USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1078 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 21 LYS NZ :NH3+ 135:sc= -0.163 (180deg=-1.32!) USER MOD Set 1.2: A 110 SER OG : rot 180:sc= -0.382 USER MOD Set 2.1: A 50 GLN : amide:sc= 1.04 K(o=0.46,f=-3.2!) USER MOD Set 2.2: A 74 SER OG : rot 180:sc= -0.597 USER MOD Set 2.3: A 87 HIS : no HE2:sc= 0.0142 K(o=0.46,f=-8.9!) USER MOD Single : A 1 GLY N :NH3+ -139:sc= 0.0467 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl 138:sc= -0.118 (180deg=-0.729) USER MOD Single : A 7 LYS NZ :NH3+ 159:sc= -0.0539 (180deg=-0.315) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= -0.475 K(o=-0.47,f=-1.3) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 LYS NZ :NH3+ -156:sc= 0.351 (180deg=-2.09) USER MOD Single : A 49 SER OG : rot 180:sc= -0.0872 USER MOD Single : A 52 GLN : amide:sc= -0.136 K(o=-0.14,f=-3.2!) USER MOD Single : A 67 THR OG1 : rot 123:sc= 0.0882 USER MOD Single : A 71 TYR OH : rot 15:sc= -0.0946 USER MOD Single : A 75 HIS :FLIP no HD1:sc= -0.226 F(o=-1.1,f=-0.23) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 80 SER OG : rot 44:sc= 0.0943 USER MOD Single : A 85 HIS : no HE2:sc= 0.767 K(o=0.77,f=-2.6!) USER MOD Single : A 90 HIS : +bothHN:sc= -2.45! C(o=-2.5!,f=-14!) USER MOD Single : A 95 HIS : no HD1:sc= -0.0021 X(o=-0.0021,f=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 101 HIS : no HE2:sc= 1.25 K(o=1.2,f=-5.2!) USER MOD Single : A 103 HIS : +bothHN:sc= -1.78! C(o=-1.8!,f=-13!) USER MOD Single : A 104 GLN : amide:sc= -0.164 K(o=-0.16,f=-0.74) USER MOD Single : A 109 CYS SG : rot 29:sc= -0.353 USER MOD Single : A 116 GLN : amide:sc= 0.0206 X(o=0.021,f=-0.39) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 MET CE :methyl -176:sc= -1.78 (180deg=-1.89) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -30.741 -5.566 -5.380 1.00 0.00 N ATOM 2 CA GLY A 1 -31.089 -6.929 -5.849 1.00 0.00 C ATOM 3 C GLY A 1 -31.118 -7.926 -4.710 1.00 0.00 C ATOM 4 O GLY A 1 -31.394 -7.552 -3.571 1.00 0.00 O ATOM 0 H1 GLY A 1 -31.337 -4.868 -5.869 1.00 0.00 H new ATOM 0 H2 GLY A 1 -30.901 -5.500 -4.354 1.00 0.00 H new ATOM 0 H3 GLY A 1 -29.740 -5.372 -5.588 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -32.063 -6.907 -6.338 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -30.364 -7.252 -6.596 1.00 0.00 H new ATOM 10 N PRO A 2 -30.839 -9.209 -4.990 1.00 0.00 N ATOM 11 CA PRO A 2 -30.808 -10.258 -3.966 1.00 0.00 C ATOM 12 C PRO A 2 -29.684 -10.040 -2.956 1.00 0.00 C ATOM 13 O PRO A 2 -28.698 -9.356 -3.246 1.00 0.00 O ATOM 14 CB PRO A 2 -30.566 -11.548 -4.766 1.00 0.00 C ATOM 15 CG PRO A 2 -30.879 -11.195 -6.181 1.00 0.00 C ATOM 16 CD PRO A 2 -30.536 -9.742 -6.326 1.00 0.00 C ATOM 0 HA PRO A 2 -31.726 -10.278 -3.379 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -29.535 -11.887 -4.664 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -31.205 -12.357 -4.411 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -30.299 -11.805 -6.874 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -31.931 -11.373 -6.405 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -29.489 -9.597 -6.593 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -31.132 -9.259 -7.100 1.00 0.00 H new ATOM 24 N LEU A 3 -29.826 -10.625 -1.771 1.00 0.00 N ATOM 25 CA LEU A 3 -28.843 -10.444 -0.712 1.00 0.00 C ATOM 26 C LEU A 3 -27.644 -11.368 -0.918 1.00 0.00 C ATOM 27 O LEU A 3 -27.523 -12.419 -0.280 1.00 0.00 O ATOM 28 CB LEU A 3 -29.474 -10.678 0.663 1.00 0.00 C ATOM 29 CG LEU A 3 -28.564 -10.375 1.856 1.00 0.00 C ATOM 30 CD1 LEU A 3 -28.143 -8.913 1.856 1.00 0.00 C ATOM 31 CD2 LEU A 3 -29.260 -10.727 3.160 1.00 0.00 C ATOM 0 H LEU A 3 -30.611 -11.227 -1.521 1.00 0.00 H new ATOM 0 HA LEU A 3 -28.490 -9.414 -0.754 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -30.370 -10.062 0.744 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -29.795 -11.718 0.726 1.00 0.00 H new ATOM 0 HG LEU A 3 -27.668 -10.989 1.765 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -27.497 -8.720 2.712 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -27.602 -8.690 0.936 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -29.028 -8.280 1.919 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -28.598 -10.505 3.997 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -30.174 -10.141 3.254 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -29.508 -11.788 3.165 1.00 0.00 H new ATOM 43 N GLY A 4 -26.780 -10.981 -1.841 1.00 0.00 N ATOM 44 CA GLY A 4 -25.568 -11.728 -2.099 1.00 0.00 C ATOM 45 C GLY A 4 -24.450 -10.816 -2.547 1.00 0.00 C ATOM 46 O GLY A 4 -23.850 -11.023 -3.602 1.00 0.00 O ATOM 0 H GLY A 4 -26.899 -10.152 -2.423 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -25.267 -12.261 -1.197 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -25.757 -12.480 -2.865 1.00 0.00 H new ATOM 50 N SER A 5 -24.167 -9.803 -1.740 1.00 0.00 N ATOM 51 CA SER A 5 -23.203 -8.781 -2.111 1.00 0.00 C ATOM 52 C SER A 5 -21.779 -9.234 -1.811 1.00 0.00 C ATOM 53 O SER A 5 -21.213 -8.911 -0.767 1.00 0.00 O ATOM 54 CB SER A 5 -23.508 -7.462 -1.390 1.00 0.00 C ATOM 55 OG SER A 5 -22.696 -6.404 -1.882 1.00 0.00 O ATOM 0 H SER A 5 -24.593 -9.668 -0.823 1.00 0.00 H new ATOM 0 HA SER A 5 -23.287 -8.617 -3.185 1.00 0.00 H new ATOM 0 HB2 SER A 5 -24.560 -7.208 -1.522 1.00 0.00 H new ATOM 0 HB3 SER A 5 -23.342 -7.583 -0.320 1.00 0.00 H new ATOM 0 HG SER A 5 -22.913 -5.576 -1.405 1.00 0.00 H new ATOM 61 N MET A 6 -21.219 -10.017 -2.720 1.00 0.00 N ATOM 62 CA MET A 6 -19.815 -10.380 -2.653 1.00 0.00 C ATOM 63 C MET A 6 -19.019 -9.428 -3.527 1.00 0.00 C ATOM 64 O MET A 6 -18.266 -9.839 -4.410 1.00 0.00 O ATOM 65 CB MET A 6 -19.591 -11.825 -3.101 1.00 0.00 C ATOM 66 CG MET A 6 -20.234 -12.859 -2.192 1.00 0.00 C ATOM 67 SD MET A 6 -19.914 -14.550 -2.732 1.00 0.00 S ATOM 68 CE MET A 6 -18.130 -14.624 -2.574 1.00 0.00 C ATOM 0 H MET A 6 -21.719 -10.414 -3.515 1.00 0.00 H new ATOM 0 HA MET A 6 -19.480 -10.304 -1.619 1.00 0.00 H new ATOM 0 HB2 MET A 6 -19.985 -11.947 -4.110 1.00 0.00 H new ATOM 0 HB3 MET A 6 -18.519 -12.017 -3.152 1.00 0.00 H new ATOM 0 HG2 MET A 6 -19.859 -12.728 -1.177 1.00 0.00 H new ATOM 0 HG3 MET A 6 -21.310 -12.689 -2.159 1.00 0.00 H new ATOM 0 HE1 MET A 6 -17.843 -15.581 -2.140 1.00 0.00 H new ATOM 0 HE2 MET A 6 -17.673 -14.520 -3.558 1.00 0.00 H new ATOM 0 HE3 MET A 6 -17.788 -13.815 -1.928 1.00 0.00 H new ATOM 78 N LYS A 7 -19.225 -8.144 -3.282 1.00 0.00 N ATOM 79 CA LYS A 7 -18.554 -7.100 -4.033 1.00 0.00 C ATOM 80 C LYS A 7 -17.065 -7.093 -3.746 1.00 0.00 C ATOM 81 O LYS A 7 -16.616 -7.586 -2.706 1.00 0.00 O ATOM 82 CB LYS A 7 -19.140 -5.734 -3.687 1.00 0.00 C ATOM 83 CG LYS A 7 -20.240 -5.273 -4.625 1.00 0.00 C ATOM 84 CD LYS A 7 -19.725 -5.134 -6.049 1.00 0.00 C ATOM 85 CE LYS A 7 -20.557 -4.152 -6.856 1.00 0.00 C ATOM 86 NZ LYS A 7 -20.384 -2.753 -6.377 1.00 0.00 N ATOM 0 H LYS A 7 -19.859 -7.799 -2.561 1.00 0.00 H new ATOM 0 HA LYS A 7 -18.708 -7.304 -5.093 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -19.534 -5.767 -2.671 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -18.339 -4.995 -3.694 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -21.064 -5.986 -4.601 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -20.636 -4.317 -4.283 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -18.687 -4.801 -6.029 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -19.738 -6.109 -6.537 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -20.274 -4.214 -7.907 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -21.609 -4.430 -6.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -20.659 -2.091 -7.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -20.984 -2.595 -5.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -19.388 -2.594 -6.123 1.00 0.00 H new ATOM 100 N MET A 8 -16.304 -6.528 -4.666 1.00 0.00 N ATOM 101 CA MET A 8 -14.881 -6.385 -4.471 1.00 0.00 C ATOM 102 C MET A 8 -14.574 -5.010 -3.915 1.00 0.00 C ATOM 103 O MET A 8 -15.106 -3.999 -4.377 1.00 0.00 O ATOM 104 CB MET A 8 -14.106 -6.623 -5.771 1.00 0.00 C ATOM 105 CG MET A 8 -13.959 -8.092 -6.131 1.00 0.00 C ATOM 106 SD MET A 8 -12.887 -8.348 -7.560 1.00 0.00 S ATOM 107 CE MET A 8 -12.926 -10.134 -7.693 1.00 0.00 C ATOM 0 H MET A 8 -16.651 -6.163 -5.553 1.00 0.00 H new ATOM 0 HA MET A 8 -14.559 -7.143 -3.756 1.00 0.00 H new ATOM 0 HB2 MET A 8 -14.613 -6.107 -6.586 1.00 0.00 H new ATOM 0 HB3 MET A 8 -13.115 -6.179 -5.680 1.00 0.00 H new ATOM 0 HG2 MET A 8 -13.555 -8.634 -5.276 1.00 0.00 H new ATOM 0 HG3 MET A 8 -14.943 -8.512 -6.339 1.00 0.00 H new ATOM 0 HE1 MET A 8 -12.308 -10.450 -8.534 1.00 0.00 H new ATOM 0 HE2 MET A 8 -12.541 -10.576 -6.774 1.00 0.00 H new ATOM 0 HE3 MET A 8 -13.952 -10.465 -7.852 1.00 0.00 H new ATOM 117 N ILE A 9 -13.730 -4.993 -2.909 1.00 0.00 N ATOM 118 CA ILE A 9 -13.282 -3.769 -2.293 1.00 0.00 C ATOM 119 C ILE A 9 -11.868 -3.515 -2.753 1.00 0.00 C ATOM 120 O ILE A 9 -10.953 -4.240 -2.390 1.00 0.00 O ATOM 121 CB ILE A 9 -13.312 -3.875 -0.757 1.00 0.00 C ATOM 122 CG1 ILE A 9 -14.744 -4.104 -0.269 1.00 0.00 C ATOM 123 CG2 ILE A 9 -12.701 -2.647 -0.090 1.00 0.00 C ATOM 124 CD1 ILE A 9 -14.896 -3.995 1.232 1.00 0.00 C ATOM 0 H ILE A 9 -13.333 -5.836 -2.493 1.00 0.00 H new ATOM 0 HA ILE A 9 -13.944 -2.952 -2.582 1.00 0.00 H new ATOM 0 HB ILE A 9 -12.702 -4.732 -0.472 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.402 -3.378 -0.746 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.074 -5.092 -0.589 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -12.742 -2.763 0.993 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.663 -2.541 -0.404 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -13.261 -1.758 -0.381 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -15.937 -4.169 1.506 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -14.264 -4.739 1.717 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -14.597 -2.998 1.557 1.00 0.00 H new ATOM 136 N GLU A 10 -11.681 -2.512 -3.563 1.00 0.00 N ATOM 137 CA GLU A 10 -10.383 -2.285 -4.152 1.00 0.00 C ATOM 138 C GLU A 10 -9.621 -1.280 -3.322 1.00 0.00 C ATOM 139 O GLU A 10 -10.112 -0.188 -3.047 1.00 0.00 O ATOM 140 CB GLU A 10 -10.506 -1.816 -5.601 1.00 0.00 C ATOM 141 CG GLU A 10 -11.199 -2.826 -6.497 1.00 0.00 C ATOM 142 CD GLU A 10 -10.868 -2.623 -7.955 1.00 0.00 C ATOM 143 OE1 GLU A 10 -9.797 -3.104 -8.390 1.00 0.00 O ATOM 144 OE2 GLU A 10 -11.670 -1.995 -8.674 1.00 0.00 O ATOM 0 H GLU A 10 -12.401 -1.841 -3.832 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.834 -3.227 -4.163 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.059 -0.877 -5.627 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.511 -1.611 -5.996 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -10.908 -3.833 -6.198 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.278 -2.751 -6.358 1.00 0.00 H new ATOM 151 N VAL A 11 -8.434 -1.663 -2.901 1.00 0.00 N ATOM 152 CA VAL A 11 -7.610 -0.815 -2.076 1.00 0.00 C ATOM 153 C VAL A 11 -6.236 -0.706 -2.706 1.00 0.00 C ATOM 154 O VAL A 11 -5.592 -1.714 -3.005 1.00 0.00 O ATOM 155 CB VAL A 11 -7.475 -1.365 -0.637 1.00 0.00 C ATOM 156 CG1 VAL A 11 -6.570 -0.474 0.203 1.00 0.00 C ATOM 157 CG2 VAL A 11 -8.840 -1.503 0.021 1.00 0.00 C ATOM 0 H VAL A 11 -8.017 -2.568 -3.122 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.084 0.164 -2.012 1.00 0.00 H new ATOM 0 HB VAL A 11 -7.021 -2.354 -0.699 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -6.491 -0.882 1.211 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -5.579 -0.432 -0.250 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -6.991 0.530 0.250 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -8.719 -1.892 1.032 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -9.324 -0.527 0.063 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.456 -2.189 -0.560 1.00 0.00 H new ATOM 167 N VAL A 12 -5.799 0.506 -2.931 1.00 0.00 N ATOM 168 CA VAL A 12 -4.499 0.730 -3.512 1.00 0.00 C ATOM 169 C VAL A 12 -3.502 1.052 -2.418 1.00 0.00 C ATOM 170 O VAL A 12 -3.761 1.897 -1.558 1.00 0.00 O ATOM 171 CB VAL A 12 -4.531 1.854 -4.565 1.00 0.00 C ATOM 172 CG1 VAL A 12 -5.084 1.335 -5.882 1.00 0.00 C ATOM 173 CG2 VAL A 12 -5.355 3.039 -4.072 1.00 0.00 C ATOM 0 H VAL A 12 -6.324 1.355 -2.721 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.192 -0.182 -4.024 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.508 2.195 -4.727 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.099 2.143 -6.614 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -4.452 0.526 -6.248 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.098 0.964 -5.730 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -5.362 3.819 -4.833 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -6.377 2.715 -3.875 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -4.916 3.431 -3.155 1.00 0.00 H new ATOM 183 N ALA A 13 -2.374 0.366 -2.433 1.00 0.00 N ATOM 184 CA ALA A 13 -1.386 0.525 -1.394 1.00 0.00 C ATOM 185 C ALA A 13 -0.177 1.241 -1.950 1.00 0.00 C ATOM 186 O ALA A 13 0.412 0.814 -2.944 1.00 0.00 O ATOM 187 CB ALA A 13 -0.992 -0.830 -0.819 1.00 0.00 C ATOM 0 H ALA A 13 -2.123 -0.307 -3.157 1.00 0.00 H new ATOM 0 HA ALA A 13 -1.810 1.122 -0.587 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.246 -0.690 -0.037 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -1.872 -1.317 -0.398 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.576 -1.454 -1.610 1.00 0.00 H new ATOM 193 N ALA A 14 0.189 2.326 -1.306 1.00 0.00 N ATOM 194 CA ALA A 14 1.294 3.139 -1.754 1.00 0.00 C ATOM 195 C ALA A 14 2.526 2.846 -0.936 1.00 0.00 C ATOM 196 O ALA A 14 2.585 3.133 0.261 1.00 0.00 O ATOM 197 CB ALA A 14 0.942 4.608 -1.654 1.00 0.00 C ATOM 0 H ALA A 14 -0.269 2.668 -0.461 1.00 0.00 H new ATOM 0 HA ALA A 14 1.499 2.898 -2.797 1.00 0.00 H new ATOM 0 HB1 ALA A 14 1.785 5.208 -1.995 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.072 4.817 -2.277 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.715 4.858 -0.618 1.00 0.00 H new ATOM 203 N ILE A 15 3.509 2.272 -1.589 1.00 0.00 N ATOM 204 CA ILE A 15 4.758 1.972 -0.951 1.00 0.00 C ATOM 205 C ILE A 15 5.689 3.146 -1.146 1.00 0.00 C ATOM 206 O ILE A 15 6.271 3.323 -2.224 1.00 0.00 O ATOM 207 CB ILE A 15 5.390 0.688 -1.533 1.00 0.00 C ATOM 208 CG1 ILE A 15 4.519 -0.523 -1.189 1.00 0.00 C ATOM 209 CG2 ILE A 15 6.815 0.495 -1.039 1.00 0.00 C ATOM 210 CD1 ILE A 15 5.227 -1.854 -1.337 1.00 0.00 C ATOM 0 H ILE A 15 3.461 2.003 -2.572 1.00 0.00 H new ATOM 0 HA ILE A 15 4.585 1.799 0.111 1.00 0.00 H new ATOM 0 HB ILE A 15 5.438 0.790 -2.617 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.166 -0.423 -0.163 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.638 -0.518 -1.831 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.228 -0.418 -1.468 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.424 1.347 -1.342 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.816 0.417 0.048 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.543 -2.661 -1.075 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.557 -1.978 -2.369 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.092 -1.882 -0.674 1.00 0.00 H new ATOM 222 N ILE A 16 5.804 3.977 -0.123 1.00 0.00 N ATOM 223 CA ILE A 16 6.652 5.142 -0.197 1.00 0.00 C ATOM 224 C ILE A 16 8.063 4.717 0.143 1.00 0.00 C ATOM 225 O ILE A 16 8.386 4.515 1.306 1.00 0.00 O ATOM 226 CB ILE A 16 6.206 6.235 0.801 1.00 0.00 C ATOM 227 CG1 ILE A 16 4.675 6.292 0.907 1.00 0.00 C ATOM 228 CG2 ILE A 16 6.762 7.594 0.389 1.00 0.00 C ATOM 229 CD1 ILE A 16 3.993 7.006 -0.234 1.00 0.00 C ATOM 0 H ILE A 16 5.318 3.861 0.766 1.00 0.00 H new ATOM 0 HA ILE A 16 6.590 5.558 -1.203 1.00 0.00 H new ATOM 0 HB ILE A 16 6.605 5.979 1.783 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.290 5.274 0.964 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.407 6.787 1.840 1.00 0.00 H new ATOM 0 HG21 ILE A 16 6.438 8.351 1.103 1.00 0.00 H new ATOM 0 HG22 ILE A 16 7.851 7.552 0.374 1.00 0.00 H new ATOM 0 HG23 ILE A 16 6.395 7.851 -0.605 1.00 0.00 H new ATOM 0 HD11 ILE A 16 2.915 6.998 -0.076 1.00 0.00 H new ATOM 0 HD12 ILE A 16 4.345 8.037 -0.281 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.226 6.500 -1.171 1.00 0.00 H new ATOM 241 N GLU A 17 8.888 4.551 -0.865 1.00 0.00 N ATOM 242 CA GLU A 17 10.234 4.072 -0.644 1.00 0.00 C ATOM 243 C GLU A 17 11.224 5.109 -1.127 1.00 0.00 C ATOM 244 O GLU A 17 11.209 5.509 -2.294 1.00 0.00 O ATOM 245 CB GLU A 17 10.444 2.718 -1.335 1.00 0.00 C ATOM 246 CG GLU A 17 11.809 2.079 -1.094 1.00 0.00 C ATOM 247 CD GLU A 17 12.895 2.641 -1.991 1.00 0.00 C ATOM 248 OE1 GLU A 17 12.741 2.555 -3.230 1.00 0.00 O ATOM 249 OE2 GLU A 17 13.906 3.148 -1.469 1.00 0.00 O ATOM 0 H GLU A 17 8.654 4.739 -1.840 1.00 0.00 H new ATOM 0 HA GLU A 17 10.396 3.917 0.423 1.00 0.00 H new ATOM 0 HB2 GLU A 17 9.671 2.029 -0.994 1.00 0.00 H new ATOM 0 HB3 GLU A 17 10.304 2.849 -2.408 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.094 2.227 -0.052 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.734 1.004 -1.255 1.00 0.00 H new ATOM 256 N ARG A 18 12.050 5.556 -0.209 1.00 0.00 N ATOM 257 CA ARG A 18 13.071 6.537 -0.501 1.00 0.00 C ATOM 258 C ARG A 18 14.261 6.275 0.407 1.00 0.00 C ATOM 259 O ARG A 18 14.080 5.955 1.584 1.00 0.00 O ATOM 260 CB ARG A 18 12.532 7.955 -0.274 1.00 0.00 C ATOM 261 CG ARG A 18 13.106 8.996 -1.224 1.00 0.00 C ATOM 262 CD ARG A 18 12.511 8.867 -2.622 1.00 0.00 C ATOM 263 NE ARG A 18 13.049 9.865 -3.546 1.00 0.00 N ATOM 264 CZ ARG A 18 12.499 10.156 -4.724 1.00 0.00 C ATOM 265 NH1 ARG A 18 11.420 9.500 -5.137 1.00 0.00 N ATOM 266 NH2 ARG A 18 13.034 11.090 -5.496 1.00 0.00 N ATOM 0 H ARG A 18 12.033 5.249 0.764 1.00 0.00 H new ATOM 0 HA ARG A 18 13.374 6.456 -1.545 1.00 0.00 H new ATOM 0 HB2 ARG A 18 11.447 7.941 -0.379 1.00 0.00 H new ATOM 0 HB3 ARG A 18 12.749 8.255 0.751 1.00 0.00 H new ATOM 0 HG2 ARG A 18 12.908 9.994 -0.834 1.00 0.00 H new ATOM 0 HG3 ARG A 18 14.189 8.884 -1.277 1.00 0.00 H new ATOM 0 HD2 ARG A 18 12.713 7.869 -3.010 1.00 0.00 H new ATOM 0 HD3 ARG A 18 11.428 8.974 -2.565 1.00 0.00 H new ATOM 0 HE ARG A 18 13.894 10.367 -3.273 1.00 0.00 H new ATOM 0 HH11 ARG A 18 11.011 8.772 -4.552 1.00 0.00 H new ATOM 0 HH12 ARG A 18 11.001 9.725 -6.039 1.00 0.00 H new ATOM 0 HH21 ARG A 18 13.869 11.589 -5.189 1.00 0.00 H new ATOM 0 HH22 ARG A 18 12.611 11.311 -6.397 1.00 0.00 H new ATOM 280 N ASP A 19 15.466 6.359 -0.153 1.00 0.00 N ATOM 281 CA ASP A 19 16.699 6.152 0.612 1.00 0.00 C ATOM 282 C ASP A 19 16.822 4.706 1.080 1.00 0.00 C ATOM 283 O ASP A 19 17.604 4.397 1.980 1.00 0.00 O ATOM 284 CB ASP A 19 16.764 7.100 1.819 1.00 0.00 C ATOM 285 CG ASP A 19 17.033 8.536 1.426 1.00 0.00 C ATOM 286 OD1 ASP A 19 16.246 9.106 0.641 1.00 0.00 O ATOM 287 OD2 ASP A 19 18.045 9.103 1.886 1.00 0.00 O ATOM 0 H ASP A 19 15.618 6.570 -1.139 1.00 0.00 H new ATOM 0 HA ASP A 19 17.535 6.373 -0.052 1.00 0.00 H new ATOM 0 HB2 ASP A 19 15.823 7.049 2.366 1.00 0.00 H new ATOM 0 HB3 ASP A 19 17.546 6.762 2.498 1.00 0.00 H new ATOM 292 N GLY A 20 16.054 3.821 0.459 1.00 0.00 N ATOM 293 CA GLY A 20 16.113 2.418 0.800 1.00 0.00 C ATOM 294 C GLY A 20 15.202 2.062 1.957 1.00 0.00 C ATOM 295 O GLY A 20 15.307 0.972 2.519 1.00 0.00 O ATOM 0 H GLY A 20 15.389 4.054 -0.278 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.837 1.824 -0.071 1.00 0.00 H new ATOM 0 HA3 GLY A 20 17.139 2.152 1.055 1.00 0.00 H new ATOM 299 N LYS A 21 14.331 2.984 2.345 1.00 0.00 N ATOM 300 CA LYS A 21 13.362 2.709 3.399 1.00 0.00 C ATOM 301 C LYS A 21 11.946 2.845 2.864 1.00 0.00 C ATOM 302 O LYS A 21 11.692 3.637 1.957 1.00 0.00 O ATOM 303 CB LYS A 21 13.531 3.666 4.582 1.00 0.00 C ATOM 304 CG LYS A 21 14.967 4.003 4.933 1.00 0.00 C ATOM 305 CD LYS A 21 15.406 3.327 6.217 1.00 0.00 C ATOM 306 CE LYS A 21 15.944 1.936 5.951 1.00 0.00 C ATOM 307 NZ LYS A 21 17.069 1.945 4.975 1.00 0.00 N ATOM 0 H LYS A 21 14.275 3.923 1.949 1.00 0.00 H new ATOM 0 HA LYS A 21 13.539 1.689 3.740 1.00 0.00 H new ATOM 0 HB2 LYS A 21 13.000 4.592 4.360 1.00 0.00 H new ATOM 0 HB3 LYS A 21 13.052 3.226 5.457 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.622 3.696 4.118 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.072 5.083 5.036 1.00 0.00 H new ATOM 0 HD2 LYS A 21 16.173 3.929 6.703 1.00 0.00 H new ATOM 0 HD3 LYS A 21 14.563 3.268 6.906 1.00 0.00 H new ATOM 0 HE2 LYS A 21 16.282 1.494 6.888 1.00 0.00 H new ATOM 0 HE3 LYS A 21 15.141 1.304 5.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 17.835 1.333 5.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 16.734 1.593 4.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 17.425 2.916 4.865 1.00 0.00 H new ATOM 321 N ILE A 22 11.034 2.075 3.431 1.00 0.00 N ATOM 322 CA ILE A 22 9.631 2.137 3.069 1.00 0.00 C ATOM 323 C ILE A 22 8.831 2.800 4.184 1.00 0.00 C ATOM 324 O ILE A 22 9.084 2.567 5.368 1.00 0.00 O ATOM 325 CB ILE A 22 9.051 0.734 2.797 1.00 0.00 C ATOM 326 CG1 ILE A 22 9.936 -0.031 1.820 1.00 0.00 C ATOM 327 CG2 ILE A 22 7.636 0.844 2.246 1.00 0.00 C ATOM 328 CD1 ILE A 22 9.464 -1.441 1.569 1.00 0.00 C ATOM 0 H ILE A 22 11.246 1.389 4.156 1.00 0.00 H new ATOM 0 HA ILE A 22 9.555 2.725 2.154 1.00 0.00 H new ATOM 0 HB ILE A 22 9.020 0.187 3.739 1.00 0.00 H new ATOM 0 HG12 ILE A 22 9.971 0.508 0.873 1.00 0.00 H new ATOM 0 HG13 ILE A 22 10.954 -0.059 2.208 1.00 0.00 H new ATOM 0 HG21 ILE A 22 7.240 -0.154 2.059 1.00 0.00 H new ATOM 0 HG22 ILE A 22 7.002 1.356 2.970 1.00 0.00 H new ATOM 0 HG23 ILE A 22 7.651 1.409 1.314 1.00 0.00 H new ATOM 0 HD11 ILE A 22 10.137 -1.930 0.865 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.456 -1.995 2.508 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.457 -1.419 1.152 1.00 0.00 H new ATOM 340 N LEU A 23 7.884 3.632 3.792 1.00 0.00 N ATOM 341 CA LEU A 23 7.033 4.347 4.728 1.00 0.00 C ATOM 342 C LEU A 23 5.948 3.435 5.299 1.00 0.00 C ATOM 343 O LEU A 23 5.071 2.959 4.575 1.00 0.00 O ATOM 344 CB LEU A 23 6.393 5.543 4.015 1.00 0.00 C ATOM 345 CG LEU A 23 5.574 6.493 4.892 1.00 0.00 C ATOM 346 CD1 LEU A 23 6.468 7.172 5.914 1.00 0.00 C ATOM 347 CD2 LEU A 23 4.867 7.533 4.032 1.00 0.00 C ATOM 0 H LEU A 23 7.682 3.832 2.813 1.00 0.00 H new ATOM 0 HA LEU A 23 7.646 4.696 5.559 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.184 6.118 3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.746 5.164 3.223 1.00 0.00 H new ATOM 0 HG LEU A 23 4.820 5.911 5.422 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.871 7.844 6.530 1.00 0.00 H new ATOM 0 HD12 LEU A 23 6.935 6.418 6.548 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.241 7.742 5.399 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.289 8.201 4.670 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.607 8.111 3.478 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.199 7.032 3.331 1.00 0.00 H new ATOM 359 N LEU A 24 6.023 3.199 6.600 1.00 0.00 N ATOM 360 CA LEU A 24 4.986 2.455 7.303 1.00 0.00 C ATOM 361 C LEU A 24 4.203 3.389 8.207 1.00 0.00 C ATOM 362 O LEU A 24 4.784 4.232 8.893 1.00 0.00 O ATOM 363 CB LEU A 24 5.557 1.294 8.123 1.00 0.00 C ATOM 364 CG LEU A 24 6.040 0.091 7.313 1.00 0.00 C ATOM 365 CD1 LEU A 24 6.404 -1.064 8.232 1.00 0.00 C ATOM 366 CD2 LEU A 24 4.994 -0.338 6.295 1.00 0.00 C ATOM 0 H LEU A 24 6.792 3.512 7.192 1.00 0.00 H new ATOM 0 HA LEU A 24 4.325 2.027 6.549 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.390 1.668 8.718 1.00 0.00 H new ATOM 0 HB3 LEU A 24 4.793 0.956 8.822 1.00 0.00 H new ATOM 0 HG LEU A 24 6.935 0.390 6.768 1.00 0.00 H new ATOM 0 HD11 LEU A 24 6.745 -1.910 7.635 1.00 0.00 H new ATOM 0 HD12 LEU A 24 7.199 -0.753 8.909 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.529 -1.358 8.811 1.00 0.00 H new ATOM 0 HD21 LEU A 24 5.364 -1.196 5.733 1.00 0.00 H new ATOM 0 HD22 LEU A 24 4.074 -0.612 6.812 1.00 0.00 H new ATOM 0 HD23 LEU A 24 4.794 0.486 5.610 1.00 0.00 H new ATOM 378 N ALA A 25 2.888 3.243 8.196 1.00 0.00 N ATOM 379 CA ALA A 25 2.018 4.104 8.981 1.00 0.00 C ATOM 380 C ALA A 25 1.234 3.296 10.011 1.00 0.00 C ATOM 381 O ALA A 25 0.489 2.381 9.659 1.00 0.00 O ATOM 382 CB ALA A 25 1.081 4.861 8.058 1.00 0.00 C ATOM 0 H ALA A 25 2.398 2.534 7.650 1.00 0.00 H new ATOM 0 HA ALA A 25 2.632 4.821 9.526 1.00 0.00 H new ATOM 0 HB1 ALA A 25 0.430 5.505 8.649 1.00 0.00 H new ATOM 0 HB2 ALA A 25 1.664 5.470 7.367 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.475 4.152 7.494 1.00 0.00 H new ATOM 388 N GLN A 26 1.421 3.630 11.284 1.00 0.00 N ATOM 389 CA GLN A 26 0.767 2.911 12.375 1.00 0.00 C ATOM 390 C GLN A 26 -0.716 3.260 12.439 1.00 0.00 C ATOM 391 O GLN A 26 -1.087 4.360 12.851 1.00 0.00 O ATOM 392 CB GLN A 26 1.447 3.227 13.716 1.00 0.00 C ATOM 393 CG GLN A 26 1.236 2.169 14.806 1.00 0.00 C ATOM 394 CD GLN A 26 -0.200 2.069 15.296 1.00 0.00 C ATOM 395 OE1 GLN A 26 -0.607 2.770 16.218 1.00 0.00 O ATOM 396 NE2 GLN A 26 -0.967 1.164 14.708 1.00 0.00 N ATOM 0 H GLN A 26 2.022 4.396 11.587 1.00 0.00 H new ATOM 0 HA GLN A 26 0.862 1.843 12.181 1.00 0.00 H new ATOM 0 HB2 GLN A 26 2.517 3.346 13.546 1.00 0.00 H new ATOM 0 HB3 GLN A 26 1.074 4.184 14.081 1.00 0.00 H new ATOM 0 HG2 GLN A 26 1.547 1.198 14.421 1.00 0.00 H new ATOM 0 HG3 GLN A 26 1.883 2.399 15.652 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -0.595 0.599 13.944 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -1.930 1.032 15.019 1.00 0.00 H new ATOM 405 N ARG A 27 -1.537 2.310 11.999 1.00 0.00 N ATOM 406 CA ARG A 27 -2.996 2.381 12.075 1.00 0.00 C ATOM 407 C ARG A 27 -3.545 1.272 11.197 1.00 0.00 C ATOM 408 O ARG A 27 -3.536 1.402 9.983 1.00 0.00 O ATOM 409 CB ARG A 27 -3.528 3.744 11.596 1.00 0.00 C ATOM 410 CG ARG A 27 -4.973 4.054 11.978 1.00 0.00 C ATOM 411 CD ARG A 27 -5.986 3.309 11.123 1.00 0.00 C ATOM 412 NE ARG A 27 -7.339 3.842 11.297 1.00 0.00 N ATOM 413 CZ ARG A 27 -8.459 3.179 10.994 1.00 0.00 C ATOM 414 NH1 ARG A 27 -8.409 1.923 10.575 1.00 0.00 N ATOM 415 NH2 ARG A 27 -9.633 3.775 11.127 1.00 0.00 N ATOM 0 H ARG A 27 -1.200 1.449 11.569 1.00 0.00 H new ATOM 0 HA ARG A 27 -3.315 2.265 13.111 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -2.887 4.528 12.000 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.440 3.788 10.511 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -5.130 3.796 13.025 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -5.146 5.126 11.885 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -5.699 3.380 10.074 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -5.975 2.251 11.385 1.00 0.00 H new ATOM 0 HE ARG A 27 -7.433 4.784 11.676 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -7.509 1.452 10.481 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -9.270 1.427 10.347 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -9.681 4.738 11.460 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -10.490 3.271 10.896 1.00 0.00 H new ATOM 429 N PRO A 28 -4.016 0.171 11.788 1.00 0.00 N ATOM 430 CA PRO A 28 -4.416 -1.001 11.031 1.00 0.00 C ATOM 431 C PRO A 28 -5.861 -0.904 10.571 1.00 0.00 C ATOM 432 O PRO A 28 -6.405 0.191 10.424 1.00 0.00 O ATOM 433 CB PRO A 28 -4.228 -2.114 12.054 1.00 0.00 C ATOM 434 CG PRO A 28 -4.598 -1.484 13.348 1.00 0.00 C ATOM 435 CD PRO A 28 -4.258 -0.016 13.228 1.00 0.00 C ATOM 0 HA PRO A 28 -3.847 -1.146 10.113 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -4.864 -2.971 11.832 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -3.199 -2.475 12.066 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -5.659 -1.620 13.555 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -4.051 -1.942 14.172 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -5.074 0.614 13.582 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -3.378 0.241 13.818 1.00 0.00 H new ATOM 443 N ALA A 29 -6.489 -2.046 10.375 1.00 0.00 N ATOM 444 CA ALA A 29 -7.835 -2.079 9.840 1.00 0.00 C ATOM 445 C ALA A 29 -8.882 -2.025 10.947 1.00 0.00 C ATOM 446 O ALA A 29 -9.404 -0.959 11.270 1.00 0.00 O ATOM 447 CB ALA A 29 -8.025 -3.316 8.981 1.00 0.00 C ATOM 0 H ALA A 29 -6.089 -2.962 10.578 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.972 -1.193 9.220 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.040 -3.331 8.584 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.313 -3.299 8.156 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -7.859 -4.208 9.585 1.00 0.00 H new ATOM 453 N GLN A 30 -9.173 -3.177 11.539 1.00 0.00 N ATOM 454 CA GLN A 30 -10.225 -3.280 12.544 1.00 0.00 C ATOM 455 C GLN A 30 -9.644 -3.672 13.899 1.00 0.00 C ATOM 456 O GLN A 30 -10.360 -4.128 14.786 1.00 0.00 O ATOM 457 CB GLN A 30 -11.272 -4.310 12.108 1.00 0.00 C ATOM 458 CG GLN A 30 -11.857 -4.039 10.731 1.00 0.00 C ATOM 459 CD GLN A 30 -12.966 -5.006 10.368 1.00 0.00 C ATOM 460 OE1 GLN A 30 -14.138 -4.747 10.638 1.00 0.00 O ATOM 461 NE2 GLN A 30 -12.606 -6.126 9.760 1.00 0.00 N ATOM 0 H GLN A 30 -8.694 -4.055 11.340 1.00 0.00 H new ATOM 0 HA GLN A 30 -10.701 -2.304 12.641 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -10.818 -5.301 12.112 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -12.080 -4.327 12.840 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -12.243 -3.020 10.699 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -11.065 -4.104 9.985 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -11.622 -6.301 9.555 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -13.312 -6.813 9.497 1.00 0.00 H new ATOM 470 N SER A 31 -8.344 -3.488 14.052 1.00 0.00 N ATOM 471 CA SER A 31 -7.648 -3.936 15.244 1.00 0.00 C ATOM 472 C SER A 31 -7.490 -2.805 16.259 1.00 0.00 C ATOM 473 O SER A 31 -6.680 -1.896 16.068 1.00 0.00 O ATOM 474 CB SER A 31 -6.281 -4.495 14.855 1.00 0.00 C ATOM 475 OG SER A 31 -6.417 -5.533 13.900 1.00 0.00 O ATOM 0 H SER A 31 -7.748 -3.030 13.363 1.00 0.00 H new ATOM 0 HA SER A 31 -8.242 -4.718 15.716 1.00 0.00 H new ATOM 0 HB2 SER A 31 -5.660 -3.698 14.447 1.00 0.00 H new ATOM 0 HB3 SER A 31 -5.772 -4.874 15.741 1.00 0.00 H new ATOM 0 HG SER A 31 -5.531 -5.877 13.662 1.00 0.00 H new ATOM 481 N ASP A 32 -8.248 -2.882 17.349 1.00 0.00 N ATOM 482 CA ASP A 32 -8.182 -1.877 18.415 1.00 0.00 C ATOM 483 C ASP A 32 -6.895 -2.013 19.218 1.00 0.00 C ATOM 484 O ASP A 32 -6.651 -1.260 20.158 1.00 0.00 O ATOM 485 CB ASP A 32 -9.375 -2.013 19.366 1.00 0.00 C ATOM 486 CG ASP A 32 -10.707 -1.779 18.688 1.00 0.00 C ATOM 487 OD1 ASP A 32 -11.061 -0.604 18.446 1.00 0.00 O ATOM 488 OD2 ASP A 32 -11.414 -2.770 18.407 1.00 0.00 O ATOM 0 H ASP A 32 -8.918 -3.631 17.521 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.206 -0.898 17.937 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -9.369 -3.010 19.806 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.262 -1.303 20.185 1.00 0.00 H new ATOM 493 N GLN A 33 -6.074 -2.976 18.836 1.00 0.00 N ATOM 494 CA GLN A 33 -4.853 -3.276 19.563 1.00 0.00 C ATOM 495 C GLN A 33 -3.766 -2.268 19.237 1.00 0.00 C ATOM 496 O GLN A 33 -2.865 -2.034 20.041 1.00 0.00 O ATOM 497 CB GLN A 33 -4.374 -4.684 19.222 1.00 0.00 C ATOM 498 CG GLN A 33 -5.503 -5.697 19.129 1.00 0.00 C ATOM 499 CD GLN A 33 -4.997 -7.113 18.961 1.00 0.00 C ATOM 500 OE1 GLN A 33 -4.787 -7.826 19.938 1.00 0.00 O ATOM 501 NE2 GLN A 33 -4.788 -7.525 17.720 1.00 0.00 N ATOM 0 H GLN A 33 -6.233 -3.567 18.020 1.00 0.00 H new ATOM 0 HA GLN A 33 -5.068 -3.217 20.630 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -3.839 -4.658 18.273 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -3.663 -5.012 19.980 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -6.115 -5.638 20.029 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -6.147 -5.442 18.287 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -4.976 -6.899 16.937 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -4.439 -8.468 17.548 1.00 0.00 H new ATOM 510 N ALA A 34 -3.873 -1.672 18.056 1.00 0.00 N ATOM 511 CA ALA A 34 -2.886 -0.717 17.565 1.00 0.00 C ATOM 512 C ALA A 34 -1.493 -1.350 17.472 1.00 0.00 C ATOM 513 O ALA A 34 -1.347 -2.572 17.547 1.00 0.00 O ATOM 514 CB ALA A 34 -2.858 0.532 18.440 1.00 0.00 C ATOM 0 H ALA A 34 -4.646 -1.837 17.411 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.183 -0.422 16.558 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.115 1.230 18.055 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.840 1.005 18.430 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.600 0.255 19.462 1.00 0.00 H new ATOM 520 N GLY A 35 -0.477 -0.521 17.264 1.00 0.00 N ATOM 521 CA GLY A 35 0.893 -1.006 17.224 1.00 0.00 C ATOM 522 C GLY A 35 1.302 -1.531 15.859 1.00 0.00 C ATOM 523 O GLY A 35 2.480 -1.531 15.513 1.00 0.00 O ATOM 0 H GLY A 35 -0.577 0.484 17.121 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.566 -0.198 17.512 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.013 -1.799 17.962 1.00 0.00 H new ATOM 527 N LEU A 36 0.328 -1.988 15.092 1.00 0.00 N ATOM 528 CA LEU A 36 0.577 -2.563 13.778 1.00 0.00 C ATOM 529 C LEU A 36 0.841 -1.476 12.742 1.00 0.00 C ATOM 530 O LEU A 36 0.273 -0.382 12.817 1.00 0.00 O ATOM 531 CB LEU A 36 -0.640 -3.388 13.361 1.00 0.00 C ATOM 532 CG LEU A 36 -1.209 -4.300 14.454 1.00 0.00 C ATOM 533 CD1 LEU A 36 -2.514 -4.926 14.000 1.00 0.00 C ATOM 534 CD2 LEU A 36 -0.209 -5.379 14.832 1.00 0.00 C ATOM 0 H LEU A 36 -0.656 -1.972 15.360 1.00 0.00 H new ATOM 0 HA LEU A 36 1.462 -3.196 13.833 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.425 -2.708 13.031 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.368 -4.001 12.502 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.404 -3.690 15.336 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.903 -5.570 14.789 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.238 -4.141 13.783 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -2.340 -5.518 13.101 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.635 -6.014 15.609 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.022 -5.984 13.955 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.705 -4.914 15.203 1.00 0.00 H new ATOM 546 N TRP A 37 1.688 -1.786 11.771 1.00 0.00 N ATOM 547 CA TRP A 37 2.019 -0.841 10.715 1.00 0.00 C ATOM 548 C TRP A 37 1.551 -1.389 9.376 1.00 0.00 C ATOM 549 O TRP A 37 1.446 -2.602 9.202 1.00 0.00 O ATOM 550 CB TRP A 37 3.529 -0.567 10.655 1.00 0.00 C ATOM 551 CG TRP A 37 4.131 -0.165 11.971 1.00 0.00 C ATOM 552 CD1 TRP A 37 4.473 -0.990 13.003 1.00 0.00 C ATOM 553 CD2 TRP A 37 4.474 1.163 12.390 1.00 0.00 C ATOM 554 NE1 TRP A 37 4.997 -0.258 14.038 1.00 0.00 N ATOM 555 CE2 TRP A 37 5.009 1.064 13.687 1.00 0.00 C ATOM 556 CE3 TRP A 37 4.379 2.424 11.795 1.00 0.00 C ATOM 557 CZ2 TRP A 37 5.446 2.177 14.400 1.00 0.00 C ATOM 558 CZ3 TRP A 37 4.813 3.530 12.504 1.00 0.00 C ATOM 559 CH2 TRP A 37 5.341 3.400 13.794 1.00 0.00 C ATOM 0 H TRP A 37 2.159 -2.687 11.693 1.00 0.00 H new ATOM 0 HA TRP A 37 1.513 0.099 10.934 1.00 0.00 H new ATOM 0 HB2 TRP A 37 4.036 -1.462 10.294 1.00 0.00 H new ATOM 0 HB3 TRP A 37 3.716 0.221 9.926 1.00 0.00 H new ATOM 0 HD1 TRP A 37 4.349 -2.063 13.005 1.00 0.00 H new ATOM 0 HE1 TRP A 37 5.325 -0.638 14.926 1.00 0.00 H new ATOM 0 HE3 TRP A 37 3.974 2.533 10.800 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 5.853 2.079 15.395 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 4.743 4.510 12.055 1.00 0.00 H new ATOM 0 HH2 TRP A 37 5.672 4.282 14.322 1.00 0.00 H new ATOM 570 N GLU A 38 1.270 -0.499 8.443 1.00 0.00 N ATOM 571 CA GLU A 38 0.825 -0.894 7.115 1.00 0.00 C ATOM 572 C GLU A 38 1.204 0.176 6.104 1.00 0.00 C ATOM 573 O GLU A 38 1.740 1.228 6.478 1.00 0.00 O ATOM 574 CB GLU A 38 -0.691 -1.139 7.091 1.00 0.00 C ATOM 575 CG GLU A 38 -1.511 0.009 7.663 1.00 0.00 C ATOM 576 CD GLU A 38 -3.007 -0.193 7.503 1.00 0.00 C ATOM 577 OE1 GLU A 38 -3.535 -1.209 8.008 1.00 0.00 O ATOM 578 OE2 GLU A 38 -3.660 0.687 6.897 1.00 0.00 O ATOM 0 H GLU A 38 1.342 0.509 8.579 1.00 0.00 H new ATOM 0 HA GLU A 38 1.320 -1.828 6.849 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.004 -1.319 6.062 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -0.911 -2.046 7.654 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.277 0.124 8.721 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.220 0.937 7.170 1.00 0.00 H new ATOM 585 N PHE A 39 0.937 -0.092 4.835 1.00 0.00 N ATOM 586 CA PHE A 39 1.251 0.851 3.775 1.00 0.00 C ATOM 587 C PHE A 39 0.138 1.887 3.652 1.00 0.00 C ATOM 588 O PHE A 39 -1.021 1.600 3.950 1.00 0.00 O ATOM 589 CB PHE A 39 1.450 0.113 2.444 1.00 0.00 C ATOM 590 CG PHE A 39 2.529 -0.919 2.483 1.00 0.00 C ATOM 591 CD1 PHE A 39 3.848 -0.568 2.281 1.00 0.00 C ATOM 592 CD2 PHE A 39 2.218 -2.241 2.714 1.00 0.00 C ATOM 593 CE1 PHE A 39 4.840 -1.520 2.310 1.00 0.00 C ATOM 594 CE2 PHE A 39 3.202 -3.201 2.744 1.00 0.00 C ATOM 595 CZ PHE A 39 4.519 -2.843 2.543 1.00 0.00 C ATOM 0 H PHE A 39 0.502 -0.957 4.515 1.00 0.00 H new ATOM 0 HA PHE A 39 2.180 1.364 4.024 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.512 -0.365 2.161 1.00 0.00 H new ATOM 0 HB3 PHE A 39 1.684 0.841 1.667 1.00 0.00 H new ATOM 0 HD1 PHE A 39 4.104 0.465 2.098 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.189 -2.527 2.873 1.00 0.00 H new ATOM 0 HE1 PHE A 39 5.869 -1.233 2.151 1.00 0.00 H new ATOM 0 HE2 PHE A 39 2.944 -4.234 2.925 1.00 0.00 H new ATOM 0 HZ PHE A 39 5.295 -3.594 2.568 1.00 0.00 H new ATOM 605 N ALA A 40 0.491 3.091 3.229 1.00 0.00 N ATOM 606 CA ALA A 40 -0.489 4.157 3.077 1.00 0.00 C ATOM 607 C ALA A 40 -1.293 3.957 1.802 1.00 0.00 C ATOM 608 O ALA A 40 -0.879 3.215 0.916 1.00 0.00 O ATOM 609 CB ALA A 40 0.200 5.513 3.064 1.00 0.00 C ATOM 0 H ALA A 40 1.446 3.355 2.985 1.00 0.00 H new ATOM 0 HA ALA A 40 -1.172 4.125 3.926 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -0.546 6.299 2.950 1.00 0.00 H new ATOM 0 HB2 ALA A 40 0.738 5.657 4.001 1.00 0.00 H new ATOM 0 HB3 ALA A 40 0.903 5.556 2.232 1.00 0.00 H new ATOM 615 N GLY A 41 -2.440 4.607 1.704 1.00 0.00 N ATOM 616 CA GLY A 41 -3.256 4.483 0.518 1.00 0.00 C ATOM 617 C GLY A 41 -4.721 4.667 0.831 1.00 0.00 C ATOM 618 O GLY A 41 -5.084 5.582 1.565 1.00 0.00 O ATOM 0 H GLY A 41 -2.821 5.219 2.426 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.945 5.224 -0.218 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.100 3.502 0.069 1.00 0.00 H new ATOM 622 N GLY A 42 -5.557 3.794 0.293 1.00 0.00 N ATOM 623 CA GLY A 42 -6.977 3.896 0.545 1.00 0.00 C ATOM 624 C GLY A 42 -7.812 3.103 -0.434 1.00 0.00 C ATOM 625 O GLY A 42 -7.281 2.439 -1.327 1.00 0.00 O ATOM 0 H GLY A 42 -5.279 3.020 -0.311 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.186 3.548 1.557 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.273 4.944 0.500 1.00 0.00 H new ATOM 629 N LYS A 43 -9.122 3.170 -0.253 1.00 0.00 N ATOM 630 CA LYS A 43 -10.057 2.441 -1.097 1.00 0.00 C ATOM 631 C LYS A 43 -10.281 3.182 -2.411 1.00 0.00 C ATOM 632 O LYS A 43 -10.236 4.412 -2.460 1.00 0.00 O ATOM 633 CB LYS A 43 -11.388 2.240 -0.361 1.00 0.00 C ATOM 634 CG LYS A 43 -12.387 1.362 -1.105 1.00 0.00 C ATOM 635 CD LYS A 43 -13.637 1.090 -0.273 1.00 0.00 C ATOM 636 CE LYS A 43 -14.724 2.146 -0.468 1.00 0.00 C ATOM 637 NZ LYS A 43 -14.285 3.511 -0.076 1.00 0.00 N ATOM 0 H LYS A 43 -9.565 3.727 0.478 1.00 0.00 H new ATOM 0 HA LYS A 43 -9.632 1.463 -1.323 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -11.188 1.797 0.614 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.842 3.215 -0.181 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -12.671 1.847 -2.039 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -11.913 0.416 -1.368 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -14.037 0.111 -0.537 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -13.363 1.048 0.781 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -15.030 2.155 -1.514 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -15.600 1.870 0.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -15.117 4.088 0.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -13.657 3.450 0.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -13.773 3.952 -0.867 1.00 0.00 H new ATOM 651 N VAL A 44 -10.536 2.424 -3.463 1.00 0.00 N ATOM 652 CA VAL A 44 -10.749 2.984 -4.783 1.00 0.00 C ATOM 653 C VAL A 44 -12.236 3.005 -5.096 1.00 0.00 C ATOM 654 O VAL A 44 -12.907 1.972 -5.009 1.00 0.00 O ATOM 655 CB VAL A 44 -10.026 2.160 -5.870 1.00 0.00 C ATOM 656 CG1 VAL A 44 -10.158 2.822 -7.235 1.00 0.00 C ATOM 657 CG2 VAL A 44 -8.565 1.956 -5.510 1.00 0.00 C ATOM 0 H VAL A 44 -10.601 1.407 -3.425 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.344 3.996 -4.784 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.504 1.182 -5.923 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -9.640 2.221 -7.982 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -11.212 2.901 -7.500 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.717 3.818 -7.201 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.076 1.373 -6.290 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.074 2.925 -5.419 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -8.495 1.424 -4.561 1.00 0.00 H new ATOM 667 N GLU A 45 -12.756 4.171 -5.437 1.00 0.00 N ATOM 668 CA GLU A 45 -14.141 4.273 -5.853 1.00 0.00 C ATOM 669 C GLU A 45 -14.241 3.899 -7.328 1.00 0.00 C ATOM 670 O GLU A 45 -13.314 4.154 -8.094 1.00 0.00 O ATOM 671 CB GLU A 45 -14.675 5.689 -5.633 1.00 0.00 C ATOM 672 CG GLU A 45 -14.456 6.228 -4.227 1.00 0.00 C ATOM 673 CD GLU A 45 -14.980 5.305 -3.148 1.00 0.00 C ATOM 674 OE1 GLU A 45 -16.194 5.019 -3.140 1.00 0.00 O ATOM 675 OE2 GLU A 45 -14.182 4.889 -2.284 1.00 0.00 O ATOM 0 H GLU A 45 -12.244 5.053 -5.434 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.745 3.591 -5.254 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -14.196 6.360 -6.346 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.743 5.700 -5.852 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.390 6.393 -4.070 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.945 7.198 -4.136 1.00 0.00 H new ATOM 682 N PRO A 46 -15.365 3.300 -7.753 1.00 0.00 N ATOM 683 CA PRO A 46 -15.554 2.856 -9.144 1.00 0.00 C ATOM 684 C PRO A 46 -15.493 4.002 -10.159 1.00 0.00 C ATOM 685 O PRO A 46 -15.510 3.771 -11.370 1.00 0.00 O ATOM 686 CB PRO A 46 -16.955 2.225 -9.138 1.00 0.00 C ATOM 687 CG PRO A 46 -17.624 2.775 -7.925 1.00 0.00 C ATOM 688 CD PRO A 46 -16.533 2.989 -6.917 1.00 0.00 C ATOM 0 HA PRO A 46 -14.760 2.174 -9.449 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -17.507 2.481 -10.043 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -16.897 1.137 -9.097 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -18.136 3.710 -8.151 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -18.376 2.083 -7.546 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -16.769 3.805 -6.234 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -16.368 2.101 -6.307 1.00 0.00 H new ATOM 696 N ASP A 47 -15.392 5.230 -9.665 1.00 0.00 N ATOM 697 CA ASP A 47 -15.380 6.406 -10.527 1.00 0.00 C ATOM 698 C ASP A 47 -13.990 7.024 -10.614 1.00 0.00 C ATOM 699 O ASP A 47 -13.808 8.073 -11.230 1.00 0.00 O ATOM 700 CB ASP A 47 -16.386 7.444 -10.034 1.00 0.00 C ATOM 701 CG ASP A 47 -17.810 7.071 -10.382 1.00 0.00 C ATOM 702 OD1 ASP A 47 -18.231 7.342 -11.527 1.00 0.00 O ATOM 703 OD2 ASP A 47 -18.513 6.500 -9.519 1.00 0.00 O ATOM 0 H ASP A 47 -15.317 5.438 -8.669 1.00 0.00 H new ATOM 0 HA ASP A 47 -15.666 6.081 -11.527 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -16.294 7.551 -8.953 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -16.149 8.414 -10.472 1.00 0.00 H new ATOM 708 N GLU A 48 -13.013 6.368 -10.010 1.00 0.00 N ATOM 709 CA GLU A 48 -11.637 6.836 -10.080 1.00 0.00 C ATOM 710 C GLU A 48 -10.703 5.669 -10.362 1.00 0.00 C ATOM 711 O GLU A 48 -11.034 4.516 -10.086 1.00 0.00 O ATOM 712 CB GLU A 48 -11.237 7.571 -8.796 1.00 0.00 C ATOM 713 CG GLU A 48 -11.248 6.714 -7.544 1.00 0.00 C ATOM 714 CD GLU A 48 -11.076 7.545 -6.293 1.00 0.00 C ATOM 715 OE1 GLU A 48 -9.968 8.066 -6.059 1.00 0.00 O ATOM 716 OE2 GLU A 48 -12.062 7.707 -5.546 1.00 0.00 O ATOM 0 H GLU A 48 -13.145 5.514 -9.468 1.00 0.00 H new ATOM 0 HA GLU A 48 -11.554 7.549 -10.900 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -10.237 7.985 -8.927 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -11.914 8.413 -8.650 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -12.187 6.164 -7.488 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -10.449 5.975 -7.602 1.00 0.00 H new ATOM 723 N SER A 49 -9.546 5.963 -10.934 1.00 0.00 N ATOM 724 CA SER A 49 -8.609 4.918 -11.309 1.00 0.00 C ATOM 725 C SER A 49 -7.645 4.625 -10.166 1.00 0.00 C ATOM 726 O SER A 49 -7.549 5.394 -9.211 1.00 0.00 O ATOM 727 CB SER A 49 -7.844 5.316 -12.574 1.00 0.00 C ATOM 728 OG SER A 49 -7.019 4.257 -13.037 1.00 0.00 O ATOM 0 H SER A 49 -9.235 6.911 -11.147 1.00 0.00 H new ATOM 0 HA SER A 49 -9.172 4.009 -11.519 1.00 0.00 H new ATOM 0 HB2 SER A 49 -8.551 5.596 -13.355 1.00 0.00 H new ATOM 0 HB3 SER A 49 -7.231 6.194 -12.369 1.00 0.00 H new ATOM 0 HG SER A 49 -6.545 4.541 -13.846 1.00 0.00 H new ATOM 734 N GLN A 50 -6.924 3.517 -10.282 1.00 0.00 N ATOM 735 CA GLN A 50 -6.009 3.068 -9.240 1.00 0.00 C ATOM 736 C GLN A 50 -4.919 4.102 -8.975 1.00 0.00 C ATOM 737 O GLN A 50 -4.595 4.388 -7.823 1.00 0.00 O ATOM 738 CB GLN A 50 -5.386 1.728 -9.629 1.00 0.00 C ATOM 739 CG GLN A 50 -6.402 0.596 -9.727 1.00 0.00 C ATOM 740 CD GLN A 50 -5.779 -0.730 -10.115 1.00 0.00 C ATOM 741 OE1 GLN A 50 -4.613 -0.991 -9.823 1.00 0.00 O ATOM 742 NE2 GLN A 50 -6.558 -1.591 -10.751 1.00 0.00 N ATOM 0 H GLN A 50 -6.957 2.906 -11.098 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.580 2.942 -8.320 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.879 1.836 -10.588 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -4.626 1.462 -8.895 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.908 0.486 -8.768 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -7.163 0.861 -10.461 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -7.520 -1.338 -10.976 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.196 -2.507 -11.016 1.00 0.00 H new ATOM 751 N ARG A 51 -4.363 4.672 -10.041 1.00 0.00 N ATOM 752 CA ARG A 51 -3.344 5.706 -9.897 1.00 0.00 C ATOM 753 C ARG A 51 -3.946 6.932 -9.233 1.00 0.00 C ATOM 754 O ARG A 51 -3.356 7.528 -8.333 1.00 0.00 O ATOM 755 CB ARG A 51 -2.777 6.134 -11.249 1.00 0.00 C ATOM 756 CG ARG A 51 -2.305 4.999 -12.141 1.00 0.00 C ATOM 757 CD ARG A 51 -1.581 5.552 -13.357 1.00 0.00 C ATOM 758 NE ARG A 51 -1.180 4.506 -14.296 1.00 0.00 N ATOM 759 CZ ARG A 51 -0.231 4.662 -15.218 1.00 0.00 C ATOM 760 NH1 ARG A 51 0.432 5.808 -15.313 1.00 0.00 N ATOM 761 NH2 ARG A 51 0.054 3.666 -16.047 1.00 0.00 N ATOM 0 H ARG A 51 -4.599 4.438 -11.005 1.00 0.00 H new ATOM 0 HA ARG A 51 -2.541 5.286 -9.291 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.540 6.700 -11.782 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.940 6.811 -11.076 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -1.641 4.340 -11.582 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.157 4.398 -12.458 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -2.228 6.265 -13.868 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -0.697 6.101 -13.031 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.654 3.605 -14.242 1.00 0.00 H new ATOM 0 HH11 ARG A 51 0.216 6.576 -14.678 1.00 0.00 H new ATOM 0 HH12 ARG A 51 1.157 5.920 -16.021 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -0.453 2.784 -15.977 1.00 0.00 H new ATOM 0 HH22 ARG A 51 0.780 3.783 -16.754 1.00 0.00 H new ATOM 775 N GLN A 52 -5.146 7.273 -9.674 1.00 0.00 N ATOM 776 CA GLN A 52 -5.840 8.462 -9.213 1.00 0.00 C ATOM 777 C GLN A 52 -6.183 8.344 -7.734 1.00 0.00 C ATOM 778 O GLN A 52 -6.024 9.299 -6.973 1.00 0.00 O ATOM 779 CB GLN A 52 -7.100 8.666 -10.057 1.00 0.00 C ATOM 780 CG GLN A 52 -8.086 9.664 -9.482 1.00 0.00 C ATOM 781 CD GLN A 52 -9.195 10.004 -10.454 1.00 0.00 C ATOM 782 OE1 GLN A 52 -9.584 9.181 -11.285 1.00 0.00 O ATOM 783 NE2 GLN A 52 -9.716 11.216 -10.357 1.00 0.00 N ATOM 0 H GLN A 52 -5.667 6.731 -10.364 1.00 0.00 H new ATOM 0 HA GLN A 52 -5.191 9.330 -9.329 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -6.806 8.998 -11.053 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.602 7.706 -10.176 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -8.519 9.257 -8.568 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -7.557 10.576 -9.205 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -9.365 11.867 -9.655 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -10.469 11.499 -10.984 1.00 0.00 H new ATOM 792 N ALA A 53 -6.623 7.160 -7.338 1.00 0.00 N ATOM 793 CA ALA A 53 -6.965 6.893 -5.951 1.00 0.00 C ATOM 794 C ALA A 53 -5.744 7.053 -5.056 1.00 0.00 C ATOM 795 O ALA A 53 -5.815 7.705 -4.021 1.00 0.00 O ATOM 796 CB ALA A 53 -7.557 5.500 -5.808 1.00 0.00 C ATOM 0 H ALA A 53 -6.752 6.364 -7.963 1.00 0.00 H new ATOM 0 HA ALA A 53 -7.715 7.619 -5.636 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -7.807 5.317 -4.763 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -8.458 5.424 -6.416 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -6.830 4.760 -6.142 1.00 0.00 H new ATOM 802 N LEU A 54 -4.614 6.489 -5.474 1.00 0.00 N ATOM 803 CA LEU A 54 -3.384 6.587 -4.695 1.00 0.00 C ATOM 804 C LEU A 54 -2.969 8.039 -4.526 1.00 0.00 C ATOM 805 O LEU A 54 -2.659 8.482 -3.423 1.00 0.00 O ATOM 806 CB LEU A 54 -2.258 5.808 -5.381 1.00 0.00 C ATOM 807 CG LEU A 54 -2.339 4.292 -5.235 1.00 0.00 C ATOM 808 CD1 LEU A 54 -1.458 3.604 -6.263 1.00 0.00 C ATOM 809 CD2 LEU A 54 -1.924 3.890 -3.832 1.00 0.00 C ATOM 0 H LEU A 54 -4.525 5.962 -6.343 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.571 6.158 -3.711 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.260 6.056 -6.442 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.304 6.146 -4.976 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.369 3.979 -5.408 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -1.531 2.523 -6.140 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.786 3.878 -7.266 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.423 3.916 -6.122 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.983 2.806 -3.732 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.900 4.216 -3.648 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.590 4.358 -3.107 1.00 0.00 H new ATOM 821 N VAL A 55 -2.990 8.774 -5.627 1.00 0.00 N ATOM 822 CA VAL A 55 -2.590 10.172 -5.628 1.00 0.00 C ATOM 823 C VAL A 55 -3.449 10.993 -4.671 1.00 0.00 C ATOM 824 O VAL A 55 -2.922 11.744 -3.847 1.00 0.00 O ATOM 825 CB VAL A 55 -2.661 10.774 -7.051 1.00 0.00 C ATOM 826 CG1 VAL A 55 -2.448 12.281 -7.017 1.00 0.00 C ATOM 827 CG2 VAL A 55 -1.630 10.116 -7.954 1.00 0.00 C ATOM 0 H VAL A 55 -3.282 8.421 -6.538 1.00 0.00 H new ATOM 0 HA VAL A 55 -1.556 10.212 -5.286 1.00 0.00 H new ATOM 0 HB VAL A 55 -3.656 10.581 -7.452 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.503 12.679 -8.030 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -3.221 12.744 -6.403 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.468 12.500 -6.593 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -1.691 10.549 -8.952 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.632 10.281 -7.547 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.826 9.045 -8.011 1.00 0.00 H new ATOM 837 N ARG A 56 -4.766 10.838 -4.759 1.00 0.00 N ATOM 838 CA ARG A 56 -5.661 11.623 -3.919 1.00 0.00 C ATOM 839 C ARG A 56 -5.576 11.188 -2.456 1.00 0.00 C ATOM 840 O ARG A 56 -5.540 12.031 -1.564 1.00 0.00 O ATOM 841 CB ARG A 56 -7.110 11.590 -4.445 1.00 0.00 C ATOM 842 CG ARG A 56 -7.775 10.219 -4.502 1.00 0.00 C ATOM 843 CD ARG A 56 -8.589 9.924 -3.249 1.00 0.00 C ATOM 844 NE ARG A 56 -9.631 8.925 -3.503 1.00 0.00 N ATOM 845 CZ ARG A 56 -10.501 8.497 -2.586 1.00 0.00 C ATOM 846 NH1 ARG A 56 -10.392 8.885 -1.323 1.00 0.00 N ATOM 847 NH2 ARG A 56 -11.471 7.662 -2.931 1.00 0.00 N ATOM 0 H ARG A 56 -5.231 10.187 -5.392 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.330 12.660 -3.967 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.718 12.240 -3.815 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -7.120 12.018 -5.448 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -8.424 10.168 -5.376 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -7.011 9.451 -4.627 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.927 9.567 -2.460 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.047 10.844 -2.888 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.695 8.531 -4.442 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.639 9.515 -1.046 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.061 8.553 -0.628 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.553 7.346 -3.898 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -12.136 7.335 -2.230 1.00 0.00 H new ATOM 861 N GLU A 57 -5.516 9.880 -2.215 1.00 0.00 N ATOM 862 CA GLU A 57 -5.423 9.360 -0.852 1.00 0.00 C ATOM 863 C GLU A 57 -4.168 9.858 -0.146 1.00 0.00 C ATOM 864 O GLU A 57 -4.235 10.329 0.987 1.00 0.00 O ATOM 865 CB GLU A 57 -5.454 7.829 -0.846 1.00 0.00 C ATOM 866 CG GLU A 57 -6.816 7.246 -1.181 1.00 0.00 C ATOM 867 CD GLU A 57 -7.858 7.549 -0.124 1.00 0.00 C ATOM 868 OE1 GLU A 57 -8.140 8.741 0.122 1.00 0.00 O ATOM 869 OE2 GLU A 57 -8.421 6.595 0.451 1.00 0.00 O ATOM 0 H GLU A 57 -5.530 9.164 -2.941 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.290 9.732 -0.307 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -4.723 7.457 -1.563 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -5.147 7.472 0.137 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -7.151 7.643 -2.139 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -6.726 6.166 -1.297 1.00 0.00 H new ATOM 876 N LEU A 58 -3.024 9.776 -0.818 1.00 0.00 N ATOM 877 CA LEU A 58 -1.777 10.238 -0.217 1.00 0.00 C ATOM 878 C LEU A 58 -1.813 11.743 -0.035 1.00 0.00 C ATOM 879 O LEU A 58 -1.223 12.277 0.892 1.00 0.00 O ATOM 880 CB LEU A 58 -0.570 9.868 -1.068 1.00 0.00 C ATOM 881 CG LEU A 58 -0.493 8.409 -1.499 1.00 0.00 C ATOM 882 CD1 LEU A 58 0.811 8.148 -2.231 1.00 0.00 C ATOM 883 CD2 LEU A 58 -0.644 7.484 -0.302 1.00 0.00 C ATOM 0 H LEU A 58 -2.934 9.401 -1.762 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.680 9.746 0.751 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.572 10.493 -1.961 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.334 10.112 -0.510 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.317 8.203 -2.182 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.855 7.102 -2.534 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.866 8.784 -3.114 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.650 8.370 -1.571 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.586 6.447 -0.634 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.154 7.681 0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.609 7.659 0.174 1.00 0.00 H new ATOM 895 N ARG A 59 -2.477 12.429 -0.945 1.00 0.00 N ATOM 896 CA ARG A 59 -2.664 13.861 -0.817 1.00 0.00 C ATOM 897 C ARG A 59 -3.446 14.205 0.449 1.00 0.00 C ATOM 898 O ARG A 59 -3.181 15.218 1.098 1.00 0.00 O ATOM 899 CB ARG A 59 -3.383 14.408 -2.042 1.00 0.00 C ATOM 900 CG ARG A 59 -3.566 15.907 -2.005 1.00 0.00 C ATOM 901 CD ARG A 59 -4.061 16.432 -3.339 1.00 0.00 C ATOM 902 NE ARG A 59 -3.578 17.784 -3.621 1.00 0.00 N ATOM 903 CZ ARG A 59 -3.995 18.510 -4.655 1.00 0.00 C ATOM 904 NH1 ARG A 59 -4.983 18.063 -5.420 1.00 0.00 N ATOM 905 NH2 ARG A 59 -3.444 19.688 -4.917 1.00 0.00 N ATOM 0 H ARG A 59 -2.895 12.019 -1.780 1.00 0.00 H new ATOM 0 HA ARG A 59 -1.680 14.325 -0.743 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.820 14.139 -2.936 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.360 13.931 -2.125 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.277 16.170 -1.221 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -2.620 16.385 -1.751 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.736 15.760 -4.134 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.151 16.430 -3.345 1.00 0.00 H new ATOM 0 HE ARG A 59 -2.886 18.191 -2.992 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -5.421 17.165 -5.215 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -5.305 18.618 -6.213 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -2.694 20.044 -4.324 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -3.770 20.238 -5.712 1.00 0.00 H new ATOM 919 N GLU A 60 -4.399 13.356 0.801 1.00 0.00 N ATOM 920 CA GLU A 60 -5.242 13.613 1.955 1.00 0.00 C ATOM 921 C GLU A 60 -4.603 13.085 3.236 1.00 0.00 C ATOM 922 O GLU A 60 -4.721 13.705 4.291 1.00 0.00 O ATOM 923 CB GLU A 60 -6.631 12.998 1.769 1.00 0.00 C ATOM 924 CG GLU A 60 -7.322 13.438 0.491 1.00 0.00 C ATOM 925 CD GLU A 60 -8.815 13.185 0.517 1.00 0.00 C ATOM 926 OE1 GLU A 60 -9.237 12.045 0.249 1.00 0.00 O ATOM 927 OE2 GLU A 60 -9.579 14.132 0.805 1.00 0.00 O ATOM 0 H GLU A 60 -4.606 12.488 0.307 1.00 0.00 H new ATOM 0 HA GLU A 60 -5.349 14.694 2.045 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.542 11.912 1.769 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -7.255 13.266 2.621 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.140 14.501 0.332 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -6.883 12.910 -0.355 1.00 0.00 H new ATOM 934 N GLU A 61 -3.927 11.947 3.148 1.00 0.00 N ATOM 935 CA GLU A 61 -3.268 11.375 4.320 1.00 0.00 C ATOM 936 C GLU A 61 -1.877 11.945 4.513 1.00 0.00 C ATOM 937 O GLU A 61 -1.559 12.482 5.571 1.00 0.00 O ATOM 938 CB GLU A 61 -3.119 9.859 4.217 1.00 0.00 C ATOM 939 CG GLU A 61 -4.324 9.060 4.635 1.00 0.00 C ATOM 940 CD GLU A 61 -3.892 7.805 5.363 1.00 0.00 C ATOM 941 OE1 GLU A 61 -3.457 7.918 6.535 1.00 0.00 O ATOM 942 OE2 GLU A 61 -3.960 6.710 4.779 1.00 0.00 O ATOM 0 H GLU A 61 -3.820 11.406 2.290 1.00 0.00 H new ATOM 0 HA GLU A 61 -3.909 11.631 5.163 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -2.876 9.605 3.185 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -2.271 9.552 4.829 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -4.963 9.662 5.281 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -4.916 8.795 3.759 1.00 0.00 H new ATOM 949 N LEU A 62 -1.068 11.857 3.467 1.00 0.00 N ATOM 950 CA LEU A 62 0.356 12.124 3.578 1.00 0.00 C ATOM 951 C LEU A 62 0.689 13.529 3.109 1.00 0.00 C ATOM 952 O LEU A 62 1.850 13.914 3.107 1.00 0.00 O ATOM 953 CB LEU A 62 1.153 11.114 2.745 1.00 0.00 C ATOM 954 CG LEU A 62 0.833 9.636 2.988 1.00 0.00 C ATOM 955 CD1 LEU A 62 1.692 8.765 2.087 1.00 0.00 C ATOM 956 CD2 LEU A 62 1.054 9.259 4.445 1.00 0.00 C ATOM 0 H LEU A 62 -1.377 11.602 2.529 1.00 0.00 H new ATOM 0 HA LEU A 62 0.628 12.030 4.629 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.986 11.332 1.690 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.214 11.271 2.939 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.218 9.472 2.752 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.459 7.715 2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.490 9.009 1.044 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.745 8.945 2.304 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.819 8.204 4.588 1.00 0.00 H new ATOM 0 HD22 LEU A 62 2.095 9.438 4.713 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.406 9.864 5.080 1.00 0.00 H new ATOM 968 N GLY A 63 -0.332 14.296 2.741 1.00 0.00 N ATOM 969 CA GLY A 63 -0.117 15.615 2.169 1.00 0.00 C ATOM 970 C GLY A 63 0.881 15.647 1.018 1.00 0.00 C ATOM 971 O GLY A 63 1.553 16.659 0.814 1.00 0.00 O ATOM 0 H GLY A 63 -1.312 14.026 2.829 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -1.072 16.005 1.817 1.00 0.00 H new ATOM 0 HA3 GLY A 63 0.231 16.286 2.954 1.00 0.00 H new ATOM 975 N ILE A 64 0.985 14.560 0.256 1.00 0.00 N ATOM 976 CA ILE A 64 1.929 14.520 -0.857 1.00 0.00 C ATOM 977 C ILE A 64 1.221 14.256 -2.178 1.00 0.00 C ATOM 978 O ILE A 64 0.253 13.499 -2.244 1.00 0.00 O ATOM 979 CB ILE A 64 3.055 13.465 -0.677 1.00 0.00 C ATOM 980 CG1 ILE A 64 2.480 12.052 -0.544 1.00 0.00 C ATOM 981 CG2 ILE A 64 3.928 13.800 0.521 1.00 0.00 C ATOM 982 CD1 ILE A 64 3.538 10.966 -0.494 1.00 0.00 C ATOM 0 H ILE A 64 0.437 13.709 0.386 1.00 0.00 H new ATOM 0 HA ILE A 64 2.392 15.507 -0.869 1.00 0.00 H new ATOM 0 HB ILE A 64 3.675 13.492 -1.573 1.00 0.00 H new ATOM 0 HG12 ILE A 64 1.875 11.999 0.361 1.00 0.00 H new ATOM 0 HG13 ILE A 64 1.814 11.860 -1.385 1.00 0.00 H new ATOM 0 HG21 ILE A 64 4.708 13.046 0.625 1.00 0.00 H new ATOM 0 HG22 ILE A 64 4.386 14.778 0.375 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.317 13.816 1.423 1.00 0.00 H new ATOM 0 HD11 ILE A 64 3.056 9.993 -0.399 1.00 0.00 H new ATOM 0 HD12 ILE A 64 4.129 10.991 -1.410 1.00 0.00 H new ATOM 0 HD13 ILE A 64 4.190 11.133 0.363 1.00 0.00 H new ATOM 994 N GLU A 65 1.708 14.906 -3.217 1.00 0.00 N ATOM 995 CA GLU A 65 1.230 14.684 -4.568 1.00 0.00 C ATOM 996 C GLU A 65 2.147 13.696 -5.271 1.00 0.00 C ATOM 997 O GLU A 65 3.219 14.059 -5.749 1.00 0.00 O ATOM 998 CB GLU A 65 1.179 16.006 -5.331 1.00 0.00 C ATOM 999 CG GLU A 65 0.071 16.930 -4.860 1.00 0.00 C ATOM 1000 CD GLU A 65 0.085 18.263 -5.574 1.00 0.00 C ATOM 1001 OE1 GLU A 65 -0.274 18.306 -6.769 1.00 0.00 O ATOM 1002 OE2 GLU A 65 0.455 19.272 -4.941 1.00 0.00 O ATOM 0 H GLU A 65 2.448 15.605 -3.148 1.00 0.00 H new ATOM 0 HA GLU A 65 0.222 14.271 -4.534 1.00 0.00 H new ATOM 0 HB2 GLU A 65 2.137 16.516 -5.225 1.00 0.00 H new ATOM 0 HB3 GLU A 65 1.043 15.800 -6.393 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -0.893 16.447 -5.019 1.00 0.00 H new ATOM 0 HG3 GLU A 65 0.172 17.095 -3.787 1.00 0.00 H new ATOM 1009 N ALA A 66 1.737 12.444 -5.299 1.00 0.00 N ATOM 1010 CA ALA A 66 2.583 11.382 -5.811 1.00 0.00 C ATOM 1011 C ALA A 66 2.417 11.193 -7.314 1.00 0.00 C ATOM 1012 O ALA A 66 1.393 11.556 -7.893 1.00 0.00 O ATOM 1013 CB ALA A 66 2.280 10.089 -5.079 1.00 0.00 C ATOM 0 H ALA A 66 0.821 12.135 -4.973 1.00 0.00 H new ATOM 0 HA ALA A 66 3.620 11.667 -5.636 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.917 9.294 -5.466 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.471 10.221 -4.014 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.234 9.822 -5.230 1.00 0.00 H new ATOM 1019 N THR A 67 3.440 10.629 -7.932 1.00 0.00 N ATOM 1020 CA THR A 67 3.408 10.307 -9.346 1.00 0.00 C ATOM 1021 C THR A 67 3.425 8.788 -9.519 1.00 0.00 C ATOM 1022 O THR A 67 4.408 8.133 -9.170 1.00 0.00 O ATOM 1023 CB THR A 67 4.616 10.926 -10.082 1.00 0.00 C ATOM 1024 OG1 THR A 67 4.682 12.340 -9.829 1.00 0.00 O ATOM 1025 CG2 THR A 67 4.527 10.679 -11.582 1.00 0.00 C ATOM 0 H THR A 67 4.314 10.382 -7.468 1.00 0.00 H new ATOM 0 HA THR A 67 2.496 10.721 -9.776 1.00 0.00 H new ATOM 0 HB THR A 67 5.520 10.448 -9.704 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.550 12.561 -9.431 1.00 0.00 H new ATOM 0 HG21 THR A 67 5.390 11.125 -12.076 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.514 9.606 -11.774 1.00 0.00 H new ATOM 0 HG23 THR A 67 3.613 11.129 -11.971 1.00 0.00 H new ATOM 1033 N VAL A 68 2.336 8.229 -10.033 1.00 0.00 N ATOM 1034 CA VAL A 68 2.214 6.783 -10.166 1.00 0.00 C ATOM 1035 C VAL A 68 2.762 6.313 -11.511 1.00 0.00 C ATOM 1036 O VAL A 68 2.441 6.890 -12.551 1.00 0.00 O ATOM 1037 CB VAL A 68 0.743 6.332 -10.032 1.00 0.00 C ATOM 1038 CG1 VAL A 68 0.629 4.817 -10.108 1.00 0.00 C ATOM 1039 CG2 VAL A 68 0.140 6.846 -8.735 1.00 0.00 C ATOM 0 H VAL A 68 1.526 8.754 -10.364 1.00 0.00 H new ATOM 0 HA VAL A 68 2.797 6.334 -9.362 1.00 0.00 H new ATOM 0 HB VAL A 68 0.184 6.757 -10.865 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.417 4.526 -10.011 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.015 4.471 -11.067 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.207 4.368 -9.301 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -0.897 6.517 -8.660 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.707 6.455 -7.890 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.177 7.935 -8.723 1.00 0.00 H new ATOM 1049 N GLY A 69 3.580 5.262 -11.485 1.00 0.00 N ATOM 1050 CA GLY A 69 4.155 4.740 -12.708 1.00 0.00 C ATOM 1051 C GLY A 69 5.148 3.619 -12.457 1.00 0.00 C ATOM 1052 O GLY A 69 6.317 3.750 -12.819 1.00 0.00 O ATOM 0 H GLY A 69 3.853 4.765 -10.637 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.356 4.374 -13.353 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.653 5.548 -13.244 1.00 0.00 H new ATOM 1056 N GLU A 70 4.656 2.513 -11.868 1.00 0.00 N ATOM 1057 CA GLU A 70 5.459 1.323 -11.518 1.00 0.00 C ATOM 1058 C GLU A 70 4.787 0.564 -10.366 1.00 0.00 C ATOM 1059 O GLU A 70 4.896 0.939 -9.199 1.00 0.00 O ATOM 1060 CB GLU A 70 6.929 1.631 -11.160 1.00 0.00 C ATOM 1061 CG GLU A 70 7.136 2.573 -9.985 1.00 0.00 C ATOM 1062 CD GLU A 70 8.596 2.705 -9.622 1.00 0.00 C ATOM 1063 OE1 GLU A 70 9.124 1.807 -8.937 1.00 0.00 O ATOM 1064 OE2 GLU A 70 9.225 3.706 -10.017 1.00 0.00 O ATOM 0 H GLU A 70 3.672 2.418 -11.617 1.00 0.00 H new ATOM 0 HA GLU A 70 5.494 0.708 -12.417 1.00 0.00 H new ATOM 0 HB2 GLU A 70 7.436 0.691 -10.942 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.415 2.060 -12.036 1.00 0.00 H new ATOM 0 HG2 GLU A 70 6.733 3.555 -10.231 1.00 0.00 H new ATOM 0 HG3 GLU A 70 6.579 2.206 -9.123 1.00 0.00 H new ATOM 1071 N TYR A 71 4.063 -0.492 -10.696 1.00 0.00 N ATOM 1072 CA TYR A 71 3.353 -1.264 -9.695 1.00 0.00 C ATOM 1073 C TYR A 71 4.170 -2.475 -9.258 1.00 0.00 C ATOM 1074 O TYR A 71 4.905 -3.058 -10.054 1.00 0.00 O ATOM 1075 CB TYR A 71 1.994 -1.690 -10.236 1.00 0.00 C ATOM 1076 CG TYR A 71 0.958 -0.588 -10.190 1.00 0.00 C ATOM 1077 CD1 TYR A 71 0.239 -0.343 -9.027 1.00 0.00 C ATOM 1078 CD2 TYR A 71 0.699 0.206 -11.301 1.00 0.00 C ATOM 1079 CE1 TYR A 71 -0.707 0.661 -8.969 1.00 0.00 C ATOM 1080 CE2 TYR A 71 -0.248 1.213 -11.251 1.00 0.00 C ATOM 1081 CZ TYR A 71 -0.948 1.435 -10.083 1.00 0.00 C ATOM 1082 OH TYR A 71 -1.888 2.439 -10.024 1.00 0.00 O ATOM 0 H TYR A 71 3.952 -0.833 -11.651 1.00 0.00 H new ATOM 0 HA TYR A 71 3.198 -0.637 -8.817 1.00 0.00 H new ATOM 0 HB2 TYR A 71 2.110 -2.027 -11.266 1.00 0.00 H new ATOM 0 HB3 TYR A 71 1.633 -2.543 -9.661 1.00 0.00 H new ATOM 0 HD1 TYR A 71 0.423 -0.949 -8.152 1.00 0.00 H new ATOM 0 HD2 TYR A 71 1.245 0.034 -12.217 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -1.255 0.839 -8.055 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -0.439 1.822 -12.122 1.00 0.00 H new ATOM 0 HH TYR A 71 -2.110 2.624 -9.088 1.00 0.00 H new ATOM 1092 N VAL A 72 4.041 -2.837 -7.987 1.00 0.00 N ATOM 1093 CA VAL A 72 4.841 -3.910 -7.410 1.00 0.00 C ATOM 1094 C VAL A 72 4.125 -5.257 -7.484 1.00 0.00 C ATOM 1095 O VAL A 72 4.525 -6.139 -8.244 1.00 0.00 O ATOM 1096 CB VAL A 72 5.176 -3.611 -5.935 1.00 0.00 C ATOM 1097 CG1 VAL A 72 6.040 -4.712 -5.341 1.00 0.00 C ATOM 1098 CG2 VAL A 72 5.854 -2.256 -5.810 1.00 0.00 C ATOM 0 H VAL A 72 3.388 -2.402 -7.335 1.00 0.00 H new ATOM 0 HA VAL A 72 5.758 -3.965 -7.997 1.00 0.00 H new ATOM 0 HB VAL A 72 4.245 -3.580 -5.370 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.263 -4.478 -4.300 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.507 -5.661 -5.393 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.971 -4.787 -5.903 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.084 -2.060 -4.763 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.777 -2.256 -6.390 1.00 0.00 H new ATOM 0 HG23 VAL A 72 5.188 -1.480 -6.187 1.00 0.00 H new ATOM 1108 N ALA A 73 3.062 -5.412 -6.703 1.00 0.00 N ATOM 1109 CA ALA A 73 2.314 -6.667 -6.691 1.00 0.00 C ATOM 1110 C ALA A 73 0.877 -6.451 -6.239 1.00 0.00 C ATOM 1111 O ALA A 73 0.511 -5.356 -5.819 1.00 0.00 O ATOM 1112 CB ALA A 73 2.999 -7.681 -5.786 1.00 0.00 C ATOM 0 H ALA A 73 2.700 -4.694 -6.076 1.00 0.00 H new ATOM 0 HA ALA A 73 2.294 -7.053 -7.710 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.431 -8.611 -5.786 1.00 0.00 H new ATOM 0 HB2 ALA A 73 4.008 -7.872 -6.152 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.049 -7.287 -4.771 1.00 0.00 H new ATOM 1118 N SER A 74 0.067 -7.497 -6.334 1.00 0.00 N ATOM 1119 CA SER A 74 -1.313 -7.443 -5.874 1.00 0.00 C ATOM 1120 C SER A 74 -1.626 -8.647 -4.988 1.00 0.00 C ATOM 1121 O SER A 74 -1.035 -9.716 -5.151 1.00 0.00 O ATOM 1122 CB SER A 74 -2.277 -7.422 -7.065 1.00 0.00 C ATOM 1123 OG SER A 74 -1.970 -6.374 -7.965 1.00 0.00 O ATOM 0 H SER A 74 0.344 -8.396 -6.727 1.00 0.00 H new ATOM 0 HA SER A 74 -1.442 -6.528 -5.296 1.00 0.00 H new ATOM 0 HB2 SER A 74 -2.231 -8.377 -7.588 1.00 0.00 H new ATOM 0 HB3 SER A 74 -3.299 -7.305 -6.705 1.00 0.00 H new ATOM 0 HG SER A 74 -2.603 -6.390 -8.713 1.00 0.00 H new ATOM 1129 N HIS A 75 -2.550 -8.472 -4.054 1.00 0.00 N ATOM 1130 CA HIS A 75 -2.989 -9.566 -3.199 1.00 0.00 C ATOM 1131 C HIS A 75 -4.476 -9.413 -2.893 1.00 0.00 C ATOM 1132 O HIS A 75 -4.994 -8.295 -2.833 1.00 0.00 O ATOM 1133 CB HIS A 75 -2.187 -9.607 -1.896 1.00 0.00 C ATOM 1134 CG HIS A 75 -2.438 -10.847 -1.082 1.00 0.00 C ATOM 1135 ND1 HIS A 75 -3.207 -11.048 0.013 1.00 0.00 N flip ATOM 1136 CD2 HIS A 75 -1.882 -12.074 -1.379 1.00 0.00 C flip ATOM 1137 CE1 HIS A 75 -3.103 -12.373 0.352 1.00 0.00 C flip ATOM 1138 NE2 HIS A 75 -2.299 -12.969 -0.503 1.00 0.00 N flip ATOM 0 H HIS A 75 -3.011 -7.581 -3.869 1.00 0.00 H new ATOM 0 HA HIS A 75 -2.819 -10.504 -3.728 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -1.124 -9.543 -2.129 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -2.435 -8.731 -1.297 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -1.210 -12.272 -2.201 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -3.600 -12.849 1.184 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -2.042 -13.956 -0.491 1.00 0.00 H new ATOM 1147 N GLN A 76 -5.156 -10.534 -2.714 1.00 0.00 N ATOM 1148 CA GLN A 76 -6.566 -10.526 -2.357 1.00 0.00 C ATOM 1149 C GLN A 76 -6.778 -11.019 -0.934 1.00 0.00 C ATOM 1150 O GLN A 76 -6.113 -11.949 -0.479 1.00 0.00 O ATOM 1151 CB GLN A 76 -7.380 -11.382 -3.327 1.00 0.00 C ATOM 1152 CG GLN A 76 -7.763 -10.658 -4.608 1.00 0.00 C ATOM 1153 CD GLN A 76 -8.530 -11.552 -5.568 1.00 0.00 C ATOM 1154 OE1 GLN A 76 -9.254 -12.454 -5.150 1.00 0.00 O ATOM 1155 NE2 GLN A 76 -8.368 -11.319 -6.860 1.00 0.00 N ATOM 0 H GLN A 76 -4.752 -11.466 -2.811 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.911 -9.494 -2.422 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -6.806 -12.273 -3.581 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -8.287 -11.720 -2.826 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -8.370 -9.787 -4.363 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.862 -10.291 -5.099 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -7.759 -10.561 -7.169 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -8.852 -11.897 -7.547 1.00 0.00 H new ATOM 1164 N ARG A 77 -7.698 -10.374 -0.240 1.00 0.00 N ATOM 1165 CA ARG A 77 -8.116 -10.787 1.093 1.00 0.00 C ATOM 1166 C ARG A 77 -9.599 -10.497 1.198 1.00 0.00 C ATOM 1167 O ARG A 77 -10.132 -9.826 0.331 1.00 0.00 O ATOM 1168 CB ARG A 77 -7.321 -10.045 2.183 1.00 0.00 C ATOM 1169 CG ARG A 77 -7.642 -8.559 2.323 1.00 0.00 C ATOM 1170 CD ARG A 77 -6.612 -7.864 3.205 1.00 0.00 C ATOM 1171 NE ARG A 77 -6.963 -6.476 3.532 1.00 0.00 N ATOM 1172 CZ ARG A 77 -6.065 -5.540 3.890 1.00 0.00 C ATOM 1173 NH1 ARG A 77 -4.765 -5.836 3.927 1.00 0.00 N ATOM 1174 NH2 ARG A 77 -6.463 -4.310 4.199 1.00 0.00 N ATOM 0 H ARG A 77 -8.181 -9.544 -0.585 1.00 0.00 H new ATOM 0 HA ARG A 77 -7.921 -11.848 1.246 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -7.506 -10.532 3.140 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -6.257 -10.152 1.971 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -7.659 -8.092 1.338 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -8.637 -8.436 2.751 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -6.497 -8.429 4.130 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -5.646 -7.877 2.701 1.00 0.00 H new ATOM 0 HE ARG A 77 -7.945 -6.206 3.485 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -4.449 -6.775 3.683 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -4.087 -5.124 4.199 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -7.454 -4.071 4.166 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -5.777 -3.605 4.470 1.00 0.00 H new ATOM 1188 N GLU A 78 -10.287 -11.001 2.203 1.00 0.00 N ATOM 1189 CA GLU A 78 -11.716 -10.734 2.288 1.00 0.00 C ATOM 1190 C GLU A 78 -12.086 -10.018 3.582 1.00 0.00 C ATOM 1191 O GLU A 78 -11.430 -10.174 4.613 1.00 0.00 O ATOM 1192 CB GLU A 78 -12.528 -12.025 2.138 1.00 0.00 C ATOM 1193 CG GLU A 78 -12.551 -12.901 3.376 1.00 0.00 C ATOM 1194 CD GLU A 78 -13.327 -14.181 3.162 1.00 0.00 C ATOM 1195 OE1 GLU A 78 -12.767 -15.136 2.579 1.00 0.00 O ATOM 1196 OE2 GLU A 78 -14.501 -14.245 3.578 1.00 0.00 O ATOM 0 H GLU A 78 -9.901 -11.578 2.950 1.00 0.00 H new ATOM 0 HA GLU A 78 -11.965 -10.070 1.461 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -13.553 -11.766 1.873 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.120 -12.602 1.308 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -11.528 -13.143 3.665 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -12.993 -12.345 4.203 1.00 0.00 H new ATOM 1203 N VAL A 79 -13.134 -9.211 3.500 1.00 0.00 N ATOM 1204 CA VAL A 79 -13.701 -8.564 4.667 1.00 0.00 C ATOM 1205 C VAL A 79 -15.170 -8.963 4.789 1.00 0.00 C ATOM 1206 O VAL A 79 -16.042 -8.391 4.129 1.00 0.00 O ATOM 1207 CB VAL A 79 -13.549 -7.018 4.629 1.00 0.00 C ATOM 1208 CG1 VAL A 79 -14.017 -6.437 3.302 1.00 0.00 C ATOM 1209 CG2 VAL A 79 -14.287 -6.367 5.793 1.00 0.00 C ATOM 0 H VAL A 79 -13.611 -8.989 2.626 1.00 0.00 H new ATOM 0 HA VAL A 79 -13.148 -8.900 5.544 1.00 0.00 H new ATOM 0 HB VAL A 79 -12.487 -6.796 4.729 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.894 -5.354 3.316 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -13.424 -6.859 2.491 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -15.068 -6.681 3.148 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.164 -5.285 5.742 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -15.347 -6.615 5.736 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.878 -6.735 6.734 1.00 0.00 H new ATOM 1219 N SER A 80 -15.418 -9.981 5.609 1.00 0.00 N ATOM 1220 CA SER A 80 -16.755 -10.544 5.803 1.00 0.00 C ATOM 1221 C SER A 80 -17.506 -10.723 4.476 1.00 0.00 C ATOM 1222 O SER A 80 -18.431 -9.971 4.162 1.00 0.00 O ATOM 1223 CB SER A 80 -17.565 -9.688 6.787 1.00 0.00 C ATOM 1224 OG SER A 80 -17.563 -8.316 6.418 1.00 0.00 O ATOM 0 H SER A 80 -14.695 -10.442 6.161 1.00 0.00 H new ATOM 0 HA SER A 80 -16.631 -11.538 6.232 1.00 0.00 H new ATOM 0 HB2 SER A 80 -18.592 -10.052 6.826 1.00 0.00 H new ATOM 0 HB3 SER A 80 -17.150 -9.796 7.789 1.00 0.00 H new ATOM 0 HG SER A 80 -17.711 -8.237 5.453 1.00 0.00 H new ATOM 1230 N GLY A 81 -17.077 -11.700 3.683 1.00 0.00 N ATOM 1231 CA GLY A 81 -17.764 -12.011 2.441 1.00 0.00 C ATOM 1232 C GLY A 81 -17.345 -11.148 1.257 1.00 0.00 C ATOM 1233 O GLY A 81 -17.520 -11.548 0.107 1.00 0.00 O ATOM 0 H GLY A 81 -16.264 -12.284 3.879 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -17.586 -13.057 2.193 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -18.837 -11.898 2.595 1.00 0.00 H new ATOM 1237 N ARG A 82 -16.801 -9.968 1.521 1.00 0.00 N ATOM 1238 CA ARG A 82 -16.381 -9.072 0.446 1.00 0.00 C ATOM 1239 C ARG A 82 -14.909 -9.281 0.133 1.00 0.00 C ATOM 1240 O ARG A 82 -14.097 -9.408 1.039 1.00 0.00 O ATOM 1241 CB ARG A 82 -16.626 -7.614 0.835 1.00 0.00 C ATOM 1242 CG ARG A 82 -18.071 -7.315 1.182 1.00 0.00 C ATOM 1243 CD ARG A 82 -18.263 -5.853 1.550 1.00 0.00 C ATOM 1244 NE ARG A 82 -19.625 -5.573 2.002 1.00 0.00 N ATOM 1245 CZ ARG A 82 -19.963 -5.407 3.281 1.00 0.00 C ATOM 1246 NH1 ARG A 82 -19.032 -5.446 4.229 1.00 0.00 N ATOM 1247 NH2 ARG A 82 -21.228 -5.177 3.609 1.00 0.00 N ATOM 0 H ARG A 82 -16.640 -9.608 2.462 1.00 0.00 H new ATOM 0 HA ARG A 82 -16.971 -9.302 -0.441 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -15.996 -7.363 1.689 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -16.318 -6.970 0.012 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -18.709 -7.565 0.335 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -18.385 -7.945 2.014 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -17.558 -5.582 2.336 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.033 -5.229 0.686 1.00 0.00 H new ATOM 0 HE ARG A 82 -20.359 -5.500 1.298 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -18.056 -5.603 3.979 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -19.294 -5.319 5.207 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -21.942 -5.127 2.883 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -21.486 -5.050 4.588 1.00 0.00 H new ATOM 1261 N ILE A 83 -14.563 -9.299 -1.142 1.00 0.00 N ATOM 1262 CA ILE A 83 -13.191 -9.574 -1.549 1.00 0.00 C ATOM 1263 C ILE A 83 -12.427 -8.272 -1.765 1.00 0.00 C ATOM 1264 O ILE A 83 -12.749 -7.487 -2.651 1.00 0.00 O ATOM 1265 CB ILE A 83 -13.125 -10.444 -2.834 1.00 0.00 C ATOM 1266 CG1 ILE A 83 -13.522 -11.899 -2.539 1.00 0.00 C ATOM 1267 CG2 ILE A 83 -11.730 -10.402 -3.448 1.00 0.00 C ATOM 1268 CD1 ILE A 83 -14.979 -12.095 -2.170 1.00 0.00 C ATOM 0 H ILE A 83 -15.208 -9.127 -1.913 1.00 0.00 H new ATOM 0 HA ILE A 83 -12.725 -10.139 -0.742 1.00 0.00 H new ATOM 0 HB ILE A 83 -13.836 -10.028 -3.548 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -13.298 -12.507 -3.415 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -12.901 -12.273 -1.725 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -11.709 -11.019 -4.346 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.478 -9.374 -3.708 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.005 -10.783 -2.729 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -15.167 -13.152 -1.979 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -15.208 -11.518 -1.274 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -15.611 -11.756 -2.991 1.00 0.00 H new ATOM 1280 N ILE A 84 -11.423 -8.048 -0.935 1.00 0.00 N ATOM 1281 CA ILE A 84 -10.609 -6.852 -1.020 1.00 0.00 C ATOM 1282 C ILE A 84 -9.427 -7.080 -1.958 1.00 0.00 C ATOM 1283 O ILE A 84 -8.676 -8.046 -1.818 1.00 0.00 O ATOM 1284 CB ILE A 84 -10.079 -6.403 0.364 1.00 0.00 C ATOM 1285 CG1 ILE A 84 -10.845 -7.077 1.499 1.00 0.00 C ATOM 1286 CG2 ILE A 84 -10.205 -4.903 0.518 1.00 0.00 C ATOM 1287 CD1 ILE A 84 -10.759 -6.312 2.803 1.00 0.00 C ATOM 0 H ILE A 84 -11.152 -8.687 -0.188 1.00 0.00 H new ATOM 0 HA ILE A 84 -11.250 -6.061 -1.410 1.00 0.00 H new ATOM 0 HB ILE A 84 -9.031 -6.697 0.419 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -11.892 -7.181 1.213 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.454 -8.083 1.647 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -9.828 -4.605 1.496 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -9.625 -4.407 -0.261 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -11.253 -4.615 0.430 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -11.323 -6.840 3.572 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -9.716 -6.231 3.109 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -11.176 -5.314 2.668 1.00 0.00 H new ATOM 1299 N HIS A 85 -9.271 -6.174 -2.904 1.00 0.00 N ATOM 1300 CA HIS A 85 -8.229 -6.263 -3.910 1.00 0.00 C ATOM 1301 C HIS A 85 -7.169 -5.199 -3.648 1.00 0.00 C ATOM 1302 O HIS A 85 -7.405 -4.016 -3.883 1.00 0.00 O ATOM 1303 CB HIS A 85 -8.845 -6.090 -5.309 1.00 0.00 C ATOM 1304 CG HIS A 85 -7.851 -5.847 -6.408 1.00 0.00 C ATOM 1305 ND1 HIS A 85 -7.912 -4.758 -7.249 1.00 0.00 N ATOM 1306 CD2 HIS A 85 -6.772 -6.563 -6.805 1.00 0.00 C ATOM 1307 CE1 HIS A 85 -6.916 -4.812 -8.108 1.00 0.00 C ATOM 1308 NE2 HIS A 85 -6.206 -5.898 -7.865 1.00 0.00 N ATOM 0 H HIS A 85 -9.866 -5.351 -2.997 1.00 0.00 H new ATOM 0 HA HIS A 85 -7.753 -7.243 -3.860 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -9.421 -6.983 -5.550 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -9.546 -5.256 -5.281 1.00 0.00 H new ATOM 0 HD1 HIS A 85 -8.619 -4.024 -7.212 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -6.421 -7.487 -6.368 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -6.713 -4.088 -8.883 1.00 0.00 H new ATOM 1317 N LEU A 86 -6.010 -5.619 -3.159 1.00 0.00 N ATOM 1318 CA LEU A 86 -4.931 -4.690 -2.857 1.00 0.00 C ATOM 1319 C LEU A 86 -3.901 -4.684 -3.971 1.00 0.00 C ATOM 1320 O LEU A 86 -3.423 -5.739 -4.390 1.00 0.00 O ATOM 1321 CB LEU A 86 -4.249 -5.054 -1.537 1.00 0.00 C ATOM 1322 CG LEU A 86 -4.962 -4.569 -0.272 1.00 0.00 C ATOM 1323 CD1 LEU A 86 -6.166 -5.437 0.052 1.00 0.00 C ATOM 1324 CD2 LEU A 86 -3.998 -4.536 0.900 1.00 0.00 C ATOM 0 H LEU A 86 -5.794 -6.596 -2.963 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.368 -3.696 -2.767 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.152 -6.138 -1.485 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -3.239 -4.643 -1.544 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.322 -3.557 -0.458 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.650 -5.066 0.956 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -6.872 -5.404 -0.778 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -5.841 -6.465 0.211 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -4.521 -4.189 1.791 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.605 -5.537 1.076 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.175 -3.858 0.675 1.00 0.00 H new ATOM 1336 N HIS A 87 -3.573 -3.501 -4.461 1.00 0.00 N ATOM 1337 CA HIS A 87 -2.529 -3.353 -5.465 1.00 0.00 C ATOM 1338 C HIS A 87 -1.425 -2.459 -4.912 1.00 0.00 C ATOM 1339 O HIS A 87 -1.659 -1.288 -4.614 1.00 0.00 O ATOM 1340 CB HIS A 87 -3.100 -2.756 -6.759 1.00 0.00 C ATOM 1341 CG HIS A 87 -2.245 -2.999 -7.970 1.00 0.00 C ATOM 1342 ND1 HIS A 87 -2.606 -2.595 -9.234 1.00 0.00 N ATOM 1343 CD2 HIS A 87 -1.069 -3.654 -8.114 1.00 0.00 C ATOM 1344 CE1 HIS A 87 -1.696 -2.995 -10.101 1.00 0.00 C ATOM 1345 NE2 HIS A 87 -0.749 -3.644 -9.451 1.00 0.00 N ATOM 0 H HIS A 87 -4.015 -2.626 -4.180 1.00 0.00 H new ATOM 0 HA HIS A 87 -2.119 -4.335 -5.700 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -4.090 -3.176 -6.935 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -3.228 -1.682 -6.626 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -3.448 -2.067 -9.465 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -0.488 -4.103 -7.322 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -1.722 -2.820 -11.166 1.00 0.00 H new ATOM 1354 N ALA A 88 -0.233 -3.016 -4.770 1.00 0.00 N ATOM 1355 CA ALA A 88 0.897 -2.282 -4.212 1.00 0.00 C ATOM 1356 C ALA A 88 1.659 -1.542 -5.300 1.00 0.00 C ATOM 1357 O ALA A 88 1.958 -2.102 -6.357 1.00 0.00 O ATOM 1358 CB ALA A 88 1.832 -3.223 -3.469 1.00 0.00 C ATOM 0 H ALA A 88 -0.020 -3.978 -5.034 1.00 0.00 H new ATOM 0 HA ALA A 88 0.503 -1.548 -3.509 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.669 -2.657 -3.060 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.290 -3.708 -2.657 1.00 0.00 H new ATOM 0 HB3 ALA A 88 2.208 -3.980 -4.157 1.00 0.00 H new ATOM 1364 N TRP A 89 1.965 -0.284 -5.033 1.00 0.00 N ATOM 1365 CA TRP A 89 2.669 0.566 -5.979 1.00 0.00 C ATOM 1366 C TRP A 89 3.860 1.245 -5.306 1.00 0.00 C ATOM 1367 O TRP A 89 3.752 1.730 -4.184 1.00 0.00 O ATOM 1368 CB TRP A 89 1.691 1.606 -6.550 1.00 0.00 C ATOM 1369 CG TRP A 89 2.335 2.877 -7.018 1.00 0.00 C ATOM 1370 CD1 TRP A 89 3.077 3.066 -8.147 1.00 0.00 C ATOM 1371 CD2 TRP A 89 2.277 4.144 -6.359 1.00 0.00 C ATOM 1372 NE1 TRP A 89 3.499 4.372 -8.216 1.00 0.00 N ATOM 1373 CE2 TRP A 89 3.015 5.053 -7.133 1.00 0.00 C ATOM 1374 CE3 TRP A 89 1.672 4.597 -5.185 1.00 0.00 C ATOM 1375 CZ2 TRP A 89 3.166 6.387 -6.771 1.00 0.00 C ATOM 1376 CZ3 TRP A 89 1.822 5.921 -4.828 1.00 0.00 C ATOM 1377 CH2 TRP A 89 2.562 6.802 -5.619 1.00 0.00 C ATOM 0 H TRP A 89 1.732 0.178 -4.154 1.00 0.00 H new ATOM 0 HA TRP A 89 3.056 -0.043 -6.796 1.00 0.00 H new ATOM 0 HB2 TRP A 89 1.152 1.158 -7.385 1.00 0.00 H new ATOM 0 HB3 TRP A 89 0.952 1.848 -5.786 1.00 0.00 H new ATOM 0 HD1 TRP A 89 3.300 2.303 -8.878 1.00 0.00 H new ATOM 0 HE1 TRP A 89 4.079 4.769 -8.955 1.00 0.00 H new ATOM 0 HE3 TRP A 89 1.097 3.923 -4.567 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 3.740 7.070 -7.379 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 1.359 6.282 -3.921 1.00 0.00 H new ATOM 0 HH2 TRP A 89 2.659 7.833 -5.313 1.00 0.00 H new ATOM 1388 N HIS A 90 4.994 1.259 -5.992 1.00 0.00 N ATOM 1389 CA HIS A 90 6.181 1.942 -5.496 1.00 0.00 C ATOM 1390 C HIS A 90 6.209 3.360 -6.046 1.00 0.00 C ATOM 1391 O HIS A 90 6.028 3.561 -7.240 1.00 0.00 O ATOM 1392 CB HIS A 90 7.450 1.184 -5.912 1.00 0.00 C ATOM 1393 CG HIS A 90 8.727 1.889 -5.558 1.00 0.00 C ATOM 1394 ND1 HIS A 90 9.559 2.447 -6.497 1.00 0.00 N ATOM 1395 CD2 HIS A 90 9.321 2.107 -4.364 1.00 0.00 C ATOM 1396 CE1 HIS A 90 10.602 2.983 -5.901 1.00 0.00 C ATOM 1397 NE2 HIS A 90 10.488 2.792 -4.604 1.00 0.00 N ATOM 0 H HIS A 90 5.117 0.804 -6.896 1.00 0.00 H new ATOM 0 HA HIS A 90 6.148 1.976 -4.407 1.00 0.00 H new ATOM 0 HB2 HIS A 90 7.446 0.202 -5.438 1.00 0.00 H new ATOM 0 HB3 HIS A 90 7.425 1.018 -6.989 1.00 0.00 H new ATOM 0 HD1 HIS A 90 9.394 2.446 -7.503 1.00 0.00 H new ATOM 0 HD2 HIS A 90 8.947 1.799 -3.399 1.00 0.00 H new ATOM 0 HE1 HIS A 90 11.416 3.494 -6.394 1.00 0.00 H new ATOM 0 HE2 HIS A 90 11.154 3.101 -3.896 1.00 0.00 H new ATOM 1406 N VAL A 91 6.452 4.334 -5.186 1.00 0.00 N ATOM 1407 CA VAL A 91 6.403 5.727 -5.606 1.00 0.00 C ATOM 1408 C VAL A 91 7.763 6.205 -6.120 1.00 0.00 C ATOM 1409 O VAL A 91 8.731 6.323 -5.366 1.00 0.00 O ATOM 1410 CB VAL A 91 5.904 6.640 -4.460 1.00 0.00 C ATOM 1411 CG1 VAL A 91 6.759 6.493 -3.214 1.00 0.00 C ATOM 1412 CG2 VAL A 91 5.854 8.092 -4.904 1.00 0.00 C ATOM 0 H VAL A 91 6.683 4.191 -4.203 1.00 0.00 H new ATOM 0 HA VAL A 91 5.691 5.792 -6.429 1.00 0.00 H new ATOM 0 HB VAL A 91 4.893 6.321 -4.209 1.00 0.00 H new ATOM 0 HG11 VAL A 91 6.378 7.149 -2.432 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.725 5.460 -2.869 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.789 6.764 -3.445 1.00 0.00 H new ATOM 0 HG21 VAL A 91 5.500 8.712 -4.081 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.852 8.416 -5.200 1.00 0.00 H new ATOM 0 HG23 VAL A 91 5.174 8.190 -5.750 1.00 0.00 H new ATOM 1422 N PRO A 92 7.854 6.458 -7.434 1.00 0.00 N ATOM 1423 CA PRO A 92 9.075 6.968 -8.055 1.00 0.00 C ATOM 1424 C PRO A 92 9.306 8.442 -7.732 1.00 0.00 C ATOM 1425 O PRO A 92 10.444 8.907 -7.678 1.00 0.00 O ATOM 1426 CB PRO A 92 8.824 6.779 -9.551 1.00 0.00 C ATOM 1427 CG PRO A 92 7.340 6.801 -9.701 1.00 0.00 C ATOM 1428 CD PRO A 92 6.780 6.236 -8.423 1.00 0.00 C ATOM 0 HA PRO A 92 9.965 6.451 -7.696 1.00 0.00 H new ATOM 0 HB2 PRO A 92 9.291 7.574 -10.133 1.00 0.00 H new ATOM 0 HB3 PRO A 92 9.242 5.837 -9.905 1.00 0.00 H new ATOM 0 HG2 PRO A 92 6.981 7.816 -9.868 1.00 0.00 H new ATOM 0 HG3 PRO A 92 7.027 6.207 -10.559 1.00 0.00 H new ATOM 0 HD2 PRO A 92 5.859 6.742 -8.133 1.00 0.00 H new ATOM 0 HD3 PRO A 92 6.544 5.177 -8.525 1.00 0.00 H new ATOM 1436 N ASP A 93 8.217 9.166 -7.501 1.00 0.00 N ATOM 1437 CA ASP A 93 8.289 10.595 -7.223 1.00 0.00 C ATOM 1438 C ASP A 93 7.043 11.064 -6.490 1.00 0.00 C ATOM 1439 O ASP A 93 5.936 10.598 -6.764 1.00 0.00 O ATOM 1440 CB ASP A 93 8.435 11.385 -8.524 1.00 0.00 C ATOM 1441 CG ASP A 93 8.416 12.887 -8.305 1.00 0.00 C ATOM 1442 OD1 ASP A 93 9.473 13.455 -7.955 1.00 0.00 O ATOM 1443 OD2 ASP A 93 7.345 13.500 -8.483 1.00 0.00 O ATOM 0 H ASP A 93 7.271 8.785 -7.501 1.00 0.00 H new ATOM 0 HA ASP A 93 9.161 10.770 -6.593 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.369 11.105 -9.011 1.00 0.00 H new ATOM 0 HB3 ASP A 93 7.627 11.111 -9.203 1.00 0.00 H new ATOM 1448 N PHE A 94 7.237 11.975 -5.557 1.00 0.00 N ATOM 1449 CA PHE A 94 6.139 12.577 -4.816 1.00 0.00 C ATOM 1450 C PHE A 94 6.474 14.025 -4.482 1.00 0.00 C ATOM 1451 O PHE A 94 7.624 14.354 -4.190 1.00 0.00 O ATOM 1452 CB PHE A 94 5.829 11.780 -3.537 1.00 0.00 C ATOM 1453 CG PHE A 94 6.977 11.677 -2.569 1.00 0.00 C ATOM 1454 CD1 PHE A 94 7.977 10.736 -2.752 1.00 0.00 C ATOM 1455 CD2 PHE A 94 7.052 12.526 -1.475 1.00 0.00 C ATOM 1456 CE1 PHE A 94 9.030 10.641 -1.863 1.00 0.00 C ATOM 1457 CE2 PHE A 94 8.104 12.435 -0.582 1.00 0.00 C ATOM 1458 CZ PHE A 94 9.094 11.492 -0.777 1.00 0.00 C ATOM 0 H PHE A 94 8.158 12.321 -5.289 1.00 0.00 H new ATOM 0 HA PHE A 94 5.246 12.555 -5.441 1.00 0.00 H new ATOM 0 HB2 PHE A 94 4.984 12.246 -3.030 1.00 0.00 H new ATOM 0 HB3 PHE A 94 5.517 10.774 -3.818 1.00 0.00 H new ATOM 0 HD1 PHE A 94 7.933 10.069 -3.600 1.00 0.00 H new ATOM 0 HD2 PHE A 94 6.281 13.266 -1.319 1.00 0.00 H new ATOM 0 HE1 PHE A 94 9.802 9.902 -2.017 1.00 0.00 H new ATOM 0 HE2 PHE A 94 8.151 13.101 0.267 1.00 0.00 H new ATOM 0 HZ PHE A 94 9.917 11.420 -0.081 1.00 0.00 H new ATOM 1468 N HIS A 95 5.480 14.894 -4.564 1.00 0.00 N ATOM 1469 CA HIS A 95 5.673 16.307 -4.278 1.00 0.00 C ATOM 1470 C HIS A 95 4.973 16.690 -2.982 1.00 0.00 C ATOM 1471 O HIS A 95 3.758 16.549 -2.865 1.00 0.00 O ATOM 1472 CB HIS A 95 5.127 17.150 -5.439 1.00 0.00 C ATOM 1473 CG HIS A 95 5.833 16.906 -6.740 1.00 0.00 C ATOM 1474 ND1 HIS A 95 5.206 16.393 -7.853 1.00 0.00 N ATOM 1475 CD2 HIS A 95 7.121 17.109 -7.099 1.00 0.00 C ATOM 1476 CE1 HIS A 95 6.078 16.286 -8.836 1.00 0.00 C ATOM 1477 NE2 HIS A 95 7.251 16.714 -8.408 1.00 0.00 N ATOM 0 H HIS A 95 4.527 14.645 -4.828 1.00 0.00 H new ATOM 0 HA HIS A 95 6.740 16.499 -4.164 1.00 0.00 H new ATOM 0 HB2 HIS A 95 4.066 16.936 -5.565 1.00 0.00 H new ATOM 0 HB3 HIS A 95 5.211 18.206 -5.182 1.00 0.00 H new ATOM 0 HD2 HIS A 95 7.904 17.509 -6.471 1.00 0.00 H new ATOM 0 HE1 HIS A 95 5.868 15.911 -9.827 1.00 0.00 H new ATOM 0 HE2 HIS A 95 8.110 16.746 -8.957 1.00 0.00 H new ATOM 1486 N GLY A 96 5.736 17.169 -2.012 1.00 0.00 N ATOM 1487 CA GLY A 96 5.155 17.582 -0.749 1.00 0.00 C ATOM 1488 C GLY A 96 5.894 17.002 0.440 1.00 0.00 C ATOM 1489 O GLY A 96 6.993 16.470 0.289 1.00 0.00 O ATOM 0 H GLY A 96 6.748 17.280 -2.075 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.165 18.670 -0.685 1.00 0.00 H new ATOM 0 HA3 GLY A 96 4.111 17.271 -0.713 1.00 0.00 H new ATOM 1493 N THR A 97 5.292 17.100 1.620 1.00 0.00 N ATOM 1494 CA THR A 97 5.886 16.571 2.831 1.00 0.00 C ATOM 1495 C THR A 97 4.961 15.520 3.423 1.00 0.00 C ATOM 1496 O THR A 97 3.804 15.811 3.727 1.00 0.00 O ATOM 1497 CB THR A 97 6.134 17.688 3.863 1.00 0.00 C ATOM 1498 OG1 THR A 97 6.937 18.724 3.279 1.00 0.00 O ATOM 1499 CG2 THR A 97 6.830 17.143 5.101 1.00 0.00 C ATOM 0 H THR A 97 4.385 17.546 1.759 1.00 0.00 H new ATOM 0 HA THR A 97 6.848 16.124 2.580 1.00 0.00 H new ATOM 0 HB THR A 97 5.168 18.096 4.160 1.00 0.00 H new ATOM 0 HG1 THR A 97 7.089 19.432 3.940 1.00 0.00 H new ATOM 0 HG21 THR A 97 6.993 17.952 5.813 1.00 0.00 H new ATOM 0 HG22 THR A 97 6.207 16.376 5.560 1.00 0.00 H new ATOM 0 HG23 THR A 97 7.790 16.710 4.818 1.00 0.00 H new ATOM 1507 N LEU A 98 5.472 14.310 3.592 1.00 0.00 N ATOM 1508 CA LEU A 98 4.629 13.195 3.990 1.00 0.00 C ATOM 1509 C LEU A 98 4.289 13.261 5.467 1.00 0.00 C ATOM 1510 O LEU A 98 5.165 13.353 6.330 1.00 0.00 O ATOM 1511 CB LEU A 98 5.252 11.848 3.603 1.00 0.00 C ATOM 1512 CG LEU A 98 6.769 11.751 3.724 1.00 0.00 C ATOM 1513 CD1 LEU A 98 7.175 11.224 5.092 1.00 0.00 C ATOM 1514 CD2 LEU A 98 7.317 10.877 2.610 1.00 0.00 C ATOM 0 H LEU A 98 6.456 14.077 3.461 1.00 0.00 H new ATOM 0 HA LEU A 98 3.692 13.278 3.440 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.808 11.073 4.227 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.975 11.625 2.573 1.00 0.00 H new ATOM 0 HG LEU A 98 7.196 12.749 3.624 1.00 0.00 H new ATOM 0 HD11 LEU A 98 8.262 11.165 5.151 1.00 0.00 H new ATOM 0 HD12 LEU A 98 6.806 11.897 5.866 1.00 0.00 H new ATOM 0 HD13 LEU A 98 6.749 10.232 5.241 1.00 0.00 H new ATOM 0 HD21 LEU A 98 8.401 10.810 2.700 1.00 0.00 H new ATOM 0 HD22 LEU A 98 6.885 9.879 2.684 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.059 11.313 1.645 1.00 0.00 H new ATOM 1526 N GLN A 99 2.996 13.256 5.738 1.00 0.00 N ATOM 1527 CA GLN A 99 2.486 13.371 7.088 1.00 0.00 C ATOM 1528 C GLN A 99 1.432 12.294 7.324 1.00 0.00 C ATOM 1529 O GLN A 99 1.018 11.621 6.388 1.00 0.00 O ATOM 1530 CB GLN A 99 1.896 14.772 7.295 1.00 0.00 C ATOM 1531 CG GLN A 99 0.587 15.016 6.557 1.00 0.00 C ATOM 1532 CD GLN A 99 0.060 16.420 6.778 1.00 0.00 C ATOM 1533 OE1 GLN A 99 0.829 17.357 6.986 1.00 0.00 O ATOM 1534 NE2 GLN A 99 -1.250 16.582 6.726 1.00 0.00 N ATOM 0 H GLN A 99 2.271 13.172 5.026 1.00 0.00 H new ATOM 0 HA GLN A 99 3.294 13.228 7.806 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.734 14.931 8.361 1.00 0.00 H new ATOM 0 HB3 GLN A 99 2.626 15.513 6.970 1.00 0.00 H new ATOM 0 HG2 GLN A 99 0.736 14.849 5.490 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -0.157 14.293 6.891 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -1.856 15.781 6.551 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -1.655 17.508 6.861 1.00 0.00 H new ATOM 1543 N ALA A 100 1.013 12.117 8.562 1.00 0.00 N ATOM 1544 CA ALA A 100 -0.019 11.138 8.873 1.00 0.00 C ATOM 1545 C ALA A 100 -1.308 11.820 9.304 1.00 0.00 C ATOM 1546 O ALA A 100 -1.334 12.558 10.292 1.00 0.00 O ATOM 1547 CB ALA A 100 0.456 10.184 9.951 1.00 0.00 C ATOM 0 H ALA A 100 1.367 12.634 9.367 1.00 0.00 H new ATOM 0 HA ALA A 100 -0.221 10.568 7.967 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -0.330 9.461 10.169 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.347 9.659 9.606 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.693 10.745 10.855 1.00 0.00 H new ATOM 1553 N HIS A 101 -2.374 11.580 8.558 1.00 0.00 N ATOM 1554 CA HIS A 101 -3.669 12.151 8.892 1.00 0.00 C ATOM 1555 C HIS A 101 -4.623 11.066 9.369 1.00 0.00 C ATOM 1556 O HIS A 101 -5.167 11.142 10.469 1.00 0.00 O ATOM 1557 CB HIS A 101 -4.275 12.871 7.688 1.00 0.00 C ATOM 1558 CG HIS A 101 -5.385 13.802 8.067 1.00 0.00 C ATOM 1559 ND1 HIS A 101 -6.712 13.431 8.100 1.00 0.00 N ATOM 1560 CD2 HIS A 101 -5.350 15.094 8.460 1.00 0.00 C ATOM 1561 CE1 HIS A 101 -7.439 14.456 8.497 1.00 0.00 C ATOM 1562 NE2 HIS A 101 -6.638 15.478 8.724 1.00 0.00 N ATOM 0 H HIS A 101 -2.369 10.997 7.721 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.517 12.874 9.694 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -3.494 13.433 7.176 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -4.652 12.132 6.981 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -7.074 12.509 7.856 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -4.468 15.711 8.550 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -8.512 14.458 8.616 1.00 0.00 H new ATOM 1571 N GLU A 102 -4.827 10.061 8.531 1.00 0.00 N ATOM 1572 CA GLU A 102 -5.713 8.960 8.868 1.00 0.00 C ATOM 1573 C GLU A 102 -4.964 7.940 9.716 1.00 0.00 C ATOM 1574 O GLU A 102 -5.472 7.463 10.729 1.00 0.00 O ATOM 1575 CB GLU A 102 -6.257 8.312 7.595 1.00 0.00 C ATOM 1576 CG GLU A 102 -7.049 9.265 6.710 1.00 0.00 C ATOM 1577 CD GLU A 102 -8.155 9.982 7.448 1.00 0.00 C ATOM 1578 OE1 GLU A 102 -9.133 9.322 7.855 1.00 0.00 O ATOM 1579 OE2 GLU A 102 -8.061 11.218 7.608 1.00 0.00 O ATOM 0 H GLU A 102 -4.390 9.986 7.612 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.557 9.340 9.443 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -5.424 7.906 7.021 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.895 7.472 7.870 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -6.370 10.002 6.282 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -7.479 8.706 5.879 1.00 0.00 H new ATOM 1586 N HIS A 103 -3.750 7.611 9.294 1.00 0.00 N ATOM 1587 CA HIS A 103 -2.857 6.794 10.107 1.00 0.00 C ATOM 1588 C HIS A 103 -2.180 7.683 11.154 1.00 0.00 C ATOM 1589 O HIS A 103 -2.190 8.905 11.021 1.00 0.00 O ATOM 1590 CB HIS A 103 -1.817 6.082 9.230 1.00 0.00 C ATOM 1591 CG HIS A 103 -2.396 5.036 8.307 1.00 0.00 C ATOM 1592 ND1 HIS A 103 -3.061 5.336 7.136 1.00 0.00 N ATOM 1593 CD2 HIS A 103 -2.400 3.682 8.393 1.00 0.00 C ATOM 1594 CE1 HIS A 103 -3.446 4.216 6.547 1.00 0.00 C ATOM 1595 NE2 HIS A 103 -3.055 3.203 7.289 1.00 0.00 N ATOM 0 H HIS A 103 -3.361 7.896 8.395 1.00 0.00 H new ATOM 0 HA HIS A 103 -3.435 6.022 10.614 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -1.292 6.827 8.632 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -1.076 5.611 9.875 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -3.230 6.277 6.779 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -1.967 3.091 9.186 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -3.989 4.145 5.616 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -3.214 2.218 7.077 1.00 0.00 H new ATOM 1604 N GLN A 104 -1.598 7.087 12.192 1.00 0.00 N ATOM 1605 CA GLN A 104 -1.100 7.868 13.325 1.00 0.00 C ATOM 1606 C GLN A 104 0.337 8.367 13.115 1.00 0.00 C ATOM 1607 O GLN A 104 0.570 9.570 13.031 1.00 0.00 O ATOM 1608 CB GLN A 104 -1.190 7.055 14.619 1.00 0.00 C ATOM 1609 CG GLN A 104 -0.958 7.885 15.873 1.00 0.00 C ATOM 1610 CD GLN A 104 -2.008 8.967 16.055 1.00 0.00 C ATOM 1611 OE1 GLN A 104 -3.166 8.804 15.664 1.00 0.00 O ATOM 1612 NE2 GLN A 104 -1.613 10.085 16.639 1.00 0.00 N ATOM 0 H GLN A 104 -1.460 6.080 12.274 1.00 0.00 H new ATOM 0 HA GLN A 104 -1.738 8.748 13.403 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -2.173 6.588 14.678 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -0.456 6.250 14.585 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -0.961 7.230 16.744 1.00 0.00 H new ATOM 0 HG3 GLN A 104 0.029 8.345 15.823 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -0.647 10.184 16.950 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -2.275 10.849 16.779 1.00 0.00 H new ATOM 1621 N ALA A 105 1.297 7.451 13.047 1.00 0.00 N ATOM 1622 CA ALA A 105 2.709 7.833 12.946 1.00 0.00 C ATOM 1623 C ALA A 105 3.381 7.157 11.756 1.00 0.00 C ATOM 1624 O ALA A 105 2.845 6.193 11.205 1.00 0.00 O ATOM 1625 CB ALA A 105 3.439 7.484 14.236 1.00 0.00 C ATOM 0 H ALA A 105 1.130 6.445 13.060 1.00 0.00 H new ATOM 0 HA ALA A 105 2.759 8.911 12.789 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.487 7.772 14.150 1.00 0.00 H new ATOM 0 HB2 ALA A 105 2.983 8.019 15.069 1.00 0.00 H new ATOM 0 HB3 ALA A 105 3.371 6.411 14.414 1.00 0.00 H new ATOM 1631 N LEU A 106 4.560 7.652 11.367 1.00 0.00 N ATOM 1632 CA LEU A 106 5.289 7.106 10.221 1.00 0.00 C ATOM 1633 C LEU A 106 6.649 6.581 10.664 1.00 0.00 C ATOM 1634 O LEU A 106 7.317 7.202 11.493 1.00 0.00 O ATOM 1635 CB LEU A 106 5.542 8.169 9.139 1.00 0.00 C ATOM 1636 CG LEU A 106 4.324 8.875 8.533 1.00 0.00 C ATOM 1637 CD1 LEU A 106 3.196 7.894 8.252 1.00 0.00 C ATOM 1638 CD2 LEU A 106 3.863 10.013 9.428 1.00 0.00 C ATOM 0 H LEU A 106 5.029 8.430 11.830 1.00 0.00 H new ATOM 0 HA LEU A 106 4.669 6.308 9.811 1.00 0.00 H new ATOM 0 HB2 LEU A 106 6.194 8.932 9.565 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.093 7.696 8.327 1.00 0.00 H new ATOM 0 HG LEU A 106 4.624 9.302 7.576 1.00 0.00 H new ATOM 0 HD11 LEU A 106 2.348 8.428 7.823 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.540 7.135 7.549 1.00 0.00 H new ATOM 0 HD13 LEU A 106 2.890 7.415 9.182 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.998 10.501 8.980 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.590 9.619 10.407 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.670 10.737 9.541 1.00 0.00 H new ATOM 1650 N VAL A 107 7.056 5.445 10.119 1.00 0.00 N ATOM 1651 CA VAL A 107 8.412 4.951 10.324 1.00 0.00 C ATOM 1652 C VAL A 107 9.039 4.529 8.995 1.00 0.00 C ATOM 1653 O VAL A 107 8.361 3.975 8.128 1.00 0.00 O ATOM 1654 CB VAL A 107 8.450 3.770 11.328 1.00 0.00 C ATOM 1655 CG1 VAL A 107 7.773 2.532 10.758 1.00 0.00 C ATOM 1656 CG2 VAL A 107 9.878 3.456 11.745 1.00 0.00 C ATOM 0 H VAL A 107 6.471 4.849 9.534 1.00 0.00 H new ATOM 0 HA VAL A 107 8.993 5.770 10.749 1.00 0.00 H new ATOM 0 HB VAL A 107 7.893 4.076 12.214 1.00 0.00 H new ATOM 0 HG11 VAL A 107 7.818 1.724 11.488 1.00 0.00 H new ATOM 0 HG12 VAL A 107 6.731 2.759 10.532 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.284 2.225 9.845 1.00 0.00 H new ATOM 0 HG21 VAL A 107 9.877 2.624 12.449 1.00 0.00 H new ATOM 0 HG22 VAL A 107 10.463 3.186 10.866 1.00 0.00 H new ATOM 0 HG23 VAL A 107 10.320 4.332 12.219 1.00 0.00 H new ATOM 1666 N TRP A 108 10.322 4.827 8.825 1.00 0.00 N ATOM 1667 CA TRP A 108 11.055 4.412 7.637 1.00 0.00 C ATOM 1668 C TRP A 108 11.889 3.174 7.927 1.00 0.00 C ATOM 1669 O TRP A 108 12.863 3.230 8.678 1.00 0.00 O ATOM 1670 CB TRP A 108 11.970 5.535 7.148 1.00 0.00 C ATOM 1671 CG TRP A 108 11.242 6.717 6.589 1.00 0.00 C ATOM 1672 CD1 TRP A 108 10.881 7.850 7.259 1.00 0.00 C ATOM 1673 CD2 TRP A 108 10.794 6.889 5.239 1.00 0.00 C ATOM 1674 NE1 TRP A 108 10.241 8.718 6.409 1.00 0.00 N ATOM 1675 CE2 TRP A 108 10.174 8.151 5.164 1.00 0.00 C ATOM 1676 CE3 TRP A 108 10.860 6.103 4.086 1.00 0.00 C ATOM 1677 CZ2 TRP A 108 9.626 8.641 3.984 1.00 0.00 C ATOM 1678 CZ3 TRP A 108 10.311 6.591 2.915 1.00 0.00 C ATOM 1679 CH2 TRP A 108 9.702 7.850 2.872 1.00 0.00 C ATOM 0 H TRP A 108 10.877 5.356 9.498 1.00 0.00 H new ATOM 0 HA TRP A 108 10.327 4.180 6.860 1.00 0.00 H new ATOM 0 HB2 TRP A 108 12.596 5.866 7.977 1.00 0.00 H new ATOM 0 HB3 TRP A 108 12.638 5.138 6.383 1.00 0.00 H new ATOM 0 HD1 TRP A 108 11.071 8.037 8.306 1.00 0.00 H new ATOM 0 HE1 TRP A 108 9.875 9.636 6.663 1.00 0.00 H new ATOM 0 HE3 TRP A 108 11.331 5.132 4.109 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 9.157 9.613 3.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 10.353 5.990 2.018 1.00 0.00 H new ATOM 0 HH2 TRP A 108 9.284 8.204 1.941 1.00 0.00 H new ATOM 1690 N CYS A 109 11.505 2.056 7.340 1.00 0.00 N ATOM 1691 CA CYS A 109 12.261 0.826 7.496 1.00 0.00 C ATOM 1692 C CYS A 109 12.550 0.205 6.136 1.00 0.00 C ATOM 1693 O CYS A 109 11.759 0.336 5.208 1.00 0.00 O ATOM 1694 CB CYS A 109 11.498 -0.156 8.387 1.00 0.00 C ATOM 1695 SG CYS A 109 9.800 -0.462 7.858 1.00 0.00 S ATOM 0 H CYS A 109 10.676 1.973 6.752 1.00 0.00 H new ATOM 0 HA CYS A 109 13.212 1.058 7.975 1.00 0.00 H new ATOM 0 HB2 CYS A 109 12.037 -1.103 8.410 1.00 0.00 H new ATOM 0 HB3 CYS A 109 11.486 0.229 9.407 1.00 0.00 H new ATOM 0 HG CYS A 109 9.711 -0.304 6.571 1.00 0.00 H new ATOM 1701 N SER A 110 13.685 -0.467 6.031 1.00 0.00 N ATOM 1702 CA SER A 110 14.110 -1.108 4.789 1.00 0.00 C ATOM 1703 C SER A 110 13.090 -2.169 4.355 1.00 0.00 C ATOM 1704 O SER A 110 12.297 -2.628 5.175 1.00 0.00 O ATOM 1705 CB SER A 110 15.468 -1.772 5.011 1.00 0.00 C ATOM 1706 OG SER A 110 16.329 -0.947 5.777 1.00 0.00 O ATOM 0 H SER A 110 14.341 -0.586 6.803 1.00 0.00 H new ATOM 0 HA SER A 110 14.183 -0.353 4.006 1.00 0.00 H new ATOM 0 HB2 SER A 110 15.329 -2.726 5.519 1.00 0.00 H new ATOM 0 HB3 SER A 110 15.931 -1.988 4.048 1.00 0.00 H new ATOM 0 HG SER A 110 17.189 -1.400 5.903 1.00 0.00 H new ATOM 1712 N PRO A 111 13.093 -2.572 3.067 1.00 0.00 N ATOM 1713 CA PRO A 111 12.203 -3.624 2.559 1.00 0.00 C ATOM 1714 C PRO A 111 12.195 -4.872 3.443 1.00 0.00 C ATOM 1715 O PRO A 111 11.140 -5.310 3.899 1.00 0.00 O ATOM 1716 CB PRO A 111 12.768 -3.952 1.165 1.00 0.00 C ATOM 1717 CG PRO A 111 14.054 -3.197 1.054 1.00 0.00 C ATOM 1718 CD PRO A 111 13.943 -2.035 1.996 1.00 0.00 C ATOM 0 HA PRO A 111 11.166 -3.289 2.539 1.00 0.00 H new ATOM 0 HB2 PRO A 111 12.934 -5.024 1.053 1.00 0.00 H new ATOM 0 HB3 PRO A 111 12.071 -3.654 0.381 1.00 0.00 H new ATOM 0 HG2 PRO A 111 14.901 -3.831 1.317 1.00 0.00 H new ATOM 0 HG3 PRO A 111 14.217 -2.855 0.032 1.00 0.00 H new ATOM 0 HD2 PRO A 111 14.918 -1.722 2.370 1.00 0.00 H new ATOM 0 HD3 PRO A 111 13.491 -1.166 1.517 1.00 0.00 H new ATOM 1726 N GLU A 112 13.368 -5.434 3.704 1.00 0.00 N ATOM 1727 CA GLU A 112 13.462 -6.644 4.514 1.00 0.00 C ATOM 1728 C GLU A 112 13.092 -6.369 5.971 1.00 0.00 C ATOM 1729 O GLU A 112 12.619 -7.258 6.678 1.00 0.00 O ATOM 1730 CB GLU A 112 14.858 -7.281 4.419 1.00 0.00 C ATOM 1731 CG GLU A 112 16.018 -6.351 4.756 1.00 0.00 C ATOM 1732 CD GLU A 112 16.405 -5.445 3.604 1.00 0.00 C ATOM 1733 OE1 GLU A 112 15.813 -4.358 3.476 1.00 0.00 O ATOM 1734 OE2 GLU A 112 17.307 -5.816 2.823 1.00 0.00 O ATOM 0 H GLU A 112 14.263 -5.075 3.370 1.00 0.00 H new ATOM 0 HA GLU A 112 12.742 -7.356 4.111 1.00 0.00 H new ATOM 0 HB2 GLU A 112 14.895 -8.140 5.089 1.00 0.00 H new ATOM 0 HB3 GLU A 112 14.999 -7.660 3.407 1.00 0.00 H new ATOM 0 HG2 GLU A 112 15.748 -5.740 5.617 1.00 0.00 H new ATOM 0 HG3 GLU A 112 16.882 -6.948 5.048 1.00 0.00 H new ATOM 1741 N GLU A 113 13.294 -5.134 6.411 1.00 0.00 N ATOM 1742 CA GLU A 113 12.944 -4.739 7.771 1.00 0.00 C ATOM 1743 C GLU A 113 11.431 -4.616 7.938 1.00 0.00 C ATOM 1744 O GLU A 113 10.891 -4.935 8.997 1.00 0.00 O ATOM 1745 CB GLU A 113 13.605 -3.407 8.130 1.00 0.00 C ATOM 1746 CG GLU A 113 15.123 -3.437 8.075 1.00 0.00 C ATOM 1747 CD GLU A 113 15.718 -4.501 8.969 1.00 0.00 C ATOM 1748 OE1 GLU A 113 15.398 -4.515 10.176 1.00 0.00 O ATOM 1749 OE2 GLU A 113 16.521 -5.315 8.474 1.00 0.00 O ATOM 0 H GLU A 113 13.699 -4.387 5.846 1.00 0.00 H new ATOM 0 HA GLU A 113 13.308 -5.516 8.443 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.242 -2.637 7.449 1.00 0.00 H new ATOM 0 HB3 GLU A 113 13.293 -3.117 9.133 1.00 0.00 H new ATOM 0 HG2 GLU A 113 15.442 -3.612 7.047 1.00 0.00 H new ATOM 0 HG3 GLU A 113 15.513 -2.462 8.368 1.00 0.00 H new ATOM 1756 N ALA A 114 10.759 -4.158 6.888 1.00 0.00 N ATOM 1757 CA ALA A 114 9.314 -3.937 6.915 1.00 0.00 C ATOM 1758 C ALA A 114 8.551 -5.224 7.198 1.00 0.00 C ATOM 1759 O ALA A 114 7.566 -5.219 7.931 1.00 0.00 O ATOM 1760 CB ALA A 114 8.851 -3.334 5.599 1.00 0.00 C ATOM 0 H ALA A 114 11.197 -3.929 5.996 1.00 0.00 H new ATOM 0 HA ALA A 114 9.102 -3.241 7.726 1.00 0.00 H new ATOM 0 HB1 ALA A 114 7.773 -3.174 5.631 1.00 0.00 H new ATOM 0 HB2 ALA A 114 9.355 -2.381 5.438 1.00 0.00 H new ATOM 0 HB3 ALA A 114 9.093 -4.014 4.782 1.00 0.00 H new ATOM 1766 N LEU A 115 9.019 -6.325 6.632 1.00 0.00 N ATOM 1767 CA LEU A 115 8.337 -7.603 6.786 1.00 0.00 C ATOM 1768 C LEU A 115 8.542 -8.155 8.198 1.00 0.00 C ATOM 1769 O LEU A 115 7.847 -9.074 8.628 1.00 0.00 O ATOM 1770 CB LEU A 115 8.835 -8.591 5.722 1.00 0.00 C ATOM 1771 CG LEU A 115 7.751 -9.439 5.035 1.00 0.00 C ATOM 1772 CD1 LEU A 115 7.330 -10.609 5.906 1.00 0.00 C ATOM 1773 CD2 LEU A 115 6.538 -8.583 4.690 1.00 0.00 C ATOM 0 H LEU A 115 9.865 -6.361 6.064 1.00 0.00 H new ATOM 0 HA LEU A 115 7.267 -7.456 6.643 1.00 0.00 H new ATOM 0 HB2 LEU A 115 9.371 -8.031 4.956 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.555 -9.264 6.187 1.00 0.00 H new ATOM 0 HG LEU A 115 8.178 -9.836 4.114 1.00 0.00 H new ATOM 0 HD11 LEU A 115 6.563 -11.188 5.392 1.00 0.00 H new ATOM 0 HD12 LEU A 115 8.193 -11.245 6.104 1.00 0.00 H new ATOM 0 HD13 LEU A 115 6.931 -10.235 6.849 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.783 -9.201 4.205 1.00 0.00 H new ATOM 0 HD22 LEU A 115 6.124 -8.154 5.602 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.838 -7.781 4.016 1.00 0.00 H new ATOM 1785 N GLN A 116 9.495 -7.578 8.922 1.00 0.00 N ATOM 1786 CA GLN A 116 9.734 -7.949 10.310 1.00 0.00 C ATOM 1787 C GLN A 116 8.776 -7.197 11.226 1.00 0.00 C ATOM 1788 O GLN A 116 8.641 -7.516 12.409 1.00 0.00 O ATOM 1789 CB GLN A 116 11.177 -7.637 10.698 1.00 0.00 C ATOM 1790 CG GLN A 116 12.205 -8.325 9.815 1.00 0.00 C ATOM 1791 CD GLN A 116 13.623 -7.884 10.113 1.00 0.00 C ATOM 1792 OE1 GLN A 116 13.957 -7.549 11.249 1.00 0.00 O ATOM 1793 NE2 GLN A 116 14.460 -7.858 9.089 1.00 0.00 N ATOM 0 H GLN A 116 10.115 -6.850 8.568 1.00 0.00 H new ATOM 0 HA GLN A 116 9.562 -9.020 10.420 1.00 0.00 H new ATOM 0 HB2 GLN A 116 11.333 -6.559 10.651 1.00 0.00 H new ATOM 0 HB3 GLN A 116 11.340 -7.938 11.733 1.00 0.00 H new ATOM 0 HG2 GLN A 116 12.129 -9.404 9.950 1.00 0.00 H new ATOM 0 HG3 GLN A 116 11.977 -8.117 8.770 1.00 0.00 H new ATOM 0 HE21 GLN A 116 14.142 -8.144 8.163 1.00 0.00 H new ATOM 0 HE22 GLN A 116 15.423 -7.552 9.225 1.00 0.00 H new ATOM 1802 N TYR A 117 8.104 -6.205 10.664 1.00 0.00 N ATOM 1803 CA TYR A 117 7.139 -5.414 11.405 1.00 0.00 C ATOM 1804 C TYR A 117 5.776 -6.090 11.349 1.00 0.00 C ATOM 1805 O TYR A 117 5.551 -6.964 10.510 1.00 0.00 O ATOM 1806 CB TYR A 117 7.045 -3.994 10.829 1.00 0.00 C ATOM 1807 CG TYR A 117 8.065 -3.026 11.386 1.00 0.00 C ATOM 1808 CD1 TYR A 117 9.371 -3.004 10.915 1.00 0.00 C ATOM 1809 CD2 TYR A 117 7.712 -2.123 12.379 1.00 0.00 C ATOM 1810 CE1 TYR A 117 10.297 -2.111 11.423 1.00 0.00 C ATOM 1811 CE2 TYR A 117 8.629 -1.227 12.891 1.00 0.00 C ATOM 1812 CZ TYR A 117 9.919 -1.224 12.410 1.00 0.00 C ATOM 1813 OH TYR A 117 10.835 -0.334 12.924 1.00 0.00 O ATOM 0 H TYR A 117 8.212 -5.928 9.688 1.00 0.00 H new ATOM 0 HA TYR A 117 7.467 -5.342 12.442 1.00 0.00 H new ATOM 0 HB2 TYR A 117 7.164 -4.045 9.747 1.00 0.00 H new ATOM 0 HB3 TYR A 117 6.046 -3.602 11.022 1.00 0.00 H new ATOM 0 HD1 TYR A 117 9.668 -3.695 10.140 1.00 0.00 H new ATOM 0 HD2 TYR A 117 6.701 -2.121 12.758 1.00 0.00 H new ATOM 0 HE1 TYR A 117 11.310 -2.108 11.049 1.00 0.00 H new ATOM 0 HE2 TYR A 117 8.336 -0.532 13.664 1.00 0.00 H new ATOM 0 HH TYR A 117 10.405 0.219 13.609 1.00 0.00 H new ATOM 1823 N PRO A 118 4.855 -5.722 12.250 1.00 0.00 N ATOM 1824 CA PRO A 118 3.502 -6.273 12.241 1.00 0.00 C ATOM 1825 C PRO A 118 2.665 -5.729 11.082 1.00 0.00 C ATOM 1826 O PRO A 118 1.868 -4.803 11.253 1.00 0.00 O ATOM 1827 CB PRO A 118 2.931 -5.835 13.590 1.00 0.00 C ATOM 1828 CG PRO A 118 3.681 -4.596 13.936 1.00 0.00 C ATOM 1829 CD PRO A 118 5.059 -4.765 13.357 1.00 0.00 C ATOM 0 HA PRO A 118 3.496 -7.354 12.102 1.00 0.00 H new ATOM 0 HB2 PRO A 118 1.860 -5.643 13.523 1.00 0.00 H new ATOM 0 HB3 PRO A 118 3.070 -6.606 14.348 1.00 0.00 H new ATOM 0 HG2 PRO A 118 3.190 -3.715 13.522 1.00 0.00 H new ATOM 0 HG3 PRO A 118 3.727 -4.457 15.016 1.00 0.00 H new ATOM 0 HD2 PRO A 118 5.463 -3.818 12.999 1.00 0.00 H new ATOM 0 HD3 PRO A 118 5.760 -5.151 14.097 1.00 0.00 H new ATOM 1837 N LEU A 119 2.893 -6.286 9.899 1.00 0.00 N ATOM 1838 CA LEU A 119 2.140 -5.919 8.706 1.00 0.00 C ATOM 1839 C LEU A 119 0.861 -6.743 8.604 1.00 0.00 C ATOM 1840 O LEU A 119 0.781 -7.851 9.139 1.00 0.00 O ATOM 1841 CB LEU A 119 2.988 -6.124 7.443 1.00 0.00 C ATOM 1842 CG LEU A 119 4.197 -5.194 7.285 1.00 0.00 C ATOM 1843 CD1 LEU A 119 4.919 -5.492 5.982 1.00 0.00 C ATOM 1844 CD2 LEU A 119 3.757 -3.738 7.325 1.00 0.00 C ATOM 0 H LEU A 119 3.602 -7.002 9.740 1.00 0.00 H new ATOM 0 HA LEU A 119 1.878 -4.864 8.787 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.344 -7.154 7.432 1.00 0.00 H new ATOM 0 HB3 LEU A 119 2.343 -6.000 6.573 1.00 0.00 H new ATOM 0 HG LEU A 119 4.883 -5.370 8.114 1.00 0.00 H new ATOM 0 HD11 LEU A 119 5.776 -4.826 5.880 1.00 0.00 H new ATOM 0 HD12 LEU A 119 5.262 -6.527 5.985 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.238 -5.338 5.145 1.00 0.00 H new ATOM 0 HD21 LEU A 119 4.627 -3.092 7.212 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.055 -3.548 6.513 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.273 -3.530 8.279 1.00 0.00 H new ATOM 1856 N ALA A 120 -0.141 -6.191 7.932 1.00 0.00 N ATOM 1857 CA ALA A 120 -1.406 -6.881 7.734 1.00 0.00 C ATOM 1858 C ALA A 120 -1.216 -8.122 6.853 1.00 0.00 C ATOM 1859 O ALA A 120 -0.275 -8.191 6.060 1.00 0.00 O ATOM 1860 CB ALA A 120 -2.423 -5.932 7.120 1.00 0.00 C ATOM 0 H ALA A 120 -0.100 -5.262 7.513 1.00 0.00 H new ATOM 0 HA ALA A 120 -1.779 -7.214 8.702 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.368 -6.456 6.975 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.577 -5.083 7.786 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.054 -5.576 6.158 1.00 0.00 H new ATOM 1866 N PRO A 121 -2.120 -9.117 6.974 1.00 0.00 N ATOM 1867 CA PRO A 121 -2.013 -10.406 6.264 1.00 0.00 C ATOM 1868 C PRO A 121 -1.826 -10.276 4.747 1.00 0.00 C ATOM 1869 O PRO A 121 -1.198 -11.125 4.119 1.00 0.00 O ATOM 1870 CB PRO A 121 -3.344 -11.107 6.574 1.00 0.00 C ATOM 1871 CG PRO A 121 -4.227 -10.056 7.158 1.00 0.00 C ATOM 1872 CD PRO A 121 -3.312 -9.080 7.832 1.00 0.00 C ATOM 0 HA PRO A 121 -1.128 -10.950 6.595 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -3.783 -11.530 5.671 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -3.199 -11.930 7.274 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -4.817 -9.567 6.383 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -4.930 -10.488 7.870 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.747 -8.082 7.879 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.085 -9.377 8.856 1.00 0.00 H new ATOM 1880 N ALA A 122 -2.363 -9.215 4.156 1.00 0.00 N ATOM 1881 CA ALA A 122 -2.270 -9.034 2.711 1.00 0.00 C ATOM 1882 C ALA A 122 -1.061 -8.196 2.342 1.00 0.00 C ATOM 1883 O ALA A 122 -0.610 -8.205 1.198 1.00 0.00 O ATOM 1884 CB ALA A 122 -3.524 -8.388 2.168 1.00 0.00 C ATOM 0 H ALA A 122 -2.862 -8.474 4.648 1.00 0.00 H new ATOM 0 HA ALA A 122 -2.159 -10.022 2.264 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.431 -8.263 1.089 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.384 -9.021 2.387 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.663 -7.413 2.635 1.00 0.00 H new ATOM 1890 N ASP A 123 -0.539 -7.485 3.320 1.00 0.00 N ATOM 1891 CA ASP A 123 0.571 -6.573 3.103 1.00 0.00 C ATOM 1892 C ASP A 123 1.887 -7.330 3.096 1.00 0.00 C ATOM 1893 O ASP A 123 2.871 -6.892 2.497 1.00 0.00 O ATOM 1894 CB ASP A 123 0.578 -5.497 4.186 1.00 0.00 C ATOM 1895 CG ASP A 123 -0.628 -4.576 4.092 1.00 0.00 C ATOM 1896 OD1 ASP A 123 -1.781 -5.081 4.163 1.00 0.00 O ATOM 1897 OD2 ASP A 123 -0.429 -3.354 3.957 1.00 0.00 O ATOM 0 H ASP A 123 -0.869 -7.521 4.285 1.00 0.00 H new ATOM 0 HA ASP A 123 0.449 -6.094 2.132 1.00 0.00 H new ATOM 0 HB2 ASP A 123 0.594 -5.972 5.167 1.00 0.00 H new ATOM 0 HB3 ASP A 123 1.491 -4.907 4.103 1.00 0.00 H new ATOM 1902 N ILE A 124 1.888 -8.486 3.748 1.00 0.00 N ATOM 1903 CA ILE A 124 3.054 -9.360 3.768 1.00 0.00 C ATOM 1904 C ILE A 124 3.418 -9.821 2.344 1.00 0.00 C ATOM 1905 O ILE A 124 4.518 -9.541 1.877 1.00 0.00 O ATOM 1906 CB ILE A 124 2.826 -10.583 4.692 1.00 0.00 C ATOM 1907 CG1 ILE A 124 2.541 -10.120 6.126 1.00 0.00 C ATOM 1908 CG2 ILE A 124 4.030 -11.518 4.654 1.00 0.00 C ATOM 1909 CD1 ILE A 124 2.200 -11.252 7.073 1.00 0.00 C ATOM 0 H ILE A 124 1.089 -8.842 4.273 1.00 0.00 H new ATOM 0 HA ILE A 124 3.889 -8.786 4.170 1.00 0.00 H new ATOM 0 HB ILE A 124 1.959 -11.135 4.329 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.413 -9.589 6.507 1.00 0.00 H new ATOM 0 HG13 ILE A 124 1.715 -9.408 6.112 1.00 0.00 H new ATOM 0 HG21 ILE A 124 3.850 -12.370 5.309 1.00 0.00 H new ATOM 0 HG22 ILE A 124 4.185 -11.871 3.634 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.917 -10.982 4.991 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.011 -10.849 8.068 1.00 0.00 H new ATOM 0 HD12 ILE A 124 1.310 -11.770 6.716 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.034 -11.953 7.118 1.00 0.00 H new ATOM 1921 N PRO A 125 2.501 -10.514 1.625 1.00 0.00 N ATOM 1922 CA PRO A 125 2.736 -10.953 0.238 1.00 0.00 C ATOM 1923 C PRO A 125 3.155 -9.811 -0.691 1.00 0.00 C ATOM 1924 O PRO A 125 3.913 -10.021 -1.638 1.00 0.00 O ATOM 1925 CB PRO A 125 1.383 -11.531 -0.211 1.00 0.00 C ATOM 1926 CG PRO A 125 0.405 -11.128 0.836 1.00 0.00 C ATOM 1927 CD PRO A 125 1.185 -10.957 2.102 1.00 0.00 C ATOM 0 HA PRO A 125 3.556 -11.669 0.193 1.00 0.00 H new ATOM 0 HB2 PRO A 125 1.095 -11.140 -1.187 1.00 0.00 H new ATOM 0 HB3 PRO A 125 1.432 -12.616 -0.304 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -0.097 -10.200 0.561 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -0.369 -11.886 0.956 1.00 0.00 H new ATOM 0 HD2 PRO A 125 0.726 -10.220 2.762 1.00 0.00 H new ATOM 0 HD3 PRO A 125 1.252 -11.889 2.663 1.00 0.00 H new ATOM 1935 N LEU A 126 2.680 -8.601 -0.408 1.00 0.00 N ATOM 1936 CA LEU A 126 3.000 -7.450 -1.243 1.00 0.00 C ATOM 1937 C LEU A 126 4.456 -7.056 -1.057 1.00 0.00 C ATOM 1938 O LEU A 126 5.186 -6.838 -2.026 1.00 0.00 O ATOM 1939 CB LEU A 126 2.100 -6.263 -0.890 1.00 0.00 C ATOM 1940 CG LEU A 126 0.603 -6.480 -1.119 1.00 0.00 C ATOM 1941 CD1 LEU A 126 -0.188 -5.263 -0.663 1.00 0.00 C ATOM 1942 CD2 LEU A 126 0.324 -6.776 -2.581 1.00 0.00 C ATOM 0 H LEU A 126 2.076 -8.394 0.388 1.00 0.00 H new ATOM 0 HA LEU A 126 2.831 -7.725 -2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 126 2.256 -6.010 0.159 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.418 -5.401 -1.477 1.00 0.00 H new ATOM 0 HG LEU A 126 0.287 -7.339 -0.528 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -1.251 -5.435 -0.833 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.014 -5.093 0.399 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.133 -4.388 -1.228 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.746 -6.927 -2.724 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.657 -5.937 -3.192 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.861 -7.677 -2.879 1.00 0.00 H new ATOM 1954 N LEU A 127 4.875 -6.982 0.198 1.00 0.00 N ATOM 1955 CA LEU A 127 6.236 -6.599 0.524 1.00 0.00 C ATOM 1956 C LEU A 127 7.199 -7.728 0.164 1.00 0.00 C ATOM 1957 O LEU A 127 8.306 -7.475 -0.315 1.00 0.00 O ATOM 1958 CB LEU A 127 6.339 -6.226 2.010 1.00 0.00 C ATOM 1959 CG LEU A 127 7.660 -5.573 2.451 1.00 0.00 C ATOM 1960 CD1 LEU A 127 8.761 -6.602 2.606 1.00 0.00 C ATOM 1961 CD2 LEU A 127 8.076 -4.502 1.459 1.00 0.00 C ATOM 0 H LEU A 127 4.288 -7.183 1.008 1.00 0.00 H new ATOM 0 HA LEU A 127 6.513 -5.722 -0.061 1.00 0.00 H new ATOM 0 HB2 LEU A 127 5.522 -5.546 2.251 1.00 0.00 H new ATOM 0 HB3 LEU A 127 6.187 -7.128 2.602 1.00 0.00 H new ATOM 0 HG LEU A 127 7.495 -5.111 3.424 1.00 0.00 H new ATOM 0 HD11 LEU A 127 9.680 -6.107 2.918 1.00 0.00 H new ATOM 0 HD12 LEU A 127 8.470 -7.335 3.358 1.00 0.00 H new ATOM 0 HD13 LEU A 127 8.926 -7.105 1.653 1.00 0.00 H new ATOM 0 HD21 LEU A 127 9.012 -4.049 1.784 1.00 0.00 H new ATOM 0 HD22 LEU A 127 8.213 -4.951 0.475 1.00 0.00 H new ATOM 0 HD23 LEU A 127 7.302 -3.736 1.404 1.00 0.00 H new ATOM 1973 N GLU A 128 6.772 -8.969 0.385 1.00 0.00 N ATOM 1974 CA GLU A 128 7.575 -10.131 0.025 1.00 0.00 C ATOM 1975 C GLU A 128 7.996 -10.076 -1.439 1.00 0.00 C ATOM 1976 O GLU A 128 9.135 -10.398 -1.773 1.00 0.00 O ATOM 1977 CB GLU A 128 6.803 -11.423 0.304 1.00 0.00 C ATOM 1978 CG GLU A 128 6.762 -11.802 1.777 1.00 0.00 C ATOM 1979 CD GLU A 128 8.096 -12.323 2.282 1.00 0.00 C ATOM 1980 OE1 GLU A 128 9.100 -11.587 2.210 1.00 0.00 O ATOM 1981 OE2 GLU A 128 8.149 -13.491 2.731 1.00 0.00 O ATOM 0 H GLU A 128 5.873 -9.194 0.812 1.00 0.00 H new ATOM 0 HA GLU A 128 8.476 -10.119 0.639 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.782 -11.313 -0.063 1.00 0.00 H new ATOM 0 HB3 GLU A 128 7.258 -12.237 -0.260 1.00 0.00 H new ATOM 0 HG2 GLU A 128 6.470 -10.932 2.365 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.997 -12.563 1.932 1.00 0.00 H new ATOM 1988 N ALA A 129 7.090 -9.650 -2.311 1.00 0.00 N ATOM 1989 CA ALA A 129 7.423 -9.524 -3.721 1.00 0.00 C ATOM 1990 C ALA A 129 8.192 -8.248 -3.992 1.00 0.00 C ATOM 1991 O ALA A 129 8.962 -8.182 -4.943 1.00 0.00 O ATOM 1992 CB ALA A 129 6.197 -9.570 -4.604 1.00 0.00 C ATOM 0 H ALA A 129 6.134 -9.390 -2.070 1.00 0.00 H new ATOM 0 HA ALA A 129 8.051 -10.381 -3.965 1.00 0.00 H new ATOM 0 HB1 ALA A 129 6.496 -9.472 -5.648 1.00 0.00 H new ATOM 0 HB2 ALA A 129 5.682 -10.520 -4.462 1.00 0.00 H new ATOM 0 HB3 ALA A 129 5.528 -8.751 -4.340 1.00 0.00 H new ATOM 1998 N PHE A 130 8.006 -7.234 -3.155 1.00 0.00 N ATOM 1999 CA PHE A 130 8.697 -5.972 -3.341 1.00 0.00 C ATOM 2000 C PHE A 130 10.186 -6.188 -3.137 1.00 0.00 C ATOM 2001 O PHE A 130 11.011 -5.733 -3.931 1.00 0.00 O ATOM 2002 CB PHE A 130 8.164 -4.926 -2.351 1.00 0.00 C ATOM 2003 CG PHE A 130 8.812 -3.575 -2.468 1.00 0.00 C ATOM 2004 CD1 PHE A 130 8.404 -2.683 -3.442 1.00 0.00 C ATOM 2005 CD2 PHE A 130 9.824 -3.197 -1.600 1.00 0.00 C ATOM 2006 CE1 PHE A 130 8.990 -1.438 -3.552 1.00 0.00 C ATOM 2007 CE2 PHE A 130 10.414 -1.953 -1.705 1.00 0.00 C ATOM 2008 CZ PHE A 130 9.996 -1.073 -2.683 1.00 0.00 C ATOM 0 H PHE A 130 7.385 -7.264 -2.346 1.00 0.00 H new ATOM 0 HA PHE A 130 8.522 -5.603 -4.352 1.00 0.00 H new ATOM 0 HB2 PHE A 130 7.090 -4.815 -2.501 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.307 -5.298 -1.336 1.00 0.00 H new ATOM 0 HD1 PHE A 130 7.617 -2.964 -4.126 1.00 0.00 H new ATOM 0 HD2 PHE A 130 10.155 -3.882 -0.834 1.00 0.00 H new ATOM 0 HE1 PHE A 130 8.661 -0.751 -4.318 1.00 0.00 H new ATOM 0 HE2 PHE A 130 11.202 -1.669 -1.023 1.00 0.00 H new ATOM 0 HZ PHE A 130 10.457 -0.100 -2.767 1.00 0.00 H new ATOM 2018 N MET A 131 10.521 -6.905 -2.073 1.00 0.00 N ATOM 2019 CA MET A 131 11.901 -7.258 -1.815 1.00 0.00 C ATOM 2020 C MET A 131 12.385 -8.274 -2.855 1.00 0.00 C ATOM 2021 O MET A 131 13.526 -8.202 -3.300 1.00 0.00 O ATOM 2022 CB MET A 131 12.079 -7.809 -0.393 1.00 0.00 C ATOM 2023 CG MET A 131 11.561 -9.225 -0.205 1.00 0.00 C ATOM 2024 SD MET A 131 12.068 -9.954 1.364 1.00 0.00 S ATOM 2025 CE MET A 131 11.334 -8.818 2.533 1.00 0.00 C ATOM 0 H MET A 131 9.856 -7.250 -1.380 1.00 0.00 H new ATOM 0 HA MET A 131 12.506 -6.355 -1.895 1.00 0.00 H new ATOM 0 HB2 MET A 131 13.138 -7.784 -0.136 1.00 0.00 H new ATOM 0 HB3 MET A 131 11.565 -7.150 0.307 1.00 0.00 H new ATOM 0 HG2 MET A 131 10.473 -9.219 -0.262 1.00 0.00 H new ATOM 0 HG3 MET A 131 11.920 -9.850 -1.023 1.00 0.00 H new ATOM 0 HE1 MET A 131 11.623 -9.101 3.545 1.00 0.00 H new ATOM 0 HE2 MET A 131 11.683 -7.806 2.325 1.00 0.00 H new ATOM 0 HE3 MET A 131 10.248 -8.853 2.442 1.00 0.00 H new ATOM 2035 N ALA A 132 11.505 -9.205 -3.255 1.00 0.00 N ATOM 2036 CA ALA A 132 11.831 -10.201 -4.278 1.00 0.00 C ATOM 2037 C ALA A 132 12.231 -9.540 -5.591 1.00 0.00 C ATOM 2038 O ALA A 132 13.218 -9.920 -6.218 1.00 0.00 O ATOM 2039 CB ALA A 132 10.632 -11.120 -4.502 1.00 0.00 C ATOM 0 H ALA A 132 10.559 -9.286 -2.881 1.00 0.00 H new ATOM 0 HA ALA A 132 12.681 -10.785 -3.924 1.00 0.00 H new ATOM 0 HB1 ALA A 132 10.878 -11.860 -5.264 1.00 0.00 H new ATOM 0 HB2 ALA A 132 10.384 -11.628 -3.570 1.00 0.00 H new ATOM 0 HB3 ALA A 132 9.778 -10.529 -4.832 1.00 0.00 H new ATOM 2045 N LEU A 133 11.472 -8.531 -5.976 1.00 0.00 N ATOM 2046 CA LEU A 133 11.688 -7.827 -7.229 1.00 0.00 C ATOM 2047 C LEU A 133 13.029 -7.110 -7.228 1.00 0.00 C ATOM 2048 O LEU A 133 13.795 -7.189 -8.185 1.00 0.00 O ATOM 2049 CB LEU A 133 10.554 -6.829 -7.441 1.00 0.00 C ATOM 2050 CG LEU A 133 9.238 -7.453 -7.913 1.00 0.00 C ATOM 2051 CD1 LEU A 133 8.095 -6.459 -7.814 1.00 0.00 C ATOM 2052 CD2 LEU A 133 9.373 -7.961 -9.339 1.00 0.00 C ATOM 0 H LEU A 133 10.688 -8.175 -5.430 1.00 0.00 H new ATOM 0 HA LEU A 133 11.699 -8.550 -8.045 1.00 0.00 H new ATOM 0 HB2 LEU A 133 10.375 -6.298 -6.506 1.00 0.00 H new ATOM 0 HB3 LEU A 133 10.872 -6.087 -8.173 1.00 0.00 H new ATOM 0 HG LEU A 133 9.012 -8.296 -7.259 1.00 0.00 H new ATOM 0 HD11 LEU A 133 7.173 -6.929 -8.156 1.00 0.00 H new ATOM 0 HD12 LEU A 133 7.978 -6.141 -6.778 1.00 0.00 H new ATOM 0 HD13 LEU A 133 8.312 -5.591 -8.437 1.00 0.00 H new ATOM 0 HD21 LEU A 133 8.429 -8.402 -9.659 1.00 0.00 H new ATOM 0 HD22 LEU A 133 9.628 -7.131 -9.998 1.00 0.00 H new ATOM 0 HD23 LEU A 133 10.159 -8.715 -9.384 1.00 0.00 H new ATOM 2064 N ARG A 134 13.307 -6.436 -6.131 1.00 0.00 N ATOM 2065 CA ARG A 134 14.530 -5.656 -5.995 1.00 0.00 C ATOM 2066 C ARG A 134 15.748 -6.549 -5.748 1.00 0.00 C ATOM 2067 O ARG A 134 16.889 -6.116 -5.909 1.00 0.00 O ATOM 2068 CB ARG A 134 14.363 -4.637 -4.870 1.00 0.00 C ATOM 2069 CG ARG A 134 13.276 -3.616 -5.163 1.00 0.00 C ATOM 2070 CD ARG A 134 12.921 -2.793 -3.935 1.00 0.00 C ATOM 2071 NE ARG A 134 14.049 -2.008 -3.428 1.00 0.00 N ATOM 2072 CZ ARG A 134 14.062 -0.676 -3.370 1.00 0.00 C ATOM 2073 NH1 ARG A 134 13.104 0.034 -3.953 1.00 0.00 N ATOM 2074 NH2 ARG A 134 15.065 -0.053 -2.764 1.00 0.00 N ATOM 0 H ARG A 134 12.700 -6.410 -5.312 1.00 0.00 H new ATOM 0 HA ARG A 134 14.708 -5.130 -6.933 1.00 0.00 H new ATOM 0 HB2 ARG A 134 14.125 -5.160 -3.944 1.00 0.00 H new ATOM 0 HB3 ARG A 134 15.309 -4.119 -4.710 1.00 0.00 H new ATOM 0 HG2 ARG A 134 13.608 -2.952 -5.961 1.00 0.00 H new ATOM 0 HG3 ARG A 134 12.385 -4.129 -5.525 1.00 0.00 H new ATOM 0 HD2 ARG A 134 12.098 -2.121 -4.180 1.00 0.00 H new ATOM 0 HD3 ARG A 134 12.566 -3.459 -3.148 1.00 0.00 H new ATOM 0 HE ARG A 134 14.874 -2.510 -3.100 1.00 0.00 H new ATOM 0 HH11 ARG A 134 12.350 -0.439 -4.451 1.00 0.00 H new ATOM 0 HH12 ARG A 134 13.122 1.053 -3.903 1.00 0.00 H new ATOM 0 HH21 ARG A 134 15.822 -0.593 -2.345 1.00 0.00 H new ATOM 0 HH22 ARG A 134 15.079 0.966 -2.717 1.00 0.00 H new ATOM 2088 N ALA A 135 15.508 -7.792 -5.353 1.00 0.00 N ATOM 2089 CA ALA A 135 16.593 -8.743 -5.140 1.00 0.00 C ATOM 2090 C ALA A 135 16.889 -9.560 -6.398 1.00 0.00 C ATOM 2091 O ALA A 135 18.046 -9.840 -6.705 1.00 0.00 O ATOM 2092 CB ALA A 135 16.265 -9.668 -3.980 1.00 0.00 C ATOM 0 H ALA A 135 14.576 -8.165 -5.174 1.00 0.00 H new ATOM 0 HA ALA A 135 17.488 -8.169 -4.900 1.00 0.00 H new ATOM 0 HB1 ALA A 135 17.084 -10.372 -3.833 1.00 0.00 H new ATOM 0 HB2 ALA A 135 16.126 -9.079 -3.073 1.00 0.00 H new ATOM 0 HB3 ALA A 135 15.350 -10.217 -4.200 1.00 0.00 H new ATOM 2098 N ALA A 136 15.842 -9.930 -7.126 1.00 0.00 N ATOM 2099 CA ALA A 136 15.990 -10.803 -8.289 1.00 0.00 C ATOM 2100 C ALA A 136 16.163 -10.010 -9.583 1.00 0.00 C ATOM 2101 O ALA A 136 16.682 -10.540 -10.567 1.00 0.00 O ATOM 2102 CB ALA A 136 14.794 -11.737 -8.402 1.00 0.00 C ATOM 0 H ALA A 136 14.883 -9.641 -6.934 1.00 0.00 H new ATOM 0 HA ALA A 136 16.896 -11.391 -8.142 1.00 0.00 H new ATOM 0 HB1 ALA A 136 14.917 -12.382 -9.272 1.00 0.00 H new ATOM 0 HB2 ALA A 136 14.725 -12.350 -7.503 1.00 0.00 H new ATOM 0 HB3 ALA A 136 13.883 -11.149 -8.512 1.00 0.00 H new ATOM 2108 N ARG A 137 15.722 -8.746 -9.558 1.00 0.00 N ATOM 2109 CA ARG A 137 15.762 -7.837 -10.716 1.00 0.00 C ATOM 2110 C ARG A 137 15.407 -8.546 -12.031 1.00 0.00 C ATOM 2111 O ARG A 137 16.278 -8.871 -12.844 1.00 0.00 O ATOM 2112 CB ARG A 137 17.115 -7.097 -10.819 1.00 0.00 C ATOM 2113 CG ARG A 137 18.335 -7.988 -11.021 1.00 0.00 C ATOM 2114 CD ARG A 137 19.609 -7.172 -11.170 1.00 0.00 C ATOM 2115 NE ARG A 137 19.529 -6.206 -12.271 1.00 0.00 N ATOM 2116 CZ ARG A 137 20.584 -5.566 -12.776 1.00 0.00 C ATOM 2117 NH1 ARG A 137 21.805 -5.832 -12.333 1.00 0.00 N ATOM 2118 NH2 ARG A 137 20.413 -4.668 -13.737 1.00 0.00 N ATOM 0 H ARG A 137 15.322 -8.318 -8.723 1.00 0.00 H new ATOM 0 HA ARG A 137 14.990 -7.086 -10.545 1.00 0.00 H new ATOM 0 HB2 ARG A 137 17.061 -6.391 -11.647 1.00 0.00 H new ATOM 0 HB3 ARG A 137 17.260 -6.512 -9.911 1.00 0.00 H new ATOM 0 HG2 ARG A 137 18.434 -8.666 -10.174 1.00 0.00 H new ATOM 0 HG3 ARG A 137 18.192 -8.605 -11.908 1.00 0.00 H new ATOM 0 HD2 ARG A 137 19.809 -6.642 -10.239 1.00 0.00 H new ATOM 0 HD3 ARG A 137 20.450 -7.844 -11.340 1.00 0.00 H new ATOM 0 HE ARG A 137 18.612 -6.012 -12.674 1.00 0.00 H new ATOM 0 HH11 ARG A 137 21.941 -6.530 -11.602 1.00 0.00 H new ATOM 0 HH12 ARG A 137 22.608 -5.339 -12.724 1.00 0.00 H new ATOM 0 HH21 ARG A 137 19.476 -4.469 -14.088 1.00 0.00 H new ATOM 0 HH22 ARG A 137 21.218 -4.177 -14.125 1.00 0.00 H new ATOM 2132 N PRO A 138 14.110 -8.821 -12.244 1.00 0.00 N ATOM 2133 CA PRO A 138 13.638 -9.496 -13.454 1.00 0.00 C ATOM 2134 C PRO A 138 13.870 -8.668 -14.706 1.00 0.00 C ATOM 2135 O PRO A 138 13.745 -7.440 -14.689 1.00 0.00 O ATOM 2136 CB PRO A 138 12.137 -9.675 -13.219 1.00 0.00 C ATOM 2137 CG PRO A 138 11.962 -9.515 -11.753 1.00 0.00 C ATOM 2138 CD PRO A 138 13.001 -8.516 -11.332 1.00 0.00 C ATOM 0 HA PRO A 138 14.171 -10.433 -13.618 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.559 -8.933 -13.770 1.00 0.00 H new ATOM 0 HB3 PRO A 138 11.798 -10.656 -13.553 1.00 0.00 H new ATOM 0 HG2 PRO A 138 10.959 -9.162 -11.514 1.00 0.00 H new ATOM 0 HG3 PRO A 138 12.098 -10.465 -11.235 1.00 0.00 H new ATOM 0 HD2 PRO A 138 12.650 -7.490 -11.446 1.00 0.00 H new ATOM 0 HD3 PRO A 138 13.286 -8.641 -10.287 1.00 0.00 H new ATOM 2146 N ALA A 139 14.220 -9.349 -15.782 1.00 0.00 N ATOM 2147 CA ALA A 139 14.420 -8.706 -17.069 1.00 0.00 C ATOM 2148 C ALA A 139 13.113 -8.106 -17.574 1.00 0.00 C ATOM 2149 O ALA A 139 12.998 -6.895 -17.766 1.00 0.00 O ATOM 2150 CB ALA A 139 14.962 -9.720 -18.060 1.00 0.00 C ATOM 0 H ALA A 139 14.373 -10.357 -15.790 1.00 0.00 H new ATOM 0 HA ALA A 139 15.141 -7.896 -16.958 1.00 0.00 H new ATOM 0 HB1 ALA A 139 15.113 -9.239 -19.027 1.00 0.00 H new ATOM 0 HB2 ALA A 139 15.912 -10.111 -17.697 1.00 0.00 H new ATOM 0 HB3 ALA A 139 14.251 -10.539 -18.169 1.00 0.00 H new ATOM 2156 N ASP A 140 12.128 -8.966 -17.776 1.00 0.00 N ATOM 2157 CA ASP A 140 10.792 -8.539 -18.163 1.00 0.00 C ATOM 2158 C ASP A 140 9.775 -9.138 -17.212 1.00 0.00 C ATOM 2159 O ASP A 140 9.387 -8.446 -16.247 1.00 0.00 O ATOM 2160 CB ASP A 140 10.470 -8.954 -19.602 1.00 0.00 C ATOM 2161 CG ASP A 140 11.079 -8.025 -20.630 1.00 0.00 C ATOM 2162 OD1 ASP A 140 10.523 -6.926 -20.847 1.00 0.00 O ATOM 2163 OD2 ASP A 140 12.100 -8.399 -21.249 1.00 0.00 O ATOM 2164 OXT ASP A 140 9.397 -10.311 -17.406 1.00 0.00 O ATOM 0 H ASP A 140 12.231 -9.976 -17.677 1.00 0.00 H new ATOM 0 HA ASP A 140 10.750 -7.451 -18.111 1.00 0.00 H new ATOM 0 HB2 ASP A 140 10.834 -9.967 -19.773 1.00 0.00 H new ATOM 0 HB3 ASP A 140 9.388 -8.977 -19.735 1.00 0.00 H new TER 2169 ASP A 140