.00 H new ATOM 0 HE2 LYS A 115 7.790 33.886 -39.916 1.00 0.00 H new ATOM 0 HE3 LYS A 115 6.893 32.794 -38.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 7.345 34.883 -37.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 8.149 33.618 -36.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 9.017 34.676 -37.976 1.00 0.00 H new ATOM 1758 N LEU A 116 9.978 26.432 -37.697 1.00 0.00 N ATOM 1759 CA LEU A 116 10.563 25.168 -38.130 1.00 0.00 C ATOM 1760 C LEU A 116 9.720 24.526 -39.227 1.00 0.00 C ATOM 1761 O LEU A 116 8.541 24.843 -39.386 1.00 0.00 O ATOM 1762 CB LEU A 116 10.692 24.210 -36.944 1.00 0.00 C ATOM 1763 CG LEU A 116 11.415 24.759 -35.714 1.00 0.00 C ATOM 1764 CD1 LEU A 116 11.061 23.946 -34.478 1.00 0.00 C ATOM 1765 CD2 LEU A 116 12.921 24.764 -35.937 1.00 0.00 C ATOM 0 H LEU A 116 9.169 26.334 -37.084 1.00 0.00 H new ATOM 0 HA LEU A 116 11.555 25.374 -38.532 1.00 0.00 H new ATOM 0 HB2 LEU A 116 9.692 23.898 -36.644 1.00 0.00 H new ATOM 0 HB3 LEU A 116 11.217 23.316 -37.280 1.00 0.00 H new ATOM 0 HG LEU A 116 11.088 25.786 -35.554 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.585 24.352 -33.613 1.00 0.00 H new ATOM 0 HD12 LEU A 116 9.986 23.995 -34.306 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.358 22.908 -34.628 1.00 0.00 H new ATOM 0 HD21 LEU A 116 13.419 25.158 -35.051 1.00 0.00 H new ATOM 0 HD22 LEU A 116 13.265 23.747 -36.124 1.00 0.00 H new ATOM 0 HD23 LEU A 116 13.160 25.391 -36.796 1.00 0.00 H new ATOM 1777 N THR A 117 10.333 23.619 -39.982 1.00 0.00 N ATOM 1778 CA THR A 117 9.640 22.930 -41.064 1.00 0.00 C ATOM 1779 C THR A 117 9.686 21.419 -40.872 1.00 0.00 C ATOM 1780 O THR A 117 10.515 20.903 -40.123 1.00 0.00 O ATOM 1781 CB THR A 117 10.248 23.282 -42.434 1.00 0.00 C ATOM 1782 OG1 THR A 117 11.659 23.033 -42.422 1.00 0.00 O ATOM 1783 CG2 THR A 117 9.988 24.739 -42.784 1.00 0.00 C ATOM 0 H THR A 117 11.308 23.345 -39.864 1.00 0.00 H new ATOM 0 HA THR A 117 8.603 23.264 -41.039 1.00 0.00 H new ATOM 0 HB THR A 117 9.775 22.654 -43.189 1.00 0.00 H new ATOM 0 HG1 THR A 117 12.038 23.258 -43.297 1.00 0.00 H new ATOM 0 HG21 THR A 117 10.427 24.964 -43.756 1.00 0.00 H new ATOM 0 HG22 THR A 117 8.913 24.918 -42.821 1.00 0.00 H new ATOM 0 HG23 THR A 117 10.437 25.381 -42.026 1.00 0.00 H new ATOM 1791 N ASP A 118 8.791 20.713 -41.555 1.00 0.00 N ATOM 1792 CA ASP A 118 8.731 19.259 -41.462 1.00 0.00 C ATOM 1793 C ASP A 118 10.127 18.667 -41.297 1.00 0.00 C ATOM 1794 O ASP A 118 10.337 17.761 -40.492 1.00 0.00 O ATOM 1795 CB ASP A 118 8.058 18.674 -42.704 1.00 0.00 C ATOM 1796 CG ASP A 118 6.552 18.587 -42.560 1.00 0.00 C ATOM 1797 OD1 ASP A 118 5.986 19.360 -41.758 1.00 0.00 O ATOM 1798 OD2 ASP A 118 5.938 17.746 -43.249 1.00 0.00 O ATOM 0 H ASP A 118 8.097 21.124 -42.179 1.00 0.00 H new ATOM 0 HA ASP A 118 8.140 19.000 -40.583 1.00 0.00 H new ATOM 0 HB2 ASP A 118 8.302 19.290 -43.570 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.460 17.679 -42.897 1.00 0.00 H new ATOM 1803 N GLU A 119 11.079 19.185 -42.068 1.00 0.00 N ATOM 1804 CA GLU A 119 12.455 18.706 -42.009 1.00 0.00 C ATOM 1805 C GLU A 119 13.024 18.860 -40.602 1.00 0.00 C ATOM 1806 O GLU A 119 13.450 17.885 -39.984 1.00 0.00 O ATOM 1807 CB GLU A 119 13.327 19.466 -43.011 1.00 0.00 C ATOM 1808 CG GLU A 119 12.968 19.191 -44.461 1.00 0.00 C ATOM 1809 CD GLU A 119 13.217 17.750 -44.861 1.00 0.00 C ATOM 1810 OE1 GLU A 119 14.318 17.236 -44.571 1.00 0.00 O ATOM 1811 OE2 GLU A 119 12.311 17.136 -45.463 1.00 0.00 O ATOM 0 H GLU A 119 10.922 19.936 -42.740 1.00 0.00 H new ATOM 0 HA GLU A 119 12.456 17.647 -42.269 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.238 20.535 -42.820 1.00 0.00 H new ATOM 0 HB3 GLU A 119 14.371 19.199 -42.847 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.918 19.433 -44.623 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.550 19.849 -45.106 1.00 0.00 H new ATOM 1818 N GLU A 120 13.028 20.092 -40.103 1.00 0.00 N ATOM 1819 CA GLU A 120 13.547 20.374 -38.770 1.00 0.00 C ATOM 1820 C GLU A 120 12.944 19.424 -37.739 1.00 0.00 C ATOM 1821 O GLU A 120 13.665 18.768 -36.987 1.00 0.00 O ATOM 1822 CB GLU A 120 13.249 21.823 -38.379 1.00 0.00 C ATOM 1823 CG GLU A 120 13.897 22.847 -39.296 1.00 0.00 C ATOM 1824 CD GLU A 120 15.324 22.484 -39.659 1.00 0.00 C ATOM 1825 OE1 GLU A 120 15.510 21.674 -40.592 1.00 0.00 O ATOM 1826 OE2 GLU A 120 16.254 23.008 -39.011 1.00 0.00 O ATOM 0 H GLU A 120 12.678 20.910 -40.601 1.00 0.00 H new ATOM 0 HA GLU A 120 14.627 20.224 -38.789 1.00 0.00 H new ATOM 0 HB2 GLU A 120 12.170 21.977 -38.382 1.00 0.00 H new ATOM 0 HB3 GLU A 120 13.592 21.993 -37.359 1.00 0.00 H new ATOM 0 HG2 GLU A 120 13.306 22.938 -40.207 1.00 0.00 H new ATOM 0 HG3 GLU A 120 13.887 23.823 -38.810 1.00 0.00 H new ATOM 1833 N VAL A 121 11.617 19.355 -37.711 1.00 0.00 N ATOM 1834 CA VAL A 121 10.917 18.485 -36.774 1.00 0.00 C ATOM 1835 C VAL A 121 11.308 17.026 -36.981 1.00 0.00 C ATOM 1836 O VAL A 121 11.532 16.290 -36.020 1.00 0.00 O ATOM 1837 CB VAL A 121 9.389 18.620 -36.917 1.00 0.00 C ATOM 1838 CG1 VAL A 121 8.678 17.624 -36.014 1.00 0.00 C ATOM 1839 CG2 VAL A 121 8.950 20.043 -36.606 1.00 0.00 C ATOM 0 H VAL A 121 11.005 19.891 -38.326 1.00 0.00 H new ATOM 0 HA VAL A 121 11.210 18.798 -35.772 1.00 0.00 H new ATOM 0 HB VAL A 121 9.116 18.397 -37.948 1.00 0.00 H new ATOM 0 HG11 VAL A 121 7.600 17.734 -36.129 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.970 16.611 -36.289 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.954 17.812 -34.976 1.00 0.00 H new ATOM 0 HG21 VAL A 121 7.868 20.121 -36.712 1.00 0.00 H new ATOM 0 HG22 VAL A 121 9.234 20.296 -35.585 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.433 20.732 -37.299 1.00 0.00 H new ATOM 1849 N ASP A 122 11.389 16.614 -38.242 1.00 0.00 N ATOM 1850 CA ASP A 122 11.755 15.243 -38.576 1.00 0.00 C ATOM 1851 C ASP A 122 13.007 14.814 -37.817 1.00 0.00 C ATOM 1852 O ASP A 122 13.054 13.727 -37.242 1.00 0.00 O ATOM 1853 CB ASP A 122 11.985 15.106 -40.082 1.00 0.00 C ATOM 1854 CG ASP A 122 10.720 14.731 -40.829 1.00 0.00 C ATOM 1855 OD1 ASP A 122 9.854 14.062 -40.229 1.00 0.00 O ATOM 1856 OD2 ASP A 122 10.597 15.107 -42.014 1.00 0.00 O ATOM 0 H ASP A 122 11.206 17.210 -39.049 1.00 0.00 H new ATOM 0 HA ASP A 122 10.932 14.592 -38.281 1.00 0.00 H new ATOM 0 HB2 ASP A 122 12.370 16.047 -40.475 1.00 0.00 H new ATOM 0 HB3 ASP A 122 12.748 14.349 -40.263 1.00 0.00 H new ATOM 1861 N GLU A 123 14.020 15.675 -37.822 1.00 0.00 N ATOM 1862 CA GLU A 123 15.273 15.384 -37.135 1.00 0.00 C ATOM 1863 C GLU A 123 15.038 15.170 -35.642 1.00 0.00 C ATOM 1864 O GLU A 123 15.760 14.414 -34.992 1.00 0.00 O ATOM 1865 CB GLU A 123 16.273 16.522 -37.347 1.00 0.00 C ATOM 1866 CG GLU A 123 16.588 16.791 -38.809 1.00 0.00 C ATOM 1867 CD GLU A 123 17.824 17.651 -38.991 1.00 0.00 C ATOM 1868 OE1 GLU A 123 18.773 17.500 -38.194 1.00 0.00 O ATOM 1869 OE2 GLU A 123 17.841 18.475 -39.929 1.00 0.00 O ATOM 0 H GLU A 123 13.997 16.579 -38.294 1.00 0.00 H new ATOM 0 HA GLU A 123 15.684 14.466 -37.556 1.00 0.00 H new ATOM 0 HB2 GLU A 123 15.876 17.432 -36.896 1.00 0.00 H new ATOM 0 HB3 GLU A 123 17.198 16.284 -36.823 1.00 0.00 H new ATOM 0 HG2 GLU A 123 16.731 15.842 -39.327 1.00 0.00 H new ATOM 0 HG3 GLU A 123 15.735 17.284 -39.276 1.00 0.00 H new ATOM 1876 N MET A 124 14.024 15.841 -35.107 1.00 0.00 N ATOM 1877 CA MET A 124 13.694 15.724 -33.691 1.00 0.00 C ATOM 1878 C MET A 124 12.989 14.402 -33.405 1.00 0.00 C ATOM 1879 O MET A 124 13.357 13.680 -32.478 1.00 0.00 O ATOM 1880 CB MET A 124 12.809 16.893 -33.254 1.00 0.00 C ATOM 1881 CG MET A 124 12.233 16.730 -31.857 1.00 0.00 C ATOM 1882 SD MET A 124 11.872 18.309 -31.065 1.00 0.00 S ATOM 1883 CE MET A 124 11.094 17.758 -29.549 1.00 0.00 C ATOM 0 H MET A 124 13.417 16.471 -35.631 1.00 0.00 H new ATOM 0 HA MET A 124 14.624 15.750 -33.123 1.00 0.00 H new ATOM 0 HB2 MET A 124 13.392 17.813 -33.293 1.00 0.00 H new ATOM 0 HB3 MET A 124 11.990 17.004 -33.965 1.00 0.00 H new ATOM 0 HG2 MET A 124 11.319 16.138 -31.912 1.00 0.00 H new ATOM 0 HG3 MET A 124 12.938 16.172 -31.241 1.00 0.00 H new ATOM 0 HE1 MET A 124 10.309 18.459 -29.267 1.00 0.00 H new ATOM 0 HE2 MET A 124 10.660 16.770 -29.701 1.00 0.00 H new ATOM 0 HE3 MET A 124 11.839 17.709 -28.755 1.00 0.00 H new ATOM 1893 N ILE A 125 11.975 14.092 -34.205 1.00 0.00 N ATOM 1894 CA ILE A 125 11.219 12.857 -34.037 1.00 0.00 C ATOM 1895 C ILE A 125 12.147 11.648 -33.989 1.00 0.00 C ATOM 1896 O ILE A 125 12.006 10.778 -33.129 1.00 0.00 O ATOM 1897 CB ILE A 125 10.199 12.662 -35.174 1.00 0.00 C ATOM 1898 CG1 ILE A 125 9.130 13.756 -35.123 1.00 0.00 C ATOM 1899 CG2 ILE A 125 9.559 11.285 -35.081 1.00 0.00 C ATOM 1900 CD1 ILE A 125 8.220 13.656 -33.919 1.00 0.00 C ATOM 0 H ILE A 125 11.658 14.679 -34.976 1.00 0.00 H new ATOM 0 HA ILE A 125 10.684 12.940 -33.091 1.00 0.00 H new ATOM 0 HB ILE A 125 10.722 12.735 -36.128 1.00 0.00 H new ATOM 0 HG12 ILE A 125 9.619 14.730 -35.119 1.00 0.00 H new ATOM 0 HG13 ILE A 125 8.527 13.706 -36.029 1.00 0.00 H new ATOM 0 HG21 ILE A 125 8.840 11.162 -35.891 1.00 0.00 H new ATOM 0 HG22 ILE A 125 10.330 10.519 -35.161 1.00 0.00 H new ATOM 0 HG23 ILE A 125 9.047 11.186 -34.124 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.488 14.463 -33.948 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.703 12.696 -33.932 1.00 0.00 H new ATOM 0 HD13 ILE A 125 8.812 13.737 -33.008 1.00 0.00 H new ATOM 1912 N ARG A 126 13.098 11.601 -34.917 1.00 0.00 N ATOM 1913 CA ARG A 126 14.050 10.499 -34.980 1.00 0.00 C ATOM 1914 C ARG A 126 14.901 10.443 -33.715 1.00 0.00 C ATOM 1915 O ARG A 126 15.667 9.501 -33.512 1.00 0.00 O ATOM 1916 CB ARG A 126 14.951 10.645 -36.208 1.00 0.00 C ATOM 1917 CG ARG A 126 16.007 11.728 -36.063 1.00 0.00 C ATOM 1918 CD ARG A 126 17.204 11.462 -36.962 1.00 0.00 C ATOM 1919 NE ARG A 126 17.958 10.286 -36.538 1.00 0.00 N ATOM 1920 CZ ARG A 126 18.816 9.640 -37.321 1.00 0.00 C ATOM 1921 NH1 ARG A 126 19.028 10.056 -38.562 1.00 0.00 N ATOM 1922 NH2 ARG A 126 19.464 8.577 -36.862 1.00 0.00 N ATOM 0 H ARG A 126 13.229 12.313 -35.635 1.00 0.00 H new ATOM 0 HA ARG A 126 13.487 9.569 -35.060 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.444 9.692 -36.402 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.332 10.867 -37.078 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.573 12.697 -36.310 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.335 11.781 -35.025 1.00 0.00 H new ATOM 0 HD2 ARG A 126 16.863 11.323 -37.988 1.00 0.00 H new ATOM 0 HD3 ARG A 126 17.860 12.333 -36.959 1.00 0.00 H new ATOM 0 HE ARG A 126 17.819 9.941 -35.588 1.00 0.00 H new ATOM 0 HH11 ARG A 126 18.532 10.873 -38.918 1.00 0.00 H new ATOM 0 HH12 ARG A 126 19.687 9.559 -39.161 1.00 0.00 H new ATOM 0 HH21 ARG A 126 19.304 8.255 -35.908 1.00 0.00 H new ATOM 0 HH22 ARG A 126 20.122 8.082 -37.464 1.00 0.00 H new ATOM 1936 N GLU A 127 14.762 11.458 -32.868 1.00 0.00 N ATOM 1937 CA GLU A 127 15.520 11.524 -31.624 1.00 0.00 C ATOM 1938 C GLU A 127 14.794 10.782 -30.505 1.00 0.00 C ATOM 1939 O GLU A 127 15.361 9.899 -29.863 1.00 0.00 O ATOM 1940 CB GLU A 127 15.751 12.981 -31.218 1.00 0.00 C ATOM 1941 CG GLU A 127 16.941 13.174 -30.294 1.00 0.00 C ATOM 1942 CD GLU A 127 16.819 14.419 -29.438 1.00 0.00 C ATOM 1943 OE1 GLU A 127 16.755 15.528 -30.010 1.00 0.00 O ATOM 1944 OE2 GLU A 127 16.787 14.287 -28.197 1.00 0.00 O ATOM 0 H GLU A 127 14.132 12.245 -33.020 1.00 0.00 H new ATOM 0 HA GLU A 127 16.484 11.043 -31.790 1.00 0.00 H new ATOM 0 HB2 GLU A 127 15.898 13.581 -32.116 1.00 0.00 H new ATOM 0 HB3 GLU A 127 14.855 13.359 -30.726 1.00 0.00 H new ATOM 0 HG2 GLU A 127 17.040 12.302 -29.648 1.00 0.00 H new ATOM 0 HG3 GLU A 127 17.852 13.235 -30.889 1.00 0.00 H new ATOM 1951 N ALA A 128 13.537 11.149 -30.278 1.00 0.00 N ATOM 1952 CA ALA A 128 12.733 10.518 -29.239 1.00 0.00 C ATOM 1953 C ALA A 128 12.040 9.266 -29.765 1.00 0.00 C ATOM 1954 O ALA A 128 11.961 8.251 -29.073 1.00 0.00 O ATOM 1955 CB ALA A 128 11.708 11.502 -28.695 1.00 0.00 C ATOM 0 H ALA A 128 13.054 11.880 -30.800 1.00 0.00 H new ATOM 0 HA ALA A 128 13.399 10.219 -28.430 1.00 0.00 H new ATOM 0 HB1 ALA A 128 11.114 11.018 -27.920 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.221 12.366 -28.272 1.00 0.00 H new ATOM 0 HB3 ALA A 128 11.053 11.829 -29.503 1.00 0.00 H new ATOM 1961 N ASP A 129 11.538 9.344 -30.993 1.00 0.00 N ATOM 1962 CA ASP A 129 10.852 8.217 -31.612 1.00 0.00 C ATOM 1963 C ASP A 129 11.744 6.979 -31.627 1.00 0.00 C ATOM 1964 O ASP A 129 12.725 6.918 -32.369 1.00 0.00 O ATOM 1965 CB ASP A 129 10.427 8.572 -33.038 1.00 0.00 C ATOM 1966 CG ASP A 129 9.251 7.741 -33.515 1.00 0.00 C ATOM 1967 OD1 ASP A 129 8.986 6.684 -32.905 1.00 0.00 O ATOM 1968 OD2 ASP A 129 8.598 8.148 -34.499 1.00 0.00 O ATOM 0 H ASP A 129 11.594 10.177 -31.579 1.00 0.00 H new ATOM 0 HA ASP A 129 9.964 7.995 -31.021 1.00 0.00 H new ATOM 0 HB2 ASP A 129 10.164 9.629 -33.083 1.00 0.00 H new ATOM 0 HB3 ASP A 129 11.270 8.424 -33.713 1.00 0.00 H new ATOM 1973 N ILE A 130 11.397 5.996 -30.803 1.00 0.00 N ATOM 1974 CA ILE A 130 12.166 4.761 -30.723 1.00 0.00 C ATOM 1975 C ILE A 130 11.738 3.775 -31.804 1.00 0.00 C ATOM 1976 O ILE A 130 12.531 3.406 -32.671 1.00 0.00 O ATOM 1977 CB ILE A 130 12.013 4.091 -29.344 1.00 0.00 C ATOM 1978 CG1 ILE A 130 12.203 5.122 -28.229 1.00 0.00 C ATOM 1979 CG2 ILE A 130 13.010 2.952 -29.195 1.00 0.00 C ATOM 1980 CD1 ILE A 130 13.621 5.634 -28.114 1.00 0.00 C ATOM 0 H ILE A 130 10.589 6.031 -30.182 1.00 0.00 H new ATOM 0 HA ILE A 130 13.211 5.030 -30.874 1.00 0.00 H new ATOM 0 HB ILE A 130 11.007 3.679 -29.266 1.00 0.00 H new ATOM 0 HG12 ILE A 130 11.535 5.964 -28.407 1.00 0.00 H new ATOM 0 HG13 ILE A 130 11.908 4.676 -27.279 1.00 0.00 H new ATOM 0 HG21 ILE A 130 12.889 2.489 -28.216 1.00 0.00 H new ATOM 0 HG22 ILE A 130 12.832 2.209 -29.972 1.00 0.00 H new ATOM 0 HG23 ILE A 130 14.024 3.341 -29.290 1.00 0.00 H new ATOM 0 HD11 ILE A 130 13.681 6.361 -27.304 1.00 0.00 H new ATOM 0 HD12 ILE A 130 14.293 4.801 -27.905 1.00 0.00 H new ATOM 0 HD13 ILE A 130 13.913 6.110 -29.050 1.00 0.00 H new ATOM 1992 N ASP A 131 10.480 3.353 -31.748 1.00 0.00 N ATOM 1993 CA ASP A 131 9.944 2.412 -32.725 1.00 0.00 C ATOM 1994 C ASP A 131 10.135 2.936 -34.145 1.00 0.00 C ATOM 1995 O ASP A 131 10.562 2.203 -35.035 1.00 0.00 O ATOM 1996 CB ASP A 131 8.461 2.155 -32.457 1.00 0.00 C ATOM 1997 CG ASP A 131 7.606 3.381 -32.711 1.00 0.00 C ATOM 1998 OD1 ASP A 131 7.945 4.460 -32.182 1.00 0.00 O ATOM 1999 OD2 ASP A 131 6.597 3.261 -33.438 1.00 0.00 O ATOM 0 H ASP A 131 9.812 3.648 -31.036 1.00 0.00 H new ATOM 0 HA ASP A 131 10.490 1.474 -32.627 1.00 0.00 H new ATOM 0 HB2 ASP A 131 8.117 1.338 -33.091 1.00 0.00 H new ATOM 0 HB3 ASP A 131 8.332 1.833 -31.424 1.00 0.00 H new ATOM 2004 N GLY A 132 9.812 4.209 -34.349 1.00 0.00 N ATOM 2005 CA GLY A 132 9.953 4.809 -35.663 1.00 0.00 C ATOM 2006 C GLY A 132 8.631 4.914 -36.397 1.00 0.00 C ATOM 2007 O GLY A 132 8.547 4.601 -37.585 1.00 0.00 O ATOM 0 H GLY A 132 9.455 4.836 -33.628 1.00 0.00 H new ATOM 0 HA2 GLY A 132 10.388 5.803 -35.560 1.00 0.00 H new ATOM 0 HA3 GLY A 132 10.649 4.216 -36.257 1.00 0.00 H new ATOM 2011 N ASP A 133 7.596 5.353 -35.690 1.00 0.00 N ATOM 2012 CA ASP A 133 6.272 5.497 -36.281 1.00 0.00 C ATOM 2013 C ASP A 133 5.933 6.968 -36.503 1.00 0.00 C ATOM 2014 O ASP A 133 4.775 7.323 -36.719 1.00 0.00 O ATOM 2015 CB ASP A 133 5.216 4.847 -35.386 1.00 0.00 C ATOM 2016 CG ASP A 133 5.199 5.436 -33.989 1.00 0.00 C ATOM 2017 OD1 ASP A 133 5.856 6.476 -33.776 1.00 0.00 O ATOM 2018 OD2 ASP A 133 4.529 4.856 -33.108 1.00 0.00 O ATOM 0 H ASP A 133 7.649 5.615 -34.706 1.00 0.00 H new ATOM 0 HA ASP A 133 6.277 4.994 -37.248 1.00 0.00 H new ATOM 0 HB2 ASP A 133 4.233 4.970 -35.841 1.00 0.00 H new ATOM 0 HB3 ASP A 133 5.407 3.776 -35.323 1.00 0.00 H new ATOM 2023 N GLY A 134 6.952 7.820 -36.446 1.00 0.00 N ATOM 2024 CA GLY A 134 6.741 9.243 -36.640 1.00 0.00 C ATOM 2025 C GLY A 134 5.939 9.869 -35.517 1.00 0.00 C ATOM 2026 O GLY A 134 5.176 10.809 -35.740 1.00 0.00 O ATOM 0 H GLY A 134 7.920 7.550 -36.269 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.706 9.743 -36.715 1.00 0.00 H new ATOM 0 HA3 GLY A 134 6.224 9.405 -37.586 1.00 0.00 H new ATOM 2030 N GLN A 135 6.111 9.347 -34.307 1.00 0.00 N ATOM 2031 CA GLN A 135 5.394 9.861 -33.145 1.00 0.00 C ATOM 2032 C GLN A 135 6.301 9.897 -31.919 1.00 0.00 C ATOM 2033 O GLN A 135 7.352 9.258 -31.892 1.00 0.00 O ATOM 2034 CB GLN A 135 4.162 9.001 -32.858 1.00 0.00 C ATOM 2035 CG GLN A 135 3.334 8.693 -34.095 1.00 0.00 C ATOM 2036 CD GLN A 135 1.860 8.526 -33.784 1.00 0.00 C ATOM 2037 OE1 GLN A 135 1.127 9.506 -33.646 1.00 0.00 O ATOM 2038 NE2 GLN A 135 1.416 7.279 -33.670 1.00 0.00 N ATOM 0 H GLN A 135 6.740 8.569 -34.105 1.00 0.00 H new ATOM 0 HA GLN A 135 5.073 10.879 -33.368 1.00 0.00 H new ATOM 0 HB2 GLN A 135 4.481 8.064 -32.402 1.00 0.00 H new ATOM 0 HB3 GLN A 135 3.534 9.512 -32.129 1.00 0.00 H new ATOM 0 HG2 GLN A 135 3.459 9.496 -34.821 1.00 0.00 H new ATOM 0 HG3 GLN A 135 3.709 7.781 -34.561 1.00 0.00 H new ATOM 0 HE21 GLN A 135 2.058 6.496 -33.792 1.00 0.00 H new ATOM 0 HE22 GLN A 135 0.433 7.105 -33.460 1.00 0.00 H new ATOM 2047 N VAL A 136 5.886 10.650 -30.905 1.00 0.00 N ATOM 2048 CA VAL A 136 6.660 10.769 -29.675 1.00 0.00 C ATOM 2049 C VAL A 136 5.764 10.642 -28.448 1.00 0.00 C ATOM 2050 O VAL A 136 5.376 11.642 -27.845 1.00 0.00 O ATOM 2051 CB VAL A 136 7.411 12.113 -29.612 1.00 0.00 C ATOM 2052 CG1 VAL A 136 8.174 12.237 -28.303 1.00 0.00 C ATOM 2053 CG2 VAL A 136 8.349 12.254 -30.802 1.00 0.00 C ATOM 0 H VAL A 136 5.019 11.186 -30.911 1.00 0.00 H new ATOM 0 HA VAL A 136 7.386 9.956 -29.677 1.00 0.00 H new ATOM 0 HB VAL A 136 6.681 12.921 -29.656 1.00 0.00 H new ATOM 0 HG11 VAL A 136 8.698 13.192 -28.276 1.00 0.00 H new ATOM 0 HG12 VAL A 136 7.475 12.183 -27.468 1.00 0.00 H new ATOM 0 HG13 VAL A 136 8.896 11.425 -28.225 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.872 13.209 -30.742 1.00 0.00 H new ATOM 0 HG22 VAL A 136 9.075 11.441 -30.791 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.773 12.213 -31.726 1.00 0.00 H new ATOM 2063 N ASN A 137 5.441 9.406 -28.083 1.00 0.00 N ATOM 2064 CA ASN A 137 4.590 9.147 -26.927 1.00 0.00 C ATOM 2065 C ASN A 137 5.291 9.555 -25.635 1.00 0.00 C ATOM 2066 O ASN A 137 6.434 10.014 -25.654 1.00 0.00 O ATOM 2067 CB ASN A 137 4.209 7.667 -26.869 1.00 0.00 C ATOM 2068 CG ASN A 137 5.403 6.754 -27.071 1.00 0.00 C ATOM 2069 OD1 ASN A 137 5.778 6.446 -28.203 1.00 0.00 O ATOM 2070 ND2 ASN A 137 6.006 6.316 -25.972 1.00 0.00 N ATOM 0 H ASN A 137 5.756 8.567 -28.571 1.00 0.00 H new ATOM 0 HA ASN A 137 3.684 9.744 -27.032 1.00 0.00 H new ATOM 0 HB2 ASN A 137 3.749 7.451 -25.905 1.00 0.00 H new ATOM 0 HB3 ASN A 137 3.461 7.457 -27.634 1.00 0.00 H new ATOM 0 HD21 ASN A 137 6.814 5.698 -26.046 1.00 0.00 H new ATOM 0 HD22 ASN A 137 5.661 6.597 -25.054 1.00 0.00 H new ATOM 2077 N TYR A 138 4.600 9.383 -24.514 1.00 0.00 N ATOM 2078 CA TYR A 138 5.154 9.734 -23.212 1.00 0.00 C ATOM 2079 C TYR A 138 6.521 9.088 -23.010 1.00 0.00 C ATOM 2080 O TYR A 138 7.515 9.774 -22.775 1.00 0.00 O ATOM 2081 CB TYR A 138 4.203 9.301 -22.095 1.00 0.00 C ATOM 2082 CG TYR A 138 4.688 9.667 -20.711 1.00 0.00 C ATOM 2083 CD1 TYR A 138 4.902 10.993 -20.356 1.00 0.00 C ATOM 2084 CD2 TYR A 138 4.934 8.686 -19.758 1.00 0.00 C ATOM 2085 CE1 TYR A 138 5.346 11.332 -19.092 1.00 0.00 C ATOM 2086 CE2 TYR A 138 5.377 9.016 -18.491 1.00 0.00 C ATOM 2087 CZ TYR A 138 5.581 10.340 -18.163 1.00 0.00 C ATOM 2088 OH TYR A 138 6.024 10.672 -16.904 1.00 0.00 O ATOM 0 H TYR A 138 3.654 9.002 -24.481 1.00 0.00 H new ATOM 0 HA TYR A 138 5.275 10.817 -23.177 1.00 0.00 H new ATOM 0 HB2 TYR A 138 3.228 9.759 -22.262 1.00 0.00 H new ATOM 0 HB3 TYR A 138 4.062 8.221 -22.148 1.00 0.00 H new ATOM 0 HD1 TYR A 138 4.718 11.773 -21.081 1.00 0.00 H new ATOM 0 HD2 TYR A 138 4.776 7.648 -20.012 1.00 0.00 H new ATOM 0 HE1 TYR A 138 5.508 12.368 -18.833 1.00 0.00 H new ATOM 0 HE2 TYR A 138 5.562 8.241 -17.762 1.00 0.00 H new ATOM 0 HH TYR A 138 6.989 10.841 -16.931 1.00 0.00 H new ATOM 2098 N GLU A 139 6.562 7.762 -23.104 1.00 0.00 N ATOM 2099 CA GLU A 139 7.806 7.022 -22.932 1.00 0.00 C ATOM 2100 C GLU A 139 8.903 7.585 -23.833 1.00 0.00 C ATOM 2101 O GLU A 139 10.012 7.861 -23.378 1.00 0.00 O ATOM 2102 CB GLU A 139 7.590 5.539 -23.238 1.00 0.00 C ATOM 2103 CG GLU A 139 8.848 4.698 -23.092 1.00 0.00 C ATOM 2104 CD GLU A 139 8.861 3.502 -24.024 1.00 0.00 C ATOM 2105 OE1 GLU A 139 8.245 3.585 -25.106 1.00 0.00 O ATOM 2106 OE2 GLU A 139 9.489 2.482 -23.670 1.00 0.00 O ATOM 0 H GLU A 139 5.748 7.179 -23.298 1.00 0.00 H new ATOM 0 HA GLU A 139 8.122 7.129 -21.894 1.00 0.00 H new ATOM 0 HB2 GLU A 139 6.822 5.147 -22.571 1.00 0.00 H new ATOM 0 HB3 GLU A 139 7.211 5.438 -24.255 1.00 0.00 H new ATOM 0 HG2 GLU A 139 9.721 5.319 -23.292 1.00 0.00 H new ATOM 0 HG3 GLU A 139 8.932 4.352 -22.062 1.00 0.00 H new ATOM 2113 N GLU A 140 8.582 7.750 -25.112 1.00 0.00 N ATOM 2114 CA GLU A 140 9.540 8.278 -26.077 1.00 0.00 C ATOM 2115 C GLU A 140 9.972 9.691 -25.697 1.00 0.00 C ATOM 2116 O GLU A 140 11.131 10.067 -25.875 1.00 0.00 O ATOM 2117 CB GLU A 140 8.935 8.277 -27.482 1.00 0.00 C ATOM 2118 CG GLU A 140 8.680 6.885 -28.035 1.00 0.00 C ATOM 2119 CD GLU A 140 8.022 6.912 -29.401 1.00 0.00 C ATOM 2120 OE1 GLU A 140 7.161 7.786 -29.629 1.00 0.00 O ATOM 2121 OE2 GLU A 140 8.370 6.057 -30.243 1.00 0.00 O ATOM 0 H GLU A 140 7.667 7.526 -25.504 1.00 0.00 H new ATOM 0 HA GLU A 140 10.419 7.634 -26.068 1.00 0.00 H new ATOM 0 HB2 GLU A 140 7.995 8.829 -27.464 1.00 0.00 H new ATOM 0 HB3 GLU A 140 9.605 8.810 -28.157 1.00 0.00 H new ATOM 0 HG2 GLU A 140 9.625 6.346 -28.102 1.00 0.00 H new ATOM 0 HG3 GLU A 140 8.046 6.333 -27.341 1.00 0.00 H new ATOM 2128 N PHE A 141 9.032 10.470 -25.173 1.00 0.00 N ATOM 2129 CA PHE A 141 9.314 11.843 -24.770 1.00 0.00 C ATOM 2130 C PHE A 141 10.244 11.874 -23.561 1.00 0.00 C ATOM 2131 O PHE A 141 11.223 12.620 -23.536 1.00 0.00 O ATOM 2132 CB PHE A 141 8.012 12.579 -24.445 1.00 0.00 C ATOM 2133 CG PHE A 141 8.214 13.818 -23.621 1.00 0.00 C ATOM 2134 CD1 PHE A 141 9.043 14.835 -24.067 1.00 0.00 C ATOM 2135 CD2 PHE A 141 7.574 13.967 -22.401 1.00 0.00 C ATOM 2136 CE1 PHE A 141 9.230 15.976 -23.310 1.00 0.00 C ATOM 2137 CE2 PHE A 141 7.758 15.106 -21.640 1.00 0.00 C ATOM 2138 CZ PHE A 141 8.586 16.112 -22.096 1.00 0.00 C ATOM 0 H PHE A 141 8.068 10.174 -25.017 1.00 0.00 H new ATOM 0 HA PHE A 141 9.810 12.345 -25.601 1.00 0.00 H new ATOM 0 HB2 PHE A 141 7.514 12.849 -25.376 1.00 0.00 H new ATOM 0 HB3 PHE A 141 7.345 11.902 -23.911 1.00 0.00 H new ATOM 0 HD1 PHE A 141 9.548 14.735 -25.016 1.00 0.00 H new ATOM 0 HD2 PHE A 141 6.924 13.184 -22.040 1.00 0.00 H new ATOM 0 HE1 PHE A 141 9.880 16.761 -23.668 1.00 0.00 H new ATOM 0 HE2 PHE A 141 7.255 15.209 -20.690 1.00 0.00 H new ATOM 0 HZ PHE A 141 8.730 17.004 -21.504 1.00 0.00 H new ATOM 2148 N VAL A 142 9.930 11.059 -22.559 1.00 0.00 N ATOM 2149 CA VAL A 142 10.737 10.992 -21.346 1.00 0.00 C ATOM 2150 C VAL A 142 12.201 10.725 -21.675 1.00 0.00 C ATOM 2151 O VAL A 142 13.092 11.428 -21.198 1.00 0.00 O ATOM 2152 CB VAL A 142 10.227 9.894 -20.393 1.00 0.00 C ATOM 2153 CG1 VAL A 142 11.183 9.718 -19.223 1.00 0.00 C ATOM 2154 CG2 VAL A 142 8.826 10.223 -19.902 1.00 0.00 C ATOM 0 H VAL A 142 9.123 10.436 -22.563 1.00 0.00 H new ATOM 0 HA VAL A 142 10.649 11.960 -20.853 1.00 0.00 H new ATOM 0 HB VAL A 142 10.183 8.953 -20.941 1.00 0.00 H new ATOM 0 HG11 VAL A 142 10.807 8.939 -18.560 1.00 0.00 H new ATOM 0 HG12 VAL A 142 12.167 9.433 -19.597 1.00 0.00 H new ATOM 0 HG13 VAL A 142 11.261 10.656 -18.673 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.482 9.437 -19.230 1.00 0.00 H new ATOM 0 HG22 VAL A 142 8.841 11.174 -19.370 1.00 0.00 H new ATOM 0 HG23 VAL A 142 8.149 10.294 -20.754 1.00 0.00 H new ATOM 2164 N GLN A 143 12.442 9.706 -22.492 1.00 0.00 N ATOM 2165 CA GLN A 143 13.800 9.346 -22.884 1.00 0.00 C ATOM 2166 C GLN A 143 14.541 10.553 -23.451 1.00 0.00 C ATOM 2167 O GLN A 143 15.652 10.867 -23.026 1.00 0.00 O ATOM 2168 CB GLN A 143 13.773 8.218 -23.918 1.00 0.00 C ATOM 2169 CG GLN A 143 13.156 6.930 -23.396 1.00 0.00 C ATOM 2170 CD GLN A 143 13.928 6.344 -22.230 1.00 0.00 C ATOM 2171 OE1 GLN A 143 13.936 6.903 -21.133 1.00 0.00 O ATOM 2172 NE2 GLN A 143 14.581 5.212 -22.462 1.00 0.00 N ATOM 0 H GLN A 143 11.715 9.115 -22.896 1.00 0.00 H new ATOM 0 HA GLN A 143 14.329 9.002 -21.995 1.00 0.00 H new ATOM 0 HB2 GLN A 143 13.214 8.551 -24.792 1.00 0.00 H new ATOM 0 HB3 GLN A 143 14.791 8.015 -24.249 1.00 0.00 H new ATOM 0 HG2 GLN A 143 12.129 7.123 -23.086 1.00 0.00 H new ATOM 0 HG3 GLN A 143 13.114 6.199 -24.203 1.00 0.00 H new ATOM 0 HE21 GLN A 143 14.546 4.784 -23.387 1.00 0.00 H new ATOM 0 HE22 GLN A 143 15.117 4.770 -21.715 1.00 0.00 H new ATOM 2181 N MET A 144 13.917 11.226 -24.413 1.00 0.00 N ATOM 2182 CA MET A 144 14.518 12.399 -25.037 1.00 0.00 C ATOM 2183 C MET A 144 15.007 13.386 -23.981 1.00 0.00 C ATOM 2184 O MET A 144 16.157 13.822 -24.012 1.00 0.00 O ATOM 2185 CB MET A 144 13.510 13.083 -25.963 1.00 0.00 C ATOM 2186 CG MET A 144 13.969 14.443 -26.462 1.00 0.00 C ATOM 2187 SD MET A 144 12.811 15.181 -27.631 1.00 0.00 S ATOM 2188 CE MET A 144 11.515 15.730 -26.523 1.00 0.00 C ATOM 0 H MET A 144 12.997 10.979 -24.777 1.00 0.00 H new ATOM 0 HA MET A 144 15.375 12.069 -25.625 1.00 0.00 H new ATOM 0 HB2 MET A 144 13.319 12.436 -26.819 1.00 0.00 H new ATOM 0 HB3 MET A 144 12.564 13.199 -25.434 1.00 0.00 H new ATOM 0 HG2 MET A 144 14.098 15.113 -25.612 1.00 0.00 H new ATOM 0 HG3 MET A 144 14.944 14.341 -26.938 1.00 0.00 H new ATOM 0 HE1 MET A 144 10.556 15.339 -26.863 1.00 0.00 H new ATOM 0 HE2 MET A 144 11.719 15.366 -25.516 1.00 0.00 H new ATOM 0 HE3 MET A 144 11.480 16.819 -26.515 1.00 0.00 H new ATOM 2198 N MET A 145 14.126 13.733 -23.048 1.00 0.00 N ATOM 2199 CA MET A 145 14.470 14.667 -21.983 1.00 0.00 C ATOM 2200 C MET A 145 15.724 14.212 -21.244 1.00 0.00 C ATOM 2201 O MET A 145 16.595 15.020 -20.920 1.00 0.00 O ATOM 2202 CB MET A 145 13.305 14.804 -21.000 1.00 0.00 C ATOM 2203 CG MET A 145 12.040 15.363 -21.631 1.00 0.00 C ATOM 2204 SD MET A 145 12.282 17.005 -22.335 1.00 0.00 S ATOM 2205 CE MET A 145 12.725 17.939 -20.872 1.00 0.00 C ATOM 0 H MET A 145 13.169 13.381 -23.008 1.00 0.00 H new ATOM 0 HA MET A 145 14.670 15.638 -22.436 1.00 0.00 H new ATOM 0 HB2 MET A 145 13.086 13.826 -20.571 1.00 0.00 H new ATOM 0 HB3 MET A 145 13.608 15.452 -20.178 1.00 0.00 H new ATOM 0 HG2 MET A 145 11.698 14.684 -22.412 1.00 0.00 H new ATOM 0 HG3 MET A 145 11.252 15.407 -20.879 1.00 0.00 H new ATOM 0 HE1 MET A 145 12.596 19.004 -21.067 1.00 0.00 H new ATOM 0 HE2 MET A 145 12.084 17.641 -20.042 1.00 0.00 H new ATOM 0 HE3 MET A 145 13.766 17.741 -20.615 1.00 0.00 H new ATOM 2215 N THR A 146 15.809 12.912 -20.978 1.00 0.00 N ATOM 2216 CA THR A 146 16.956 12.349 -20.276 1.00 0.00 C ATOM 2217 C THR A 146 17.934 11.702 -21.250 1.00 0.00 C ATOM 2218 O THR A 146 18.494 10.642 -20.970 1.00 0.00 O ATOM 2219 CB THR A 146 16.518 11.302 -19.234 1.00 0.00 C ATOM 2220 OG1 THR A 146 15.787 10.250 -19.874 1.00 0.00 O ATOM 2221 CG2 THR A 146 15.657 11.941 -18.154 1.00 0.00 C ATOM 0 H THR A 146 15.097 12.229 -21.238 1.00 0.00 H new ATOM 0 HA THR A 146 17.450 13.175 -19.765 1.00 0.00 H new ATOM 0 HB THR A 146 17.412 10.890 -18.767 1.00 0.00 H new ATOM 0 HG1 THR A 146 15.750 10.417 -20.839 1.00 0.00 H new ATOM 0 HG21 THR A 146 15.360 11.183 -17.430 1.00 0.00 H new ATOM 0 HG22 THR A 146 16.226 12.722 -17.649 1.00 0.00 H new ATOM 0 HG23 THR A 146 14.767 12.377 -18.609 1.00 0.00 H new ATOM 2229 N ALA A 147 18.136 12.346 -22.394 1.00 0.00 N ATOM 2230 CA ALA A 147 19.049 11.834 -23.409 1.00 0.00 C ATOM 2231 C ALA A 147 19.997 12.925 -23.894 1.00 0.00 C ATOM 2232 O ALA A 147 19.582 13.868 -24.569 1.00 0.00 O ATOM 2233 CB ALA A 147 18.267 11.253 -24.577 1.00 0.00 C ATOM 0 H ALA A 147 17.680 13.224 -22.642 1.00 0.00 H new ATOM 0 HA ALA A 147 19.648 11.043 -22.958 1.00 0.00 H new ATOM 0 HB1 ALA A 147 18.961 10.874 -25.327 1.00 0.00 H new ATOM 0 HB2 ALA A 147 17.636 10.438 -24.223 1.00 0.00 H new ATOM 0 HB3 ALA A 147 17.643 12.030 -25.019 1.00 0.00 H new ATOM 2239 N LYS A 148 21.273 12.791 -23.547 1.00 0.00 N ATOM 2240 CA LYS A 148 22.282 13.765 -23.948 1.00 0.00 C ATOM 2241 C LYS A 148 23.137 13.223 -25.089 1.00 0.00 C ATOM 2242 O LYS A 148 23.975 12.355 -24.853 1.00 0.00 O ATOM 2243 CB LYS A 148 23.171 14.128 -22.758 1.00 0.00 C ATOM 2244 CG LYS A 148 22.399 14.652 -21.559 1.00 0.00 C ATOM 2245 CD LYS A 148 21.752 15.994 -21.856 1.00 0.00 C ATOM 2246 CE LYS A 148 22.764 17.128 -21.788 1.00 0.00 C ATOM 2247 NZ LYS A 148 23.128 17.463 -20.383 1.00 0.00 N ATOM 0 H LYS A 148 21.633 12.017 -22.989 1.00 0.00 H new ATOM 0 HA LYS A 148 21.768 14.661 -24.296 1.00 0.00 H new ATOM 0 HB2 LYS A 148 23.739 13.247 -22.457 1.00 0.00 H new ATOM 0 HB3 LYS A 148 23.894 14.881 -23.072 1.00 0.00 H new ATOM 0 HG2 LYS A 148 21.631 13.932 -21.276 1.00 0.00 H new ATOM 0 HG3 LYS A 148 23.072 14.752 -20.707 1.00 0.00 H new ATOM 0 HD2 LYS A 148 21.298 15.969 -22.847 1.00 0.00 H new ATOM 0 HD3 LYS A 148 20.949 16.178 -21.142 1.00 0.00 H new ATOM 0 HE2 LYS A 148 23.662 16.847 -22.339 1.00 0.00 H new ATOM 0 HE3 LYS A 148 22.353 18.011 -22.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 23.668 18.351 -20.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 22.262 17.574 -19.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 23.708 16.698 -19.983 1.00 0.00 H new TER 2261 LYS A 148 HETATM 2262 CA CA A 200 29.515 -4.277 -4.103 1.00 0.00 CA HETATM 2263 CA CA A 250 26.762 0.287 5.001 1.00 0.00 CA HETATM 2264 CA CA A 300 -0.929 13.375 -30.299 1.00 0.00 CA HETATM 2265 CA CA A 350 6.795 6.832 -31.273 1.00 0.00 CA