USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1089 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 125 HIS : no HD1:sc=-0.00392 X(o=-0.0039,f=-0.052) USER MOD Set 1.2: A 128 LYS NZ :NH3+ -158:sc= 0 (180deg=0) USER MOD Set 2.1: A 103 HIS : no HD1:sc= 0.233 K(o=0.5,f=-4.4) USER MOD Set 2.2: A 110 SER OG : rot 146:sc= 0.264 USER MOD Set 3.1: A 54 THR OG1 : rot 180:sc= -0.387 USER MOD Set 3.2: A 57 MET CE :methyl -167:sc= -1.15 (180deg=-1.66) USER MOD Set 4.1: A 20 LYS NZ :NH3+ 141:sc= -0.714 (180deg=-1.39) USER MOD Set 4.2: A 123 GLN :FLIP amide:sc= -0.832 F(o=-3.3,f=-1.5) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0.0908 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc=0.000252 USER MOD Single : A 18 GLN : amide:sc= -0.0162 X(o=-0.016,f=-0.0016) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 GLN : amide:sc= -0.0185 X(o=-0.018,f=0) USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.00311 USER MOD Single : A 40 MET CE :methyl 159:sc= -0.168 (180deg=-0.988) USER MOD Single : A 41 GLN :FLIP amide:sc= -0.439 F(o=-1.8,f=-0.44) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 HIS : no HD1:sc= -0.223 X(o=-0.22,f=-0.19) USER MOD Single : A 48 GLN : amide:sc= -0.0846 X(o=-0.085,f=0) USER MOD Single : A 50 GLN : amide:sc= -0.197 K(o=-0.2,f=-2.2!) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot -27:sc= 0.329 USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 66 GLN : amide:sc= -0.192 K(o=-0.19,f=-2.1!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 69 MET CE :methyl 149:sc= -1.84 (180deg=-4.08!) USER MOD Single : A 79 GLN : amide:sc= 0.0192 X(o=0.019,f=0) USER MOD Single : A 81 MET CE :methyl -171:sc= -2.71 (180deg=-2.8!) USER MOD Single : A 82 HIS : no HD1:sc= -6.8! C(o=-6.8!,f=-12!) USER MOD Single : A 84 THR OG1 : rot -36:sc= 1.02 USER MOD Single : A 88 LYS NZ :NH3+ 160:sc= -1.29 (180deg=-2.01!) USER MOD Single : A 90 THR OG1 : rot -100:sc= -3.02! USER MOD Single : A 92 MET CE :methyl -118:sc= -6.45! (180deg=-8.65!) USER MOD Single : A 98 ASN : amide:sc= -0.91 K(o=-0.91,f=-2.4!) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl 166:sc= -8.16! (180deg=-9.06!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 73:sc= -2.24! USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.0143 K(o=-0.014,f=-4.3!) USER MOD Single : A 137 SER OG : rot 106:sc= 0.0775 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0.00529 USER MOD Single : A 143 THR OG1 : rot 180:sc= -0.438 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -30.222 -31.238 22.020 1.00 0.00 N ATOM 2 CA GLY A 1 -30.422 -29.810 22.396 1.00 0.00 C ATOM 3 C GLY A 1 -30.277 -28.873 21.209 1.00 0.00 C ATOM 4 O GLY A 1 -29.174 -28.694 20.691 1.00 0.00 O ATOM 0 H1 GLY A 1 -30.331 -31.837 22.863 1.00 0.00 H new ATOM 0 H2 GLY A 1 -30.928 -31.511 21.307 1.00 0.00 H new ATOM 0 H3 GLY A 1 -29.267 -31.363 21.627 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -31.413 -29.688 22.833 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -29.699 -29.534 23.163 1.00 0.00 H new ATOM 10 N PRO A 2 -31.381 -28.251 20.753 1.00 0.00 N ATOM 11 CA PRO A 2 -31.354 -27.328 19.612 1.00 0.00 C ATOM 12 C PRO A 2 -30.460 -26.118 19.870 1.00 0.00 C ATOM 13 O PRO A 2 -30.120 -25.818 21.014 1.00 0.00 O ATOM 14 CB PRO A 2 -32.816 -26.887 19.461 1.00 0.00 C ATOM 15 CG PRO A 2 -33.612 -27.921 20.182 1.00 0.00 C ATOM 16 CD PRO A 2 -32.738 -28.402 21.304 1.00 0.00 C ATOM 0 HA PRO A 2 -30.948 -27.803 18.719 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -32.975 -25.898 19.890 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -33.104 -26.830 18.411 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -34.543 -27.502 20.564 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -33.881 -28.741 19.517 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -32.876 -27.807 22.207 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -32.954 -29.437 21.569 1.00 0.00 H new ATOM 24 N LEU A 3 -30.082 -25.429 18.797 1.00 0.00 N ATOM 25 CA LEU A 3 -29.229 -24.251 18.906 1.00 0.00 C ATOM 26 C LEU A 3 -30.054 -22.972 18.825 1.00 0.00 C ATOM 27 O LEU A 3 -31.063 -22.916 18.122 1.00 0.00 O ATOM 28 CB LEU A 3 -28.169 -24.257 17.802 1.00 0.00 C ATOM 29 CG LEU A 3 -27.549 -25.624 17.506 1.00 0.00 C ATOM 30 CD1 LEU A 3 -27.182 -25.735 16.034 1.00 0.00 C ATOM 31 CD2 LEU A 3 -26.328 -25.855 18.381 1.00 0.00 C ATOM 0 H LEU A 3 -30.353 -25.666 17.843 1.00 0.00 H new ATOM 0 HA LEU A 3 -28.734 -24.282 19.876 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -28.618 -23.873 16.886 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -27.373 -23.567 18.080 1.00 0.00 H new ATOM 0 HG LEU A 3 -28.286 -26.394 17.735 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -26.742 -26.714 15.841 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -28.078 -25.614 15.425 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -26.462 -24.957 15.779 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -25.900 -26.832 18.157 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -25.587 -25.080 18.184 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -26.620 -25.819 19.430 1.00 0.00 H new ATOM 43 N GLY A 4 -29.617 -21.945 19.549 1.00 0.00 N ATOM 44 CA GLY A 4 -30.325 -20.678 19.544 1.00 0.00 C ATOM 45 C GLY A 4 -29.714 -19.679 18.582 1.00 0.00 C ATOM 46 O GLY A 4 -28.492 -19.542 18.510 1.00 0.00 O ATOM 0 H GLY A 4 -28.785 -21.968 20.139 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -31.367 -20.848 19.274 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -30.321 -20.259 20.550 1.00 0.00 H new ATOM 50 N SER A 5 -30.567 -18.979 17.838 1.00 0.00 N ATOM 51 CA SER A 5 -30.105 -17.986 16.875 1.00 0.00 C ATOM 52 C SER A 5 -29.958 -16.618 17.532 1.00 0.00 C ATOM 53 O SER A 5 -30.705 -16.276 18.448 1.00 0.00 O ATOM 54 CB SER A 5 -31.078 -17.896 15.697 1.00 0.00 C ATOM 55 OG SER A 5 -32.272 -18.612 15.966 1.00 0.00 O ATOM 0 H SER A 5 -31.581 -19.082 17.884 1.00 0.00 H new ATOM 0 HA SER A 5 -29.128 -18.300 16.508 1.00 0.00 H new ATOM 0 HB2 SER A 5 -31.314 -16.851 15.495 1.00 0.00 H new ATOM 0 HB3 SER A 5 -30.605 -18.295 14.799 1.00 0.00 H new ATOM 0 HG SER A 5 -32.878 -18.538 15.199 1.00 0.00 H new ATOM 61 N ALA A 6 -28.987 -15.842 17.058 1.00 0.00 N ATOM 62 CA ALA A 6 -28.735 -14.508 17.597 1.00 0.00 C ATOM 63 C ALA A 6 -28.478 -14.564 19.100 1.00 0.00 C ATOM 64 O ALA A 6 -29.206 -13.960 19.888 1.00 0.00 O ATOM 65 CB ALA A 6 -29.902 -13.583 17.288 1.00 0.00 C ATOM 0 H ALA A 6 -28.361 -16.114 16.300 1.00 0.00 H new ATOM 0 HA ALA A 6 -27.840 -14.111 17.118 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -29.699 -12.593 17.696 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -30.033 -13.511 16.208 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -30.811 -13.982 17.738 1.00 0.00 H new ATOM 71 N ALA A 7 -27.438 -15.295 19.489 1.00 0.00 N ATOM 72 CA ALA A 7 -27.083 -15.430 20.897 1.00 0.00 C ATOM 73 C ALA A 7 -26.104 -14.341 21.320 1.00 0.00 C ATOM 74 O ALA A 7 -25.525 -14.400 22.405 1.00 0.00 O ATOM 75 CB ALA A 7 -26.493 -16.807 21.164 1.00 0.00 C ATOM 0 H ALA A 7 -26.827 -15.803 18.849 1.00 0.00 H new ATOM 0 HA ALA A 7 -27.991 -15.317 21.489 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -26.233 -16.893 22.219 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -27.225 -17.573 20.907 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -25.598 -16.943 20.557 1.00 0.00 H new ATOM 81 N ALA A 8 -25.924 -13.347 20.456 1.00 0.00 N ATOM 82 CA ALA A 8 -25.015 -12.242 20.735 1.00 0.00 C ATOM 83 C ALA A 8 -25.394 -11.007 19.925 1.00 0.00 C ATOM 84 O ALA A 8 -24.527 -10.305 19.401 1.00 0.00 O ATOM 85 CB ALA A 8 -23.581 -12.654 20.442 1.00 0.00 C ATOM 0 H ALA A 8 -26.397 -13.285 19.555 1.00 0.00 H new ATOM 0 HA ALA A 8 -25.097 -11.989 21.792 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -22.912 -11.820 20.654 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -23.311 -13.504 21.069 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -23.490 -12.934 19.392 1.00 0.00 H new ATOM 91 N ALA A 9 -26.696 -10.753 19.823 1.00 0.00 N ATOM 92 CA ALA A 9 -27.202 -9.605 19.075 1.00 0.00 C ATOM 93 C ALA A 9 -26.805 -9.687 17.604 1.00 0.00 C ATOM 94 O ALA A 9 -26.132 -10.629 17.182 1.00 0.00 O ATOM 95 CB ALA A 9 -26.702 -8.305 19.689 1.00 0.00 C ATOM 0 H ALA A 9 -27.422 -11.328 20.250 1.00 0.00 H new ATOM 0 HA ALA A 9 -28.290 -9.622 19.132 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -27.089 -7.461 19.119 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -27.046 -8.234 20.721 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -25.612 -8.288 19.668 1.00 0.00 H new ATOM 101 N THR A 10 -27.231 -8.697 16.827 1.00 0.00 N ATOM 102 CA THR A 10 -26.922 -8.657 15.402 1.00 0.00 C ATOM 103 C THR A 10 -26.477 -7.255 14.981 1.00 0.00 C ATOM 104 O THR A 10 -27.091 -6.263 15.373 1.00 0.00 O ATOM 105 CB THR A 10 -28.143 -9.083 14.583 1.00 0.00 C ATOM 106 OG1 THR A 10 -29.297 -8.372 14.999 1.00 0.00 O ATOM 107 CG2 THR A 10 -28.450 -10.561 14.687 1.00 0.00 C ATOM 0 H THR A 10 -27.791 -7.912 17.160 1.00 0.00 H new ATOM 0 HA THR A 10 -26.104 -9.352 15.212 1.00 0.00 H new ATOM 0 HB THR A 10 -27.890 -8.856 13.547 1.00 0.00 H new ATOM 0 HG1 THR A 10 -30.067 -8.656 14.463 1.00 0.00 H new ATOM 0 HG21 THR A 10 -29.327 -10.794 14.083 1.00 0.00 H new ATOM 0 HG22 THR A 10 -27.597 -11.136 14.326 1.00 0.00 H new ATOM 0 HG23 THR A 10 -28.648 -10.819 15.727 1.00 0.00 H new ATOM 115 N PRO A 11 -25.400 -7.150 14.176 1.00 0.00 N ATOM 116 CA PRO A 11 -24.637 -8.302 13.675 1.00 0.00 C ATOM 117 C PRO A 11 -23.828 -8.986 14.773 1.00 0.00 C ATOM 118 O PRO A 11 -23.274 -8.325 15.652 1.00 0.00 O ATOM 119 CB PRO A 11 -23.697 -7.695 12.622 1.00 0.00 C ATOM 120 CG PRO A 11 -24.188 -6.302 12.397 1.00 0.00 C ATOM 121 CD PRO A 11 -24.852 -5.885 13.675 1.00 0.00 C ATOM 0 HA PRO A 11 -25.296 -9.075 13.278 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -22.665 -7.695 12.972 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -23.720 -8.272 11.698 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -23.364 -5.633 12.150 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -24.889 -6.266 11.563 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -24.143 -5.444 14.376 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -25.633 -5.144 13.504 1.00 0.00 H new ATOM 129 N ALA A 12 -23.766 -10.312 14.716 1.00 0.00 N ATOM 130 CA ALA A 12 -23.028 -11.089 15.706 1.00 0.00 C ATOM 131 C ALA A 12 -21.531 -11.070 15.416 1.00 0.00 C ATOM 132 O ALA A 12 -20.714 -11.323 16.302 1.00 0.00 O ATOM 133 CB ALA A 12 -23.542 -12.520 15.744 1.00 0.00 C ATOM 0 H ALA A 12 -24.219 -10.872 13.994 1.00 0.00 H new ATOM 0 HA ALA A 12 -23.188 -10.631 16.682 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -22.982 -13.088 16.487 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -24.599 -12.520 16.008 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -23.413 -12.979 14.764 1.00 0.00 H new ATOM 139 N VAL A 13 -21.178 -10.773 14.169 1.00 0.00 N ATOM 140 CA VAL A 13 -19.778 -10.719 13.763 1.00 0.00 C ATOM 141 C VAL A 13 -19.308 -9.276 13.617 1.00 0.00 C ATOM 142 O VAL A 13 -19.990 -8.448 13.013 1.00 0.00 O ATOM 143 CB VAL A 13 -19.532 -11.463 12.434 1.00 0.00 C ATOM 144 CG1 VAL A 13 -18.863 -12.804 12.691 1.00 0.00 C ATOM 145 CG2 VAL A 13 -20.831 -11.647 11.665 1.00 0.00 C ATOM 0 H VAL A 13 -21.842 -10.566 13.423 1.00 0.00 H new ATOM 0 HA VAL A 13 -19.208 -11.214 14.549 1.00 0.00 H new ATOM 0 HB VAL A 13 -18.864 -10.856 11.823 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -18.697 -13.315 11.743 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -17.907 -12.644 13.189 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -19.505 -13.415 13.325 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -20.630 -12.174 10.732 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -21.531 -12.227 12.266 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -21.265 -10.672 11.444 1.00 0.00 H new ATOM 155 N ARG A 14 -18.138 -8.981 14.176 1.00 0.00 N ATOM 156 CA ARG A 14 -17.576 -7.637 14.111 1.00 0.00 C ATOM 157 C ARG A 14 -16.771 -7.444 12.832 1.00 0.00 C ATOM 158 O ARG A 14 -17.079 -6.573 12.018 1.00 0.00 O ATOM 159 CB ARG A 14 -16.689 -7.375 15.329 1.00 0.00 C ATOM 160 CG ARG A 14 -17.442 -7.416 16.649 1.00 0.00 C ATOM 161 CD ARG A 14 -16.496 -7.586 17.826 1.00 0.00 C ATOM 162 NE ARG A 14 -16.053 -6.302 18.363 1.00 0.00 N ATOM 163 CZ ARG A 14 -14.779 -5.996 18.589 1.00 0.00 C ATOM 164 NH1 ARG A 14 -13.824 -6.878 18.324 1.00 0.00 N ATOM 165 NH2 ARG A 14 -14.458 -4.806 19.079 1.00 0.00 N ATOM 0 H ARG A 14 -17.561 -9.655 14.679 1.00 0.00 H new ATOM 0 HA ARG A 14 -18.401 -6.925 14.109 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -15.890 -8.116 15.353 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -16.215 -6.399 15.220 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -18.014 -6.496 16.771 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -18.158 -8.238 16.635 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -16.993 -8.155 18.611 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -15.628 -8.166 17.513 1.00 0.00 H new ATOM 0 HE ARG A 14 -16.761 -5.600 18.577 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -14.066 -7.794 17.946 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -12.848 -6.640 18.498 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -15.189 -4.124 19.283 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -13.480 -4.573 19.252 1.00 0.00 H new ATOM 179 N THR A 15 -15.736 -8.261 12.660 1.00 0.00 N ATOM 180 CA THR A 15 -14.885 -8.179 11.479 1.00 0.00 C ATOM 181 C THR A 15 -15.267 -9.239 10.454 1.00 0.00 C ATOM 182 O THR A 15 -15.329 -10.428 10.769 1.00 0.00 O ATOM 183 CB THR A 15 -13.416 -8.343 11.872 1.00 0.00 C ATOM 184 OG1 THR A 15 -13.268 -8.329 13.281 1.00 0.00 O ATOM 185 CG2 THR A 15 -12.519 -7.265 11.303 1.00 0.00 C ATOM 0 H THR A 15 -15.467 -8.987 13.324 1.00 0.00 H new ATOM 0 HA THR A 15 -15.029 -7.197 11.029 1.00 0.00 H new ATOM 0 HB THR A 15 -13.111 -9.302 11.454 1.00 0.00 H new ATOM 0 HG1 THR A 15 -12.322 -8.437 13.512 1.00 0.00 H new ATOM 0 HG21 THR A 15 -11.491 -7.442 11.621 1.00 0.00 H new ATOM 0 HG22 THR A 15 -12.571 -7.285 10.214 1.00 0.00 H new ATOM 0 HG23 THR A 15 -12.848 -6.290 11.664 1.00 0.00 H new ATOM 193 N VAL A 16 -15.520 -8.802 9.225 1.00 0.00 N ATOM 194 CA VAL A 16 -15.890 -9.714 8.148 1.00 0.00 C ATOM 195 C VAL A 16 -14.831 -9.714 7.046 1.00 0.00 C ATOM 196 O VAL A 16 -14.611 -8.695 6.391 1.00 0.00 O ATOM 197 CB VAL A 16 -17.253 -9.343 7.535 1.00 0.00 C ATOM 198 CG1 VAL A 16 -17.796 -10.498 6.708 1.00 0.00 C ATOM 199 CG2 VAL A 16 -18.240 -8.947 8.623 1.00 0.00 C ATOM 0 H VAL A 16 -15.476 -7.821 8.949 1.00 0.00 H new ATOM 0 HA VAL A 16 -15.961 -10.710 8.586 1.00 0.00 H new ATOM 0 HB VAL A 16 -17.113 -8.486 6.876 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -18.760 -10.219 6.282 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -17.097 -10.730 5.904 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -17.921 -11.374 7.344 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -19.197 -8.688 8.170 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -18.378 -9.782 9.310 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -17.853 -8.087 9.170 1.00 0.00 H new ATOM 209 N PRO A 17 -14.156 -10.858 6.829 1.00 0.00 N ATOM 210 CA PRO A 17 -13.112 -10.977 5.803 1.00 0.00 C ATOM 211 C PRO A 17 -13.617 -10.591 4.417 1.00 0.00 C ATOM 212 O PRO A 17 -14.462 -11.275 3.841 1.00 0.00 O ATOM 213 CB PRO A 17 -12.736 -12.461 5.839 1.00 0.00 C ATOM 214 CG PRO A 17 -13.132 -12.922 7.199 1.00 0.00 C ATOM 215 CD PRO A 17 -14.348 -12.121 7.567 1.00 0.00 C ATOM 0 HA PRO A 17 -12.274 -10.309 6.000 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -13.260 -13.020 5.064 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -11.669 -12.603 5.669 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -13.352 -13.990 7.201 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -12.327 -12.761 7.916 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -15.267 -12.625 7.270 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -14.410 -11.954 8.642 1.00 0.00 H new ATOM 223 N GLN A 18 -13.090 -9.491 3.887 1.00 0.00 N ATOM 224 CA GLN A 18 -13.483 -9.013 2.566 1.00 0.00 C ATOM 225 C GLN A 18 -12.689 -9.723 1.473 1.00 0.00 C ATOM 226 O GLN A 18 -12.072 -10.760 1.718 1.00 0.00 O ATOM 227 CB GLN A 18 -13.273 -7.500 2.468 1.00 0.00 C ATOM 228 CG GLN A 18 -14.504 -6.745 1.991 1.00 0.00 C ATOM 229 CD GLN A 18 -14.236 -5.918 0.748 1.00 0.00 C ATOM 230 OE1 GLN A 18 -14.850 -6.132 -0.297 1.00 0.00 O ATOM 231 NE2 GLN A 18 -13.317 -4.967 0.856 1.00 0.00 N ATOM 0 H GLN A 18 -12.390 -8.914 4.353 1.00 0.00 H new ATOM 0 HA GLN A 18 -14.540 -9.236 2.423 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -12.979 -7.118 3.446 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -12.447 -7.300 1.786 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -15.304 -7.456 1.784 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -14.856 -6.091 2.789 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -12.832 -4.824 1.742 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -13.095 -4.378 0.053 1.00 0.00 H new ATOM 240 N TYR A 19 -12.711 -9.159 0.269 1.00 0.00 N ATOM 241 CA TYR A 19 -11.992 -9.739 -0.860 1.00 0.00 C ATOM 242 C TYR A 19 -10.494 -9.804 -0.577 1.00 0.00 C ATOM 243 O TYR A 19 -9.865 -8.788 -0.280 1.00 0.00 O ATOM 244 CB TYR A 19 -12.246 -8.919 -2.127 1.00 0.00 C ATOM 245 CG TYR A 19 -12.237 -9.742 -3.395 1.00 0.00 C ATOM 246 CD1 TYR A 19 -13.359 -10.462 -3.787 1.00 0.00 C ATOM 247 CD2 TYR A 19 -11.108 -9.796 -4.202 1.00 0.00 C ATOM 248 CE1 TYR A 19 -13.354 -11.214 -4.946 1.00 0.00 C ATOM 249 CE2 TYR A 19 -11.096 -10.546 -5.363 1.00 0.00 C ATOM 250 CZ TYR A 19 -12.221 -11.253 -5.731 1.00 0.00 C ATOM 251 OH TYR A 19 -12.213 -12.002 -6.886 1.00 0.00 O ATOM 0 H TYR A 19 -13.219 -8.302 0.050 1.00 0.00 H new ATOM 0 HA TYR A 19 -12.360 -10.754 -1.010 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -13.209 -8.417 -2.037 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -11.487 -8.141 -2.204 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -14.249 -10.433 -3.176 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -10.225 -9.243 -3.918 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -14.234 -11.769 -5.236 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -10.209 -10.578 -5.979 1.00 0.00 H new ATOM 0 HH TYR A 19 -11.339 -11.921 -7.323 1.00 0.00 H new ATOM 261 N LYS A 20 -9.930 -11.004 -0.670 1.00 0.00 N ATOM 262 CA LYS A 20 -8.507 -11.201 -0.424 1.00 0.00 C ATOM 263 C LYS A 20 -7.702 -11.011 -1.706 1.00 0.00 C ATOM 264 O LYS A 20 -8.261 -10.732 -2.766 1.00 0.00 O ATOM 265 CB LYS A 20 -8.257 -12.598 0.145 1.00 0.00 C ATOM 266 CG LYS A 20 -7.594 -12.588 1.513 1.00 0.00 C ATOM 267 CD LYS A 20 -8.510 -13.164 2.580 1.00 0.00 C ATOM 268 CE LYS A 20 -8.301 -12.480 3.922 1.00 0.00 C ATOM 269 NZ LYS A 20 -9.586 -12.020 4.516 1.00 0.00 N ATOM 0 H LYS A 20 -10.437 -11.855 -0.914 1.00 0.00 H new ATOM 0 HA LYS A 20 -8.182 -10.456 0.302 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -9.207 -13.128 0.215 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -7.630 -13.157 -0.549 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.670 -13.165 1.475 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.321 -11.567 1.779 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -9.549 -13.049 2.270 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.324 -14.233 2.682 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -7.810 -13.170 4.609 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.634 -11.627 3.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -9.571 -12.181 5.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -9.713 -11.005 4.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.374 -12.552 4.094 1.00 0.00 H new ATOM 283 N TYR A 21 -6.385 -11.162 -1.600 1.00 0.00 N ATOM 284 CA TYR A 21 -5.503 -11.007 -2.750 1.00 0.00 C ATOM 285 C TYR A 21 -5.314 -12.337 -3.474 1.00 0.00 C ATOM 286 O TYR A 21 -4.188 -12.800 -3.661 1.00 0.00 O ATOM 287 CB TYR A 21 -4.145 -10.456 -2.307 1.00 0.00 C ATOM 288 CG TYR A 21 -4.124 -8.953 -2.142 1.00 0.00 C ATOM 289 CD1 TYR A 21 -4.257 -8.112 -3.240 1.00 0.00 C ATOM 290 CD2 TYR A 21 -3.967 -8.376 -0.889 1.00 0.00 C ATOM 291 CE1 TYR A 21 -4.236 -6.738 -3.093 1.00 0.00 C ATOM 292 CE2 TYR A 21 -3.946 -7.003 -0.733 1.00 0.00 C ATOM 293 CZ TYR A 21 -4.081 -6.189 -1.838 1.00 0.00 C ATOM 294 OH TYR A 21 -4.060 -4.821 -1.687 1.00 0.00 O ATOM 0 H TYR A 21 -5.906 -11.391 -0.729 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.966 -10.301 -3.440 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -3.865 -10.920 -1.361 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -3.390 -10.743 -3.039 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -4.379 -8.539 -4.224 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -3.859 -9.011 -0.022 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -4.340 -6.098 -3.957 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -3.825 -6.570 0.249 1.00 0.00 H new ATOM 0 HH TYR A 21 -3.944 -4.598 -0.740 1.00 0.00 H new ATOM 304 N ALA A 22 -6.424 -12.947 -3.879 1.00 0.00 N ATOM 305 CA ALA A 22 -6.380 -14.222 -4.584 1.00 0.00 C ATOM 306 C ALA A 22 -6.255 -14.011 -6.090 1.00 0.00 C ATOM 307 O ALA A 22 -7.252 -13.991 -6.811 1.00 0.00 O ATOM 308 CB ALA A 22 -7.618 -15.046 -4.264 1.00 0.00 C ATOM 0 H ALA A 22 -7.364 -12.579 -3.731 1.00 0.00 H new ATOM 0 HA ALA A 22 -5.499 -14.767 -4.245 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.571 -15.995 -4.798 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.662 -15.234 -3.191 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.509 -14.499 -4.573 1.00 0.00 H new ATOM 314 N ALA A 23 -5.021 -13.849 -6.557 1.00 0.00 N ATOM 315 CA ALA A 23 -4.761 -13.638 -7.975 1.00 0.00 C ATOM 316 C ALA A 23 -4.631 -14.966 -8.713 1.00 0.00 C ATOM 317 O ALA A 23 -4.223 -15.005 -9.875 1.00 0.00 O ATOM 318 CB ALA A 23 -3.505 -12.800 -8.165 1.00 0.00 C ATOM 0 H ALA A 23 -4.185 -13.860 -5.973 1.00 0.00 H new ATOM 0 HA ALA A 23 -5.609 -13.099 -8.397 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -3.324 -12.651 -9.230 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.636 -11.832 -7.681 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -2.653 -13.315 -7.721 1.00 0.00 H new ATOM 324 N GLY A 24 -4.981 -16.053 -8.031 1.00 0.00 N ATOM 325 CA GLY A 24 -4.899 -17.370 -8.636 1.00 0.00 C ATOM 326 C GLY A 24 -6.076 -17.661 -9.546 1.00 0.00 C ATOM 327 O GLY A 24 -5.914 -17.788 -10.760 1.00 0.00 O ATOM 0 H GLY A 24 -5.320 -16.045 -7.069 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -3.974 -17.448 -9.207 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -4.854 -18.125 -7.851 1.00 0.00 H new ATOM 331 N VAL A 25 -7.263 -17.767 -8.958 1.00 0.00 N ATOM 332 CA VAL A 25 -8.474 -18.044 -9.723 1.00 0.00 C ATOM 333 C VAL A 25 -9.338 -16.791 -9.848 1.00 0.00 C ATOM 334 O VAL A 25 -9.672 -16.151 -8.851 1.00 0.00 O ATOM 335 CB VAL A 25 -9.300 -19.176 -9.079 1.00 0.00 C ATOM 336 CG1 VAL A 25 -9.579 -18.874 -7.615 1.00 0.00 C ATOM 337 CG2 VAL A 25 -10.598 -19.398 -9.844 1.00 0.00 C ATOM 0 H VAL A 25 -7.413 -17.665 -7.954 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.160 -18.363 -10.717 1.00 0.00 H new ATOM 0 HB VAL A 25 -8.716 -20.095 -9.129 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -10.163 -19.686 -7.181 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -8.636 -18.778 -7.077 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -10.139 -17.942 -7.536 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -11.165 -20.201 -9.373 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.188 -18.482 -9.833 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.371 -19.671 -10.875 1.00 0.00 H new ATOM 347 N ARG A 26 -9.688 -16.444 -11.082 1.00 0.00 N ATOM 348 CA ARG A 26 -10.511 -15.269 -11.341 1.00 0.00 C ATOM 349 C ARG A 26 -11.971 -15.661 -11.537 1.00 0.00 C ATOM 350 O ARG A 26 -12.364 -16.112 -12.613 1.00 0.00 O ATOM 351 CB ARG A 26 -10.000 -14.526 -12.576 1.00 0.00 C ATOM 352 CG ARG A 26 -9.532 -13.110 -12.284 1.00 0.00 C ATOM 353 CD ARG A 26 -10.179 -12.105 -13.223 1.00 0.00 C ATOM 354 NE ARG A 26 -9.308 -11.762 -14.344 1.00 0.00 N ATOM 355 CZ ARG A 26 -9.503 -10.711 -15.136 1.00 0.00 C ATOM 356 NH1 ARG A 26 -10.536 -9.904 -14.934 1.00 0.00 N ATOM 357 NH2 ARG A 26 -8.664 -10.468 -16.133 1.00 0.00 N ATOM 0 H ARG A 26 -9.414 -16.960 -11.918 1.00 0.00 H new ATOM 0 HA ARG A 26 -10.444 -14.610 -10.475 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -9.176 -15.089 -13.013 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.793 -14.491 -13.323 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -9.771 -12.852 -11.252 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -8.448 -13.056 -12.383 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -11.115 -12.515 -13.603 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -10.429 -11.200 -12.669 1.00 0.00 H new ATOM 0 HE ARG A 26 -8.505 -12.362 -14.530 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -11.185 -10.088 -14.169 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -10.681 -9.099 -15.544 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -7.869 -11.087 -16.293 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -8.813 -9.662 -16.740 1.00 0.00 H new ATOM 371 N ASN A 27 -12.771 -15.488 -10.489 1.00 0.00 N ATOM 372 CA ASN A 27 -14.189 -15.823 -10.545 1.00 0.00 C ATOM 373 C ASN A 27 -15.037 -14.573 -10.775 1.00 0.00 C ATOM 374 O ASN A 27 -15.204 -13.755 -9.870 1.00 0.00 O ATOM 375 CB ASN A 27 -14.620 -16.515 -9.250 1.00 0.00 C ATOM 376 CG ASN A 27 -15.516 -17.712 -9.504 1.00 0.00 C ATOM 377 OD1 ASN A 27 -15.099 -18.859 -9.339 1.00 0.00 O ATOM 378 ND2 ASN A 27 -16.754 -17.451 -9.908 1.00 0.00 N ATOM 0 H ASN A 27 -12.461 -15.118 -9.591 1.00 0.00 H new ATOM 0 HA ASN A 27 -14.344 -16.503 -11.383 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -13.735 -16.837 -8.702 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -15.145 -15.800 -8.616 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -17.402 -18.217 -10.095 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -17.057 -16.485 -10.032 1.00 0.00 H new ATOM 385 N PRO A 28 -15.585 -14.407 -11.994 1.00 0.00 N ATOM 386 CA PRO A 28 -16.415 -13.246 -12.335 1.00 0.00 C ATOM 387 C PRO A 28 -17.680 -13.171 -11.487 1.00 0.00 C ATOM 388 O PRO A 28 -17.813 -12.299 -10.627 1.00 0.00 O ATOM 389 CB PRO A 28 -16.775 -13.469 -13.810 1.00 0.00 C ATOM 390 CG PRO A 28 -15.781 -14.464 -14.309 1.00 0.00 C ATOM 391 CD PRO A 28 -15.438 -15.328 -13.133 1.00 0.00 C ATOM 0 HA PRO A 28 -15.889 -12.309 -12.153 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -17.793 -13.843 -13.915 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -16.718 -12.538 -14.374 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -16.198 -15.058 -15.122 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -14.893 -13.967 -14.700 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -16.109 -16.183 -13.050 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -14.425 -15.724 -13.204 1.00 0.00 H new ATOM 399 N GLN A 29 -18.608 -14.092 -11.733 1.00 0.00 N ATOM 400 CA GLN A 29 -19.865 -14.132 -10.995 1.00 0.00 C ATOM 401 C GLN A 29 -19.728 -14.977 -9.731 1.00 0.00 C ATOM 402 O GLN A 29 -20.374 -16.017 -9.594 1.00 0.00 O ATOM 403 CB GLN A 29 -20.981 -14.692 -11.880 1.00 0.00 C ATOM 404 CG GLN A 29 -22.014 -13.654 -12.286 1.00 0.00 C ATOM 405 CD GLN A 29 -23.050 -14.208 -13.244 1.00 0.00 C ATOM 406 OE1 GLN A 29 -22.720 -14.671 -14.336 1.00 0.00 O ATOM 407 NE2 GLN A 29 -24.314 -14.163 -12.838 1.00 0.00 N ATOM 0 H GLN A 29 -18.512 -14.822 -12.439 1.00 0.00 H new ATOM 0 HA GLN A 29 -20.119 -13.113 -10.702 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -20.539 -15.123 -12.778 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -21.481 -15.503 -11.350 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -22.514 -13.276 -11.394 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -21.510 -12.807 -12.752 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -24.543 -13.771 -11.925 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -25.056 -14.521 -13.440 1.00 0.00 H new ATOM 416 N GLN A 30 -18.885 -14.523 -8.811 1.00 0.00 N ATOM 417 CA GLN A 30 -18.663 -15.237 -7.558 1.00 0.00 C ATOM 418 C GLN A 30 -19.822 -15.018 -6.593 1.00 0.00 C ATOM 419 O GLN A 30 -20.625 -15.921 -6.355 1.00 0.00 O ATOM 420 CB GLN A 30 -17.353 -14.779 -6.913 1.00 0.00 C ATOM 421 CG GLN A 30 -16.909 -15.652 -5.751 1.00 0.00 C ATOM 422 CD GLN A 30 -15.515 -15.310 -5.261 1.00 0.00 C ATOM 423 OE1 GLN A 30 -15.026 -14.198 -5.468 1.00 0.00 O ATOM 424 NE2 GLN A 30 -14.866 -16.267 -4.607 1.00 0.00 N ATOM 0 H GLN A 30 -18.344 -13.664 -8.908 1.00 0.00 H new ATOM 0 HA GLN A 30 -18.598 -16.302 -7.782 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -16.569 -14.770 -7.670 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -17.469 -13.754 -6.562 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -17.616 -15.542 -4.929 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -16.936 -16.698 -6.057 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -15.309 -17.174 -4.458 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -13.925 -16.095 -4.254 1.00 0.00 H new ATOM 433 N HIS A 31 -19.903 -13.812 -6.038 1.00 0.00 N ATOM 434 CA HIS A 31 -20.964 -13.470 -5.097 1.00 0.00 C ATOM 435 C HIS A 31 -21.183 -11.962 -5.050 1.00 0.00 C ATOM 436 O HIS A 31 -22.099 -11.477 -4.385 1.00 0.00 O ATOM 437 CB HIS A 31 -20.620 -13.989 -3.699 1.00 0.00 C ATOM 438 CG HIS A 31 -21.715 -14.795 -3.072 1.00 0.00 C ATOM 439 ND1 HIS A 31 -21.861 -16.136 -3.340 1.00 0.00 N ATOM 440 CD2 HIS A 31 -22.680 -14.409 -2.202 1.00 0.00 C ATOM 441 CE1 HIS A 31 -22.905 -16.534 -2.635 1.00 0.00 C ATOM 442 NE2 HIS A 31 -23.432 -15.523 -1.930 1.00 0.00 N ATOM 0 H HIS A 31 -19.246 -13.055 -6.224 1.00 0.00 H new ATOM 0 HA HIS A 31 -21.885 -13.943 -5.438 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -19.719 -14.600 -3.759 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -20.388 -13.142 -3.053 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -22.828 -13.417 -1.801 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -23.285 -17.545 -2.628 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -24.239 -15.573 -1.309 1.00 0.00 H new ATOM 450 N LEU A 32 -20.335 -11.225 -5.761 1.00 0.00 N ATOM 451 CA LEU A 32 -20.432 -9.771 -5.802 1.00 0.00 C ATOM 452 C LEU A 32 -21.634 -9.329 -6.630 1.00 0.00 C ATOM 453 O LEU A 32 -21.677 -9.540 -7.843 1.00 0.00 O ATOM 454 CB LEU A 32 -19.150 -9.169 -6.383 1.00 0.00 C ATOM 455 CG LEU A 32 -18.648 -7.909 -5.674 1.00 0.00 C ATOM 456 CD1 LEU A 32 -18.076 -8.256 -4.308 1.00 0.00 C ATOM 457 CD2 LEU A 32 -17.606 -7.198 -6.524 1.00 0.00 C ATOM 0 H LEU A 32 -19.572 -11.612 -6.317 1.00 0.00 H new ATOM 0 HA LEU A 32 -20.564 -9.412 -4.781 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.364 -9.924 -6.350 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -19.321 -8.933 -7.433 1.00 0.00 H new ATOM 0 HG LEU A 32 -19.493 -7.236 -5.531 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -17.724 -7.347 -3.819 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -18.850 -8.720 -3.697 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -17.243 -8.949 -4.428 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -17.260 -6.304 -6.004 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.762 -7.865 -6.699 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -18.048 -6.914 -7.479 1.00 0.00 H new ATOM 469 N ASN A 33 -22.608 -8.715 -5.966 1.00 0.00 N ATOM 470 CA ASN A 33 -23.812 -8.242 -6.639 1.00 0.00 C ATOM 471 C ASN A 33 -23.726 -6.744 -6.917 1.00 0.00 C ATOM 472 O ASN A 33 -24.403 -6.228 -7.806 1.00 0.00 O ATOM 473 CB ASN A 33 -25.048 -8.544 -5.790 1.00 0.00 C ATOM 474 CG ASN A 33 -24.878 -9.791 -4.944 1.00 0.00 C ATOM 475 OD1 ASN A 33 -24.686 -9.710 -3.730 1.00 0.00 O ATOM 476 ND2 ASN A 33 -24.949 -10.953 -5.582 1.00 0.00 N ATOM 0 H ASN A 33 -22.587 -8.533 -4.963 1.00 0.00 H new ATOM 0 HA ASN A 33 -23.896 -8.767 -7.591 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -25.256 -7.693 -5.141 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -25.913 -8.666 -6.442 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -24.843 -11.826 -5.065 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -25.110 -10.973 -6.589 1.00 0.00 H new ATOM 483 N ALA A 34 -22.889 -6.052 -6.149 1.00 0.00 N ATOM 484 CA ALA A 34 -22.714 -4.614 -6.312 1.00 0.00 C ATOM 485 C ALA A 34 -21.700 -4.305 -7.407 1.00 0.00 C ATOM 486 O ALA A 34 -20.505 -4.557 -7.250 1.00 0.00 O ATOM 487 CB ALA A 34 -22.283 -3.982 -4.998 1.00 0.00 C ATOM 0 H ALA A 34 -22.322 -6.465 -5.408 1.00 0.00 H new ATOM 0 HA ALA A 34 -23.672 -4.188 -6.610 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -22.156 -2.908 -5.135 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -23.045 -4.164 -4.240 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -21.339 -4.421 -4.676 1.00 0.00 H new ATOM 493 N GLN A 35 -22.185 -3.757 -8.518 1.00 0.00 N ATOM 494 CA GLN A 35 -21.321 -3.410 -9.640 1.00 0.00 C ATOM 495 C GLN A 35 -20.749 -2.003 -9.474 1.00 0.00 C ATOM 496 O GLN A 35 -21.499 -1.035 -9.346 1.00 0.00 O ATOM 497 CB GLN A 35 -22.097 -3.503 -10.955 1.00 0.00 C ATOM 498 CG GLN A 35 -21.817 -4.773 -11.740 1.00 0.00 C ATOM 499 CD GLN A 35 -22.720 -5.920 -11.334 1.00 0.00 C ATOM 500 OE1 GLN A 35 -22.267 -6.909 -10.758 1.00 0.00 O ATOM 501 NE2 GLN A 35 -24.008 -5.793 -11.633 1.00 0.00 N ATOM 0 H GLN A 35 -23.172 -3.544 -8.664 1.00 0.00 H new ATOM 0 HA GLN A 35 -20.494 -4.119 -9.661 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -23.164 -3.446 -10.742 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -21.849 -2.641 -11.575 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -21.945 -4.574 -12.804 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -20.777 -5.065 -11.593 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -24.340 -4.956 -12.111 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -24.665 -6.533 -11.384 1.00 0.00 H new ATOM 510 N PRO A 36 -19.410 -1.868 -9.476 1.00 0.00 N ATOM 511 CA PRO A 36 -18.750 -0.566 -9.331 1.00 0.00 C ATOM 512 C PRO A 36 -18.933 0.312 -10.565 1.00 0.00 C ATOM 513 O PRO A 36 -19.899 0.156 -11.311 1.00 0.00 O ATOM 514 CB PRO A 36 -17.277 -0.932 -9.143 1.00 0.00 C ATOM 515 CG PRO A 36 -17.126 -2.250 -9.818 1.00 0.00 C ATOM 516 CD PRO A 36 -18.435 -2.967 -9.626 1.00 0.00 C ATOM 0 HA PRO A 36 -19.163 0.014 -8.506 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -16.623 -0.182 -9.588 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -17.017 -0.996 -8.087 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -16.903 -2.123 -10.877 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -16.303 -2.818 -9.385 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -18.674 -3.602 -10.479 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -18.416 -3.610 -8.746 1.00 0.00 H new ATOM 524 N GLN A 37 -17.997 1.232 -10.777 1.00 0.00 N ATOM 525 CA GLN A 37 -18.057 2.132 -11.923 1.00 0.00 C ATOM 526 C GLN A 37 -17.560 1.438 -13.186 1.00 0.00 C ATOM 527 O GLN A 37 -16.394 1.055 -13.277 1.00 0.00 O ATOM 528 CB GLN A 37 -17.223 3.386 -11.657 1.00 0.00 C ATOM 529 CG GLN A 37 -17.762 4.247 -10.527 1.00 0.00 C ATOM 530 CD GLN A 37 -16.701 5.147 -9.923 1.00 0.00 C ATOM 531 OE1 GLN A 37 -15.900 5.748 -10.639 1.00 0.00 O ATOM 532 NE2 GLN A 37 -16.691 5.244 -8.600 1.00 0.00 N ATOM 0 H GLN A 37 -17.189 1.374 -10.171 1.00 0.00 H new ATOM 0 HA GLN A 37 -19.098 2.420 -12.073 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -16.201 3.089 -11.421 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -17.179 3.983 -12.568 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -18.583 4.859 -10.901 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -18.173 3.604 -9.749 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -17.374 4.728 -8.046 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -16.000 5.835 -8.137 1.00 0.00 H new ATOM 541 N VAL A 38 -18.451 1.283 -14.160 1.00 0.00 N ATOM 542 CA VAL A 38 -18.102 0.641 -15.421 1.00 0.00 C ATOM 543 C VAL A 38 -17.358 1.607 -16.338 1.00 0.00 C ATOM 544 O VAL A 38 -16.757 1.198 -17.331 1.00 0.00 O ATOM 545 CB VAL A 38 -19.353 0.115 -16.149 1.00 0.00 C ATOM 546 CG1 VAL A 38 -19.924 -1.094 -15.424 1.00 0.00 C ATOM 547 CG2 VAL A 38 -20.399 1.212 -16.278 1.00 0.00 C ATOM 0 H VAL A 38 -19.421 1.594 -14.100 1.00 0.00 H new ATOM 0 HA VAL A 38 -17.453 -0.201 -15.181 1.00 0.00 H new ATOM 0 HB VAL A 38 -19.062 -0.196 -17.152 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -20.807 -1.452 -15.953 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -19.175 -1.886 -15.391 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -20.199 -0.812 -14.408 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -21.275 0.820 -16.795 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -20.688 1.558 -15.285 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -19.985 2.045 -16.846 1.00 0.00 H new ATOM 557 N THR A 39 -17.401 2.891 -15.994 1.00 0.00 N ATOM 558 CA THR A 39 -16.729 3.919 -16.781 1.00 0.00 C ATOM 559 C THR A 39 -15.259 4.028 -16.391 1.00 0.00 C ATOM 560 O THR A 39 -14.929 4.187 -15.216 1.00 0.00 O ATOM 561 CB THR A 39 -17.423 5.269 -16.587 1.00 0.00 C ATOM 562 OG1 THR A 39 -18.803 5.089 -16.320 1.00 0.00 O ATOM 563 CG2 THR A 39 -17.301 6.185 -17.785 1.00 0.00 C ATOM 0 H THR A 39 -17.895 3.244 -15.174 1.00 0.00 H new ATOM 0 HA THR A 39 -16.786 3.635 -17.832 1.00 0.00 H new ATOM 0 HB THR A 39 -16.915 5.736 -15.743 1.00 0.00 H new ATOM 0 HG1 THR A 39 -19.229 5.963 -16.197 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.815 7.124 -17.579 1.00 0.00 H new ATOM 0 HG22 THR A 39 -16.248 6.384 -17.985 1.00 0.00 H new ATOM 0 HG23 THR A 39 -17.752 5.708 -18.655 1.00 0.00 H new ATOM 571 N MET A 40 -14.380 3.942 -17.385 1.00 0.00 N ATOM 572 CA MET A 40 -12.944 4.027 -17.145 1.00 0.00 C ATOM 573 C MET A 40 -12.489 5.480 -17.058 1.00 0.00 C ATOM 574 O MET A 40 -12.959 6.334 -17.809 1.00 0.00 O ATOM 575 CB MET A 40 -12.178 3.305 -18.258 1.00 0.00 C ATOM 576 CG MET A 40 -12.459 3.856 -19.646 1.00 0.00 C ATOM 577 SD MET A 40 -13.099 2.602 -20.774 1.00 0.00 S ATOM 578 CE MET A 40 -14.830 3.056 -20.836 1.00 0.00 C ATOM 0 H MET A 40 -14.637 3.814 -18.364 1.00 0.00 H new ATOM 0 HA MET A 40 -12.731 3.543 -16.192 1.00 0.00 H new ATOM 0 HB2 MET A 40 -11.109 3.377 -18.057 1.00 0.00 H new ATOM 0 HB3 MET A 40 -12.436 2.246 -18.237 1.00 0.00 H new ATOM 0 HG2 MET A 40 -13.178 4.672 -19.570 1.00 0.00 H new ATOM 0 HG3 MET A 40 -11.542 4.276 -20.059 1.00 0.00 H new ATOM 0 HE1 MET A 40 -15.282 2.645 -21.739 1.00 0.00 H new ATOM 0 HE2 MET A 40 -15.342 2.658 -19.960 1.00 0.00 H new ATOM 0 HE3 MET A 40 -14.921 4.142 -20.847 1.00 0.00 H new ATOM 588 N GLN A 41 -11.572 5.751 -16.134 1.00 0.00 N ATOM 589 CA GLN A 41 -11.048 7.100 -15.949 1.00 0.00 C ATOM 590 C GLN A 41 -9.623 7.207 -16.486 1.00 0.00 C ATOM 591 O GLN A 41 -8.747 6.432 -16.103 1.00 0.00 O ATOM 592 CB GLN A 41 -11.079 7.486 -14.469 1.00 0.00 C ATOM 593 CG GLN A 41 -10.649 6.366 -13.535 1.00 0.00 C ATOM 594 CD GLN A 41 -11.282 6.478 -12.162 1.00 0.00 C ATOM 595 OE1 GLN A 41 -10.451 6.501 -11.127 1.00 0.00 O flip ATOM 596 NE2 GLN A 41 -12.505 6.544 -12.032 1.00 0.00 N flip ATOM 0 H GLN A 41 -11.177 5.055 -15.502 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.682 7.789 -16.508 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.428 8.346 -14.314 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -12.089 7.799 -14.206 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -10.916 5.406 -13.977 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.564 6.379 -13.433 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -13.107 6.523 -12.855 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.916 6.620 -11.101 1.00 0.00 H new ATOM 605 N GLN A 42 -9.402 8.168 -17.377 1.00 0.00 N ATOM 606 CA GLN A 42 -8.086 8.373 -17.973 1.00 0.00 C ATOM 607 C GLN A 42 -7.053 8.793 -16.921 1.00 0.00 C ATOM 608 O GLN A 42 -5.987 8.184 -16.826 1.00 0.00 O ATOM 609 CB GLN A 42 -8.161 9.419 -19.089 1.00 0.00 C ATOM 610 CG GLN A 42 -8.310 8.819 -20.477 1.00 0.00 C ATOM 611 CD GLN A 42 -9.698 9.018 -21.053 1.00 0.00 C ATOM 612 OE1 GLN A 42 -10.603 8.218 -20.814 1.00 0.00 O ATOM 613 NE2 GLN A 42 -9.873 10.089 -21.817 1.00 0.00 N ATOM 0 H GLN A 42 -10.118 8.818 -17.703 1.00 0.00 H new ATOM 0 HA GLN A 42 -7.764 7.423 -18.399 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -9.004 10.083 -18.897 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -7.260 10.032 -19.062 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -7.576 9.270 -21.144 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -8.088 7.753 -20.433 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -9.095 10.726 -21.989 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -10.786 10.275 -22.232 1.00 0.00 H new ATOM 622 N PRO A 43 -7.344 9.835 -16.111 1.00 0.00 N ATOM 623 CA PRO A 43 -6.413 10.307 -15.079 1.00 0.00 C ATOM 624 C PRO A 43 -6.211 9.277 -13.973 1.00 0.00 C ATOM 625 O PRO A 43 -6.643 8.130 -14.094 1.00 0.00 O ATOM 626 CB PRO A 43 -7.086 11.567 -14.516 1.00 0.00 C ATOM 627 CG PRO A 43 -8.142 11.929 -15.505 1.00 0.00 C ATOM 628 CD PRO A 43 -8.577 10.639 -16.133 1.00 0.00 C ATOM 0 HA PRO A 43 -5.421 10.493 -15.490 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -7.517 11.376 -13.533 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -6.366 12.377 -14.396 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -8.979 12.428 -15.017 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -7.754 12.618 -16.256 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -9.380 10.165 -15.568 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -8.946 10.787 -17.148 1.00 0.00 H new ATOM 636 N ALA A 44 -5.558 9.694 -12.893 1.00 0.00 N ATOM 637 CA ALA A 44 -5.305 8.808 -11.764 1.00 0.00 C ATOM 638 C ALA A 44 -6.603 8.450 -11.049 1.00 0.00 C ATOM 639 O ALA A 44 -7.672 8.962 -11.386 1.00 0.00 O ATOM 640 CB ALA A 44 -4.326 9.453 -10.795 1.00 0.00 C ATOM 0 H ALA A 44 -5.195 10.640 -12.777 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.865 7.887 -12.147 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.147 8.780 -9.957 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.385 9.653 -11.308 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.744 10.389 -10.425 1.00 0.00 H new ATOM 646 N VAL A 45 -6.504 7.568 -10.059 1.00 0.00 N ATOM 647 CA VAL A 45 -7.672 7.141 -9.297 1.00 0.00 C ATOM 648 C VAL A 45 -7.735 7.851 -7.947 1.00 0.00 C ATOM 649 O VAL A 45 -8.817 8.084 -7.407 1.00 0.00 O ATOM 650 CB VAL A 45 -7.670 5.615 -9.072 1.00 0.00 C ATOM 651 CG1 VAL A 45 -6.454 5.192 -8.263 1.00 0.00 C ATOM 652 CG2 VAL A 45 -8.956 5.172 -8.390 1.00 0.00 C ATOM 0 H VAL A 45 -5.628 7.136 -9.766 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.551 7.408 -9.884 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.615 5.126 -10.044 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.472 4.112 -8.116 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.546 5.470 -8.798 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.470 5.690 -7.294 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.935 4.093 -8.240 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -9.046 5.671 -7.425 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.809 5.435 -9.016 1.00 0.00 H new ATOM 662 N HIS A 46 -6.570 8.196 -7.410 1.00 0.00 N ATOM 663 CA HIS A 46 -6.493 8.882 -6.125 1.00 0.00 C ATOM 664 C HIS A 46 -6.256 10.376 -6.318 1.00 0.00 C ATOM 665 O HIS A 46 -6.273 10.877 -7.442 1.00 0.00 O ATOM 666 CB HIS A 46 -5.376 8.280 -5.268 1.00 0.00 C ATOM 667 CG HIS A 46 -4.112 8.018 -6.025 1.00 0.00 C ATOM 668 ND1 HIS A 46 -3.627 6.741 -6.189 1.00 0.00 N ATOM 669 CD2 HIS A 46 -3.274 8.891 -6.637 1.00 0.00 C ATOM 670 CE1 HIS A 46 -2.515 6.864 -6.892 1.00 0.00 C ATOM 671 NE2 HIS A 46 -2.263 8.148 -7.186 1.00 0.00 N ATOM 0 H HIS A 46 -5.666 8.012 -7.844 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.446 8.749 -5.612 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -5.160 8.956 -4.441 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -5.728 7.345 -4.832 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -3.383 9.965 -6.683 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -1.889 6.036 -7.192 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -1.469 8.504 -7.718 1.00 0.00 H new ATOM 679 N VAL A 47 -6.035 11.083 -5.214 1.00 0.00 N ATOM 680 CA VAL A 47 -5.797 12.521 -5.260 1.00 0.00 C ATOM 681 C VAL A 47 -4.303 12.829 -5.307 1.00 0.00 C ATOM 682 O VAL A 47 -3.494 12.113 -4.717 1.00 0.00 O ATOM 683 CB VAL A 47 -6.419 13.239 -4.047 1.00 0.00 C ATOM 684 CG1 VAL A 47 -6.568 14.726 -4.325 1.00 0.00 C ATOM 685 CG2 VAL A 47 -7.762 12.620 -3.686 1.00 0.00 C ATOM 0 H VAL A 47 -6.016 10.683 -4.276 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.272 12.888 -6.169 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.749 13.116 -3.196 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -7.009 15.216 -3.457 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -5.588 15.158 -4.527 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -7.214 14.871 -5.191 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -8.184 13.142 -2.827 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -8.442 12.707 -4.533 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.623 11.568 -3.439 1.00 0.00 H new ATOM 695 N GLN A 48 -3.946 13.899 -6.009 1.00 0.00 N ATOM 696 CA GLN A 48 -2.551 14.304 -6.130 1.00 0.00 C ATOM 697 C GLN A 48 -2.141 15.203 -4.968 1.00 0.00 C ATOM 698 O GLN A 48 -0.968 15.263 -4.601 1.00 0.00 O ATOM 699 CB GLN A 48 -2.323 15.032 -7.457 1.00 0.00 C ATOM 700 CG GLN A 48 -1.453 14.259 -8.434 1.00 0.00 C ATOM 701 CD GLN A 48 -0.343 15.106 -9.025 1.00 0.00 C ATOM 702 OE1 GLN A 48 -0.227 15.233 -10.244 1.00 0.00 O ATOM 703 NE2 GLN A 48 0.483 15.686 -8.162 1.00 0.00 N ATOM 0 H GLN A 48 -4.604 14.502 -6.503 1.00 0.00 H new ATOM 0 HA GLN A 48 -1.935 13.405 -6.105 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -3.288 15.232 -7.923 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -1.860 15.998 -7.257 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -1.017 13.400 -7.925 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -2.076 13.870 -9.239 1.00 0.00 H new ATOM 0 HE21 GLN A 48 0.349 15.553 -7.160 1.00 0.00 H new ATOM 0 HE22 GLN A 48 1.251 16.264 -8.502 1.00 0.00 H new ATOM 712 N GLY A 49 -3.117 15.902 -4.396 1.00 0.00 N ATOM 713 CA GLY A 49 -2.838 16.793 -3.285 1.00 0.00 C ATOM 714 C GLY A 49 -3.057 16.132 -1.938 1.00 0.00 C ATOM 715 O GLY A 49 -2.561 16.610 -0.917 1.00 0.00 O ATOM 0 H GLY A 49 -4.095 15.867 -4.682 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -1.807 17.139 -3.352 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -3.476 17.674 -3.361 1.00 0.00 H new ATOM 719 N GLN A 50 -3.800 15.030 -1.934 1.00 0.00 N ATOM 720 CA GLN A 50 -4.086 14.304 -0.701 1.00 0.00 C ATOM 721 C GLN A 50 -3.211 13.058 -0.588 1.00 0.00 C ATOM 722 O GLN A 50 -3.712 11.952 -0.380 1.00 0.00 O ATOM 723 CB GLN A 50 -5.563 13.913 -0.647 1.00 0.00 C ATOM 724 CG GLN A 50 -6.449 14.969 -0.006 1.00 0.00 C ATOM 725 CD GLN A 50 -7.689 14.382 0.639 1.00 0.00 C ATOM 726 OE1 GLN A 50 -7.806 13.166 0.796 1.00 0.00 O ATOM 727 NE2 GLN A 50 -8.625 15.245 1.018 1.00 0.00 N ATOM 0 H GLN A 50 -4.215 14.620 -2.771 1.00 0.00 H new ATOM 0 HA GLN A 50 -3.861 14.960 0.140 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -5.916 13.720 -1.660 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -5.663 12.981 -0.092 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -5.875 15.510 0.746 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.747 15.695 -0.763 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -8.487 16.245 0.869 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -9.481 14.908 1.458 1.00 0.00 H new ATOM 736 N GLU A 51 -1.903 13.247 -0.725 1.00 0.00 N ATOM 737 CA GLU A 51 -0.957 12.140 -0.633 1.00 0.00 C ATOM 738 C GLU A 51 -0.853 11.632 0.804 1.00 0.00 C ATOM 739 O GLU A 51 -0.629 12.413 1.730 1.00 0.00 O ATOM 740 CB GLU A 51 0.421 12.577 -1.134 1.00 0.00 C ATOM 741 CG GLU A 51 0.486 12.777 -2.639 1.00 0.00 C ATOM 742 CD GLU A 51 0.726 11.482 -3.389 1.00 0.00 C ATOM 743 OE1 GLU A 51 1.682 10.760 -3.037 1.00 0.00 O ATOM 744 OE2 GLU A 51 -0.042 11.190 -4.330 1.00 0.00 O ATOM 0 H GLU A 51 -1.474 14.156 -0.900 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.323 11.328 -1.261 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.700 13.508 -0.640 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.158 11.829 -0.843 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.447 13.224 -2.983 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.283 13.482 -2.874 1.00 0.00 H new ATOM 751 N PRO A 52 -1.019 10.312 1.014 1.00 0.00 N ATOM 752 CA PRO A 52 -0.945 9.711 2.350 1.00 0.00 C ATOM 753 C PRO A 52 0.475 9.707 2.905 1.00 0.00 C ATOM 754 O PRO A 52 1.394 10.249 2.292 1.00 0.00 O ATOM 755 CB PRO A 52 -1.437 8.281 2.125 1.00 0.00 C ATOM 756 CG PRO A 52 -1.134 7.997 0.695 1.00 0.00 C ATOM 757 CD PRO A 52 -1.292 9.305 -0.030 1.00 0.00 C ATOM 0 HA PRO A 52 -1.533 10.267 3.080 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -0.927 7.579 2.785 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -2.504 8.193 2.329 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -0.123 7.607 0.580 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -1.813 7.244 0.294 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -0.593 9.390 -0.862 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -2.295 9.417 -0.443 1.00 0.00 H new ATOM 765 N LEU A 53 0.646 9.089 4.069 1.00 0.00 N ATOM 766 CA LEU A 53 1.952 9.015 4.713 1.00 0.00 C ATOM 767 C LEU A 53 2.702 7.755 4.287 1.00 0.00 C ATOM 768 O LEU A 53 2.092 6.723 4.006 1.00 0.00 O ATOM 769 CB LEU A 53 1.795 9.030 6.234 1.00 0.00 C ATOM 770 CG LEU A 53 2.847 9.843 6.992 1.00 0.00 C ATOM 771 CD1 LEU A 53 2.204 11.029 7.692 1.00 0.00 C ATOM 772 CD2 LEU A 53 3.573 8.967 7.999 1.00 0.00 C ATOM 0 H LEU A 53 -0.105 8.632 4.586 1.00 0.00 H new ATOM 0 HA LEU A 53 2.529 9.885 4.401 1.00 0.00 H new ATOM 0 HB2 LEU A 53 0.809 9.426 6.477 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.824 8.002 6.596 1.00 0.00 H new ATOM 0 HG LEU A 53 3.573 10.219 6.271 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.968 11.595 8.225 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.726 11.672 6.953 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.456 10.672 8.400 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.317 9.562 8.529 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.856 8.563 8.714 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.067 8.147 7.478 1.00 0.00 H new ATOM 784 N THR A 54 4.027 7.853 4.235 1.00 0.00 N ATOM 785 CA THR A 54 4.872 6.724 3.858 1.00 0.00 C ATOM 786 C THR A 54 6.334 7.038 4.156 1.00 0.00 C ATOM 787 O THR A 54 6.636 7.992 4.873 1.00 0.00 O ATOM 788 CB THR A 54 4.702 6.384 2.374 1.00 0.00 C ATOM 789 OG1 THR A 54 3.808 7.287 1.747 1.00 0.00 O ATOM 790 CG2 THR A 54 4.184 4.980 2.136 1.00 0.00 C ATOM 0 H THR A 54 4.541 8.707 4.450 1.00 0.00 H new ATOM 0 HA THR A 54 4.565 5.859 4.446 1.00 0.00 H new ATOM 0 HB THR A 54 5.701 6.462 1.946 1.00 0.00 H new ATOM 0 HG1 THR A 54 3.716 7.052 0.800 1.00 0.00 H new ATOM 0 HG21 THR A 54 4.087 4.805 1.065 1.00 0.00 H new ATOM 0 HG22 THR A 54 4.882 4.258 2.560 1.00 0.00 H new ATOM 0 HG23 THR A 54 3.210 4.866 2.612 1.00 0.00 H new ATOM 798 N ALA A 55 7.235 6.237 3.598 1.00 0.00 N ATOM 799 CA ALA A 55 8.665 6.431 3.815 1.00 0.00 C ATOM 800 C ALA A 55 9.098 7.839 3.422 1.00 0.00 C ATOM 801 O ALA A 55 9.944 8.442 4.082 1.00 0.00 O ATOM 802 CB ALA A 55 9.463 5.399 3.038 1.00 0.00 C ATOM 0 H ALA A 55 7.002 5.449 2.994 1.00 0.00 H new ATOM 0 HA ALA A 55 8.862 6.302 4.879 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.528 5.557 3.210 1.00 0.00 H new ATOM 0 HB2 ALA A 55 9.186 4.399 3.371 1.00 0.00 H new ATOM 0 HB3 ALA A 55 9.249 5.499 1.974 1.00 0.00 H new ATOM 808 N SER A 56 8.520 8.353 2.341 1.00 0.00 N ATOM 809 CA SER A 56 8.845 9.694 1.869 1.00 0.00 C ATOM 810 C SER A 56 8.521 10.729 2.938 1.00 0.00 C ATOM 811 O SER A 56 9.338 11.600 3.242 1.00 0.00 O ATOM 812 CB SER A 56 8.077 10.010 0.586 1.00 0.00 C ATOM 813 OG SER A 56 8.152 8.934 -0.333 1.00 0.00 O ATOM 0 H SER A 56 7.826 7.863 1.777 1.00 0.00 H new ATOM 0 HA SER A 56 9.914 9.732 1.657 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.034 10.216 0.825 1.00 0.00 H new ATOM 0 HB3 SER A 56 8.483 10.912 0.128 1.00 0.00 H new ATOM 0 HG SER A 56 7.651 9.161 -1.144 1.00 0.00 H new ATOM 819 N MET A 57 7.329 10.616 3.516 1.00 0.00 N ATOM 820 CA MET A 57 6.905 11.519 4.577 1.00 0.00 C ATOM 821 C MET A 57 7.883 11.457 5.741 1.00 0.00 C ATOM 822 O MET A 57 8.276 12.482 6.296 1.00 0.00 O ATOM 823 CB MET A 57 5.501 11.148 5.059 1.00 0.00 C ATOM 824 CG MET A 57 4.376 11.662 4.170 1.00 0.00 C ATOM 825 SD MET A 57 4.960 12.361 2.612 1.00 0.00 S ATOM 826 CE MET A 57 4.674 10.988 1.498 1.00 0.00 C ATOM 0 H MET A 57 6.640 9.907 3.266 1.00 0.00 H new ATOM 0 HA MET A 57 6.887 12.535 4.182 1.00 0.00 H new ATOM 0 HB2 MET A 57 5.428 10.063 5.126 1.00 0.00 H new ATOM 0 HB3 MET A 57 5.360 11.540 6.066 1.00 0.00 H new ATOM 0 HG2 MET A 57 3.687 10.844 3.958 1.00 0.00 H new ATOM 0 HG3 MET A 57 3.812 12.421 4.712 1.00 0.00 H new ATOM 0 HE1 MET A 57 5.189 11.171 0.555 1.00 0.00 H new ATOM 0 HE2 MET A 57 5.054 10.070 1.947 1.00 0.00 H new ATOM 0 HE3 MET A 57 3.605 10.886 1.314 1.00 0.00 H new ATOM 836 N LEU A 58 8.280 10.239 6.094 1.00 0.00 N ATOM 837 CA LEU A 58 9.230 10.018 7.174 1.00 0.00 C ATOM 838 C LEU A 58 10.529 10.767 6.905 1.00 0.00 C ATOM 839 O LEU A 58 11.049 11.471 7.771 1.00 0.00 O ATOM 840 CB LEU A 58 9.521 8.519 7.311 1.00 0.00 C ATOM 841 CG LEU A 58 8.453 7.672 8.022 1.00 0.00 C ATOM 842 CD1 LEU A 58 7.231 8.502 8.400 1.00 0.00 C ATOM 843 CD2 LEU A 58 8.050 6.499 7.141 1.00 0.00 C ATOM 0 H LEU A 58 7.954 9.384 5.642 1.00 0.00 H new ATOM 0 HA LEU A 58 8.795 10.391 8.101 1.00 0.00 H new ATOM 0 HB2 LEU A 58 9.672 8.109 6.312 1.00 0.00 H new ATOM 0 HB3 LEU A 58 10.462 8.402 7.849 1.00 0.00 H new ATOM 0 HG LEU A 58 8.886 7.294 8.948 1.00 0.00 H new ATOM 0 HD11 LEU A 58 6.500 7.867 8.900 1.00 0.00 H new ATOM 0 HD12 LEU A 58 7.531 9.307 9.071 1.00 0.00 H new ATOM 0 HD13 LEU A 58 6.787 8.927 7.500 1.00 0.00 H new ATOM 0 HD21 LEU A 58 7.293 5.904 7.652 1.00 0.00 H new ATOM 0 HD22 LEU A 58 7.644 6.873 6.201 1.00 0.00 H new ATOM 0 HD23 LEU A 58 8.923 5.879 6.939 1.00 0.00 H new ATOM 855 N ALA A 59 11.045 10.605 5.692 1.00 0.00 N ATOM 856 CA ALA A 59 12.288 11.254 5.288 1.00 0.00 C ATOM 857 C ALA A 59 12.100 12.758 5.110 1.00 0.00 C ATOM 858 O ALA A 59 13.054 13.482 4.827 1.00 0.00 O ATOM 859 CB ALA A 59 12.811 10.632 4.002 1.00 0.00 C ATOM 0 H ALA A 59 10.620 10.027 4.967 1.00 0.00 H new ATOM 0 HA ALA A 59 13.019 11.101 6.082 1.00 0.00 H new ATOM 0 HB1 ALA A 59 13.739 11.125 3.711 1.00 0.00 H new ATOM 0 HB2 ALA A 59 12.998 9.570 4.161 1.00 0.00 H new ATOM 0 HB3 ALA A 59 12.071 10.755 3.211 1.00 0.00 H new ATOM 865 N SER A 60 10.864 13.220 5.269 1.00 0.00 N ATOM 866 CA SER A 60 10.552 14.638 5.117 1.00 0.00 C ATOM 867 C SER A 60 10.730 15.386 6.434 1.00 0.00 C ATOM 868 O SER A 60 10.649 16.614 6.475 1.00 0.00 O ATOM 869 CB SER A 60 9.122 14.814 4.608 1.00 0.00 C ATOM 870 OG SER A 60 8.819 16.184 4.401 1.00 0.00 O ATOM 0 H SER A 60 10.062 12.634 5.503 1.00 0.00 H new ATOM 0 HA SER A 60 11.246 15.057 4.389 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.995 14.265 3.675 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.422 14.388 5.327 1.00 0.00 H new ATOM 0 HG SER A 60 9.370 16.734 4.996 1.00 0.00 H new ATOM 876 N ALA A 61 10.975 14.642 7.508 1.00 0.00 N ATOM 877 CA ALA A 61 11.162 15.244 8.825 1.00 0.00 C ATOM 878 C ALA A 61 12.355 14.630 9.563 1.00 0.00 C ATOM 879 O ALA A 61 12.225 14.204 10.709 1.00 0.00 O ATOM 880 CB ALA A 61 9.894 15.091 9.652 1.00 0.00 C ATOM 0 H ALA A 61 11.049 13.625 7.493 1.00 0.00 H new ATOM 0 HA ALA A 61 11.373 16.304 8.682 1.00 0.00 H new ATOM 0 HB1 ALA A 61 10.043 15.543 10.633 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.067 15.588 9.145 1.00 0.00 H new ATOM 0 HB3 ALA A 61 9.663 14.032 9.771 1.00 0.00 H new ATOM 886 N PRO A 62 13.550 14.611 8.936 1.00 0.00 N ATOM 887 CA PRO A 62 14.745 14.027 9.521 1.00 0.00 C ATOM 888 C PRO A 62 15.729 15.072 10.054 1.00 0.00 C ATOM 889 O PRO A 62 16.318 15.824 9.278 1.00 0.00 O ATOM 890 CB PRO A 62 15.346 13.313 8.313 1.00 0.00 C ATOM 891 CG PRO A 62 14.981 14.175 7.136 1.00 0.00 C ATOM 892 CD PRO A 62 13.825 15.057 7.564 1.00 0.00 C ATOM 0 HA PRO A 62 14.527 13.398 10.384 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.427 13.213 8.410 1.00 0.00 H new ATOM 0 HB3 PRO A 62 14.941 12.307 8.207 1.00 0.00 H new ATOM 0 HG2 PRO A 62 15.832 14.781 6.825 1.00 0.00 H new ATOM 0 HG3 PRO A 62 14.699 13.559 6.282 1.00 0.00 H new ATOM 0 HD2 PRO A 62 14.091 16.113 7.530 1.00 0.00 H new ATOM 0 HD3 PRO A 62 12.958 14.926 6.917 1.00 0.00 H new ATOM 900 N PRO A 63 15.950 15.121 11.383 1.00 0.00 N ATOM 901 CA PRO A 63 15.311 14.250 12.359 1.00 0.00 C ATOM 902 C PRO A 63 14.146 14.932 13.072 1.00 0.00 C ATOM 903 O PRO A 63 14.270 16.068 13.531 1.00 0.00 O ATOM 904 CB PRO A 63 16.457 14.004 13.336 1.00 0.00 C ATOM 905 CG PRO A 63 17.256 15.277 13.320 1.00 0.00 C ATOM 906 CD PRO A 63 16.891 16.026 12.053 1.00 0.00 C ATOM 0 HA PRO A 63 14.878 13.353 11.916 1.00 0.00 H new ATOM 0 HB2 PRO A 63 16.084 13.784 14.336 1.00 0.00 H new ATOM 0 HB3 PRO A 63 17.064 13.152 13.028 1.00 0.00 H new ATOM 0 HG2 PRO A 63 17.034 15.881 14.200 1.00 0.00 H new ATOM 0 HG3 PRO A 63 18.324 15.060 13.343 1.00 0.00 H new ATOM 0 HD2 PRO A 63 16.433 16.990 12.274 1.00 0.00 H new ATOM 0 HD3 PRO A 63 17.768 16.223 11.436 1.00 0.00 H new ATOM 914 N GLN A 64 13.019 14.234 13.173 1.00 0.00 N ATOM 915 CA GLN A 64 11.839 14.781 13.838 1.00 0.00 C ATOM 916 C GLN A 64 10.730 13.739 13.935 1.00 0.00 C ATOM 917 O GLN A 64 10.601 13.050 14.948 1.00 0.00 O ATOM 918 CB GLN A 64 11.330 16.018 13.094 1.00 0.00 C ATOM 919 CG GLN A 64 10.710 17.063 14.006 1.00 0.00 C ATOM 920 CD GLN A 64 11.673 18.182 14.348 1.00 0.00 C ATOM 921 OE1 GLN A 64 12.664 17.971 15.049 1.00 0.00 O ATOM 922 NE2 GLN A 64 11.388 19.381 13.855 1.00 0.00 N ATOM 0 H GLN A 64 12.897 13.291 12.804 1.00 0.00 H new ATOM 0 HA GLN A 64 12.129 15.068 14.849 1.00 0.00 H new ATOM 0 HB2 GLN A 64 12.158 16.470 12.548 1.00 0.00 H new ATOM 0 HB3 GLN A 64 10.591 15.709 12.355 1.00 0.00 H new ATOM 0 HG2 GLN A 64 9.827 17.483 13.524 1.00 0.00 H new ATOM 0 HG3 GLN A 64 10.374 16.584 14.926 1.00 0.00 H new ATOM 0 HE21 GLN A 64 10.556 19.511 13.279 1.00 0.00 H new ATOM 0 HE22 GLN A 64 12.001 20.172 14.052 1.00 0.00 H new ATOM 931 N GLU A 65 9.927 13.633 12.880 1.00 0.00 N ATOM 932 CA GLU A 65 8.824 12.685 12.855 1.00 0.00 C ATOM 933 C GLU A 65 9.244 11.377 12.194 1.00 0.00 C ATOM 934 O GLU A 65 8.451 10.442 12.095 1.00 0.00 O ATOM 935 CB GLU A 65 7.632 13.287 12.114 1.00 0.00 C ATOM 936 CG GLU A 65 7.221 14.656 12.630 1.00 0.00 C ATOM 937 CD GLU A 65 6.428 14.578 13.919 1.00 0.00 C ATOM 938 OE1 GLU A 65 7.054 14.493 14.997 1.00 0.00 O ATOM 939 OE2 GLU A 65 5.182 14.599 13.851 1.00 0.00 O ATOM 0 H GLU A 65 10.022 14.193 12.033 1.00 0.00 H new ATOM 0 HA GLU A 65 8.535 12.471 13.884 1.00 0.00 H new ATOM 0 HB2 GLU A 65 7.876 13.366 11.055 1.00 0.00 H new ATOM 0 HB3 GLU A 65 6.784 12.608 12.196 1.00 0.00 H new ATOM 0 HG2 GLU A 65 8.112 15.262 12.792 1.00 0.00 H new ATOM 0 HG3 GLU A 65 6.625 15.163 11.871 1.00 0.00 H new ATOM 946 N GLN A 66 10.496 11.319 11.745 1.00 0.00 N ATOM 947 CA GLN A 66 11.021 10.114 11.113 1.00 0.00 C ATOM 948 C GLN A 66 10.799 8.907 12.015 1.00 0.00 C ATOM 949 O GLN A 66 10.264 7.884 11.585 1.00 0.00 O ATOM 950 CB GLN A 66 12.513 10.276 10.813 1.00 0.00 C ATOM 951 CG GLN A 66 12.955 9.575 9.538 1.00 0.00 C ATOM 952 CD GLN A 66 13.684 8.273 9.807 1.00 0.00 C ATOM 953 OE1 GLN A 66 13.689 7.769 10.931 1.00 0.00 O ATOM 954 NE2 GLN A 66 14.308 7.720 8.773 1.00 0.00 N ATOM 0 H GLN A 66 11.162 12.089 11.807 1.00 0.00 H new ATOM 0 HA GLN A 66 10.490 9.956 10.174 1.00 0.00 H new ATOM 0 HB2 GLN A 66 12.746 11.338 10.734 1.00 0.00 H new ATOM 0 HB3 GLN A 66 13.089 9.885 11.652 1.00 0.00 H new ATOM 0 HG2 GLN A 66 12.082 9.376 8.917 1.00 0.00 H new ATOM 0 HG3 GLN A 66 13.606 10.240 8.970 1.00 0.00 H new ATOM 0 HE21 GLN A 66 14.278 8.171 7.859 1.00 0.00 H new ATOM 0 HE22 GLN A 66 14.817 6.844 8.893 1.00 0.00 H new ATOM 963 N LYS A 67 11.186 9.049 13.277 1.00 0.00 N ATOM 964 CA LYS A 67 11.006 7.990 14.259 1.00 0.00 C ATOM 965 C LYS A 67 9.859 8.328 15.205 1.00 0.00 C ATOM 966 O LYS A 67 9.905 8.013 16.395 1.00 0.00 O ATOM 967 CB LYS A 67 12.298 7.776 15.049 1.00 0.00 C ATOM 968 CG LYS A 67 12.969 9.069 15.486 1.00 0.00 C ATOM 969 CD LYS A 67 12.581 9.447 16.906 1.00 0.00 C ATOM 970 CE LYS A 67 13.716 10.161 17.623 1.00 0.00 C ATOM 971 NZ LYS A 67 13.760 9.820 19.071 1.00 0.00 N ATOM 0 H LYS A 67 11.628 9.892 13.644 1.00 0.00 H new ATOM 0 HA LYS A 67 10.760 7.068 13.732 1.00 0.00 H new ATOM 0 HB2 LYS A 67 12.079 7.175 15.931 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.996 7.203 14.439 1.00 0.00 H new ATOM 0 HG2 LYS A 67 14.051 8.958 15.421 1.00 0.00 H new ATOM 0 HG3 LYS A 67 12.689 9.873 14.805 1.00 0.00 H new ATOM 0 HD2 LYS A 67 11.701 10.090 16.885 1.00 0.00 H new ATOM 0 HD3 LYS A 67 12.307 8.550 17.460 1.00 0.00 H new ATOM 0 HE2 LYS A 67 14.665 9.893 17.158 1.00 0.00 H new ATOM 0 HE3 LYS A 67 13.598 11.238 17.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 14.547 10.327 19.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 12.865 10.099 19.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 13.899 8.795 19.182 1.00 0.00 H new ATOM 985 N GLN A 68 8.820 8.957 14.659 1.00 0.00 N ATOM 986 CA GLN A 68 7.648 9.323 15.443 1.00 0.00 C ATOM 987 C GLN A 68 6.359 8.999 14.687 1.00 0.00 C ATOM 988 O GLN A 68 5.555 8.182 15.134 1.00 0.00 O ATOM 989 CB GLN A 68 7.689 10.814 15.788 1.00 0.00 C ATOM 990 CG GLN A 68 6.441 11.311 16.502 1.00 0.00 C ATOM 991 CD GLN A 68 6.494 11.080 17.999 1.00 0.00 C ATOM 992 OE1 GLN A 68 6.952 10.036 18.463 1.00 0.00 O ATOM 993 NE2 GLN A 68 6.023 12.057 18.765 1.00 0.00 N ATOM 0 H GLN A 68 8.768 9.223 13.676 1.00 0.00 H new ATOM 0 HA GLN A 68 7.661 8.740 16.364 1.00 0.00 H new ATOM 0 HB2 GLN A 68 8.558 11.009 16.416 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.824 11.387 14.870 1.00 0.00 H new ATOM 0 HG2 GLN A 68 6.315 12.376 16.307 1.00 0.00 H new ATOM 0 HG3 GLN A 68 5.567 10.806 16.091 1.00 0.00 H new ATOM 0 HE21 GLN A 68 5.652 12.906 18.338 1.00 0.00 H new ATOM 0 HE22 GLN A 68 6.032 11.958 19.780 1.00 0.00 H new ATOM 1002 N MET A 69 6.162 9.664 13.551 1.00 0.00 N ATOM 1003 CA MET A 69 4.956 9.480 12.747 1.00 0.00 C ATOM 1004 C MET A 69 5.033 8.239 11.855 1.00 0.00 C ATOM 1005 O MET A 69 4.327 8.152 10.851 1.00 0.00 O ATOM 1006 CB MET A 69 4.715 10.719 11.882 1.00 0.00 C ATOM 1007 CG MET A 69 5.739 10.897 10.770 1.00 0.00 C ATOM 1008 SD MET A 69 5.115 11.900 9.408 1.00 0.00 S ATOM 1009 CE MET A 69 6.636 12.621 8.795 1.00 0.00 C ATOM 0 H MET A 69 6.824 10.337 13.165 1.00 0.00 H new ATOM 0 HA MET A 69 4.126 9.336 13.438 1.00 0.00 H new ATOM 0 HB2 MET A 69 3.720 10.656 11.441 1.00 0.00 H new ATOM 0 HB3 MET A 69 4.726 11.604 12.519 1.00 0.00 H new ATOM 0 HG2 MET A 69 6.636 11.363 11.178 1.00 0.00 H new ATOM 0 HG3 MET A 69 6.032 9.918 10.391 1.00 0.00 H new ATOM 0 HE1 MET A 69 6.552 12.789 7.721 1.00 0.00 H new ATOM 0 HE2 MET A 69 6.817 13.571 9.298 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.466 11.942 8.992 1.00 0.00 H new ATOM 1019 N LEU A 70 5.879 7.279 12.219 1.00 0.00 N ATOM 1020 CA LEU A 70 6.017 6.058 11.424 1.00 0.00 C ATOM 1021 C LEU A 70 4.887 5.080 11.717 1.00 0.00 C ATOM 1022 O LEU A 70 4.317 4.486 10.802 1.00 0.00 O ATOM 1023 CB LEU A 70 7.379 5.376 11.643 1.00 0.00 C ATOM 1024 CG LEU A 70 7.754 5.010 13.082 1.00 0.00 C ATOM 1025 CD1 LEU A 70 8.998 4.134 13.082 1.00 0.00 C ATOM 1026 CD2 LEU A 70 7.986 6.244 13.927 1.00 0.00 C ATOM 0 H LEU A 70 6.473 7.319 13.047 1.00 0.00 H new ATOM 0 HA LEU A 70 5.959 6.357 10.378 1.00 0.00 H new ATOM 0 HB2 LEU A 70 7.400 4.464 11.046 1.00 0.00 H new ATOM 0 HB3 LEU A 70 8.154 6.034 11.249 1.00 0.00 H new ATOM 0 HG LEU A 70 6.921 4.461 13.520 1.00 0.00 H new ATOM 0 HD11 LEU A 70 9.261 3.876 14.108 1.00 0.00 H new ATOM 0 HD12 LEU A 70 8.801 3.222 12.518 1.00 0.00 H new ATOM 0 HD13 LEU A 70 9.824 4.675 12.621 1.00 0.00 H new ATOM 0 HD21 LEU A 70 8.250 5.946 14.942 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.798 6.831 13.498 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.077 6.845 13.950 1.00 0.00 H new ATOM 1038 N GLY A 71 4.560 4.920 12.992 1.00 0.00 N ATOM 1039 CA GLY A 71 3.480 4.023 13.368 1.00 0.00 C ATOM 1040 C GLY A 71 2.634 4.581 14.493 1.00 0.00 C ATOM 1041 O GLY A 71 2.094 3.830 15.305 1.00 0.00 O ATOM 0 H GLY A 71 5.019 5.392 13.771 1.00 0.00 H new ATOM 0 HA2 GLY A 71 2.848 3.835 12.500 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.897 3.063 13.672 1.00 0.00 H new ATOM 1045 N GLU A 72 2.510 5.905 14.535 1.00 0.00 N ATOM 1046 CA GLU A 72 1.722 6.569 15.566 1.00 0.00 C ATOM 1047 C GLU A 72 0.939 7.747 14.991 1.00 0.00 C ATOM 1048 O GLU A 72 0.103 8.338 15.674 1.00 0.00 O ATOM 1049 CB GLU A 72 2.632 7.055 16.698 1.00 0.00 C ATOM 1050 CG GLU A 72 3.370 5.934 17.412 1.00 0.00 C ATOM 1051 CD GLU A 72 3.320 6.073 18.921 1.00 0.00 C ATOM 1052 OE1 GLU A 72 2.206 6.200 19.470 1.00 0.00 O ATOM 1053 OE2 GLU A 72 4.396 6.055 19.554 1.00 0.00 O ATOM 0 H GLU A 72 2.946 6.539 13.865 1.00 0.00 H new ATOM 0 HA GLU A 72 1.010 5.844 15.961 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.360 7.756 16.291 1.00 0.00 H new ATOM 0 HB3 GLU A 72 2.032 7.604 17.424 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.936 4.977 17.124 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.410 5.923 17.086 1.00 0.00 H new ATOM 1060 N ARG A 73 1.209 8.080 13.732 1.00 0.00 N ATOM 1061 CA ARG A 73 0.527 9.189 13.074 1.00 0.00 C ATOM 1062 C ARG A 73 -0.083 8.748 11.748 1.00 0.00 C ATOM 1063 O ARG A 73 -0.917 9.449 11.177 1.00 0.00 O ATOM 1064 CB ARG A 73 1.497 10.348 12.842 1.00 0.00 C ATOM 1065 CG ARG A 73 0.829 11.713 12.859 1.00 0.00 C ATOM 1066 CD ARG A 73 0.524 12.203 11.452 1.00 0.00 C ATOM 1067 NE ARG A 73 -0.340 13.379 11.457 1.00 0.00 N ATOM 1068 CZ ARG A 73 0.069 14.599 11.119 1.00 0.00 C ATOM 1069 NH1 ARG A 73 1.328 14.802 10.752 1.00 0.00 N ATOM 1070 NH2 ARG A 73 -0.779 15.617 11.150 1.00 0.00 N ATOM 0 H ARG A 73 1.894 7.599 13.149 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.278 9.523 13.728 1.00 0.00 H new ATOM 0 HB2 ARG A 73 2.271 10.322 13.609 1.00 0.00 H new ATOM 0 HB3 ARG A 73 1.994 10.208 11.882 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -0.095 11.660 13.435 1.00 0.00 H new ATOM 0 HG3 ARG A 73 1.477 12.430 13.362 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.457 12.441 10.941 1.00 0.00 H new ATOM 0 HD3 ARG A 73 0.045 11.404 10.886 1.00 0.00 H new ATOM 0 HE ARG A 73 -1.314 13.259 11.736 1.00 0.00 H new ATOM 0 HH11 ARG A 73 1.985 14.022 10.729 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.639 15.738 10.493 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -1.747 15.466 11.433 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -0.464 16.552 10.891 1.00 0.00 H new ATOM 1084 N LEU A 74 0.332 7.580 11.267 1.00 0.00 N ATOM 1085 CA LEU A 74 -0.183 7.049 10.014 1.00 0.00 C ATOM 1086 C LEU A 74 -1.588 6.497 10.187 1.00 0.00 C ATOM 1087 O LEU A 74 -2.283 6.235 9.207 1.00 0.00 O ATOM 1088 CB LEU A 74 0.723 5.937 9.501 1.00 0.00 C ATOM 1089 CG LEU A 74 1.546 6.293 8.276 1.00 0.00 C ATOM 1090 CD1 LEU A 74 2.927 5.677 8.386 1.00 0.00 C ATOM 1091 CD2 LEU A 74 0.839 5.834 7.011 1.00 0.00 C ATOM 0 H LEU A 74 1.022 6.986 11.726 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.210 7.869 9.296 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.401 5.642 10.302 1.00 0.00 H new ATOM 0 HB3 LEU A 74 0.109 5.067 9.267 1.00 0.00 H new ATOM 0 HG LEU A 74 1.657 7.376 8.222 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.512 5.936 7.504 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.426 6.058 9.277 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.837 4.593 8.456 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.442 6.097 6.142 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.700 4.753 7.043 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.133 6.323 6.940 1.00 0.00 H new ATOM 1103 N PHE A 75 -1.981 6.285 11.437 1.00 0.00 N ATOM 1104 CA PHE A 75 -3.290 5.716 11.744 1.00 0.00 C ATOM 1105 C PHE A 75 -4.411 6.406 10.953 1.00 0.00 C ATOM 1106 O PHE A 75 -5.157 5.740 10.235 1.00 0.00 O ATOM 1107 CB PHE A 75 -3.568 5.786 13.252 1.00 0.00 C ATOM 1108 CG PHE A 75 -5.008 5.552 13.617 1.00 0.00 C ATOM 1109 CD1 PHE A 75 -5.713 4.490 13.071 1.00 0.00 C ATOM 1110 CD2 PHE A 75 -5.653 6.395 14.508 1.00 0.00 C ATOM 1111 CE1 PHE A 75 -7.040 4.283 13.399 1.00 0.00 C ATOM 1112 CE2 PHE A 75 -6.977 6.187 14.845 1.00 0.00 C ATOM 1113 CZ PHE A 75 -7.671 5.128 14.291 1.00 0.00 C ATOM 0 H PHE A 75 -1.412 6.498 12.256 1.00 0.00 H new ATOM 0 HA PHE A 75 -3.273 4.669 11.440 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -2.950 5.046 13.760 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -3.264 6.765 13.623 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -5.221 3.818 12.383 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -5.115 7.224 14.944 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -7.583 3.461 12.958 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -7.469 6.851 15.540 1.00 0.00 H new ATOM 0 HZ PHE A 75 -8.705 4.961 14.555 1.00 0.00 H new ATOM 1123 N PRO A 76 -4.555 7.744 11.063 1.00 0.00 N ATOM 1124 CA PRO A 76 -5.605 8.477 10.342 1.00 0.00 C ATOM 1125 C PRO A 76 -5.480 8.327 8.829 1.00 0.00 C ATOM 1126 O PRO A 76 -6.392 8.686 8.083 1.00 0.00 O ATOM 1127 CB PRO A 76 -5.383 9.937 10.753 1.00 0.00 C ATOM 1128 CG PRO A 76 -4.590 9.870 12.012 1.00 0.00 C ATOM 1129 CD PRO A 76 -3.731 8.645 11.889 1.00 0.00 C ATOM 0 HA PRO A 76 -6.598 8.102 10.588 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -4.848 10.487 9.979 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.331 10.450 10.911 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -3.980 10.764 12.138 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -5.243 9.804 12.882 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -2.776 8.868 11.413 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -3.508 8.209 12.863 1.00 0.00 H new ATOM 1137 N LEU A 77 -4.347 7.793 8.382 1.00 0.00 N ATOM 1138 CA LEU A 77 -4.095 7.611 6.957 1.00 0.00 C ATOM 1139 C LEU A 77 -4.389 6.180 6.511 1.00 0.00 C ATOM 1140 O LEU A 77 -4.738 5.947 5.354 1.00 0.00 O ATOM 1141 CB LEU A 77 -2.642 7.967 6.624 1.00 0.00 C ATOM 1142 CG LEU A 77 -2.274 9.450 6.753 1.00 0.00 C ATOM 1143 CD1 LEU A 77 -3.432 10.347 6.333 1.00 0.00 C ATOM 1144 CD2 LEU A 77 -1.845 9.758 8.174 1.00 0.00 C ATOM 0 H LEU A 77 -3.588 7.479 8.987 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.767 8.279 6.418 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.987 7.391 7.278 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.434 7.648 5.603 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.440 9.654 6.081 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.139 11.392 6.436 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.691 10.144 5.294 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.295 10.148 6.968 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.586 10.814 8.255 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.663 9.532 8.858 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.978 9.151 8.432 1.00 0.00 H new ATOM 1156 N ILE A 78 -4.232 5.219 7.422 1.00 0.00 N ATOM 1157 CA ILE A 78 -4.474 3.818 7.087 1.00 0.00 C ATOM 1158 C ILE A 78 -5.941 3.576 6.760 1.00 0.00 C ATOM 1159 O ILE A 78 -6.266 2.802 5.861 1.00 0.00 O ATOM 1160 CB ILE A 78 -4.058 2.861 8.214 1.00 0.00 C ATOM 1161 CG1 ILE A 78 -2.744 3.314 8.856 1.00 0.00 C ATOM 1162 CG2 ILE A 78 -3.934 1.446 7.674 1.00 0.00 C ATOM 1163 CD1 ILE A 78 -1.553 3.236 7.926 1.00 0.00 C ATOM 0 H ILE A 78 -3.942 5.383 8.386 1.00 0.00 H new ATOM 0 HA ILE A 78 -3.858 3.611 6.212 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.828 2.875 8.985 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -2.855 4.341 9.204 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.548 2.699 9.735 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.639 0.774 8.480 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -4.894 1.126 7.268 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -3.181 1.422 6.887 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -0.659 3.573 8.451 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.415 2.206 7.598 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -1.726 3.873 7.059 1.00 0.00 H new ATOM 1175 N GLN A 79 -6.821 4.246 7.498 1.00 0.00 N ATOM 1176 CA GLN A 79 -8.259 4.133 7.277 1.00 0.00 C ATOM 1177 C GLN A 79 -8.598 4.386 5.810 1.00 0.00 C ATOM 1178 O GLN A 79 -9.682 4.045 5.338 1.00 0.00 O ATOM 1179 CB GLN A 79 -8.999 5.143 8.153 1.00 0.00 C ATOM 1180 CG GLN A 79 -9.494 4.567 9.469 1.00 0.00 C ATOM 1181 CD GLN A 79 -10.257 5.581 10.298 1.00 0.00 C ATOM 1182 OE1 GLN A 79 -11.265 6.130 9.854 1.00 0.00 O ATOM 1183 NE2 GLN A 79 -9.779 5.833 11.510 1.00 0.00 N ATOM 0 H GLN A 79 -6.562 4.876 8.258 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.571 3.123 7.541 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -8.337 5.983 8.361 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -9.849 5.538 7.597 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -10.137 3.710 9.268 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -8.644 4.199 10.043 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -8.940 5.354 11.837 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -10.251 6.506 12.115 1.00 0.00 H new ATOM 1192 N ALA A 80 -7.658 5.001 5.106 1.00 0.00 N ATOM 1193 CA ALA A 80 -7.820 5.308 3.690 1.00 0.00 C ATOM 1194 C ALA A 80 -7.457 4.110 2.819 1.00 0.00 C ATOM 1195 O ALA A 80 -8.076 3.875 1.782 1.00 0.00 O ATOM 1196 CB ALA A 80 -6.958 6.503 3.312 1.00 0.00 C ATOM 0 H ALA A 80 -6.765 5.300 5.497 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.869 5.549 3.516 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.087 6.724 2.252 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.258 7.369 3.902 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -5.911 6.274 3.510 1.00 0.00 H new ATOM 1202 N MET A 81 -6.431 3.371 3.233 1.00 0.00 N ATOM 1203 CA MET A 81 -5.983 2.201 2.483 1.00 0.00 C ATOM 1204 C MET A 81 -6.941 1.035 2.683 1.00 0.00 C ATOM 1205 O MET A 81 -7.174 0.241 1.772 1.00 0.00 O ATOM 1206 CB MET A 81 -4.576 1.781 2.919 1.00 0.00 C ATOM 1207 CG MET A 81 -3.675 2.940 3.310 1.00 0.00 C ATOM 1208 SD MET A 81 -2.621 2.552 4.716 1.00 0.00 S ATOM 1209 CE MET A 81 -1.056 2.291 3.893 1.00 0.00 C ATOM 0 H MET A 81 -5.896 3.561 4.080 1.00 0.00 H new ATOM 0 HA MET A 81 -5.963 2.472 1.427 1.00 0.00 H new ATOM 0 HB2 MET A 81 -4.658 1.098 3.764 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.106 1.228 2.106 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.052 3.215 2.459 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.289 3.808 3.549 1.00 0.00 H new ATOM 0 HE1 MET A 81 -0.334 1.887 4.603 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.190 1.587 3.072 1.00 0.00 H new ATOM 0 HE3 MET A 81 -0.688 3.239 3.502 1.00 0.00 H new ATOM 1219 N HIS A 82 -7.479 0.935 3.891 1.00 0.00 N ATOM 1220 CA HIS A 82 -8.397 -0.137 4.238 1.00 0.00 C ATOM 1221 C HIS A 82 -9.695 0.427 4.801 1.00 0.00 C ATOM 1222 O HIS A 82 -9.710 1.538 5.319 1.00 0.00 O ATOM 1223 CB HIS A 82 -7.741 -1.059 5.266 1.00 0.00 C ATOM 1224 CG HIS A 82 -7.037 -2.226 4.655 1.00 0.00 C ATOM 1225 ND1 HIS A 82 -7.287 -3.510 5.067 1.00 0.00 N ATOM 1226 CD2 HIS A 82 -6.106 -2.251 3.671 1.00 0.00 C ATOM 1227 CE1 HIS A 82 -6.514 -4.286 4.330 1.00 0.00 C ATOM 1228 NE2 HIS A 82 -5.772 -3.565 3.479 1.00 0.00 N ATOM 0 H HIS A 82 -7.293 1.589 4.651 1.00 0.00 H new ATOM 0 HA HIS A 82 -8.631 -0.703 3.337 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -7.028 -0.483 5.856 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -8.504 -1.424 5.954 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -5.705 -1.400 3.141 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -6.484 -5.363 4.404 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -5.088 -3.926 2.814 1.00 0.00 H new ATOM 1236 N PRO A 83 -10.804 -0.333 4.710 1.00 0.00 N ATOM 1237 CA PRO A 83 -12.105 0.105 5.230 1.00 0.00 C ATOM 1238 C PRO A 83 -12.071 0.316 6.742 1.00 0.00 C ATOM 1239 O PRO A 83 -12.588 -0.501 7.505 1.00 0.00 O ATOM 1240 CB PRO A 83 -13.054 -1.046 4.869 1.00 0.00 C ATOM 1241 CG PRO A 83 -12.343 -1.826 3.815 1.00 0.00 C ATOM 1242 CD PRO A 83 -10.879 -1.673 4.107 1.00 0.00 C ATOM 0 HA PRO A 83 -12.410 1.063 4.808 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -13.269 -1.666 5.739 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -14.009 -0.669 4.502 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -12.639 -2.875 3.839 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -12.584 -1.450 2.821 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -10.520 -2.444 4.789 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -10.277 -1.743 3.201 1.00 0.00 H new ATOM 1250 N THR A 84 -11.440 1.410 7.164 1.00 0.00 N ATOM 1251 CA THR A 84 -11.305 1.734 8.580 1.00 0.00 C ATOM 1252 C THR A 84 -10.813 0.524 9.374 1.00 0.00 C ATOM 1253 O THR A 84 -11.152 0.358 10.546 1.00 0.00 O ATOM 1254 CB THR A 84 -12.640 2.229 9.143 1.00 0.00 C ATOM 1255 OG1 THR A 84 -13.500 1.140 9.426 1.00 0.00 O ATOM 1256 CG2 THR A 84 -13.375 3.167 8.209 1.00 0.00 C ATOM 0 H THR A 84 -11.011 2.092 6.538 1.00 0.00 H new ATOM 0 HA THR A 84 -10.565 2.529 8.676 1.00 0.00 H new ATOM 0 HB THR A 84 -12.385 2.776 10.051 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.371 0.438 8.754 1.00 0.00 H new ATOM 0 HG21 THR A 84 -14.312 3.479 8.670 1.00 0.00 H new ATOM 0 HG22 THR A 84 -12.757 4.043 8.013 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.586 2.655 7.270 1.00 0.00 H new ATOM 1264 N LEU A 85 -10.010 -0.316 8.724 1.00 0.00 N ATOM 1265 CA LEU A 85 -9.476 -1.516 9.361 1.00 0.00 C ATOM 1266 C LEU A 85 -8.226 -1.198 10.174 1.00 0.00 C ATOM 1267 O LEU A 85 -7.579 -2.097 10.711 1.00 0.00 O ATOM 1268 CB LEU A 85 -9.154 -2.573 8.305 1.00 0.00 C ATOM 1269 CG LEU A 85 -10.143 -3.740 8.235 1.00 0.00 C ATOM 1270 CD1 LEU A 85 -10.124 -4.375 6.853 1.00 0.00 C ATOM 1271 CD2 LEU A 85 -9.824 -4.774 9.304 1.00 0.00 C ATOM 0 H LEU A 85 -9.715 -0.187 7.756 1.00 0.00 H new ATOM 0 HA LEU A 85 -10.236 -1.903 10.040 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.116 -2.090 7.329 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.159 -2.971 8.503 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.145 -3.353 8.420 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -10.833 -5.202 6.823 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -10.403 -3.631 6.107 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.123 -4.748 6.638 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.537 -5.596 9.239 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -8.815 -5.156 9.151 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.891 -4.312 10.289 1.00 0.00 H new ATOM 1283 N ALA A 86 -7.893 0.085 10.259 1.00 0.00 N ATOM 1284 CA ALA A 86 -6.726 0.529 11.016 1.00 0.00 C ATOM 1285 C ALA A 86 -6.932 0.308 12.513 1.00 0.00 C ATOM 1286 O ALA A 86 -7.447 -0.731 12.930 1.00 0.00 O ATOM 1287 CB ALA A 86 -6.438 1.992 10.717 1.00 0.00 C ATOM 0 H ALA A 86 -8.416 0.838 9.812 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.865 -0.065 10.709 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.566 2.315 11.286 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.242 2.114 9.652 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -7.299 2.597 10.999 1.00 0.00 H new ATOM 1293 N GLY A 87 -6.525 1.281 13.322 1.00 0.00 N ATOM 1294 CA GLY A 87 -6.657 1.151 14.759 1.00 0.00 C ATOM 1295 C GLY A 87 -5.522 0.348 15.354 1.00 0.00 C ATOM 1296 O GLY A 87 -5.274 0.404 16.559 1.00 0.00 O ATOM 0 H GLY A 87 -6.107 2.156 13.007 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.680 2.141 15.214 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -7.606 0.670 14.995 1.00 0.00 H new ATOM 1300 N LYS A 88 -4.810 -0.375 14.496 1.00 0.00 N ATOM 1301 CA LYS A 88 -3.692 -1.194 14.936 1.00 0.00 C ATOM 1302 C LYS A 88 -2.692 -1.451 13.811 1.00 0.00 C ATOM 1303 O LYS A 88 -1.550 -1.797 14.081 1.00 0.00 O ATOM 1304 CB LYS A 88 -4.195 -2.533 15.478 1.00 0.00 C ATOM 1305 CG LYS A 88 -3.084 -3.434 15.990 1.00 0.00 C ATOM 1306 CD LYS A 88 -3.409 -4.900 15.772 1.00 0.00 C ATOM 1307 CE LYS A 88 -2.375 -5.569 14.883 1.00 0.00 C ATOM 1308 NZ LYS A 88 -2.383 -7.050 15.035 1.00 0.00 N ATOM 0 H LYS A 88 -4.989 -0.409 13.492 1.00 0.00 H new ATOM 0 HA LYS A 88 -3.182 -0.641 15.725 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -4.902 -2.346 16.286 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.740 -3.053 14.691 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -2.152 -3.188 15.482 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -2.926 -3.250 17.053 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -3.451 -5.412 16.733 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -4.396 -4.992 15.318 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -2.570 -5.310 13.842 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -1.384 -5.185 15.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -1.933 -7.487 14.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -1.857 -7.314 15.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -3.364 -7.386 15.114 1.00 0.00 H new ATOM 1322 N ILE A 89 -3.119 -1.305 12.556 1.00 0.00 N ATOM 1323 CA ILE A 89 -2.246 -1.578 11.424 1.00 0.00 C ATOM 1324 C ILE A 89 -0.901 -0.865 11.556 1.00 0.00 C ATOM 1325 O ILE A 89 0.084 -1.476 11.952 1.00 0.00 O ATOM 1326 CB ILE A 89 -2.912 -1.187 10.090 1.00 0.00 C ATOM 1327 CG1 ILE A 89 -4.229 -1.950 9.914 1.00 0.00 C ATOM 1328 CG2 ILE A 89 -1.971 -1.466 8.928 1.00 0.00 C ATOM 1329 CD1 ILE A 89 -5.146 -1.358 8.865 1.00 0.00 C ATOM 0 H ILE A 89 -4.059 -1.001 12.303 1.00 0.00 H new ATOM 0 HA ILE A 89 -2.066 -2.653 11.425 1.00 0.00 H new ATOM 0 HB ILE A 89 -3.130 -0.119 10.105 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -4.006 -2.983 9.646 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -4.754 -1.974 10.869 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.455 -1.185 7.993 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.057 -0.885 9.053 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.726 -2.528 8.905 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -6.056 -1.954 8.800 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -5.401 -0.335 9.140 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.642 -1.359 7.899 1.00 0.00 H new ATOM 1341 N THR A 90 -0.854 0.416 11.205 1.00 0.00 N ATOM 1342 CA THR A 90 0.388 1.184 11.295 1.00 0.00 C ATOM 1343 C THR A 90 0.970 1.097 12.704 1.00 0.00 C ATOM 1344 O THR A 90 2.183 0.969 12.872 1.00 0.00 O ATOM 1345 CB THR A 90 0.133 2.640 10.893 1.00 0.00 C ATOM 1346 OG1 THR A 90 0.836 2.951 9.702 1.00 0.00 O ATOM 1347 CG2 THR A 90 0.534 3.659 11.939 1.00 0.00 C ATOM 0 H THR A 90 -1.655 0.944 10.857 1.00 0.00 H new ATOM 0 HA THR A 90 1.118 0.760 10.606 1.00 0.00 H new ATOM 0 HB THR A 90 -0.947 2.708 10.761 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.658 3.436 9.925 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.319 4.662 11.571 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.028 3.480 12.856 1.00 0.00 H new ATOM 0 HG23 THR A 90 1.601 3.569 12.144 1.00 0.00 H new ATOM 1355 N GLY A 91 0.102 1.149 13.711 1.00 0.00 N ATOM 1356 CA GLY A 91 0.561 1.006 15.079 1.00 0.00 C ATOM 1357 C GLY A 91 1.280 -0.312 15.262 1.00 0.00 C ATOM 1358 O GLY A 91 2.186 -0.439 16.087 1.00 0.00 O ATOM 0 H GLY A 91 -0.903 1.287 13.604 1.00 0.00 H new ATOM 0 HA2 GLY A 91 1.229 1.829 15.333 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.287 1.062 15.761 1.00 0.00 H new ATOM 1362 N MET A 92 0.887 -1.284 14.448 1.00 0.00 N ATOM 1363 CA MET A 92 1.512 -2.598 14.440 1.00 0.00 C ATOM 1364 C MET A 92 2.836 -2.525 13.719 1.00 0.00 C ATOM 1365 O MET A 92 3.811 -3.160 14.107 1.00 0.00 O ATOM 1366 CB MET A 92 0.622 -3.610 13.721 1.00 0.00 C ATOM 1367 CG MET A 92 0.805 -5.024 14.219 1.00 0.00 C ATOM 1368 SD MET A 92 0.788 -6.248 12.896 1.00 0.00 S ATOM 1369 CE MET A 92 -0.631 -5.703 11.953 1.00 0.00 C ATOM 0 H MET A 92 0.127 -1.182 13.776 1.00 0.00 H new ATOM 0 HA MET A 92 1.660 -2.914 15.473 1.00 0.00 H new ATOM 0 HB2 MET A 92 -0.421 -3.320 13.846 1.00 0.00 H new ATOM 0 HB3 MET A 92 0.836 -3.578 12.653 1.00 0.00 H new ATOM 0 HG2 MET A 92 1.750 -5.094 14.758 1.00 0.00 H new ATOM 0 HG3 MET A 92 0.014 -5.257 14.932 1.00 0.00 H new ATOM 0 HE1 MET A 92 -1.388 -6.487 11.950 1.00 0.00 H new ATOM 0 HE2 MET A 92 -1.044 -4.801 12.405 1.00 0.00 H new ATOM 0 HE3 MET A 92 -0.326 -5.488 10.929 1.00 0.00 H new ATOM 1379 N LEU A 93 2.846 -1.732 12.658 1.00 0.00 N ATOM 1380 CA LEU A 93 4.027 -1.547 11.832 1.00 0.00 C ATOM 1381 C LEU A 93 5.201 -1.030 12.652 1.00 0.00 C ATOM 1382 O LEU A 93 6.320 -0.911 12.154 1.00 0.00 O ATOM 1383 CB LEU A 93 3.712 -0.586 10.698 1.00 0.00 C ATOM 1384 CG LEU A 93 3.103 -1.241 9.455 1.00 0.00 C ATOM 1385 CD1 LEU A 93 4.089 -2.219 8.833 1.00 0.00 C ATOM 1386 CD2 LEU A 93 1.802 -1.946 9.807 1.00 0.00 C ATOM 0 H LEU A 93 2.034 -1.199 12.346 1.00 0.00 H new ATOM 0 HA LEU A 93 4.312 -2.515 11.419 1.00 0.00 H new ATOM 0 HB2 LEU A 93 3.023 0.175 11.065 1.00 0.00 H new ATOM 0 HB3 LEU A 93 4.629 -0.073 10.409 1.00 0.00 H new ATOM 0 HG LEU A 93 2.884 -0.461 8.726 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.641 -2.676 7.951 1.00 0.00 H new ATOM 0 HD12 LEU A 93 4.996 -1.688 8.545 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.337 -2.995 9.557 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.383 -2.406 8.912 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.996 -2.716 10.553 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.093 -1.222 10.208 1.00 0.00 H new ATOM 1398 N LEU A 94 4.935 -0.725 13.913 1.00 0.00 N ATOM 1399 CA LEU A 94 5.969 -0.292 14.828 1.00 0.00 C ATOM 1400 C LEU A 94 6.216 -1.391 15.850 1.00 0.00 C ATOM 1401 O LEU A 94 6.612 -1.133 16.987 1.00 0.00 O ATOM 1402 CB LEU A 94 5.553 1.009 15.514 1.00 0.00 C ATOM 1403 CG LEU A 94 6.175 2.282 14.929 1.00 0.00 C ATOM 1404 CD1 LEU A 94 7.568 2.495 15.502 1.00 0.00 C ATOM 1405 CD2 LEU A 94 6.216 2.214 13.401 1.00 0.00 C ATOM 0 H LEU A 94 4.003 -0.771 14.324 1.00 0.00 H new ATOM 0 HA LEU A 94 6.892 -0.101 14.281 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.468 1.097 15.463 1.00 0.00 H new ATOM 0 HB3 LEU A 94 5.818 0.946 16.569 1.00 0.00 H new ATOM 0 HG LEU A 94 5.553 3.133 15.207 1.00 0.00 H new ATOM 0 HD11 LEU A 94 8.000 3.402 15.080 1.00 0.00 H new ATOM 0 HD12 LEU A 94 7.504 2.594 16.586 1.00 0.00 H new ATOM 0 HD13 LEU A 94 8.199 1.642 15.252 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.661 3.128 13.008 1.00 0.00 H new ATOM 0 HD22 LEU A 94 6.814 1.357 13.091 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.202 2.109 13.014 1.00 0.00 H new ATOM 1417 N GLU A 95 5.943 -2.624 15.426 1.00 0.00 N ATOM 1418 CA GLU A 95 6.096 -3.792 16.281 1.00 0.00 C ATOM 1419 C GLU A 95 5.951 -5.087 15.480 1.00 0.00 C ATOM 1420 O GLU A 95 6.054 -6.180 16.038 1.00 0.00 O ATOM 1421 CB GLU A 95 5.059 -3.760 17.410 1.00 0.00 C ATOM 1422 CG GLU A 95 3.650 -4.118 16.959 1.00 0.00 C ATOM 1423 CD GLU A 95 2.750 -4.507 18.116 1.00 0.00 C ATOM 1424 OE1 GLU A 95 3.053 -5.512 18.792 1.00 0.00 O ATOM 1425 OE2 GLU A 95 1.741 -3.806 18.345 1.00 0.00 O ATOM 0 H GLU A 95 5.612 -2.837 14.485 1.00 0.00 H new ATOM 0 HA GLU A 95 7.098 -3.765 16.709 1.00 0.00 H new ATOM 0 HB2 GLU A 95 5.367 -4.453 18.193 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.047 -2.764 17.852 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.214 -3.269 16.433 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.698 -4.942 16.248 1.00 0.00 H new ATOM 1432 N ILE A 96 5.742 -4.964 14.166 1.00 0.00 N ATOM 1433 CA ILE A 96 5.584 -6.141 13.303 1.00 0.00 C ATOM 1434 C ILE A 96 6.849 -6.996 13.279 1.00 0.00 C ATOM 1435 O ILE A 96 7.647 -6.987 14.216 1.00 0.00 O ATOM 1436 CB ILE A 96 5.256 -5.770 11.836 1.00 0.00 C ATOM 1437 CG1 ILE A 96 6.423 -5.017 11.184 1.00 0.00 C ATOM 1438 CG2 ILE A 96 3.969 -4.973 11.729 1.00 0.00 C ATOM 1439 CD1 ILE A 96 6.776 -3.712 11.849 1.00 0.00 C ATOM 0 H ILE A 96 5.678 -4.070 13.679 1.00 0.00 H new ATOM 0 HA ILE A 96 4.751 -6.695 13.735 1.00 0.00 H new ATOM 0 HB ILE A 96 5.106 -6.703 11.293 1.00 0.00 H new ATOM 0 HG12 ILE A 96 7.302 -5.662 11.188 1.00 0.00 H new ATOM 0 HG13 ILE A 96 6.175 -4.823 10.140 1.00 0.00 H new ATOM 0 HG21 ILE A 96 3.775 -4.733 10.683 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.142 -5.562 12.125 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.064 -4.050 12.301 1.00 0.00 H new ATOM 0 HD11 ILE A 96 7.611 -3.249 11.322 1.00 0.00 H new ATOM 0 HD12 ILE A 96 5.915 -3.045 11.821 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.059 -3.897 12.885 1.00 0.00 H new ATOM 1451 N ASP A 97 7.036 -7.703 12.166 1.00 0.00 N ATOM 1452 CA ASP A 97 8.210 -8.532 11.947 1.00 0.00 C ATOM 1453 C ASP A 97 9.489 -7.698 12.002 1.00 0.00 C ATOM 1454 O ASP A 97 10.588 -8.233 11.869 1.00 0.00 O ATOM 1455 CB ASP A 97 8.093 -9.212 10.584 1.00 0.00 C ATOM 1456 CG ASP A 97 8.804 -10.551 10.537 1.00 0.00 C ATOM 1457 OD1 ASP A 97 8.187 -11.566 10.923 1.00 0.00 O ATOM 1458 OD2 ASP A 97 9.979 -10.584 10.113 1.00 0.00 O ATOM 0 H ASP A 97 6.373 -7.714 11.391 1.00 0.00 H new ATOM 0 HA ASP A 97 8.263 -9.282 12.736 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.040 -9.355 10.343 1.00 0.00 H new ATOM 0 HB3 ASP A 97 8.509 -8.557 9.818 1.00 0.00 H new ATOM 1463 N ASN A 98 9.319 -6.383 12.167 1.00 0.00 N ATOM 1464 CA ASN A 98 10.431 -5.434 12.233 1.00 0.00 C ATOM 1465 C ASN A 98 10.963 -5.112 10.846 1.00 0.00 C ATOM 1466 O ASN A 98 11.388 -3.988 10.578 1.00 0.00 O ATOM 1467 CB ASN A 98 11.559 -5.952 13.135 1.00 0.00 C ATOM 1468 CG ASN A 98 12.816 -6.327 12.367 1.00 0.00 C ATOM 1469 OD1 ASN A 98 13.543 -5.459 11.883 1.00 0.00 O ATOM 1470 ND2 ASN A 98 13.093 -7.622 12.277 1.00 0.00 N ATOM 0 H ASN A 98 8.402 -5.946 12.259 1.00 0.00 H new ATOM 0 HA ASN A 98 10.045 -4.514 12.672 1.00 0.00 H new ATOM 0 HB2 ASN A 98 11.806 -5.188 13.872 1.00 0.00 H new ATOM 0 HB3 ASN A 98 11.204 -6.823 13.686 1.00 0.00 H new ATOM 0 HD21 ASN A 98 13.936 -7.931 11.792 1.00 0.00 H new ATOM 0 HD22 ASN A 98 12.463 -8.308 12.693 1.00 0.00 H new ATOM 1477 N SER A 99 10.942 -6.105 9.974 1.00 0.00 N ATOM 1478 CA SER A 99 11.399 -5.918 8.603 1.00 0.00 C ATOM 1479 C SER A 99 10.455 -4.983 7.865 1.00 0.00 C ATOM 1480 O SER A 99 10.862 -4.256 6.960 1.00 0.00 O ATOM 1481 CB SER A 99 11.493 -7.258 7.877 1.00 0.00 C ATOM 1482 OG SER A 99 10.715 -7.257 6.692 1.00 0.00 O ATOM 0 H SER A 99 10.615 -7.047 10.187 1.00 0.00 H new ATOM 0 HA SER A 99 12.394 -5.473 8.626 1.00 0.00 H new ATOM 0 HB2 SER A 99 12.534 -7.469 7.631 1.00 0.00 H new ATOM 0 HB3 SER A 99 11.153 -8.056 8.537 1.00 0.00 H new ATOM 0 HG SER A 99 10.795 -8.126 6.247 1.00 0.00 H new ATOM 1488 N GLU A 100 9.195 -4.997 8.279 1.00 0.00 N ATOM 1489 CA GLU A 100 8.190 -4.116 7.705 1.00 0.00 C ATOM 1490 C GLU A 100 8.317 -2.728 8.309 1.00 0.00 C ATOM 1491 O GLU A 100 7.973 -1.734 7.677 1.00 0.00 O ATOM 1492 CB GLU A 100 6.791 -4.677 7.934 1.00 0.00 C ATOM 1493 CG GLU A 100 6.747 -6.195 7.942 1.00 0.00 C ATOM 1494 CD GLU A 100 5.554 -6.750 7.189 1.00 0.00 C ATOM 1495 OE1 GLU A 100 4.446 -6.193 7.338 1.00 0.00 O ATOM 1496 OE2 GLU A 100 5.727 -7.743 6.452 1.00 0.00 O ATOM 0 H GLU A 100 8.845 -5.612 9.013 1.00 0.00 H new ATOM 0 HA GLU A 100 8.353 -4.048 6.629 1.00 0.00 H new ATOM 0 HB2 GLU A 100 6.409 -4.304 8.884 1.00 0.00 H new ATOM 0 HB3 GLU A 100 6.126 -4.305 7.155 1.00 0.00 H new ATOM 0 HG2 GLU A 100 7.664 -6.583 7.499 1.00 0.00 H new ATOM 0 HG3 GLU A 100 6.717 -6.548 8.973 1.00 0.00 H new ATOM 1503 N LEU A 101 8.848 -2.671 9.527 1.00 0.00 N ATOM 1504 CA LEU A 101 9.091 -1.402 10.201 1.00 0.00 C ATOM 1505 C LEU A 101 10.307 -0.720 9.585 1.00 0.00 C ATOM 1506 O LEU A 101 10.431 0.503 9.608 1.00 0.00 O ATOM 1507 CB LEU A 101 9.320 -1.629 11.700 1.00 0.00 C ATOM 1508 CG LEU A 101 10.097 -0.525 12.423 1.00 0.00 C ATOM 1509 CD1 LEU A 101 9.156 0.331 13.255 1.00 0.00 C ATOM 1510 CD2 LEU A 101 11.188 -1.126 13.295 1.00 0.00 C ATOM 0 H LEU A 101 9.119 -3.492 10.068 1.00 0.00 H new ATOM 0 HA LEU A 101 8.217 -0.762 10.077 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.350 -1.744 12.185 1.00 0.00 H new ATOM 0 HB3 LEU A 101 9.855 -2.570 11.830 1.00 0.00 H new ATOM 0 HG LEU A 101 10.568 0.113 11.675 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.725 1.110 13.762 1.00 0.00 H new ATOM 0 HD12 LEU A 101 8.411 0.790 12.605 1.00 0.00 H new ATOM 0 HD13 LEU A 101 8.656 -0.293 13.996 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.730 -0.327 13.801 1.00 0.00 H new ATOM 0 HD22 LEU A 101 10.739 -1.786 14.037 1.00 0.00 H new ATOM 0 HD23 LEU A 101 11.878 -1.696 12.673 1.00 0.00 H new ATOM 1522 N LEU A 102 11.202 -1.536 9.037 1.00 0.00 N ATOM 1523 CA LEU A 102 12.422 -1.037 8.413 1.00 0.00 C ATOM 1524 C LEU A 102 12.184 -0.658 6.960 1.00 0.00 C ATOM 1525 O LEU A 102 12.617 0.400 6.503 1.00 0.00 O ATOM 1526 CB LEU A 102 13.520 -2.099 8.486 1.00 0.00 C ATOM 1527 CG LEU A 102 14.564 -1.888 9.588 1.00 0.00 C ATOM 1528 CD1 LEU A 102 13.904 -1.886 10.959 1.00 0.00 C ATOM 1529 CD2 LEU A 102 15.640 -2.959 9.513 1.00 0.00 C ATOM 0 H LEU A 102 11.104 -2.551 9.013 1.00 0.00 H new ATOM 0 HA LEU A 102 12.734 -0.145 8.957 1.00 0.00 H new ATOM 0 HB2 LEU A 102 13.052 -3.072 8.634 1.00 0.00 H new ATOM 0 HB3 LEU A 102 14.033 -2.134 7.525 1.00 0.00 H new ATOM 0 HG LEU A 102 15.034 -0.917 9.435 1.00 0.00 H new ATOM 0 HD11 LEU A 102 14.662 -1.735 11.728 1.00 0.00 H new ATOM 0 HD12 LEU A 102 13.171 -1.081 11.009 1.00 0.00 H new ATOM 0 HD13 LEU A 102 13.405 -2.841 11.124 1.00 0.00 H new ATOM 0 HD21 LEU A 102 16.373 -2.794 10.303 1.00 0.00 H new ATOM 0 HD22 LEU A 102 15.185 -3.941 9.640 1.00 0.00 H new ATOM 0 HD23 LEU A 102 16.135 -2.911 8.543 1.00 0.00 H new ATOM 1541 N HIS A 103 11.517 -1.543 6.231 1.00 0.00 N ATOM 1542 CA HIS A 103 11.247 -1.320 4.824 1.00 0.00 C ATOM 1543 C HIS A 103 10.284 -0.151 4.627 1.00 0.00 C ATOM 1544 O HIS A 103 10.456 0.656 3.713 1.00 0.00 O ATOM 1545 CB HIS A 103 10.673 -2.596 4.209 1.00 0.00 C ATOM 1546 CG HIS A 103 11.341 -3.000 2.933 1.00 0.00 C ATOM 1547 ND1 HIS A 103 11.757 -2.066 2.013 1.00 0.00 N ATOM 1548 CD2 HIS A 103 11.642 -4.240 2.471 1.00 0.00 C ATOM 1549 CE1 HIS A 103 12.296 -2.749 1.021 1.00 0.00 C ATOM 1550 NE2 HIS A 103 12.249 -4.069 1.255 1.00 0.00 N ATOM 0 H HIS A 103 11.154 -2.424 6.596 1.00 0.00 H new ATOM 0 HA HIS A 103 12.181 -1.066 4.324 1.00 0.00 H new ATOM 0 HB2 HIS A 103 10.763 -3.409 4.930 1.00 0.00 H new ATOM 0 HB3 HIS A 103 9.609 -2.452 4.022 1.00 0.00 H new ATOM 0 HD2 HIS A 103 11.442 -5.179 2.966 1.00 0.00 H new ATOM 0 HE1 HIS A 103 12.721 -2.302 0.134 1.00 0.00 H new ATOM 0 HE2 HIS A 103 12.599 -4.806 0.643 1.00 0.00 H new ATOM 1558 N MET A 104 9.278 -0.062 5.494 1.00 0.00 N ATOM 1559 CA MET A 104 8.283 1.006 5.416 1.00 0.00 C ATOM 1560 C MET A 104 8.935 2.382 5.466 1.00 0.00 C ATOM 1561 O MET A 104 8.438 3.331 4.863 1.00 0.00 O ATOM 1562 CB MET A 104 7.286 0.877 6.566 1.00 0.00 C ATOM 1563 CG MET A 104 7.903 1.142 7.923 1.00 0.00 C ATOM 1564 SD MET A 104 6.857 2.165 8.973 1.00 0.00 S ATOM 1565 CE MET A 104 5.257 1.437 8.642 1.00 0.00 C ATOM 0 H MET A 104 9.130 -0.718 6.261 1.00 0.00 H new ATOM 0 HA MET A 104 7.765 0.906 4.462 1.00 0.00 H new ATOM 0 HB2 MET A 104 6.464 1.574 6.405 1.00 0.00 H new ATOM 0 HB3 MET A 104 6.859 -0.126 6.558 1.00 0.00 H new ATOM 0 HG2 MET A 104 8.094 0.192 8.422 1.00 0.00 H new ATOM 0 HG3 MET A 104 8.867 1.632 7.790 1.00 0.00 H new ATOM 0 HE1 MET A 104 4.540 1.780 9.388 1.00 0.00 H new ATOM 0 HE2 MET A 104 4.920 1.736 7.650 1.00 0.00 H new ATOM 0 HE3 MET A 104 5.335 0.351 8.687 1.00 0.00 H new ATOM 1575 N LEU A 105 10.023 2.494 6.220 1.00 0.00 N ATOM 1576 CA LEU A 105 10.730 3.760 6.353 1.00 0.00 C ATOM 1577 C LEU A 105 11.725 3.935 5.220 1.00 0.00 C ATOM 1578 O LEU A 105 12.254 5.026 5.007 1.00 0.00 O ATOM 1579 CB LEU A 105 11.468 3.824 7.693 1.00 0.00 C ATOM 1580 CG LEU A 105 10.639 3.422 8.912 1.00 0.00 C ATOM 1581 CD1 LEU A 105 11.523 3.326 10.147 1.00 0.00 C ATOM 1582 CD2 LEU A 105 9.512 4.414 9.136 1.00 0.00 C ATOM 0 H LEU A 105 10.433 1.723 6.748 1.00 0.00 H new ATOM 0 HA LEU A 105 9.995 4.563 6.311 1.00 0.00 H new ATOM 0 HB2 LEU A 105 12.343 3.176 7.639 1.00 0.00 H new ATOM 0 HB3 LEU A 105 11.833 4.841 7.841 1.00 0.00 H new ATOM 0 HG LEU A 105 10.201 2.441 8.727 1.00 0.00 H new ATOM 0 HD11 LEU A 105 10.917 3.039 11.007 1.00 0.00 H new ATOM 0 HD12 LEU A 105 12.298 2.577 9.983 1.00 0.00 H new ATOM 0 HD13 LEU A 105 11.988 4.293 10.338 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.931 4.114 10.008 1.00 0.00 H new ATOM 0 HD22 LEU A 105 9.929 5.407 9.303 1.00 0.00 H new ATOM 0 HD23 LEU A 105 8.866 4.435 8.259 1.00 0.00 H new ATOM 1594 N GLU A 106 11.976 2.853 4.497 1.00 0.00 N ATOM 1595 CA GLU A 106 12.952 2.877 3.422 1.00 0.00 C ATOM 1596 C GLU A 106 12.297 2.826 2.039 1.00 0.00 C ATOM 1597 O GLU A 106 12.990 2.889 1.022 1.00 0.00 O ATOM 1598 CB GLU A 106 13.936 1.710 3.594 1.00 0.00 C ATOM 1599 CG GLU A 106 13.566 0.462 2.804 1.00 0.00 C ATOM 1600 CD GLU A 106 14.486 0.228 1.621 1.00 0.00 C ATOM 1601 OE1 GLU A 106 15.719 0.287 1.807 1.00 0.00 O ATOM 1602 OE2 GLU A 106 13.973 -0.014 0.508 1.00 0.00 O ATOM 0 H GLU A 106 11.518 1.952 4.636 1.00 0.00 H new ATOM 0 HA GLU A 106 13.489 3.824 3.482 1.00 0.00 H new ATOM 0 HB2 GLU A 106 14.929 2.039 3.289 1.00 0.00 H new ATOM 0 HB3 GLU A 106 13.996 1.453 4.651 1.00 0.00 H new ATOM 0 HG2 GLU A 106 13.601 -0.405 3.464 1.00 0.00 H new ATOM 0 HG3 GLU A 106 12.539 0.552 2.449 1.00 0.00 H new ATOM 1609 N SER A 107 10.969 2.726 1.993 1.00 0.00 N ATOM 1610 CA SER A 107 10.268 2.656 0.713 1.00 0.00 C ATOM 1611 C SER A 107 8.865 3.262 0.793 1.00 0.00 C ATOM 1612 O SER A 107 8.093 2.942 1.697 1.00 0.00 O ATOM 1613 CB SER A 107 10.173 1.204 0.251 1.00 0.00 C ATOM 1614 OG SER A 107 10.195 1.112 -1.163 1.00 0.00 O ATOM 0 H SER A 107 10.365 2.692 2.814 1.00 0.00 H new ATOM 0 HA SER A 107 10.842 3.239 -0.007 1.00 0.00 H new ATOM 0 HB2 SER A 107 11.002 0.632 0.668 1.00 0.00 H new ATOM 0 HB3 SER A 107 9.255 0.758 0.633 1.00 0.00 H new ATOM 0 HG SER A 107 10.135 0.171 -1.431 1.00 0.00 H new ATOM 1620 N PRO A 108 8.504 4.124 -0.182 1.00 0.00 N ATOM 1621 CA PRO A 108 7.183 4.766 -0.232 1.00 0.00 C ATOM 1622 C PRO A 108 6.069 3.767 -0.533 1.00 0.00 C ATOM 1623 O PRO A 108 4.893 4.129 -0.595 1.00 0.00 O ATOM 1624 CB PRO A 108 7.307 5.784 -1.375 1.00 0.00 C ATOM 1625 CG PRO A 108 8.769 5.887 -1.663 1.00 0.00 C ATOM 1626 CD PRO A 108 9.356 4.556 -1.299 1.00 0.00 C ATOM 0 HA PRO A 108 6.920 5.218 0.724 1.00 0.00 H new ATOM 0 HB2 PRO A 108 6.756 5.454 -2.256 1.00 0.00 H new ATOM 0 HB3 PRO A 108 6.895 6.751 -1.085 1.00 0.00 H new ATOM 0 HG2 PRO A 108 8.945 6.117 -2.714 1.00 0.00 H new ATOM 0 HG3 PRO A 108 9.226 6.687 -1.081 1.00 0.00 H new ATOM 0 HD2 PRO A 108 9.318 3.855 -2.133 1.00 0.00 H new ATOM 0 HD3 PRO A 108 10.401 4.642 -1.002 1.00 0.00 H new ATOM 1634 N GLU A 109 6.453 2.514 -0.733 1.00 0.00 N ATOM 1635 CA GLU A 109 5.500 1.444 -1.007 1.00 0.00 C ATOM 1636 C GLU A 109 5.546 0.414 0.097 1.00 0.00 C ATOM 1637 O GLU A 109 4.549 -0.225 0.401 1.00 0.00 O ATOM 1638 CB GLU A 109 5.812 0.783 -2.347 1.00 0.00 C ATOM 1639 CG GLU A 109 6.159 -0.687 -2.239 1.00 0.00 C ATOM 1640 CD GLU A 109 5.972 -1.434 -3.546 1.00 0.00 C ATOM 1641 OE1 GLU A 109 6.240 -0.841 -4.612 1.00 0.00 O ATOM 1642 OE2 GLU A 109 5.556 -2.611 -3.503 1.00 0.00 O ATOM 0 H GLU A 109 7.426 2.210 -0.711 1.00 0.00 H new ATOM 0 HA GLU A 109 4.499 1.874 -1.053 1.00 0.00 H new ATOM 0 HB2 GLU A 109 4.951 0.896 -3.006 1.00 0.00 H new ATOM 0 HB3 GLU A 109 6.643 1.309 -2.816 1.00 0.00 H new ATOM 0 HG2 GLU A 109 7.194 -0.788 -1.913 1.00 0.00 H new ATOM 0 HG3 GLU A 109 5.537 -1.147 -1.471 1.00 0.00 H new ATOM 1649 N SER A 110 6.704 0.275 0.714 1.00 0.00 N ATOM 1650 CA SER A 110 6.861 -0.700 1.772 1.00 0.00 C ATOM 1651 C SER A 110 5.937 -0.374 2.924 1.00 0.00 C ATOM 1652 O SER A 110 5.270 -1.248 3.456 1.00 0.00 O ATOM 1653 CB SER A 110 8.303 -0.745 2.256 1.00 0.00 C ATOM 1654 OG SER A 110 8.977 -1.871 1.725 1.00 0.00 O ATOM 0 H SER A 110 7.541 0.819 0.503 1.00 0.00 H new ATOM 0 HA SER A 110 6.601 -1.681 1.374 1.00 0.00 H new ATOM 0 HB2 SER A 110 8.820 0.167 1.958 1.00 0.00 H new ATOM 0 HB3 SER A 110 8.325 -0.783 3.345 1.00 0.00 H new ATOM 0 HG SER A 110 9.916 -1.643 1.562 1.00 0.00 H new ATOM 1660 N LEU A 111 5.846 0.895 3.264 1.00 0.00 N ATOM 1661 CA LEU A 111 4.975 1.310 4.346 1.00 0.00 C ATOM 1662 C LEU A 111 3.528 0.936 4.061 1.00 0.00 C ATOM 1663 O LEU A 111 2.730 0.766 4.980 1.00 0.00 O ATOM 1664 CB LEU A 111 5.084 2.806 4.576 1.00 0.00 C ATOM 1665 CG LEU A 111 4.363 3.294 5.823 1.00 0.00 C ATOM 1666 CD1 LEU A 111 5.233 4.277 6.574 1.00 0.00 C ATOM 1667 CD2 LEU A 111 3.022 3.909 5.456 1.00 0.00 C ATOM 0 H LEU A 111 6.359 1.652 2.812 1.00 0.00 H new ATOM 0 HA LEU A 111 5.296 0.787 5.247 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.137 3.076 4.649 1.00 0.00 H new ATOM 0 HB3 LEU A 111 4.680 3.327 3.708 1.00 0.00 H new ATOM 0 HG LEU A 111 4.169 2.444 6.477 1.00 0.00 H new ATOM 0 HD11 LEU A 111 4.708 4.621 7.465 1.00 0.00 H new ATOM 0 HD12 LEU A 111 6.163 3.790 6.866 1.00 0.00 H new ATOM 0 HD13 LEU A 111 5.456 5.130 5.933 1.00 0.00 H new ATOM 0 HD21 LEU A 111 2.520 4.253 6.360 1.00 0.00 H new ATOM 0 HD22 LEU A 111 3.180 4.754 4.785 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.403 3.162 4.959 1.00 0.00 H new ATOM 1679 N ARG A 112 3.198 0.810 2.785 1.00 0.00 N ATOM 1680 CA ARG A 112 1.845 0.458 2.373 1.00 0.00 C ATOM 1681 C ARG A 112 1.725 -1.030 2.127 1.00 0.00 C ATOM 1682 O ARG A 112 1.023 -1.732 2.846 1.00 0.00 O ATOM 1683 CB ARG A 112 1.479 1.226 1.114 1.00 0.00 C ATOM 1684 CG ARG A 112 1.350 2.701 1.383 1.00 0.00 C ATOM 1685 CD ARG A 112 1.430 3.521 0.106 1.00 0.00 C ATOM 1686 NE ARG A 112 0.267 3.312 -0.754 1.00 0.00 N ATOM 1687 CZ ARG A 112 0.349 2.947 -2.030 1.00 0.00 C ATOM 1688 NH1 ARG A 112 1.533 2.750 -2.594 1.00 0.00 N ATOM 1689 NH2 ARG A 112 -0.756 2.779 -2.744 1.00 0.00 N ATOM 0 H ARG A 112 3.850 0.947 2.013 1.00 0.00 H new ATOM 0 HA ARG A 112 1.157 0.726 3.175 1.00 0.00 H new ATOM 0 HB2 ARG A 112 2.240 1.060 0.352 1.00 0.00 H new ATOM 0 HB3 ARG A 112 0.539 0.845 0.715 1.00 0.00 H new ATOM 0 HG2 ARG A 112 0.400 2.897 1.881 1.00 0.00 H new ATOM 0 HG3 ARG A 112 2.139 3.015 2.066 1.00 0.00 H new ATOM 0 HD2 ARG A 112 1.508 4.578 0.359 1.00 0.00 H new ATOM 0 HD3 ARG A 112 2.336 3.256 -0.439 1.00 0.00 H new ATOM 0 HE ARG A 112 -0.660 3.454 -0.353 1.00 0.00 H new ATOM 0 HH11 ARG A 112 2.385 2.878 -2.049 1.00 0.00 H new ATOM 0 HH12 ARG A 112 1.591 2.470 -3.573 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -1.669 2.930 -2.314 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -0.693 2.499 -3.723 1.00 0.00 H new ATOM 1703 N SER A 113 2.424 -1.499 1.107 1.00 0.00 N ATOM 1704 CA SER A 113 2.453 -2.909 0.781 1.00 0.00 C ATOM 1705 C SER A 113 2.593 -3.737 2.058 1.00 0.00 C ATOM 1706 O SER A 113 2.054 -4.840 2.155 1.00 0.00 O ATOM 1707 CB SER A 113 3.610 -3.180 -0.183 1.00 0.00 C ATOM 1708 OG SER A 113 3.752 -2.123 -1.114 1.00 0.00 O ATOM 0 H SER A 113 2.984 -0.914 0.486 1.00 0.00 H new ATOM 0 HA SER A 113 1.520 -3.197 0.296 1.00 0.00 H new ATOM 0 HB2 SER A 113 4.536 -3.301 0.379 1.00 0.00 H new ATOM 0 HB3 SER A 113 3.435 -4.116 -0.714 1.00 0.00 H new ATOM 0 HG SER A 113 4.134 -1.340 -0.665 1.00 0.00 H new ATOM 1714 N LYS A 114 3.326 -3.196 3.035 1.00 0.00 N ATOM 1715 CA LYS A 114 3.474 -3.857 4.332 1.00 0.00 C ATOM 1716 C LYS A 114 2.274 -3.578 5.232 1.00 0.00 C ATOM 1717 O LYS A 114 1.802 -4.476 5.922 1.00 0.00 O ATOM 1718 CB LYS A 114 4.765 -3.440 5.037 1.00 0.00 C ATOM 1719 CG LYS A 114 6.022 -3.828 4.279 1.00 0.00 C ATOM 1720 CD LYS A 114 6.160 -5.336 4.147 1.00 0.00 C ATOM 1721 CE LYS A 114 7.007 -5.716 2.943 1.00 0.00 C ATOM 1722 NZ LYS A 114 6.756 -7.118 2.507 1.00 0.00 N ATOM 0 H LYS A 114 3.822 -2.309 2.953 1.00 0.00 H new ATOM 0 HA LYS A 114 3.525 -4.928 4.138 1.00 0.00 H new ATOM 0 HB2 LYS A 114 4.757 -2.360 5.183 1.00 0.00 H new ATOM 0 HB3 LYS A 114 4.792 -3.895 6.027 1.00 0.00 H new ATOM 0 HG2 LYS A 114 6.002 -3.377 3.287 1.00 0.00 H new ATOM 0 HG3 LYS A 114 6.895 -3.427 4.794 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.611 -5.742 5.053 1.00 0.00 H new ATOM 0 HD3 LYS A 114 5.172 -5.786 4.054 1.00 0.00 H new ATOM 0 HE2 LYS A 114 6.792 -5.036 2.119 1.00 0.00 H new ATOM 0 HE3 LYS A 114 8.062 -5.596 3.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 7.353 -7.338 1.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 6.985 -7.770 3.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 5.755 -7.227 2.248 1.00 0.00 H new ATOM 1736 N VAL A 115 1.808 -2.323 5.263 1.00 0.00 N ATOM 1737 CA VAL A 115 0.653 -1.971 6.096 1.00 0.00 C ATOM 1738 C VAL A 115 -0.567 -2.783 5.665 1.00 0.00 C ATOM 1739 O VAL A 115 -1.116 -3.551 6.454 1.00 0.00 O ATOM 1740 CB VAL A 115 0.334 -0.451 6.063 1.00 0.00 C ATOM 1741 CG1 VAL A 115 -1.167 -0.191 6.016 1.00 0.00 C ATOM 1742 CG2 VAL A 115 0.941 0.243 7.271 1.00 0.00 C ATOM 0 H VAL A 115 2.205 -1.548 4.731 1.00 0.00 H new ATOM 0 HA VAL A 115 0.909 -2.216 7.127 1.00 0.00 H new ATOM 0 HB VAL A 115 0.774 -0.044 5.153 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -1.350 0.883 5.994 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -1.588 -0.649 5.121 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.639 -0.621 6.900 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.709 1.307 7.234 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.528 -0.187 8.183 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.022 0.107 7.263 1.00 0.00 H new ATOM 1752 N ASP A 116 -0.951 -2.648 4.397 1.00 0.00 N ATOM 1753 CA ASP A 116 -2.078 -3.394 3.846 1.00 0.00 C ATOM 1754 C ASP A 116 -1.954 -4.884 4.149 1.00 0.00 C ATOM 1755 O ASP A 116 -2.938 -5.543 4.493 1.00 0.00 O ATOM 1756 CB ASP A 116 -2.149 -3.176 2.335 1.00 0.00 C ATOM 1757 CG ASP A 116 -3.407 -2.450 1.905 1.00 0.00 C ATOM 1758 OD1 ASP A 116 -3.577 -1.277 2.296 1.00 0.00 O ATOM 1759 OD2 ASP A 116 -4.216 -3.051 1.168 1.00 0.00 O ATOM 0 H ASP A 116 -0.495 -2.025 3.730 1.00 0.00 H new ATOM 0 HA ASP A 116 -2.992 -3.028 4.313 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -1.278 -2.605 2.014 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -2.102 -4.141 1.831 1.00 0.00 H new ATOM 1764 N GLU A 117 -0.741 -5.413 4.017 1.00 0.00 N ATOM 1765 CA GLU A 117 -0.490 -6.823 4.297 1.00 0.00 C ATOM 1766 C GLU A 117 -0.523 -7.071 5.797 1.00 0.00 C ATOM 1767 O GLU A 117 -0.903 -8.151 6.251 1.00 0.00 O ATOM 1768 CB GLU A 117 0.863 -7.250 3.726 1.00 0.00 C ATOM 1769 CG GLU A 117 0.791 -7.751 2.293 1.00 0.00 C ATOM 1770 CD GLU A 117 1.423 -9.119 2.118 1.00 0.00 C ATOM 1771 OE1 GLU A 117 1.968 -9.654 3.107 1.00 0.00 O ATOM 1772 OE2 GLU A 117 1.375 -9.655 0.990 1.00 0.00 O ATOM 0 H GLU A 117 0.081 -4.888 3.719 1.00 0.00 H new ATOM 0 HA GLU A 117 -1.271 -7.415 3.821 1.00 0.00 H new ATOM 0 HB2 GLU A 117 1.550 -6.405 3.772 1.00 0.00 H new ATOM 0 HB3 GLU A 117 1.281 -8.035 4.355 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -0.252 -7.795 1.980 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.291 -7.038 1.638 1.00 0.00 H new ATOM 1779 N ALA A 118 -0.126 -6.060 6.561 1.00 0.00 N ATOM 1780 CA ALA A 118 -0.149 -6.154 8.010 1.00 0.00 C ATOM 1781 C ALA A 118 -1.583 -6.201 8.494 1.00 0.00 C ATOM 1782 O ALA A 118 -1.879 -6.785 9.531 1.00 0.00 O ATOM 1783 CB ALA A 118 0.597 -4.995 8.649 1.00 0.00 C ATOM 0 H ALA A 118 0.214 -5.169 6.199 1.00 0.00 H new ATOM 0 HA ALA A 118 0.358 -7.072 8.307 1.00 0.00 H new ATOM 0 HB1 ALA A 118 0.562 -5.094 9.734 1.00 0.00 H new ATOM 0 HB2 ALA A 118 1.635 -5.003 8.317 1.00 0.00 H new ATOM 0 HB3 ALA A 118 0.130 -4.055 8.355 1.00 0.00 H new ATOM 1789 N VAL A 119 -2.477 -5.603 7.714 1.00 0.00 N ATOM 1790 CA VAL A 119 -3.890 -5.640 8.029 1.00 0.00 C ATOM 1791 C VAL A 119 -4.360 -7.071 8.078 1.00 0.00 C ATOM 1792 O VAL A 119 -4.932 -7.514 9.066 1.00 0.00 O ATOM 1793 CB VAL A 119 -4.729 -4.892 6.999 1.00 0.00 C ATOM 1794 CG1 VAL A 119 -6.160 -4.785 7.498 1.00 0.00 C ATOM 1795 CG2 VAL A 119 -4.130 -3.530 6.721 1.00 0.00 C ATOM 0 H VAL A 119 -2.244 -5.090 6.864 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.018 -5.153 8.996 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.734 -5.442 6.058 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -6.762 -4.251 6.764 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.570 -5.784 7.645 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.176 -4.243 8.444 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.740 -3.008 5.984 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.100 -2.950 7.644 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.118 -3.650 6.335 1.00 0.00 H new ATOM 1805 N ALA A 120 -4.080 -7.792 7.003 1.00 0.00 N ATOM 1806 CA ALA A 120 -4.421 -9.197 6.918 1.00 0.00 C ATOM 1807 C ALA A 120 -3.842 -9.948 8.109 1.00 0.00 C ATOM 1808 O ALA A 120 -4.341 -11.002 8.505 1.00 0.00 O ATOM 1809 CB ALA A 120 -3.895 -9.768 5.618 1.00 0.00 C ATOM 0 H ALA A 120 -3.615 -7.421 6.175 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.505 -9.309 6.938 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -4.152 -10.825 5.555 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -4.342 -9.235 4.779 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.811 -9.655 5.583 1.00 0.00 H new ATOM 1815 N VAL A 121 -2.793 -9.372 8.686 1.00 0.00 N ATOM 1816 CA VAL A 121 -2.132 -9.942 9.845 1.00 0.00 C ATOM 1817 C VAL A 121 -2.814 -9.484 11.134 1.00 0.00 C ATOM 1818 O VAL A 121 -2.849 -10.215 12.126 1.00 0.00 O ATOM 1819 CB VAL A 121 -0.645 -9.534 9.859 1.00 0.00 C ATOM 1820 CG1 VAL A 121 -0.039 -9.698 11.242 1.00 0.00 C ATOM 1821 CG2 VAL A 121 0.127 -10.337 8.826 1.00 0.00 C ATOM 0 H VAL A 121 -2.380 -8.498 8.361 1.00 0.00 H new ATOM 0 HA VAL A 121 -2.203 -11.028 9.784 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.578 -8.478 9.599 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.010 -9.402 11.217 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.577 -9.069 11.952 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -0.114 -10.741 11.551 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.176 -10.041 8.844 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.046 -11.399 9.056 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -0.286 -10.148 7.835 1.00 0.00 H new ATOM 1831 N LEU A 122 -3.370 -8.277 11.101 1.00 0.00 N ATOM 1832 CA LEU A 122 -4.072 -7.719 12.250 1.00 0.00 C ATOM 1833 C LEU A 122 -5.432 -8.391 12.414 1.00 0.00 C ATOM 1834 O LEU A 122 -5.858 -8.692 13.527 1.00 0.00 O ATOM 1835 CB LEU A 122 -4.233 -6.201 12.083 1.00 0.00 C ATOM 1836 CG LEU A 122 -5.675 -5.688 12.021 1.00 0.00 C ATOM 1837 CD1 LEU A 122 -6.049 -4.996 13.322 1.00 0.00 C ATOM 1838 CD2 LEU A 122 -5.856 -4.745 10.845 1.00 0.00 C ATOM 0 H LEU A 122 -3.347 -7.664 10.286 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.486 -7.907 13.149 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.727 -5.707 12.912 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -3.720 -5.898 11.170 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.338 -6.542 11.881 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.077 -4.638 13.261 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -5.959 -5.701 14.148 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -5.380 -4.152 13.491 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.887 -4.391 10.818 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.183 -3.894 10.954 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.628 -5.271 9.918 1.00 0.00 H new ATOM 1850 N GLN A 123 -6.109 -8.614 11.294 1.00 0.00 N ATOM 1851 CA GLN A 123 -7.412 -9.264 11.299 1.00 0.00 C ATOM 1852 C GLN A 123 -7.261 -10.734 11.661 1.00 0.00 C ATOM 1853 O GLN A 123 -8.154 -11.345 12.248 1.00 0.00 O ATOM 1854 CB GLN A 123 -8.072 -9.124 9.925 1.00 0.00 C ATOM 1855 CG GLN A 123 -7.126 -9.346 8.761 1.00 0.00 C ATOM 1856 CD GLN A 123 -7.559 -10.487 7.861 1.00 0.00 C ATOM 1857 OE1 GLN A 123 -8.043 -10.151 6.672 1.00 0.00 O flip ATOM 1858 NE2 GLN A 123 -7.459 -11.657 8.231 1.00 0.00 N flip ATOM 0 H GLN A 123 -5.774 -8.352 10.367 1.00 0.00 H new ATOM 0 HA GLN A 123 -8.045 -8.782 12.044 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -8.893 -9.837 9.853 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -8.507 -8.128 9.842 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -7.060 -8.431 8.173 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -6.127 -9.551 9.145 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -7.081 -11.869 9.154 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -7.754 -12.414 7.614 1.00 0.00 H new ATOM 1867 N ALA A 124 -6.101 -11.278 11.324 1.00 0.00 N ATOM 1868 CA ALA A 124 -5.787 -12.675 11.597 1.00 0.00 C ATOM 1869 C ALA A 124 -5.434 -12.896 13.064 1.00 0.00 C ATOM 1870 O ALA A 124 -5.716 -13.955 13.622 1.00 0.00 O ATOM 1871 CB ALA A 124 -4.634 -13.123 10.715 1.00 0.00 C ATOM 0 H ALA A 124 -5.353 -10.767 10.855 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.674 -13.268 11.375 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -4.402 -14.168 10.922 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.914 -13.014 9.667 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.758 -12.509 10.922 1.00 0.00 H new ATOM 1877 N HIS A 125 -4.792 -11.907 13.676 1.00 0.00 N ATOM 1878 CA HIS A 125 -4.375 -12.021 15.068 1.00 0.00 C ATOM 1879 C HIS A 125 -5.471 -11.553 16.017 1.00 0.00 C ATOM 1880 O HIS A 125 -5.791 -12.237 16.989 1.00 0.00 O ATOM 1881 CB HIS A 125 -3.093 -11.222 15.306 1.00 0.00 C ATOM 1882 CG HIS A 125 -2.067 -11.963 16.109 1.00 0.00 C ATOM 1883 ND1 HIS A 125 -2.407 -12.643 17.253 1.00 0.00 N ATOM 1884 CD2 HIS A 125 -0.738 -12.103 15.888 1.00 0.00 C ATOM 1885 CE1 HIS A 125 -1.286 -13.177 17.705 1.00 0.00 C ATOM 1886 NE2 HIS A 125 -0.249 -12.876 16.910 1.00 0.00 N ATOM 0 H HIS A 125 -4.550 -11.021 13.232 1.00 0.00 H new ATOM 0 HA HIS A 125 -4.181 -13.074 15.273 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -2.661 -10.948 14.343 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -3.343 -10.293 15.819 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -0.173 -11.687 15.067 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -1.214 -13.778 18.599 1.00 0.00 H new ATOM 0 HE2 HIS A 125 0.720 -13.167 17.041 1.00 0.00 H new ATOM 1894 N GLN A 126 -6.040 -10.384 15.741 1.00 0.00 N ATOM 1895 CA GLN A 126 -7.127 -9.865 16.563 1.00 0.00 C ATOM 1896 C GLN A 126 -8.259 -10.881 16.593 1.00 0.00 C ATOM 1897 O GLN A 126 -8.601 -11.421 17.644 1.00 0.00 O ATOM 1898 CB GLN A 126 -7.628 -8.527 16.019 1.00 0.00 C ATOM 1899 CG GLN A 126 -6.613 -7.401 16.145 1.00 0.00 C ATOM 1900 CD GLN A 126 -6.947 -6.437 17.264 1.00 0.00 C ATOM 1901 OE1 GLN A 126 -7.345 -6.847 18.355 1.00 0.00 O ATOM 1902 NE2 GLN A 126 -6.784 -5.145 17.001 1.00 0.00 N ATOM 0 H GLN A 126 -5.770 -9.783 14.962 1.00 0.00 H new ATOM 0 HA GLN A 126 -6.760 -9.698 17.576 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -7.896 -8.648 14.969 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -8.538 -8.246 16.550 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -5.625 -7.826 16.320 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -6.563 -6.855 15.203 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -6.452 -4.849 16.083 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -6.991 -4.449 17.717 1.00 0.00 H new ATOM 1911 N ALA A 127 -8.799 -11.171 15.416 1.00 0.00 N ATOM 1912 CA ALA A 127 -9.826 -12.191 15.273 1.00 0.00 C ATOM 1913 C ALA A 127 -9.180 -13.510 14.860 1.00 0.00 C ATOM 1914 O ALA A 127 -9.378 -13.987 13.741 1.00 0.00 O ATOM 1915 CB ALA A 127 -10.872 -11.759 14.257 1.00 0.00 C ATOM 0 H ALA A 127 -8.540 -10.711 14.543 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.329 -12.329 16.230 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -11.632 -12.535 14.164 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.340 -10.832 14.588 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.396 -11.600 13.290 1.00 0.00 H new ATOM 1921 N LYS A 128 -8.420 -14.104 15.778 1.00 0.00 N ATOM 1922 CA LYS A 128 -7.684 -15.324 15.485 1.00 0.00 C ATOM 1923 C LYS A 128 -8.609 -16.479 15.153 1.00 0.00 C ATOM 1924 O LYS A 128 -9.192 -17.105 16.038 1.00 0.00 O ATOM 1925 CB LYS A 128 -6.805 -15.717 16.671 1.00 0.00 C ATOM 1926 CG LYS A 128 -5.401 -15.154 16.588 1.00 0.00 C ATOM 1927 CD LYS A 128 -4.389 -16.229 16.230 1.00 0.00 C ATOM 1928 CE LYS A 128 -3.826 -16.899 17.473 1.00 0.00 C ATOM 1929 NZ LYS A 128 -2.399 -16.537 17.702 1.00 0.00 N ATOM 0 H LYS A 128 -8.300 -13.757 16.730 1.00 0.00 H new ATOM 0 HA LYS A 128 -7.063 -15.117 14.613 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -7.274 -15.371 17.592 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -6.750 -16.804 16.730 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -5.370 -14.361 15.841 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -5.132 -14.703 17.543 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -4.861 -16.978 15.594 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -3.576 -15.788 15.653 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -4.418 -16.609 18.341 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -3.915 -17.981 17.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -1.948 -17.261 18.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -1.904 -16.482 16.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -2.347 -15.615 18.180 1.00 0.00 H new ATOM 1943 N GLU A 129 -8.705 -16.773 13.866 1.00 0.00 N ATOM 1944 CA GLU A 129 -9.478 -17.914 13.402 1.00 0.00 C ATOM 1945 C GLU A 129 -8.587 -19.148 13.408 1.00 0.00 C ATOM 1946 O GLU A 129 -8.961 -20.212 12.915 1.00 0.00 O ATOM 1947 CB GLU A 129 -10.027 -17.661 11.997 1.00 0.00 C ATOM 1948 CG GLU A 129 -11.539 -17.789 11.905 1.00 0.00 C ATOM 1949 CD GLU A 129 -11.985 -18.580 10.690 1.00 0.00 C ATOM 1950 OE1 GLU A 129 -11.638 -19.776 10.600 1.00 0.00 O ATOM 1951 OE2 GLU A 129 -12.682 -18.002 9.829 1.00 0.00 O ATOM 0 H GLU A 129 -8.257 -16.237 13.123 1.00 0.00 H new ATOM 0 HA GLU A 129 -10.326 -18.070 14.068 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -9.735 -16.661 11.676 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -9.568 -18.366 11.304 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -11.914 -18.273 12.807 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -11.983 -16.794 11.869 1.00 0.00 H new ATOM 1958 N ALA A 130 -7.392 -18.976 13.969 1.00 0.00 N ATOM 1959 CA ALA A 130 -6.407 -20.044 14.045 1.00 0.00 C ATOM 1960 C ALA A 130 -6.614 -20.905 15.285 1.00 0.00 C ATOM 1961 O ALA A 130 -5.937 -21.916 15.471 1.00 0.00 O ATOM 1962 CB ALA A 130 -5.005 -19.451 14.037 1.00 0.00 C ATOM 0 H ALA A 130 -7.084 -18.095 14.381 1.00 0.00 H new ATOM 0 HA ALA A 130 -6.532 -20.687 13.174 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -4.270 -20.254 14.094 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.854 -18.886 13.117 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -4.885 -18.788 14.894 1.00 0.00 H new ATOM 1968 N ALA A 131 -7.554 -20.497 16.134 1.00 0.00 N ATOM 1969 CA ALA A 131 -7.850 -21.233 17.357 1.00 0.00 C ATOM 1970 C ALA A 131 -8.438 -22.605 17.039 1.00 0.00 C ATOM 1971 O ALA A 131 -9.634 -22.732 16.777 1.00 0.00 O ATOM 1972 CB ALA A 131 -8.803 -20.436 18.235 1.00 0.00 C ATOM 0 H ALA A 131 -8.122 -19.661 15.996 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.917 -21.383 17.900 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -9.015 -20.998 19.145 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -8.345 -19.482 18.496 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -9.732 -20.257 17.694 1.00 0.00 H new ATOM 1978 N GLN A 132 -7.587 -23.625 17.054 1.00 0.00 N ATOM 1979 CA GLN A 132 -8.020 -24.988 16.762 1.00 0.00 C ATOM 1980 C GLN A 132 -8.253 -25.778 18.045 1.00 0.00 C ATOM 1981 O GLN A 132 -9.389 -26.121 18.376 1.00 0.00 O ATOM 1982 CB GLN A 132 -6.980 -25.699 15.892 1.00 0.00 C ATOM 1983 CG GLN A 132 -6.586 -24.914 14.651 1.00 0.00 C ATOM 1984 CD GLN A 132 -7.323 -25.375 13.409 1.00 0.00 C ATOM 1985 OE1 GLN A 132 -6.814 -26.187 12.636 1.00 0.00 O ATOM 1986 NE2 GLN A 132 -8.530 -24.857 13.210 1.00 0.00 N ATOM 0 H GLN A 132 -6.593 -23.535 17.265 1.00 0.00 H new ATOM 0 HA GLN A 132 -8.964 -24.932 16.219 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -6.088 -25.890 16.489 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -7.374 -26.669 15.588 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -6.788 -23.856 14.816 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -5.513 -25.013 14.489 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -8.914 -24.187 13.877 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -9.073 -25.129 12.391 1.00 0.00 H new ATOM 1995 N LYS A 133 -7.171 -26.069 18.763 1.00 0.00 N ATOM 1996 CA LYS A 133 -7.257 -26.824 20.009 1.00 0.00 C ATOM 1997 C LYS A 133 -7.565 -25.902 21.185 1.00 0.00 C ATOM 1998 O LYS A 133 -6.873 -25.923 22.203 1.00 0.00 O ATOM 1999 CB LYS A 133 -5.949 -27.579 20.262 1.00 0.00 C ATOM 2000 CG LYS A 133 -5.477 -28.392 19.068 1.00 0.00 C ATOM 2001 CD LYS A 133 -3.994 -28.715 19.163 1.00 0.00 C ATOM 2002 CE LYS A 133 -3.758 -30.049 19.852 1.00 0.00 C ATOM 2003 NZ LYS A 133 -3.779 -31.185 18.888 1.00 0.00 N ATOM 0 H LYS A 133 -6.224 -25.793 18.503 1.00 0.00 H new ATOM 0 HA LYS A 133 -8.071 -27.543 19.915 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -5.173 -26.864 20.534 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -6.082 -28.245 21.115 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -6.049 -29.318 19.009 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -5.671 -27.838 18.150 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -3.561 -28.739 18.163 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -3.483 -27.925 19.713 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -2.797 -30.027 20.366 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -4.523 -30.205 20.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -3.614 -32.076 19.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -4.705 -31.222 18.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -3.033 -31.050 18.176 1.00 0.00 H new ATOM 2017 N ALA A 134 -8.609 -25.093 21.036 1.00 0.00 N ATOM 2018 CA ALA A 134 -9.011 -24.158 22.082 1.00 0.00 C ATOM 2019 C ALA A 134 -9.952 -24.822 23.082 1.00 0.00 C ATOM 2020 O ALA A 134 -11.061 -24.342 23.322 1.00 0.00 O ATOM 2021 CB ALA A 134 -9.666 -22.931 21.468 1.00 0.00 C ATOM 0 H ALA A 134 -9.193 -25.066 20.200 1.00 0.00 H new ATOM 0 HA ALA A 134 -8.116 -23.846 22.621 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -9.961 -22.242 22.259 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -8.960 -22.437 20.801 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -10.548 -23.234 20.903 1.00 0.00 H new ATOM 2027 N VAL A 135 -9.500 -25.927 23.667 1.00 0.00 N ATOM 2028 CA VAL A 135 -10.296 -26.655 24.649 1.00 0.00 C ATOM 2029 C VAL A 135 -9.870 -26.296 26.071 1.00 0.00 C ATOM 2030 O VAL A 135 -10.612 -26.515 27.028 1.00 0.00 O ATOM 2031 CB VAL A 135 -10.180 -28.181 24.451 1.00 0.00 C ATOM 2032 CG1 VAL A 135 -8.780 -28.664 24.799 1.00 0.00 C ATOM 2033 CG2 VAL A 135 -11.227 -28.913 25.277 1.00 0.00 C ATOM 0 H VAL A 135 -8.586 -26.338 23.478 1.00 0.00 H new ATOM 0 HA VAL A 135 -11.335 -26.361 24.499 1.00 0.00 H new ATOM 0 HB VAL A 135 -10.363 -28.403 23.400 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -8.720 -29.742 24.652 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -8.054 -28.169 24.154 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -8.562 -28.427 25.840 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -11.127 -29.987 25.122 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -11.083 -28.684 26.333 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -12.222 -28.593 24.969 1.00 0.00 H new ATOM 2043 N ASN A 136 -8.670 -25.738 26.195 1.00 0.00 N ATOM 2044 CA ASN A 136 -8.141 -25.344 27.496 1.00 0.00 C ATOM 2045 C ASN A 136 -8.620 -23.948 27.879 1.00 0.00 C ATOM 2046 O ASN A 136 -8.160 -23.372 28.866 1.00 0.00 O ATOM 2047 CB ASN A 136 -6.610 -25.385 27.482 1.00 0.00 C ATOM 2048 CG ASN A 136 -6.011 -24.408 26.489 1.00 0.00 C ATOM 2049 OD1 ASN A 136 -6.702 -23.899 25.605 1.00 0.00 O ATOM 2050 ND2 ASN A 136 -4.718 -24.142 26.628 1.00 0.00 N ATOM 0 H ASN A 136 -8.046 -25.549 25.411 1.00 0.00 H new ATOM 0 HA ASN A 136 -8.510 -26.051 28.239 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -6.235 -25.159 28.480 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -6.279 -26.395 27.238 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -4.259 -23.493 25.988 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -4.183 -24.586 27.375 1.00 0.00 H new ATOM 2057 N SER A 137 -9.544 -23.407 27.091 1.00 0.00 N ATOM 2058 CA SER A 137 -10.085 -22.078 27.348 1.00 0.00 C ATOM 2059 C SER A 137 -11.194 -22.134 28.394 1.00 0.00 C ATOM 2060 O SER A 137 -12.373 -22.249 28.057 1.00 0.00 O ATOM 2061 CB SER A 137 -10.618 -21.463 26.052 1.00 0.00 C ATOM 2062 OG SER A 137 -9.835 -21.857 24.939 1.00 0.00 O ATOM 0 H SER A 137 -9.933 -23.869 26.269 1.00 0.00 H new ATOM 0 HA SER A 137 -9.280 -21.453 27.734 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.653 -21.770 25.899 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.617 -20.376 26.135 1.00 0.00 H new ATOM 0 HG SER A 137 -10.328 -22.518 24.410 1.00 0.00 H new ATOM 2068 N ALA A 138 -10.806 -22.058 29.663 1.00 0.00 N ATOM 2069 CA ALA A 138 -11.765 -22.098 30.760 1.00 0.00 C ATOM 2070 C ALA A 138 -12.639 -20.849 30.768 1.00 0.00 C ATOM 2071 O ALA A 138 -13.849 -20.926 30.978 1.00 0.00 O ATOM 2072 CB ALA A 138 -11.042 -22.248 32.090 1.00 0.00 C ATOM 0 H ALA A 138 -9.833 -21.968 29.957 1.00 0.00 H new ATOM 0 HA ALA A 138 -12.412 -22.963 30.613 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -11.771 -22.276 32.899 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -10.466 -23.173 32.088 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -10.370 -21.402 32.236 1.00 0.00 H new ATOM 2078 N THR A 139 -12.016 -19.698 30.535 1.00 0.00 N ATOM 2079 CA THR A 139 -12.734 -18.429 30.516 1.00 0.00 C ATOM 2080 C THR A 139 -13.047 -18.004 29.085 1.00 0.00 C ATOM 2081 O THR A 139 -12.177 -18.027 28.215 1.00 0.00 O ATOM 2082 CB THR A 139 -11.909 -17.344 31.212 1.00 0.00 C ATOM 2083 OG1 THR A 139 -10.576 -17.344 30.733 1.00 0.00 O ATOM 2084 CG2 THR A 139 -11.859 -17.504 32.716 1.00 0.00 C ATOM 0 H THR A 139 -11.015 -19.618 30.357 1.00 0.00 H new ATOM 0 HA THR A 139 -13.674 -18.562 31.051 1.00 0.00 H new ATOM 0 HB THR A 139 -12.411 -16.404 30.980 1.00 0.00 H new ATOM 0 HG1 THR A 139 -10.065 -16.643 31.188 1.00 0.00 H new ATOM 0 HG21 THR A 139 -11.259 -16.703 33.147 1.00 0.00 H new ATOM 0 HG22 THR A 139 -12.870 -17.458 33.121 1.00 0.00 H new ATOM 0 HG23 THR A 139 -11.412 -18.467 32.965 1.00 0.00 H new ATOM 2092 N GLY A 140 -14.297 -17.613 28.850 1.00 0.00 N ATOM 2093 CA GLY A 140 -14.705 -17.189 27.524 1.00 0.00 C ATOM 2094 C GLY A 140 -14.616 -15.686 27.343 1.00 0.00 C ATOM 2095 O GLY A 140 -13.673 -15.183 26.733 1.00 0.00 O ATOM 0 H GLY A 140 -15.034 -17.583 29.555 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -14.077 -17.679 26.780 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -15.729 -17.514 27.341 1.00 0.00 H new ATOM 2099 N VAL A 141 -15.602 -14.969 27.873 1.00 0.00 N ATOM 2100 CA VAL A 141 -15.634 -13.516 27.766 1.00 0.00 C ATOM 2101 C VAL A 141 -14.825 -12.864 28.887 1.00 0.00 C ATOM 2102 O VAL A 141 -15.209 -12.930 30.055 1.00 0.00 O ATOM 2103 CB VAL A 141 -17.078 -12.979 27.809 1.00 0.00 C ATOM 2104 CG1 VAL A 141 -17.119 -11.523 27.373 1.00 0.00 C ATOM 2105 CG2 VAL A 141 -17.992 -13.830 26.941 1.00 0.00 C ATOM 0 H VAL A 141 -16.390 -15.372 28.381 1.00 0.00 H new ATOM 0 HA VAL A 141 -15.190 -13.260 26.804 1.00 0.00 H new ATOM 0 HB VAL A 141 -17.437 -13.037 28.837 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -18.146 -11.161 27.410 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -16.500 -10.925 28.042 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -16.740 -11.437 26.354 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -19.007 -13.435 26.985 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -17.638 -13.809 25.910 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -17.987 -14.857 27.305 1.00 0.00 H new ATOM 2115 N PRO A 142 -13.690 -12.223 28.547 1.00 0.00 N ATOM 2116 CA PRO A 142 -12.829 -11.563 29.536 1.00 0.00 C ATOM 2117 C PRO A 142 -13.574 -10.500 30.337 1.00 0.00 C ATOM 2118 O PRO A 142 -13.245 -10.238 31.494 1.00 0.00 O ATOM 2119 CB PRO A 142 -11.729 -10.916 28.688 1.00 0.00 C ATOM 2120 CG PRO A 142 -11.731 -11.676 27.407 1.00 0.00 C ATOM 2121 CD PRO A 142 -13.154 -12.096 27.179 1.00 0.00 C ATOM 0 HA PRO A 142 -12.453 -12.269 30.276 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -11.932 -9.858 28.519 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -10.760 -10.980 29.183 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -11.370 -11.057 26.585 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -11.073 -12.543 27.466 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -13.704 -11.356 26.598 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -13.214 -13.038 26.634 1.00 0.00 H new ATOM 2129 N THR A 143 -14.578 -9.891 29.715 1.00 0.00 N ATOM 2130 CA THR A 143 -15.368 -8.854 30.371 1.00 0.00 C ATOM 2131 C THR A 143 -16.501 -9.467 31.188 1.00 0.00 C ATOM 2132 O THR A 143 -17.635 -8.988 31.145 1.00 0.00 O ATOM 2133 CB THR A 143 -15.937 -7.884 29.331 1.00 0.00 C ATOM 2134 OG1 THR A 143 -16.583 -8.591 28.286 1.00 0.00 O ATOM 2135 CG2 THR A 143 -14.887 -6.995 28.704 1.00 0.00 C ATOM 0 H THR A 143 -14.864 -10.097 28.758 1.00 0.00 H new ATOM 0 HA THR A 143 -14.713 -8.306 31.049 1.00 0.00 H new ATOM 0 HB THR A 143 -16.641 -7.256 29.877 1.00 0.00 H new ATOM 0 HG1 THR A 143 -16.941 -7.954 27.633 1.00 0.00 H new ATOM 0 HG21 THR A 143 -15.358 -6.333 27.977 1.00 0.00 H new ATOM 0 HG22 THR A 143 -14.405 -6.399 29.479 1.00 0.00 H new ATOM 0 HG23 THR A 143 -14.140 -7.611 28.203 1.00 0.00 H new ATOM 2143 N VAL A 144 -16.171 -10.515 31.947 1.00 0.00 N ATOM 2144 CA VAL A 144 -17.138 -11.223 32.793 1.00 0.00 C ATOM 2145 C VAL A 144 -18.529 -11.271 32.153 1.00 0.00 C ATOM 2146 O VAL A 144 -18.776 -12.203 31.358 1.00 0.00 O ATOM 2147 CB VAL A 144 -17.222 -10.606 34.212 1.00 0.00 C ATOM 2148 CG1 VAL A 144 -17.464 -9.104 34.153 1.00 0.00 C ATOM 2149 CG2 VAL A 144 -18.298 -11.296 35.039 1.00 0.00 C ATOM 2150 OXT VAL A 144 -19.359 -10.384 32.447 1.00 0.00 O ATOM 0 H VAL A 144 -15.226 -10.897 31.993 1.00 0.00 H new ATOM 0 HA VAL A 144 -16.773 -12.246 32.888 1.00 0.00 H new ATOM 0 HB VAL A 144 -16.260 -10.766 34.699 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -17.517 -8.704 35.166 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -16.646 -8.624 33.616 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -18.403 -8.907 33.635 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -18.339 -10.846 36.031 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -19.264 -11.180 34.548 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -18.062 -12.356 35.131 1.00 0.00 H new TER 2160 VAL A 144