USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1027 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 59 CYS SG : rot -125:sc= -0.764 USER MOD Set 1.2: A 89 GLN : amide:sc= -2.58! C(o=-3.3!,f=-5.6!) USER MOD Set 2.1: A 48 ASN : amide:sc= -2.42! C(o=-2.3!,f=-6.4!) USER MOD Set 2.2: A 50 SER OG : rot -40:sc= 0.164 USER MOD Set 2.3: A 111 HIS : no HD1:sc= -0.0775 K(o=-2.3,f=-4.8) USER MOD Single : A 1 GLY N :NH3+ -113:sc= 0.0466 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 31:sc= 0.887 USER MOD Single : A 6 SER OG : rot 180:sc= -0.025 USER MOD Single : A 17 LYS NZ :NH3+ -124:sc=-0.00151 (180deg=-0.522) USER MOD Single : A 25 GLN : amide:sc= -0.0226 K(o=-0.023,f=-1.5!) USER MOD Single : A 27 ASN :FLIP amide:sc= -0.0868 F(o=-1.1,f=-0.087) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.0353 K(o=-0.035,f=-0.56) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 32:sc= 0.0435 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= -0.129 X(o=-0.13,f=-0.0055) USER MOD Single : A 60 GLN : amide:sc= -0.114 K(o=-0.11,f=-1.1) USER MOD Single : A 65 LYS NZ :NH3+ -157:sc= -0.0694 (180deg=-0.44) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -3.87! C(o=-3.9!,f=-11!) USER MOD Single : A 70 GLN : amide:sc= -0.402 K(o=-0.4,f=-4.1!) USER MOD Single : A 72 GLN : amide:sc= -0.252 K(o=-0.25,f=-2!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.0368 X(o=-0.037,f=-0.52) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 37:sc= 0.0702 USER MOD Single : A 95 ASN : amide:sc= -0.93! C(o=-0.93!,f=-2.8!) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.621 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 HIS : no HD1:sc= -0.0141 X(o=-0.014,f=-0.16) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 SER OG : rot 34:sc= 0.202 USER MOD Single : A 117 GLN : amide:sc= -4.18! C(o=-4.2!,f=-6.3!) USER MOD Single : A 123 ASN : amide:sc= -0.019 X(o=-0.019,f=-0.024) USER MOD Single : A 124 ASN : amide:sc= -0.0416 X(o=-0.042,f=-0.41) USER MOD Single : A 129 SER OG : rot -94:sc= 0.535 USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.346 -32.240 1.659 1.00 0.00 N ATOM 2 CA GLY A 1 -14.117 -30.825 1.883 1.00 0.00 C ATOM 3 C GLY A 1 -15.399 -30.016 1.835 1.00 0.00 C ATOM 4 O GLY A 1 -16.375 -30.425 1.206 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.136 -32.768 2.530 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.340 -32.393 1.392 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.727 -32.575 0.894 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.639 -30.686 2.853 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.425 -30.448 1.130 1.00 0.00 H new ATOM 8 N SER A 2 -15.397 -28.867 2.502 1.00 0.00 N ATOM 9 CA SER A 2 -16.570 -28.002 2.538 1.00 0.00 C ATOM 10 C SER A 2 -16.220 -26.635 3.120 1.00 0.00 C ATOM 11 O SER A 2 -15.088 -26.401 3.544 1.00 0.00 O ATOM 12 CB SER A 2 -17.683 -28.650 3.363 1.00 0.00 C ATOM 13 OG SER A 2 -17.442 -28.501 4.751 1.00 0.00 O ATOM 0 H SER A 2 -14.596 -28.513 3.025 1.00 0.00 H new ATOM 0 HA SER A 2 -16.920 -27.863 1.515 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.641 -28.197 3.106 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.754 -29.709 3.115 1.00 0.00 H new ATOM 0 HG SER A 2 -18.168 -28.922 5.256 1.00 0.00 H new ATOM 19 N SER A 3 -17.199 -25.737 3.136 1.00 0.00 N ATOM 20 CA SER A 3 -16.995 -24.393 3.662 1.00 0.00 C ATOM 21 C SER A 3 -16.160 -24.430 4.938 1.00 0.00 C ATOM 22 O SER A 3 -15.101 -23.808 5.018 1.00 0.00 O ATOM 23 CB SER A 3 -18.342 -23.721 3.940 1.00 0.00 C ATOM 24 OG SER A 3 -18.169 -22.359 4.291 1.00 0.00 O ATOM 0 H SER A 3 -18.142 -25.916 2.791 1.00 0.00 H new ATOM 0 HA SER A 3 -16.456 -23.814 2.912 1.00 0.00 H new ATOM 0 HB2 SER A 3 -18.978 -23.795 3.058 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.854 -24.246 4.747 1.00 0.00 H new ATOM 0 HG SER A 3 -19.044 -21.952 4.462 1.00 0.00 H new ATOM 30 N GLY A 4 -16.645 -25.164 5.935 1.00 0.00 N ATOM 31 CA GLY A 4 -15.931 -25.269 7.194 1.00 0.00 C ATOM 32 C GLY A 4 -14.465 -25.606 7.004 1.00 0.00 C ATOM 33 O GLY A 4 -14.003 -25.780 5.876 1.00 0.00 O ATOM 0 H GLY A 4 -17.519 -25.688 5.893 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.017 -24.327 7.736 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.400 -26.036 7.811 1.00 0.00 H new ATOM 37 N SER A 5 -13.732 -25.697 8.108 1.00 0.00 N ATOM 38 CA SER A 5 -12.309 -26.009 8.058 1.00 0.00 C ATOM 39 C SER A 5 -12.010 -27.306 8.805 1.00 0.00 C ATOM 40 O SER A 5 -12.189 -27.390 10.020 1.00 0.00 O ATOM 41 CB SER A 5 -11.492 -24.863 8.657 1.00 0.00 C ATOM 42 OG SER A 5 -11.757 -24.717 10.041 1.00 0.00 O ATOM 0 H SER A 5 -14.100 -25.559 9.049 1.00 0.00 H new ATOM 0 HA SER A 5 -12.028 -26.139 7.013 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.429 -25.052 8.505 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.728 -23.934 8.138 1.00 0.00 H new ATOM 0 HG SER A 5 -11.981 -25.590 10.425 1.00 0.00 H new ATOM 48 N SER A 6 -11.555 -28.314 8.068 1.00 0.00 N ATOM 49 CA SER A 6 -11.235 -29.609 8.658 1.00 0.00 C ATOM 50 C SER A 6 -9.759 -29.682 9.038 1.00 0.00 C ATOM 51 O SER A 6 -8.934 -30.183 8.275 1.00 0.00 O ATOM 52 CB SER A 6 -11.579 -30.737 7.684 1.00 0.00 C ATOM 53 OG SER A 6 -10.974 -31.955 8.079 1.00 0.00 O ATOM 0 H SER A 6 -11.400 -28.259 7.061 1.00 0.00 H new ATOM 0 HA SER A 6 -11.832 -29.726 9.562 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.661 -30.863 7.637 1.00 0.00 H new ATOM 0 HB3 SER A 6 -11.245 -30.470 6.681 1.00 0.00 H new ATOM 0 HG SER A 6 -11.211 -32.660 7.441 1.00 0.00 H new ATOM 59 N GLY A 7 -9.434 -29.179 10.225 1.00 0.00 N ATOM 60 CA GLY A 7 -8.059 -29.197 10.687 1.00 0.00 C ATOM 61 C GLY A 7 -7.730 -28.014 11.577 1.00 0.00 C ATOM 62 O GLY A 7 -8.598 -27.212 11.925 1.00 0.00 O ATOM 0 H GLY A 7 -10.099 -28.759 10.875 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.875 -30.122 11.234 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -7.390 -29.197 9.827 1.00 0.00 H new ATOM 66 N PRO A 8 -6.451 -27.894 11.961 1.00 0.00 N ATOM 67 CA PRO A 8 -5.981 -26.804 12.821 1.00 0.00 C ATOM 68 C PRO A 8 -5.996 -25.456 12.109 1.00 0.00 C ATOM 69 O PRO A 8 -6.156 -25.372 10.891 1.00 0.00 O ATOM 70 CB PRO A 8 -4.546 -27.214 13.161 1.00 0.00 C ATOM 71 CG PRO A 8 -4.124 -28.089 12.031 1.00 0.00 C ATOM 72 CD PRO A 8 -5.364 -28.813 11.583 1.00 0.00 C ATOM 0 HA PRO A 8 -6.619 -26.670 13.695 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -3.896 -26.343 13.251 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -4.501 -27.746 14.112 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.701 -27.499 11.218 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -3.354 -28.793 12.348 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -5.353 -29.002 10.510 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -5.465 -29.780 12.076 1.00 0.00 H new ATOM 80 N PRO A 9 -5.826 -24.375 12.885 1.00 0.00 N ATOM 81 CA PRO A 9 -5.815 -23.010 12.349 1.00 0.00 C ATOM 82 C PRO A 9 -4.573 -22.726 11.511 1.00 0.00 C ATOM 83 O PRO A 9 -3.458 -23.115 11.859 1.00 0.00 O ATOM 84 CB PRO A 9 -5.824 -22.136 13.605 1.00 0.00 C ATOM 85 CG PRO A 9 -5.220 -22.990 14.666 1.00 0.00 C ATOM 86 CD PRO A 9 -5.630 -24.401 14.344 1.00 0.00 C ATOM 0 HA PRO A 9 -6.656 -22.828 11.680 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -5.248 -21.223 13.456 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -6.837 -21.834 13.869 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -4.135 -22.891 14.676 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -5.576 -22.696 15.653 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -4.862 -25.118 14.634 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -6.544 -24.683 14.867 1.00 0.00 H new ATOM 94 N PRO A 10 -4.767 -22.032 10.380 1.00 0.00 N ATOM 95 CA PRO A 10 -3.673 -21.680 9.469 1.00 0.00 C ATOM 96 C PRO A 10 -2.737 -20.635 10.066 1.00 0.00 C ATOM 97 O PRO A 10 -2.865 -20.266 11.233 1.00 0.00 O ATOM 98 CB PRO A 10 -4.398 -21.113 8.247 1.00 0.00 C ATOM 99 CG PRO A 10 -5.699 -20.614 8.775 1.00 0.00 C ATOM 100 CD PRO A 10 -6.069 -21.538 9.903 1.00 0.00 C ATOM 0 HA PRO A 10 -3.037 -22.536 9.244 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -3.825 -20.310 7.784 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -4.547 -21.878 7.485 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -5.609 -19.586 9.126 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -6.464 -20.620 7.998 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -6.613 -21.015 10.689 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -6.708 -22.353 9.562 1.00 0.00 H new ATOM 108 N ALA A 11 -1.795 -20.161 9.257 1.00 0.00 N ATOM 109 CA ALA A 11 -0.838 -19.156 9.704 1.00 0.00 C ATOM 110 C ALA A 11 -0.882 -17.921 8.810 1.00 0.00 C ATOM 111 O ALA A 11 -0.286 -17.883 7.734 1.00 0.00 O ATOM 112 CB ALA A 11 0.566 -19.740 9.733 1.00 0.00 C ATOM 0 H ALA A 11 -1.674 -20.457 8.288 1.00 0.00 H new ATOM 0 HA ALA A 11 -1.113 -18.851 10.714 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.270 -18.978 10.069 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.594 -20.587 10.418 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.842 -20.074 8.733 1.00 0.00 H new ATOM 118 N PRO A 12 -1.603 -16.886 9.265 1.00 0.00 N ATOM 119 CA PRO A 12 -1.741 -15.630 8.522 1.00 0.00 C ATOM 120 C PRO A 12 -0.442 -14.833 8.483 1.00 0.00 C ATOM 121 O PRO A 12 0.592 -15.291 8.971 1.00 0.00 O ATOM 122 CB PRO A 12 -2.812 -14.869 9.307 1.00 0.00 C ATOM 123 CG PRO A 12 -2.729 -15.417 10.690 1.00 0.00 C ATOM 124 CD PRO A 12 -2.340 -16.861 10.540 1.00 0.00 C ATOM 0 HA PRO A 12 -2.000 -15.801 7.477 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -2.624 -13.795 9.295 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -3.802 -15.024 8.878 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -1.992 -14.874 11.282 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -3.685 -15.322 11.206 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -1.719 -17.198 11.370 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -3.214 -17.512 10.512 1.00 0.00 H new ATOM 132 N ILE A 13 -0.501 -13.641 7.901 1.00 0.00 N ATOM 133 CA ILE A 13 0.671 -12.781 7.800 1.00 0.00 C ATOM 134 C ILE A 13 0.464 -11.477 8.564 1.00 0.00 C ATOM 135 O ILE A 13 -0.454 -10.705 8.286 1.00 0.00 O ATOM 136 CB ILE A 13 1.007 -12.455 6.333 1.00 0.00 C ATOM 137 CG1 ILE A 13 1.085 -13.741 5.507 1.00 0.00 C ATOM 138 CG2 ILE A 13 2.315 -11.683 6.247 1.00 0.00 C ATOM 139 CD1 ILE A 13 0.757 -13.541 4.044 1.00 0.00 C ATOM 0 H ILE A 13 -1.349 -13.248 7.492 1.00 0.00 H new ATOM 0 HA ILE A 13 1.503 -13.330 8.241 1.00 0.00 H new ATOM 0 HB ILE A 13 0.213 -11.830 5.924 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.089 -14.157 5.592 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.398 -14.476 5.928 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.538 -11.460 5.204 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.225 -10.751 6.806 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.120 -12.283 6.670 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.832 -14.494 3.521 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.257 -13.154 3.948 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.459 -12.831 3.607 1.00 0.00 H new ATOM 151 N PRO A 14 1.338 -11.223 9.549 1.00 0.00 N ATOM 152 CA PRO A 14 1.273 -10.012 10.372 1.00 0.00 C ATOM 153 C PRO A 14 1.643 -8.758 9.588 1.00 0.00 C ATOM 154 O PRO A 14 2.262 -8.838 8.527 1.00 0.00 O ATOM 155 CB PRO A 14 2.301 -10.276 11.475 1.00 0.00 C ATOM 156 CG PRO A 14 3.263 -11.242 10.872 1.00 0.00 C ATOM 157 CD PRO A 14 2.457 -12.099 9.936 1.00 0.00 C ATOM 0 HA PRO A 14 0.266 -9.827 10.745 1.00 0.00 H new ATOM 0 HB2 PRO A 14 2.801 -9.356 11.779 1.00 0.00 H new ATOM 0 HB3 PRO A 14 1.829 -10.691 12.365 1.00 0.00 H new ATOM 0 HG2 PRO A 14 4.057 -10.720 10.337 1.00 0.00 H new ATOM 0 HG3 PRO A 14 3.742 -11.848 11.641 1.00 0.00 H new ATOM 0 HD2 PRO A 14 3.042 -12.409 9.070 1.00 0.00 H new ATOM 0 HD3 PRO A 14 2.106 -13.007 10.425 1.00 0.00 H new ATOM 165 N ASP A 15 1.261 -7.601 10.117 1.00 0.00 N ATOM 166 CA ASP A 15 1.554 -6.329 9.467 1.00 0.00 C ATOM 167 C ASP A 15 3.058 -6.144 9.288 1.00 0.00 C ATOM 168 O ASP A 15 3.858 -6.764 9.989 1.00 0.00 O ATOM 169 CB ASP A 15 0.979 -5.170 10.283 1.00 0.00 C ATOM 170 CG ASP A 15 -0.474 -4.892 9.950 1.00 0.00 C ATOM 171 OD1 ASP A 15 -1.241 -5.864 9.785 1.00 0.00 O ATOM 172 OD2 ASP A 15 -0.844 -3.703 9.856 1.00 0.00 O ATOM 0 H ASP A 15 0.748 -7.518 10.994 1.00 0.00 H new ATOM 0 HA ASP A 15 1.087 -6.337 8.482 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.068 -5.398 11.345 1.00 0.00 H new ATOM 0 HB3 ASP A 15 1.569 -4.272 10.099 1.00 0.00 H new ATOM 177 N LEU A 16 3.435 -5.289 8.344 1.00 0.00 N ATOM 178 CA LEU A 16 4.843 -5.023 8.071 1.00 0.00 C ATOM 179 C LEU A 16 5.072 -3.542 7.784 1.00 0.00 C ATOM 180 O LEU A 16 4.425 -2.961 6.913 1.00 0.00 O ATOM 181 CB LEU A 16 5.322 -5.864 6.887 1.00 0.00 C ATOM 182 CG LEU A 16 6.796 -6.271 6.904 1.00 0.00 C ATOM 183 CD1 LEU A 16 6.991 -7.602 6.195 1.00 0.00 C ATOM 184 CD2 LEU A 16 7.654 -5.191 6.261 1.00 0.00 C ATOM 0 H LEU A 16 2.786 -4.768 7.755 1.00 0.00 H new ATOM 0 HA LEU A 16 5.417 -5.295 8.957 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.717 -6.769 6.842 1.00 0.00 H new ATOM 0 HB3 LEU A 16 5.131 -5.306 5.970 1.00 0.00 H new ATOM 0 HG LEU A 16 7.109 -6.387 7.942 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.046 -7.875 6.217 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.406 -8.372 6.699 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.661 -7.515 5.160 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.700 -5.497 6.282 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.339 -5.043 5.228 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.538 -4.258 6.812 1.00 0.00 H new ATOM 196 N LYS A 17 5.999 -2.939 8.519 1.00 0.00 N ATOM 197 CA LYS A 17 6.318 -1.527 8.342 1.00 0.00 C ATOM 198 C LYS A 17 7.041 -1.294 7.019 1.00 0.00 C ATOM 199 O LYS A 17 7.889 -2.090 6.615 1.00 0.00 O ATOM 200 CB LYS A 17 7.182 -1.028 9.502 1.00 0.00 C ATOM 201 CG LYS A 17 7.615 0.421 9.359 1.00 0.00 C ATOM 202 CD LYS A 17 8.441 0.876 10.550 1.00 0.00 C ATOM 203 CE LYS A 17 7.565 1.478 11.638 1.00 0.00 C ATOM 204 NZ LYS A 17 7.118 0.452 12.620 1.00 0.00 N ATOM 0 H LYS A 17 6.544 -3.406 9.244 1.00 0.00 H new ATOM 0 HA LYS A 17 5.382 -0.968 8.328 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.627 -1.142 10.433 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.069 -1.657 9.580 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.197 0.539 8.445 1.00 0.00 H new ATOM 0 HG3 LYS A 17 6.735 1.057 9.261 1.00 0.00 H new ATOM 0 HD2 LYS A 17 8.995 0.029 10.955 1.00 0.00 H new ATOM 0 HD3 LYS A 17 9.176 1.612 10.224 1.00 0.00 H new ATOM 0 HE2 LYS A 17 8.117 2.261 12.157 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.694 1.950 11.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 6.079 0.453 12.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 7.447 -0.486 12.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 7.514 0.671 13.556 1.00 0.00 H new ATOM 218 N VAL A 18 6.700 -0.198 6.349 1.00 0.00 N ATOM 219 CA VAL A 18 7.319 0.141 5.073 1.00 0.00 C ATOM 220 C VAL A 18 7.848 1.571 5.080 1.00 0.00 C ATOM 221 O VAL A 18 8.839 1.882 4.419 1.00 0.00 O ATOM 222 CB VAL A 18 6.326 -0.021 3.907 1.00 0.00 C ATOM 223 CG1 VAL A 18 5.862 -1.466 3.797 1.00 0.00 C ATOM 224 CG2 VAL A 18 5.141 0.916 4.083 1.00 0.00 C ATOM 0 H VAL A 18 5.999 0.470 6.668 1.00 0.00 H new ATOM 0 HA VAL A 18 8.150 -0.550 4.932 1.00 0.00 H new ATOM 0 HB VAL A 18 6.835 0.243 2.980 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.161 -1.561 2.968 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.722 -2.112 3.621 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.370 -1.762 4.724 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.449 0.788 3.250 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.630 0.685 5.018 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.493 1.947 4.107 1.00 0.00 H new ATOM 234 N PHE A 19 7.180 2.439 5.833 1.00 0.00 N ATOM 235 CA PHE A 19 7.582 3.837 5.927 1.00 0.00 C ATOM 236 C PHE A 19 7.444 4.347 7.359 1.00 0.00 C ATOM 237 O PHE A 19 6.428 4.121 8.014 1.00 0.00 O ATOM 238 CB PHE A 19 6.737 4.697 4.984 1.00 0.00 C ATOM 239 CG PHE A 19 7.224 6.113 4.868 1.00 0.00 C ATOM 240 CD1 PHE A 19 8.453 6.392 4.292 1.00 0.00 C ATOM 241 CD2 PHE A 19 6.452 7.165 5.334 1.00 0.00 C ATOM 242 CE1 PHE A 19 8.903 7.695 4.182 1.00 0.00 C ATOM 243 CE2 PHE A 19 6.897 8.470 5.227 1.00 0.00 C ATOM 244 CZ PHE A 19 8.125 8.734 4.652 1.00 0.00 C ATOM 0 H PHE A 19 6.358 2.198 6.387 1.00 0.00 H new ATOM 0 HA PHE A 19 8.629 3.909 5.633 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.733 4.240 3.994 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.706 4.703 5.337 1.00 0.00 H new ATOM 0 HD1 PHE A 19 9.066 5.583 3.925 1.00 0.00 H new ATOM 0 HD2 PHE A 19 5.492 6.964 5.786 1.00 0.00 H new ATOM 0 HE1 PHE A 19 9.862 7.899 3.729 1.00 0.00 H new ATOM 0 HE2 PHE A 19 6.285 9.282 5.592 1.00 0.00 H new ATOM 0 HZ PHE A 19 8.476 9.752 4.570 1.00 0.00 H new ATOM 254 N GLU A 20 8.476 5.037 7.837 1.00 0.00 N ATOM 255 CA GLU A 20 8.471 5.578 9.191 1.00 0.00 C ATOM 256 C GLU A 20 9.039 6.994 9.213 1.00 0.00 C ATOM 257 O GLU A 20 10.224 7.203 8.957 1.00 0.00 O ATOM 258 CB GLU A 20 9.280 4.677 10.126 1.00 0.00 C ATOM 259 CG GLU A 20 9.105 5.015 11.598 1.00 0.00 C ATOM 260 CD GLU A 20 9.710 3.968 12.512 1.00 0.00 C ATOM 261 OE1 GLU A 20 10.677 3.299 12.090 1.00 0.00 O ATOM 262 OE2 GLU A 20 9.218 3.816 13.650 1.00 0.00 O ATOM 0 H GLU A 20 9.325 5.234 7.307 1.00 0.00 H new ATOM 0 HA GLU A 20 7.438 5.614 9.537 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.986 3.640 9.962 1.00 0.00 H new ATOM 0 HB3 GLU A 20 10.336 4.754 9.867 1.00 0.00 H new ATOM 0 HG2 GLU A 20 9.567 5.981 11.803 1.00 0.00 H new ATOM 0 HG3 GLU A 20 8.043 5.116 11.820 1.00 0.00 H new ATOM 269 N ARG A 21 8.183 7.963 9.520 1.00 0.00 N ATOM 270 CA ARG A 21 8.598 9.360 9.574 1.00 0.00 C ATOM 271 C ARG A 21 7.982 10.064 10.780 1.00 0.00 C ATOM 272 O ARG A 21 6.764 10.065 10.954 1.00 0.00 O ATOM 273 CB ARG A 21 8.197 10.084 8.288 1.00 0.00 C ATOM 274 CG ARG A 21 8.734 11.502 8.194 1.00 0.00 C ATOM 275 CD ARG A 21 8.335 12.164 6.884 1.00 0.00 C ATOM 276 NE ARG A 21 9.294 13.186 6.473 1.00 0.00 N ATOM 277 CZ ARG A 21 9.269 14.437 6.918 1.00 0.00 C ATOM 278 NH1 ARG A 21 8.340 14.819 7.783 1.00 0.00 N ATOM 279 NH2 ARG A 21 10.176 15.310 6.497 1.00 0.00 N ATOM 0 H ARG A 21 7.198 7.807 9.735 1.00 0.00 H new ATOM 0 HA ARG A 21 9.683 9.387 9.674 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.555 9.512 7.432 1.00 0.00 H new ATOM 0 HB3 ARG A 21 7.109 10.111 8.221 1.00 0.00 H new ATOM 0 HG2 ARG A 21 8.357 12.091 9.030 1.00 0.00 H new ATOM 0 HG3 ARG A 21 9.821 11.487 8.279 1.00 0.00 H new ATOM 0 HD2 ARG A 21 8.256 11.406 6.104 1.00 0.00 H new ATOM 0 HD3 ARG A 21 7.348 12.615 6.991 1.00 0.00 H new ATOM 0 HE ARG A 21 10.022 12.925 5.808 1.00 0.00 H new ATOM 0 HH11 ARG A 21 7.641 14.151 8.109 1.00 0.00 H new ATOM 0 HH12 ARG A 21 8.324 15.781 8.123 1.00 0.00 H new ATOM 0 HH21 ARG A 21 10.893 15.020 5.831 1.00 0.00 H new ATOM 0 HH22 ARG A 21 10.156 16.271 6.839 1.00 0.00 H new ATOM 293 N GLU A 22 8.833 10.660 11.609 1.00 0.00 N ATOM 294 CA GLU A 22 8.371 11.366 12.799 1.00 0.00 C ATOM 295 C GLU A 22 7.023 12.034 12.546 1.00 0.00 C ATOM 296 O GLU A 22 6.932 13.015 11.808 1.00 0.00 O ATOM 297 CB GLU A 22 9.400 12.415 13.228 1.00 0.00 C ATOM 298 CG GLU A 22 9.755 13.404 12.131 1.00 0.00 C ATOM 299 CD GLU A 22 10.861 14.358 12.540 1.00 0.00 C ATOM 300 OE1 GLU A 22 10.860 14.798 13.709 1.00 0.00 O ATOM 301 OE2 GLU A 22 11.725 14.663 11.693 1.00 0.00 O ATOM 0 H GLU A 22 9.845 10.668 11.479 1.00 0.00 H new ATOM 0 HA GLU A 22 8.251 10.636 13.600 1.00 0.00 H new ATOM 0 HB2 GLU A 22 9.012 12.962 14.087 1.00 0.00 H new ATOM 0 HB3 GLU A 22 10.308 11.908 13.556 1.00 0.00 H new ATOM 0 HG2 GLU A 22 10.063 12.857 11.240 1.00 0.00 H new ATOM 0 HG3 GLU A 22 8.867 13.977 11.862 1.00 0.00 H new ATOM 308 N GLY A 23 5.976 11.495 13.164 1.00 0.00 N ATOM 309 CA GLY A 23 4.647 12.050 12.993 1.00 0.00 C ATOM 310 C GLY A 23 3.758 11.173 12.134 1.00 0.00 C ATOM 311 O GLY A 23 2.641 10.836 12.526 1.00 0.00 O ATOM 0 H GLY A 23 6.025 10.684 13.780 1.00 0.00 H new ATOM 0 HA2 GLY A 23 4.184 12.184 13.971 1.00 0.00 H new ATOM 0 HA3 GLY A 23 4.725 13.038 12.539 1.00 0.00 H new ATOM 315 N VAL A 24 4.253 10.803 10.957 1.00 0.00 N ATOM 316 CA VAL A 24 3.496 9.960 10.040 1.00 0.00 C ATOM 317 C VAL A 24 4.082 8.554 9.975 1.00 0.00 C ATOM 318 O VAL A 24 5.292 8.382 9.837 1.00 0.00 O ATOM 319 CB VAL A 24 3.469 10.559 8.621 1.00 0.00 C ATOM 320 CG1 VAL A 24 2.713 9.643 7.670 1.00 0.00 C ATOM 321 CG2 VAL A 24 2.850 11.948 8.641 1.00 0.00 C ATOM 0 H VAL A 24 5.175 11.074 10.616 1.00 0.00 H new ATOM 0 HA VAL A 24 2.477 9.908 10.425 1.00 0.00 H new ATOM 0 HB VAL A 24 4.495 10.649 8.263 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.704 10.082 6.672 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.204 8.671 7.634 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.689 9.519 8.021 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.839 12.356 7.630 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.829 11.886 9.018 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.437 12.599 9.289 1.00 0.00 H new ATOM 331 N GLN A 25 3.214 7.552 10.076 1.00 0.00 N ATOM 332 CA GLN A 25 3.645 6.161 10.030 1.00 0.00 C ATOM 333 C GLN A 25 2.764 5.348 9.087 1.00 0.00 C ATOM 334 O GLN A 25 1.538 5.475 9.103 1.00 0.00 O ATOM 335 CB GLN A 25 3.615 5.548 11.431 1.00 0.00 C ATOM 336 CG GLN A 25 4.910 5.732 12.204 1.00 0.00 C ATOM 337 CD GLN A 25 4.750 5.453 13.686 1.00 0.00 C ATOM 338 OE1 GLN A 25 3.636 5.281 14.180 1.00 0.00 O ATOM 339 NE2 GLN A 25 5.867 5.406 14.403 1.00 0.00 N ATOM 0 H GLN A 25 2.208 7.678 10.190 1.00 0.00 H new ATOM 0 HA GLN A 25 4.667 6.137 9.653 1.00 0.00 H new ATOM 0 HB2 GLN A 25 2.798 5.995 11.997 1.00 0.00 H new ATOM 0 HB3 GLN A 25 3.400 4.483 11.348 1.00 0.00 H new ATOM 0 HG2 GLN A 25 5.671 5.069 11.793 1.00 0.00 H new ATOM 0 HG3 GLN A 25 5.269 6.752 12.067 1.00 0.00 H new ATOM 0 HE21 GLN A 25 6.769 5.555 13.951 1.00 0.00 H new ATOM 0 HE22 GLN A 25 5.822 5.221 15.405 1.00 0.00 H new ATOM 348 N LEU A 26 3.394 4.515 8.267 1.00 0.00 N ATOM 349 CA LEU A 26 2.666 3.681 7.316 1.00 0.00 C ATOM 350 C LEU A 26 2.872 2.201 7.621 1.00 0.00 C ATOM 351 O LEU A 26 3.980 1.770 7.936 1.00 0.00 O ATOM 352 CB LEU A 26 3.120 3.987 5.887 1.00 0.00 C ATOM 353 CG LEU A 26 2.149 3.591 4.775 1.00 0.00 C ATOM 354 CD1 LEU A 26 0.930 4.500 4.782 1.00 0.00 C ATOM 355 CD2 LEU A 26 2.842 3.636 3.421 1.00 0.00 C ATOM 0 H LEU A 26 4.407 4.399 8.241 1.00 0.00 H new ATOM 0 HA LEU A 26 1.604 3.908 7.410 1.00 0.00 H new ATOM 0 HB2 LEU A 26 3.313 5.057 5.810 1.00 0.00 H new ATOM 0 HB3 LEU A 26 4.068 3.479 5.712 1.00 0.00 H new ATOM 0 HG LEU A 26 1.816 2.569 4.957 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.250 4.203 3.984 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.420 4.418 5.742 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.245 5.532 4.625 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.136 3.351 2.641 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.204 4.646 3.231 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.683 2.943 3.420 1.00 0.00 H new ATOM 367 N ASN A 27 1.796 1.427 7.523 1.00 0.00 N ATOM 368 CA ASN A 27 1.858 -0.006 7.786 1.00 0.00 C ATOM 369 C ASN A 27 1.384 -0.803 6.575 1.00 0.00 C ATOM 370 O ASN A 27 0.561 -0.331 5.790 1.00 0.00 O ATOM 371 CB ASN A 27 1.007 -0.358 9.008 1.00 0.00 C ATOM 372 CG ASN A 27 1.559 0.238 10.289 1.00 0.00 C ATOM 373 OD1 ASN A 27 1.567 1.563 10.369 1.00 0.00 O flip ATOM 374 ND2 ASN A 27 1.972 -0.486 11.195 1.00 0.00 N flip ATOM 0 H ASN A 27 0.871 1.768 7.263 1.00 0.00 H new ATOM 0 HA ASN A 27 2.897 -0.269 7.987 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.011 -0.000 8.853 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.952 -1.442 9.109 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.946 -1.500 11.089 1.00 0.00 H new ATOM 0 HD22 ASN A 27 2.340 -0.072 12.051 1.00 0.00 H new ATOM 381 N LEU A 28 1.908 -2.015 6.430 1.00 0.00 N ATOM 382 CA LEU A 28 1.539 -2.880 5.315 1.00 0.00 C ATOM 383 C LEU A 28 0.764 -4.099 5.805 1.00 0.00 C ATOM 384 O LEU A 28 1.140 -4.730 6.793 1.00 0.00 O ATOM 385 CB LEU A 28 2.789 -3.327 4.554 1.00 0.00 C ATOM 386 CG LEU A 28 2.605 -3.597 3.061 1.00 0.00 C ATOM 387 CD1 LEU A 28 3.954 -3.691 2.365 1.00 0.00 C ATOM 388 CD2 LEU A 28 1.801 -4.870 2.843 1.00 0.00 C ATOM 0 H LEU A 28 2.590 -2.421 7.071 1.00 0.00 H new ATOM 0 HA LEU A 28 0.897 -2.311 4.643 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.555 -2.561 4.672 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.170 -4.234 5.023 1.00 0.00 H new ATOM 0 HG LEU A 28 2.052 -2.764 2.627 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.803 -3.884 1.303 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.494 -2.753 2.490 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.533 -4.504 2.802 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.680 -5.046 1.774 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.326 -5.713 3.292 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.820 -4.765 3.306 1.00 0.00 H new ATOM 400 N SER A 29 -0.317 -4.427 5.105 1.00 0.00 N ATOM 401 CA SER A 29 -1.146 -5.571 5.469 1.00 0.00 C ATOM 402 C SER A 29 -1.260 -6.552 4.306 1.00 0.00 C ATOM 403 O SER A 29 -1.452 -6.152 3.158 1.00 0.00 O ATOM 404 CB SER A 29 -2.539 -5.103 5.895 1.00 0.00 C ATOM 405 OG SER A 29 -3.215 -6.112 6.625 1.00 0.00 O ATOM 0 H SER A 29 -0.640 -3.917 4.283 1.00 0.00 H new ATOM 0 HA SER A 29 -0.670 -6.081 6.306 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.453 -4.204 6.505 1.00 0.00 H new ATOM 0 HB3 SER A 29 -3.122 -4.835 5.013 1.00 0.00 H new ATOM 0 HG SER A 29 -4.102 -5.788 6.887 1.00 0.00 H new ATOM 411 N PHE A 30 -1.139 -7.839 4.613 1.00 0.00 N ATOM 412 CA PHE A 30 -1.227 -8.879 3.594 1.00 0.00 C ATOM 413 C PHE A 30 -2.479 -9.729 3.792 1.00 0.00 C ATOM 414 O PHE A 30 -2.863 -10.034 4.921 1.00 0.00 O ATOM 415 CB PHE A 30 0.018 -9.768 3.633 1.00 0.00 C ATOM 416 CG PHE A 30 1.297 -9.019 3.390 1.00 0.00 C ATOM 417 CD1 PHE A 30 1.672 -8.660 2.106 1.00 0.00 C ATOM 418 CD2 PHE A 30 2.124 -8.672 4.447 1.00 0.00 C ATOM 419 CE1 PHE A 30 2.849 -7.972 1.879 1.00 0.00 C ATOM 420 CE2 PHE A 30 3.302 -7.983 4.227 1.00 0.00 C ATOM 421 CZ PHE A 30 3.664 -7.632 2.941 1.00 0.00 C ATOM 0 H PHE A 30 -0.980 -8.187 5.558 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.288 -8.394 2.620 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.073 -10.260 4.604 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -0.082 -10.553 2.883 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.037 -8.921 1.272 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.845 -8.943 5.454 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.131 -7.701 0.872 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.938 -7.720 5.059 1.00 0.00 H new ATOM 0 HZ PHE A 30 4.583 -7.092 2.766 1.00 0.00 H new ATOM 431 N ILE A 31 -3.110 -10.107 2.685 1.00 0.00 N ATOM 432 CA ILE A 31 -4.318 -10.922 2.736 1.00 0.00 C ATOM 433 C ILE A 31 -4.330 -11.958 1.617 1.00 0.00 C ATOM 434 O ILE A 31 -4.104 -11.630 0.452 1.00 0.00 O ATOM 435 CB ILE A 31 -5.587 -10.055 2.632 1.00 0.00 C ATOM 436 CG1 ILE A 31 -5.722 -9.159 3.865 1.00 0.00 C ATOM 437 CG2 ILE A 31 -6.818 -10.935 2.472 1.00 0.00 C ATOM 438 CD1 ILE A 31 -5.028 -7.823 3.720 1.00 0.00 C ATOM 0 H ILE A 31 -2.805 -9.862 1.743 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.314 -11.432 3.699 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.503 -9.418 1.751 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.780 -8.990 4.067 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.312 -9.680 4.730 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -7.707 -10.308 2.400 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.722 -11.534 1.566 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -6.908 -11.595 3.335 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.165 -7.241 4.631 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.963 -7.983 3.548 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.454 -7.281 2.876 1.00 0.00 H new ATOM 450 N ARG A 32 -4.596 -13.209 1.979 1.00 0.00 N ATOM 451 CA ARG A 32 -4.638 -14.293 1.005 1.00 0.00 C ATOM 452 C ARG A 32 -5.939 -15.080 1.124 1.00 0.00 C ATOM 453 O ARG A 32 -6.119 -15.896 2.029 1.00 0.00 O ATOM 454 CB ARG A 32 -3.443 -15.228 1.200 1.00 0.00 C ATOM 455 CG ARG A 32 -2.098 -14.550 0.996 1.00 0.00 C ATOM 456 CD ARG A 32 -0.993 -15.566 0.755 1.00 0.00 C ATOM 457 NE ARG A 32 -0.470 -16.113 2.005 1.00 0.00 N ATOM 458 CZ ARG A 32 -1.008 -17.152 2.633 1.00 0.00 C ATOM 459 NH1 ARG A 32 -2.078 -17.754 2.132 1.00 0.00 N ATOM 460 NH2 ARG A 32 -0.475 -17.592 3.766 1.00 0.00 N ATOM 0 H ARG A 32 -4.786 -13.497 2.939 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.589 -13.855 0.008 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -3.480 -15.646 2.206 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.529 -16.063 0.504 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -2.158 -13.868 0.148 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -1.856 -13.948 1.872 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -1.376 -16.378 0.136 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.183 -15.095 0.198 1.00 0.00 H new ATOM 0 HE ARG A 32 0.353 -15.673 2.417 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -2.491 -17.419 1.261 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -2.488 -18.552 2.617 1.00 0.00 H new ATOM 0 HH21 ARG A 32 0.348 -17.132 4.155 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.889 -18.390 4.248 1.00 0.00 H new ATOM 474 N PRO A 33 -6.869 -14.832 0.190 1.00 0.00 N ATOM 475 CA PRO A 33 -8.170 -15.507 0.169 1.00 0.00 C ATOM 476 C PRO A 33 -8.052 -16.982 -0.201 1.00 0.00 C ATOM 477 O PRO A 33 -7.205 -17.380 -1.001 1.00 0.00 O ATOM 478 CB PRO A 33 -8.948 -14.746 -0.908 1.00 0.00 C ATOM 479 CG PRO A 33 -7.900 -14.179 -1.801 1.00 0.00 C ATOM 480 CD PRO A 33 -6.722 -13.873 -0.917 1.00 0.00 C ATOM 0 HA PRO A 33 -8.650 -15.497 1.148 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.618 -15.409 -1.455 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.564 -13.960 -0.471 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.627 -14.889 -2.582 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.258 -13.278 -2.300 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.778 -14.009 -1.444 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.743 -12.843 -0.562 1.00 0.00 H new ATOM 488 N PRO A 34 -8.921 -17.813 0.393 1.00 0.00 N ATOM 489 CA PRO A 34 -8.934 -19.257 0.139 1.00 0.00 C ATOM 490 C PRO A 34 -9.420 -19.595 -1.266 1.00 0.00 C ATOM 491 O PRO A 34 -8.964 -20.563 -1.874 1.00 0.00 O ATOM 492 CB PRO A 34 -9.913 -19.792 1.187 1.00 0.00 C ATOM 493 CG PRO A 34 -10.808 -18.641 1.492 1.00 0.00 C ATOM 494 CD PRO A 34 -9.958 -17.408 1.356 1.00 0.00 C ATOM 0 HA PRO A 34 -7.937 -19.692 0.206 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -10.478 -20.642 0.804 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -9.389 -20.134 2.080 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.653 -18.610 0.804 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -11.219 -18.722 2.498 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.536 -16.560 0.990 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.525 -17.111 2.311 1.00 0.00 H new ATOM 502 N GLU A 35 -10.347 -18.790 -1.776 1.00 0.00 N ATOM 503 CA GLU A 35 -10.895 -19.005 -3.110 1.00 0.00 C ATOM 504 C GLU A 35 -9.824 -18.801 -4.177 1.00 0.00 C ATOM 505 O GLU A 35 -9.759 -19.542 -5.157 1.00 0.00 O ATOM 506 CB GLU A 35 -12.070 -18.058 -3.362 1.00 0.00 C ATOM 507 CG GLU A 35 -11.692 -16.588 -3.288 1.00 0.00 C ATOM 508 CD GLU A 35 -12.800 -15.676 -3.779 1.00 0.00 C ATOM 509 OE1 GLU A 35 -13.103 -15.708 -4.990 1.00 0.00 O ATOM 510 OE2 GLU A 35 -13.365 -14.931 -2.951 1.00 0.00 O ATOM 0 H GLU A 35 -10.734 -17.984 -1.286 1.00 0.00 H new ATOM 0 HA GLU A 35 -11.249 -20.034 -3.168 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.490 -18.268 -4.346 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -12.853 -18.261 -2.631 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -11.445 -16.332 -2.258 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -10.795 -16.417 -3.883 1.00 0.00 H new ATOM 517 N ASN A 36 -8.985 -17.789 -3.979 1.00 0.00 N ATOM 518 CA ASN A 36 -7.917 -17.485 -4.924 1.00 0.00 C ATOM 519 C ASN A 36 -6.581 -17.327 -4.204 1.00 0.00 C ATOM 520 O ASN A 36 -6.257 -16.267 -3.670 1.00 0.00 O ATOM 521 CB ASN A 36 -8.244 -16.208 -5.702 1.00 0.00 C ATOM 522 CG ASN A 36 -9.034 -16.487 -6.965 1.00 0.00 C ATOM 523 OD1 ASN A 36 -9.555 -17.587 -7.155 1.00 0.00 O ATOM 524 ND2 ASN A 36 -9.128 -15.490 -7.837 1.00 0.00 N ATOM 0 H ASN A 36 -9.024 -17.166 -3.173 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.836 -18.318 -5.623 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -8.812 -15.532 -5.063 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -7.317 -15.697 -5.962 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -9.648 -15.619 -8.705 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -8.680 -14.595 -7.639 1.00 0.00 H new ATOM 531 N PRO A 37 -5.786 -18.408 -4.188 1.00 0.00 N ATOM 532 CA PRO A 37 -4.473 -18.414 -3.538 1.00 0.00 C ATOM 533 C PRO A 37 -3.454 -17.555 -4.279 1.00 0.00 C ATOM 534 O PRO A 37 -2.583 -16.940 -3.665 1.00 0.00 O ATOM 535 CB PRO A 37 -4.062 -19.888 -3.583 1.00 0.00 C ATOM 536 CG PRO A 37 -4.806 -20.453 -4.743 1.00 0.00 C ATOM 537 CD PRO A 37 -6.109 -19.706 -4.804 1.00 0.00 C ATOM 0 HA PRO A 37 -4.516 -17.999 -2.531 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -2.985 -19.995 -3.713 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.324 -20.400 -2.657 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.241 -20.328 -5.667 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.975 -21.522 -4.615 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.457 -19.588 -5.830 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -6.896 -20.226 -4.258 1.00 0.00 H new ATOM 545 N ALA A 38 -3.571 -17.517 -5.602 1.00 0.00 N ATOM 546 CA ALA A 38 -2.662 -16.730 -6.427 1.00 0.00 C ATOM 547 C ALA A 38 -2.960 -15.240 -6.305 1.00 0.00 C ATOM 548 O ALA A 38 -2.178 -14.401 -6.753 1.00 0.00 O ATOM 549 CB ALA A 38 -2.752 -17.171 -7.880 1.00 0.00 C ATOM 0 H ALA A 38 -4.286 -18.022 -6.126 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.647 -16.901 -6.069 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -2.068 -16.575 -8.484 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -2.482 -18.224 -7.958 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -3.771 -17.031 -8.240 1.00 0.00 H new ATOM 555 N LEU A 39 -4.096 -14.917 -5.696 1.00 0.00 N ATOM 556 CA LEU A 39 -4.498 -13.526 -5.515 1.00 0.00 C ATOM 557 C LEU A 39 -4.031 -12.995 -4.164 1.00 0.00 C ATOM 558 O LEU A 39 -4.406 -13.521 -3.115 1.00 0.00 O ATOM 559 CB LEU A 39 -6.018 -13.396 -5.629 1.00 0.00 C ATOM 560 CG LEU A 39 -6.586 -11.987 -5.449 1.00 0.00 C ATOM 561 CD1 LEU A 39 -6.526 -11.216 -6.759 1.00 0.00 C ATOM 562 CD2 LEU A 39 -8.015 -12.051 -4.930 1.00 0.00 C ATOM 0 H LEU A 39 -4.755 -15.599 -5.319 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.028 -12.933 -6.299 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.322 -13.766 -6.608 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.475 -14.048 -4.885 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.977 -11.461 -4.714 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -6.934 -10.216 -6.612 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.490 -11.140 -7.089 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.111 -11.739 -7.516 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.403 -11.040 -4.808 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.636 -12.595 -5.641 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.030 -12.564 -3.968 1.00 0.00 H new ATOM 574 N LEU A 40 -3.212 -11.949 -4.196 1.00 0.00 N ATOM 575 CA LEU A 40 -2.695 -11.345 -2.973 1.00 0.00 C ATOM 576 C LEU A 40 -3.293 -9.959 -2.756 1.00 0.00 C ATOM 577 O LEU A 40 -2.908 -8.994 -3.417 1.00 0.00 O ATOM 578 CB LEU A 40 -1.169 -11.250 -3.033 1.00 0.00 C ATOM 579 CG LEU A 40 -0.493 -10.553 -1.853 1.00 0.00 C ATOM 580 CD1 LEU A 40 -0.615 -11.397 -0.593 1.00 0.00 C ATOM 581 CD2 LEU A 40 0.969 -10.269 -2.167 1.00 0.00 C ATOM 0 H LEU A 40 -2.892 -11.502 -5.055 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.981 -11.980 -2.134 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.765 -12.259 -3.113 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.893 -10.723 -3.947 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.998 -9.603 -1.680 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.128 -10.885 0.237 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.668 -11.549 -0.357 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.136 -12.363 -0.754 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.434 -9.772 -1.315 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.487 -11.207 -2.368 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.034 -9.624 -3.043 1.00 0.00 H new ATOM 593 N LEU A 41 -4.236 -9.867 -1.824 1.00 0.00 N ATOM 594 CA LEU A 41 -4.887 -8.598 -1.517 1.00 0.00 C ATOM 595 C LEU A 41 -4.102 -7.825 -0.462 1.00 0.00 C ATOM 596 O LEU A 41 -3.970 -8.271 0.678 1.00 0.00 O ATOM 597 CB LEU A 41 -6.316 -8.840 -1.030 1.00 0.00 C ATOM 598 CG LEU A 41 -7.217 -9.647 -1.966 1.00 0.00 C ATOM 599 CD1 LEU A 41 -8.473 -10.101 -1.239 1.00 0.00 C ATOM 600 CD2 LEU A 41 -7.578 -8.827 -3.196 1.00 0.00 C ATOM 0 H LEU A 41 -4.567 -10.656 -1.268 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.917 -8.003 -2.430 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.269 -9.355 -0.070 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.786 -7.873 -0.850 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.670 -10.532 -2.291 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.101 -10.674 -1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.196 -10.726 -0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -9.023 -9.229 -0.884 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.219 -9.417 -3.851 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.105 -7.924 -2.889 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.668 -8.553 -3.730 1.00 0.00 H new ATOM 612 N ILE A 42 -3.585 -6.664 -0.849 1.00 0.00 N ATOM 613 CA ILE A 42 -2.817 -5.827 0.065 1.00 0.00 C ATOM 614 C ILE A 42 -3.620 -4.606 0.500 1.00 0.00 C ATOM 615 O ILE A 42 -4.467 -4.109 -0.243 1.00 0.00 O ATOM 616 CB ILE A 42 -1.497 -5.358 -0.577 1.00 0.00 C ATOM 617 CG1 ILE A 42 -0.491 -6.509 -0.627 1.00 0.00 C ATOM 618 CG2 ILE A 42 -0.923 -4.179 0.195 1.00 0.00 C ATOM 619 CD1 ILE A 42 0.719 -6.217 -1.487 1.00 0.00 C ATOM 0 H ILE A 42 -3.684 -6.281 -1.789 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.590 -6.439 0.938 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.701 -5.035 -1.598 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -0.160 -6.736 0.386 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.990 -7.401 -1.007 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.009 -3.859 -0.270 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.636 -3.355 0.184 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.730 -4.478 1.225 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.389 -7.077 -1.476 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.399 -6.019 -2.510 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.242 -5.344 -1.095 1.00 0.00 H new ATOM 631 N THR A 43 -3.348 -4.126 1.709 1.00 0.00 N ATOM 632 CA THR A 43 -4.045 -2.963 2.244 1.00 0.00 C ATOM 633 C THR A 43 -3.068 -1.984 2.886 1.00 0.00 C ATOM 634 O THR A 43 -2.101 -2.392 3.532 1.00 0.00 O ATOM 635 CB THR A 43 -5.103 -3.372 3.286 1.00 0.00 C ATOM 636 OG1 THR A 43 -5.849 -4.499 2.810 1.00 0.00 O ATOM 637 CG2 THR A 43 -6.050 -2.217 3.577 1.00 0.00 C ATOM 0 H THR A 43 -2.650 -4.525 2.337 1.00 0.00 H new ATOM 0 HA THR A 43 -4.542 -2.478 1.404 1.00 0.00 H new ATOM 0 HB THR A 43 -4.588 -3.641 4.209 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.519 -4.754 3.479 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.788 -2.529 4.315 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.483 -1.371 3.966 1.00 0.00 H new ATOM 0 HG23 THR A 43 -6.558 -1.922 2.658 1.00 0.00 H new ATOM 645 N ILE A 44 -3.327 -0.694 2.706 1.00 0.00 N ATOM 646 CA ILE A 44 -2.471 0.342 3.270 1.00 0.00 C ATOM 647 C ILE A 44 -3.107 0.969 4.506 1.00 0.00 C ATOM 648 O ILE A 44 -4.329 1.095 4.593 1.00 0.00 O ATOM 649 CB ILE A 44 -2.174 1.450 2.242 1.00 0.00 C ATOM 650 CG1 ILE A 44 -2.172 0.872 0.825 1.00 0.00 C ATOM 651 CG2 ILE A 44 -0.842 2.116 2.550 1.00 0.00 C ATOM 652 CD1 ILE A 44 -2.062 1.924 -0.256 1.00 0.00 C ATOM 0 H ILE A 44 -4.123 -0.341 2.174 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.536 -0.142 3.551 1.00 0.00 H new ATOM 0 HB ILE A 44 -2.958 2.205 2.306 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.341 0.174 0.727 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -3.088 0.301 0.673 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.647 2.896 1.815 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.877 2.557 3.546 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -0.046 1.373 2.510 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -2.067 1.443 -1.234 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -2.907 2.609 -0.185 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -1.133 2.480 -0.130 1.00 0.00 H new ATOM 664 N THR A 45 -2.271 1.364 5.461 1.00 0.00 N ATOM 665 CA THR A 45 -2.751 1.979 6.692 1.00 0.00 C ATOM 666 C THR A 45 -1.923 3.208 7.052 1.00 0.00 C ATOM 667 O THR A 45 -0.901 3.103 7.729 1.00 0.00 O ATOM 668 CB THR A 45 -2.712 0.986 7.868 1.00 0.00 C ATOM 669 OG1 THR A 45 -3.530 -0.153 7.575 1.00 0.00 O ATOM 670 CG2 THR A 45 -3.195 1.646 9.150 1.00 0.00 C ATOM 0 H THR A 45 -1.257 1.269 5.405 1.00 0.00 H new ATOM 0 HA THR A 45 -3.784 2.279 6.513 1.00 0.00 H new ATOM 0 HB THR A 45 -1.680 0.665 8.009 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.499 -0.781 8.327 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.158 0.925 9.967 1.00 0.00 H new ATOM 0 HG22 THR A 45 -2.553 2.495 9.386 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.220 1.992 9.017 1.00 0.00 H new ATOM 678 N ALA A 46 -2.372 4.372 6.595 1.00 0.00 N ATOM 679 CA ALA A 46 -1.674 5.622 6.872 1.00 0.00 C ATOM 680 C ALA A 46 -2.324 6.368 8.032 1.00 0.00 C ATOM 681 O ALA A 46 -3.499 6.731 7.970 1.00 0.00 O ATOM 682 CB ALA A 46 -1.645 6.497 5.628 1.00 0.00 C ATOM 0 H ALA A 46 -3.216 4.476 6.031 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.650 5.382 7.157 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.121 7.427 5.849 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.128 5.971 4.825 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -2.665 6.721 5.317 1.00 0.00 H new ATOM 688 N THR A 47 -1.552 6.595 9.090 1.00 0.00 N ATOM 689 CA THR A 47 -2.054 7.297 10.265 1.00 0.00 C ATOM 690 C THR A 47 -1.289 8.596 10.497 1.00 0.00 C ATOM 691 O THR A 47 -0.062 8.597 10.583 1.00 0.00 O ATOM 692 CB THR A 47 -1.952 6.422 11.528 1.00 0.00 C ATOM 693 OG1 THR A 47 -0.655 5.820 11.604 1.00 0.00 O ATOM 694 CG2 THR A 47 -3.020 5.338 11.523 1.00 0.00 C ATOM 0 H THR A 47 -0.577 6.303 9.157 1.00 0.00 H new ATOM 0 HA THR A 47 -3.103 7.525 10.074 1.00 0.00 H new ATOM 0 HB THR A 47 -2.108 7.060 12.398 1.00 0.00 H new ATOM 0 HG1 THR A 47 0.009 6.422 11.207 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.928 4.733 12.425 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.007 5.800 11.495 1.00 0.00 H new ATOM 0 HG23 THR A 47 -2.891 4.704 10.646 1.00 0.00 H new ATOM 702 N ASN A 48 -2.023 9.699 10.599 1.00 0.00 N ATOM 703 CA ASN A 48 -1.414 11.005 10.822 1.00 0.00 C ATOM 704 C ASN A 48 -1.523 11.413 12.288 1.00 0.00 C ATOM 705 O ASN A 48 -2.610 11.405 12.866 1.00 0.00 O ATOM 706 CB ASN A 48 -2.080 12.060 9.936 1.00 0.00 C ATOM 707 CG ASN A 48 -1.712 13.473 10.344 1.00 0.00 C ATOM 708 OD1 ASN A 48 -0.718 13.692 11.038 1.00 0.00 O ATOM 709 ND2 ASN A 48 -2.514 14.440 9.915 1.00 0.00 N ATOM 0 H ASN A 48 -3.041 9.714 10.531 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.358 10.935 10.560 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -1.788 11.896 8.899 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -3.162 11.941 9.985 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -2.318 15.411 10.158 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -3.327 14.212 9.342 1.00 0.00 H new ATOM 716 N PHE A 49 -0.390 11.770 12.883 1.00 0.00 N ATOM 717 CA PHE A 49 -0.357 12.181 14.282 1.00 0.00 C ATOM 718 C PHE A 49 0.198 13.595 14.420 1.00 0.00 C ATOM 719 O PHE A 49 -0.242 14.366 15.273 1.00 0.00 O ATOM 720 CB PHE A 49 0.489 11.206 15.103 1.00 0.00 C ATOM 721 CG PHE A 49 -0.077 9.816 15.153 1.00 0.00 C ATOM 722 CD1 PHE A 49 -1.210 9.542 15.903 1.00 0.00 C ATOM 723 CD2 PHE A 49 0.522 8.783 14.450 1.00 0.00 C ATOM 724 CE1 PHE A 49 -1.732 8.263 15.952 1.00 0.00 C ATOM 725 CE2 PHE A 49 0.004 7.503 14.494 1.00 0.00 C ATOM 726 CZ PHE A 49 -1.126 7.243 15.246 1.00 0.00 C ATOM 0 H PHE A 49 0.518 11.783 12.418 1.00 0.00 H new ATOM 0 HA PHE A 49 -1.379 12.172 14.661 1.00 0.00 H new ATOM 0 HB2 PHE A 49 1.494 11.166 14.682 1.00 0.00 H new ATOM 0 HB3 PHE A 49 0.585 11.587 16.120 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -1.690 10.336 16.455 1.00 0.00 H new ATOM 0 HD2 PHE A 49 1.405 8.981 13.860 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.614 8.062 16.542 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.481 6.707 13.942 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.534 6.244 15.281 1.00 0.00 H new ATOM 736 N SER A 50 1.169 13.929 13.576 1.00 0.00 N ATOM 737 CA SER A 50 1.788 15.248 13.606 1.00 0.00 C ATOM 738 C SER A 50 0.737 16.338 13.795 1.00 0.00 C ATOM 739 O SER A 50 -0.457 16.101 13.613 1.00 0.00 O ATOM 740 CB SER A 50 2.570 15.497 12.314 1.00 0.00 C ATOM 741 OG SER A 50 1.699 15.599 11.202 1.00 0.00 O ATOM 0 H SER A 50 1.544 13.304 12.863 1.00 0.00 H new ATOM 0 HA SER A 50 2.476 15.280 14.451 1.00 0.00 H new ATOM 0 HB2 SER A 50 3.152 16.413 12.409 1.00 0.00 H new ATOM 0 HB3 SER A 50 3.278 14.685 12.152 1.00 0.00 H new ATOM 0 HG SER A 50 0.984 14.934 11.285 1.00 0.00 H new ATOM 747 N GLU A 51 1.191 17.532 14.162 1.00 0.00 N ATOM 748 CA GLU A 51 0.290 18.658 14.377 1.00 0.00 C ATOM 749 C GLU A 51 -0.112 19.295 13.049 1.00 0.00 C ATOM 750 O GLU A 51 -0.113 20.517 12.909 1.00 0.00 O ATOM 751 CB GLU A 51 0.951 19.705 15.276 1.00 0.00 C ATOM 752 CG GLU A 51 2.190 20.338 14.665 1.00 0.00 C ATOM 753 CD GLU A 51 2.888 21.290 15.617 1.00 0.00 C ATOM 754 OE1 GLU A 51 2.367 22.405 15.828 1.00 0.00 O ATOM 755 OE2 GLU A 51 3.955 20.921 16.150 1.00 0.00 O ATOM 0 H GLU A 51 2.177 17.744 14.317 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.608 18.282 14.868 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.227 20.488 15.501 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.221 19.239 16.224 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.885 19.553 14.367 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.910 20.876 13.759 1.00 0.00 H new ATOM 762 N GLY A 52 -0.453 18.455 12.076 1.00 0.00 N ATOM 763 CA GLY A 52 -0.852 18.952 10.773 1.00 0.00 C ATOM 764 C GLY A 52 -1.748 17.981 10.030 1.00 0.00 C ATOM 765 O GLY A 52 -1.311 16.900 9.637 1.00 0.00 O ATOM 0 H GLY A 52 -0.460 17.439 12.168 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.373 19.902 10.894 1.00 0.00 H new ATOM 0 HA3 GLY A 52 0.038 19.150 10.175 1.00 0.00 H new ATOM 769 N ASP A 53 -3.005 18.366 9.840 1.00 0.00 N ATOM 770 CA ASP A 53 -3.966 17.521 9.141 1.00 0.00 C ATOM 771 C ASP A 53 -3.516 17.257 7.708 1.00 0.00 C ATOM 772 O ASP A 53 -2.898 18.112 7.073 1.00 0.00 O ATOM 773 CB ASP A 53 -5.349 18.175 9.143 1.00 0.00 C ATOM 774 CG ASP A 53 -5.848 18.469 10.543 1.00 0.00 C ATOM 775 OD1 ASP A 53 -5.088 19.070 11.331 1.00 0.00 O ATOM 776 OD2 ASP A 53 -7.000 18.099 10.852 1.00 0.00 O ATOM 0 H ASP A 53 -3.382 19.258 10.160 1.00 0.00 H new ATOM 0 HA ASP A 53 -4.023 16.567 9.666 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.310 19.103 8.572 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -6.058 17.520 8.638 1.00 0.00 H new ATOM 781 N VAL A 54 -3.829 16.068 7.203 1.00 0.00 N ATOM 782 CA VAL A 54 -3.456 15.691 5.845 1.00 0.00 C ATOM 783 C VAL A 54 -4.677 15.652 4.932 1.00 0.00 C ATOM 784 O VAL A 54 -5.782 15.325 5.367 1.00 0.00 O ATOM 785 CB VAL A 54 -2.761 14.318 5.814 1.00 0.00 C ATOM 786 CG1 VAL A 54 -2.571 13.847 4.380 1.00 0.00 C ATOM 787 CG2 VAL A 54 -1.428 14.379 6.544 1.00 0.00 C ATOM 0 H VAL A 54 -4.340 15.349 7.715 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.760 16.449 5.485 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.398 13.597 6.327 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.078 12.875 4.379 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.543 13.762 3.893 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.956 14.566 3.839 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.951 13.400 6.512 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.782 15.113 6.062 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.594 14.668 7.582 1.00 0.00 H new ATOM 797 N THR A 55 -4.470 15.985 3.662 1.00 0.00 N ATOM 798 CA THR A 55 -5.553 15.989 2.686 1.00 0.00 C ATOM 799 C THR A 55 -5.041 15.632 1.295 1.00 0.00 C ATOM 800 O THR A 55 -3.837 15.667 1.038 1.00 0.00 O ATOM 801 CB THR A 55 -6.252 17.360 2.627 1.00 0.00 C ATOM 802 OG1 THR A 55 -5.276 18.403 2.526 1.00 0.00 O ATOM 803 CG2 THR A 55 -7.112 17.582 3.862 1.00 0.00 C ATOM 0 H THR A 55 -3.562 16.256 3.285 1.00 0.00 H new ATOM 0 HA THR A 55 -6.272 15.237 3.010 1.00 0.00 H new ATOM 0 HB THR A 55 -6.895 17.378 1.747 1.00 0.00 H new ATOM 0 HG1 THR A 55 -5.728 19.272 2.487 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.596 18.557 3.798 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.872 16.803 3.921 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.485 17.546 4.753 1.00 0.00 H new ATOM 811 N HIS A 56 -5.962 15.289 0.401 1.00 0.00 N ATOM 812 CA HIS A 56 -5.603 14.927 -0.966 1.00 0.00 C ATOM 813 C HIS A 56 -4.569 13.805 -0.977 1.00 0.00 C ATOM 814 O HIS A 56 -3.646 13.806 -1.791 1.00 0.00 O ATOM 815 CB HIS A 56 -5.060 16.145 -1.713 1.00 0.00 C ATOM 816 CG HIS A 56 -6.125 17.098 -2.159 1.00 0.00 C ATOM 817 ND1 HIS A 56 -5.894 18.442 -2.367 1.00 0.00 N ATOM 818 CD2 HIS A 56 -7.434 16.896 -2.438 1.00 0.00 C ATOM 819 CE1 HIS A 56 -7.014 19.025 -2.753 1.00 0.00 C ATOM 820 NE2 HIS A 56 -7.964 18.109 -2.805 1.00 0.00 N ATOM 0 H HIS A 56 -6.962 15.254 0.598 1.00 0.00 H new ATOM 0 HA HIS A 56 -6.502 14.573 -1.470 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.358 16.673 -1.068 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -4.499 15.806 -2.584 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -7.963 15.956 -2.382 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.133 20.073 -2.986 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -8.934 18.275 -3.074 1.00 0.00 H new ATOM 828 N PHE A 57 -4.730 12.850 -0.067 1.00 0.00 N ATOM 829 CA PHE A 57 -3.809 11.723 0.029 1.00 0.00 C ATOM 830 C PHE A 57 -3.789 10.924 -1.271 1.00 0.00 C ATOM 831 O PHE A 57 -4.785 10.305 -1.647 1.00 0.00 O ATOM 832 CB PHE A 57 -4.203 10.813 1.194 1.00 0.00 C ATOM 833 CG PHE A 57 -3.403 9.543 1.260 1.00 0.00 C ATOM 834 CD1 PHE A 57 -3.703 8.475 0.430 1.00 0.00 C ATOM 835 CD2 PHE A 57 -2.350 9.418 2.152 1.00 0.00 C ATOM 836 CE1 PHE A 57 -2.968 7.306 0.489 1.00 0.00 C ATOM 837 CE2 PHE A 57 -1.612 8.251 2.216 1.00 0.00 C ATOM 838 CZ PHE A 57 -1.921 7.194 1.383 1.00 0.00 C ATOM 0 H PHE A 57 -5.489 12.834 0.614 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.809 12.118 0.207 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -4.080 11.359 2.129 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -5.260 10.563 1.108 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -4.520 8.557 -0.271 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -2.103 10.242 2.805 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -3.212 6.481 -0.163 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -0.795 8.166 2.917 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.345 6.282 1.430 1.00 0.00 H new ATOM 848 N ILE A 58 -2.649 10.945 -1.954 1.00 0.00 N ATOM 849 CA ILE A 58 -2.499 10.223 -3.211 1.00 0.00 C ATOM 850 C ILE A 58 -1.808 8.881 -2.995 1.00 0.00 C ATOM 851 O ILE A 58 -0.841 8.783 -2.239 1.00 0.00 O ATOM 852 CB ILE A 58 -1.695 11.042 -4.238 1.00 0.00 C ATOM 853 CG1 ILE A 58 -2.505 12.254 -4.702 1.00 0.00 C ATOM 854 CG2 ILE A 58 -1.309 10.171 -5.424 1.00 0.00 C ATOM 855 CD1 ILE A 58 -3.914 11.911 -5.132 1.00 0.00 C ATOM 0 H ILE A 58 -1.816 11.454 -1.658 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.503 10.054 -3.599 1.00 0.00 H new ATOM 0 HB ILE A 58 -0.782 11.399 -3.762 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.548 12.983 -3.893 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.986 12.731 -5.534 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -0.741 10.764 -6.141 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.699 9.336 -5.079 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.210 9.788 -5.903 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.429 12.818 -5.448 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.879 11.205 -5.962 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -4.450 11.462 -4.296 1.00 0.00 H new ATOM 867 N CYS A 59 -2.309 7.849 -3.665 1.00 0.00 N ATOM 868 CA CYS A 59 -1.739 6.511 -3.548 1.00 0.00 C ATOM 869 C CYS A 59 -1.364 5.958 -4.918 1.00 0.00 C ATOM 870 O CYS A 59 -2.180 5.951 -5.840 1.00 0.00 O ATOM 871 CB CYS A 59 -2.729 5.571 -2.858 1.00 0.00 C ATOM 872 SG CYS A 59 -3.894 4.771 -3.985 1.00 0.00 S ATOM 0 H CYS A 59 -3.109 7.913 -4.295 1.00 0.00 H new ATOM 0 HA CYS A 59 -0.834 6.580 -2.945 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -2.171 4.802 -2.323 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -3.290 6.135 -2.113 1.00 0.00 H new ATOM 0 HG CYS A 59 -5.110 4.999 -3.586 1.00 0.00 H new ATOM 878 N GLN A 60 -0.124 5.496 -5.045 1.00 0.00 N ATOM 879 CA GLN A 60 0.359 4.943 -6.305 1.00 0.00 C ATOM 880 C GLN A 60 1.211 3.701 -6.063 1.00 0.00 C ATOM 881 O GLN A 60 1.763 3.517 -4.979 1.00 0.00 O ATOM 882 CB GLN A 60 1.171 5.991 -7.068 1.00 0.00 C ATOM 883 CG GLN A 60 0.328 7.131 -7.617 1.00 0.00 C ATOM 884 CD GLN A 60 0.972 7.812 -8.809 1.00 0.00 C ATOM 885 OE1 GLN A 60 1.626 7.167 -9.628 1.00 0.00 O ATOM 886 NE2 GLN A 60 0.790 9.123 -8.911 1.00 0.00 N ATOM 0 H GLN A 60 0.564 5.494 -4.292 1.00 0.00 H new ATOM 0 HA GLN A 60 -0.506 4.657 -6.903 1.00 0.00 H new ATOM 0 HB2 GLN A 60 1.934 6.400 -6.406 1.00 0.00 H new ATOM 0 HB3 GLN A 60 1.692 5.505 -7.893 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -0.650 6.747 -7.907 1.00 0.00 H new ATOM 0 HG3 GLN A 60 0.161 7.866 -6.830 1.00 0.00 H new ATOM 0 HE21 GLN A 60 0.240 9.618 -8.209 1.00 0.00 H new ATOM 0 HE22 GLN A 60 1.200 9.636 -9.692 1.00 0.00 H new ATOM 895 N ALA A 61 1.312 2.852 -7.080 1.00 0.00 N ATOM 896 CA ALA A 61 2.098 1.628 -6.978 1.00 0.00 C ATOM 897 C ALA A 61 2.550 1.150 -8.353 1.00 0.00 C ATOM 898 O ALA A 61 2.020 1.583 -9.377 1.00 0.00 O ATOM 899 CB ALA A 61 1.295 0.542 -6.277 1.00 0.00 C ATOM 0 H ALA A 61 0.860 2.989 -7.984 1.00 0.00 H new ATOM 0 HA ALA A 61 2.988 1.845 -6.387 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.894 -0.366 -6.208 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.027 0.877 -5.275 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.388 0.336 -6.845 1.00 0.00 H new ATOM 905 N ALA A 62 3.533 0.256 -8.370 1.00 0.00 N ATOM 906 CA ALA A 62 4.055 -0.282 -9.621 1.00 0.00 C ATOM 907 C ALA A 62 4.515 -1.726 -9.448 1.00 0.00 C ATOM 908 O ALA A 62 5.282 -2.039 -8.537 1.00 0.00 O ATOM 909 CB ALA A 62 5.200 0.581 -10.129 1.00 0.00 C ATOM 0 H ALA A 62 3.984 -0.111 -7.532 1.00 0.00 H new ATOM 0 HA ALA A 62 3.251 -0.270 -10.357 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.580 0.168 -11.063 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.842 1.596 -10.300 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.999 0.598 -9.388 1.00 0.00 H new ATOM 915 N VAL A 63 4.041 -2.602 -10.327 1.00 0.00 N ATOM 916 CA VAL A 63 4.404 -4.013 -10.272 1.00 0.00 C ATOM 917 C VAL A 63 4.881 -4.512 -11.631 1.00 0.00 C ATOM 918 O VAL A 63 4.471 -4.017 -12.681 1.00 0.00 O ATOM 919 CB VAL A 63 3.218 -4.880 -9.807 1.00 0.00 C ATOM 920 CG1 VAL A 63 2.532 -4.247 -8.606 1.00 0.00 C ATOM 921 CG2 VAL A 63 2.232 -5.087 -10.946 1.00 0.00 C ATOM 0 H VAL A 63 3.404 -2.360 -11.086 1.00 0.00 H new ATOM 0 HA VAL A 63 5.216 -4.102 -9.550 1.00 0.00 H new ATOM 0 HB VAL A 63 3.600 -5.855 -9.505 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.697 -4.873 -8.292 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.245 -4.155 -7.787 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.162 -3.258 -8.878 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.401 -5.701 -10.600 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.855 -4.121 -11.281 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.733 -5.587 -11.775 1.00 0.00 H new ATOM 931 N PRO A 64 5.770 -5.516 -11.614 1.00 0.00 N ATOM 932 CA PRO A 64 6.323 -6.105 -12.838 1.00 0.00 C ATOM 933 C PRO A 64 5.285 -6.906 -13.615 1.00 0.00 C ATOM 934 O PRO A 64 4.389 -7.515 -13.030 1.00 0.00 O ATOM 935 CB PRO A 64 7.430 -7.025 -12.319 1.00 0.00 C ATOM 936 CG PRO A 64 7.020 -7.367 -10.928 1.00 0.00 C ATOM 937 CD PRO A 64 6.304 -6.155 -10.399 1.00 0.00 C ATOM 0 HA PRO A 64 6.674 -5.344 -13.535 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.522 -7.919 -12.935 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.399 -6.526 -12.334 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.369 -8.241 -10.917 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.887 -7.607 -10.313 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.508 -6.429 -9.706 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.981 -5.492 -9.861 1.00 0.00 H new ATOM 945 N LYS A 65 5.411 -6.903 -14.938 1.00 0.00 N ATOM 946 CA LYS A 65 4.485 -7.631 -15.797 1.00 0.00 C ATOM 947 C LYS A 65 4.065 -8.948 -15.152 1.00 0.00 C ATOM 948 O LYS A 65 2.896 -9.331 -15.205 1.00 0.00 O ATOM 949 CB LYS A 65 5.126 -7.900 -17.161 1.00 0.00 C ATOM 950 CG LYS A 65 5.035 -6.724 -18.118 1.00 0.00 C ATOM 951 CD LYS A 65 5.676 -7.046 -19.458 1.00 0.00 C ATOM 952 CE LYS A 65 7.180 -6.821 -19.425 1.00 0.00 C ATOM 953 NZ LYS A 65 7.522 -5.380 -19.272 1.00 0.00 N ATOM 0 H LYS A 65 6.146 -6.404 -15.439 1.00 0.00 H new ATOM 0 HA LYS A 65 3.596 -7.015 -15.935 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.175 -8.159 -17.016 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.644 -8.766 -17.615 1.00 0.00 H new ATOM 0 HG2 LYS A 65 3.989 -6.456 -18.269 1.00 0.00 H new ATOM 0 HG3 LYS A 65 5.526 -5.856 -17.678 1.00 0.00 H new ATOM 0 HD2 LYS A 65 5.468 -8.083 -19.722 1.00 0.00 H new ATOM 0 HD3 LYS A 65 5.231 -6.424 -20.234 1.00 0.00 H new ATOM 0 HE2 LYS A 65 7.614 -7.387 -18.600 1.00 0.00 H new ATOM 0 HE3 LYS A 65 7.625 -7.204 -20.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.482 -5.211 -19.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.843 -4.803 -19.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.480 -5.118 -18.266 1.00 0.00 H new ATOM 967 N SER A 66 5.025 -9.636 -14.543 1.00 0.00 N ATOM 968 CA SER A 66 4.755 -10.911 -13.890 1.00 0.00 C ATOM 969 C SER A 66 3.536 -10.807 -12.979 1.00 0.00 C ATOM 970 O SER A 66 2.642 -11.654 -13.019 1.00 0.00 O ATOM 971 CB SER A 66 5.973 -11.362 -13.081 1.00 0.00 C ATOM 972 OG SER A 66 6.948 -11.960 -13.918 1.00 0.00 O ATOM 0 H SER A 66 5.997 -9.332 -14.488 1.00 0.00 H new ATOM 0 HA SER A 66 4.547 -11.650 -14.663 1.00 0.00 H new ATOM 0 HB2 SER A 66 6.408 -10.506 -12.565 1.00 0.00 H new ATOM 0 HB3 SER A 66 5.662 -12.072 -12.315 1.00 0.00 H new ATOM 0 HG SER A 66 7.717 -12.238 -13.378 1.00 0.00 H new ATOM 978 N LEU A 67 3.506 -9.763 -12.158 1.00 0.00 N ATOM 979 CA LEU A 67 2.396 -9.547 -11.236 1.00 0.00 C ATOM 980 C LEU A 67 1.380 -8.575 -11.826 1.00 0.00 C ATOM 981 O LEU A 67 1.661 -7.889 -12.808 1.00 0.00 O ATOM 982 CB LEU A 67 2.915 -9.012 -9.900 1.00 0.00 C ATOM 983 CG LEU A 67 4.018 -9.832 -9.231 1.00 0.00 C ATOM 984 CD1 LEU A 67 4.530 -9.124 -7.986 1.00 0.00 C ATOM 985 CD2 LEU A 67 3.511 -11.225 -8.884 1.00 0.00 C ATOM 0 H LEU A 67 4.237 -9.053 -12.112 1.00 0.00 H new ATOM 0 HA LEU A 67 1.901 -10.504 -11.070 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.287 -8.000 -10.057 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.075 -8.939 -9.210 1.00 0.00 H new ATOM 0 HG LEU A 67 4.846 -9.932 -9.933 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.315 -9.723 -7.524 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.932 -8.149 -8.261 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.710 -8.992 -7.280 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.309 -11.795 -8.409 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.666 -11.145 -8.200 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.194 -11.734 -9.794 1.00 0.00 H new ATOM 997 N GLN A 68 0.199 -8.520 -11.218 1.00 0.00 N ATOM 998 CA GLN A 68 -0.858 -7.630 -11.682 1.00 0.00 C ATOM 999 C GLN A 68 -1.164 -6.558 -10.642 1.00 0.00 C ATOM 1000 O GLN A 68 -0.903 -6.740 -9.452 1.00 0.00 O ATOM 1001 CB GLN A 68 -2.125 -8.429 -11.996 1.00 0.00 C ATOM 1002 CG GLN A 68 -3.047 -7.742 -12.990 1.00 0.00 C ATOM 1003 CD GLN A 68 -4.072 -6.852 -12.315 1.00 0.00 C ATOM 1004 OE1 GLN A 68 -3.928 -6.496 -11.145 1.00 0.00 O ATOM 1005 NE2 GLN A 68 -5.115 -6.486 -13.051 1.00 0.00 N ATOM 0 H GLN A 68 -0.049 -9.081 -10.403 1.00 0.00 H new ATOM 0 HA GLN A 68 -0.511 -7.139 -12.591 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -1.841 -9.404 -12.391 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.671 -8.607 -11.070 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -2.451 -7.145 -13.680 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -3.562 -8.497 -13.584 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -5.194 -6.804 -14.017 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -5.837 -5.887 -12.651 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.719 -5.440 -11.097 1.00 0.00 N ATOM 1015 CA LEU A 69 -2.060 -4.337 -10.205 1.00 0.00 C ATOM 1016 C LEU A 69 -3.404 -3.725 -10.586 1.00 0.00 C ATOM 1017 O LEU A 69 -3.754 -3.657 -11.764 1.00 0.00 O ATOM 1018 CB LEU A 69 -0.969 -3.266 -10.246 1.00 0.00 C ATOM 1019 CG LEU A 69 -0.961 -2.271 -9.085 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -0.732 -2.993 -7.766 1.00 0.00 C ATOM 1021 CD2 LEU A 69 0.102 -1.204 -9.303 1.00 0.00 C ATOM 0 H LEU A 69 -1.942 -5.273 -12.078 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.135 -4.731 -9.192 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.000 -3.764 -10.278 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.071 -2.707 -11.176 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.934 -1.782 -9.044 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.729 -2.269 -6.951 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.530 -3.718 -7.605 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.227 -3.510 -7.796 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.093 -0.505 -8.467 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.082 -1.676 -9.371 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.107 -0.666 -10.228 1.00 0.00 H new ATOM 1033 N GLN A 70 -4.152 -3.280 -9.582 1.00 0.00 N ATOM 1034 CA GLN A 70 -5.457 -2.671 -9.813 1.00 0.00 C ATOM 1035 C GLN A 70 -5.817 -1.711 -8.684 1.00 0.00 C ATOM 1036 O GLN A 70 -6.029 -2.127 -7.544 1.00 0.00 O ATOM 1037 CB GLN A 70 -6.532 -3.753 -9.940 1.00 0.00 C ATOM 1038 CG GLN A 70 -7.928 -3.198 -10.168 1.00 0.00 C ATOM 1039 CD GLN A 70 -8.145 -2.729 -11.593 1.00 0.00 C ATOM 1040 OE1 GLN A 70 -7.272 -2.097 -12.190 1.00 0.00 O ATOM 1041 NE2 GLN A 70 -9.312 -3.036 -12.147 1.00 0.00 N ATOM 0 H GLN A 70 -3.877 -3.330 -8.601 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.407 -2.106 -10.744 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.274 -4.415 -10.766 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -6.534 -4.359 -9.034 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.664 -3.965 -9.926 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -8.100 -2.366 -9.486 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -10.006 -3.561 -11.616 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -9.514 -2.747 -13.104 1.00 0.00 H new ATOM 1050 N LEU A 71 -5.884 -0.424 -9.008 1.00 0.00 N ATOM 1051 CA LEU A 71 -6.218 0.597 -8.022 1.00 0.00 C ATOM 1052 C LEU A 71 -7.704 0.559 -7.681 1.00 0.00 C ATOM 1053 O LEU A 71 -8.552 0.839 -8.528 1.00 0.00 O ATOM 1054 CB LEU A 71 -5.838 1.983 -8.545 1.00 0.00 C ATOM 1055 CG LEU A 71 -5.465 3.021 -7.486 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -4.466 4.022 -8.047 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -6.709 3.735 -6.977 1.00 0.00 C ATOM 0 H LEU A 71 -5.711 -0.063 -9.946 1.00 0.00 H new ATOM 0 HA LEU A 71 -5.651 0.390 -7.115 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.997 1.873 -9.229 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.674 2.371 -9.127 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.998 2.504 -6.648 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.213 4.753 -7.279 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.563 3.498 -8.361 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.905 4.533 -8.903 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.424 4.470 -6.224 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.204 4.239 -7.807 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.390 3.008 -6.535 1.00 0.00 H new ATOM 1069 N GLN A 72 -8.012 0.213 -6.435 1.00 0.00 N ATOM 1070 CA GLN A 72 -9.396 0.141 -5.982 1.00 0.00 C ATOM 1071 C GLN A 72 -9.871 1.494 -5.463 1.00 0.00 C ATOM 1072 O GLN A 72 -9.068 2.399 -5.238 1.00 0.00 O ATOM 1073 CB GLN A 72 -9.542 -0.919 -4.889 1.00 0.00 C ATOM 1074 CG GLN A 72 -10.987 -1.222 -4.525 1.00 0.00 C ATOM 1075 CD GLN A 72 -11.833 -1.567 -5.734 1.00 0.00 C ATOM 1076 OE1 GLN A 72 -12.828 -0.900 -6.021 1.00 0.00 O ATOM 1077 NE2 GLN A 72 -11.442 -2.614 -6.451 1.00 0.00 N ATOM 0 H GLN A 72 -7.322 -0.022 -5.722 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.017 -0.138 -6.834 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -9.059 -1.838 -5.219 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -9.014 -0.584 -3.996 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.013 -2.052 -3.819 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -11.419 -0.359 -4.018 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -10.611 -3.138 -6.177 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -11.973 -2.894 -7.276 1.00 0.00 H new ATOM 1086 N ALA A 73 -11.180 1.624 -5.274 1.00 0.00 N ATOM 1087 CA ALA A 73 -11.761 2.866 -4.780 1.00 0.00 C ATOM 1088 C ALA A 73 -11.423 3.082 -3.309 1.00 0.00 C ATOM 1089 O ALA A 73 -11.747 2.266 -2.446 1.00 0.00 O ATOM 1090 CB ALA A 73 -13.269 2.860 -4.981 1.00 0.00 C ATOM 0 H ALA A 73 -11.858 0.884 -5.456 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.333 3.691 -5.350 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.690 3.794 -4.607 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.494 2.760 -6.043 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.705 2.022 -4.437 1.00 0.00 H new ATOM 1096 N PRO A 74 -10.754 4.207 -3.014 1.00 0.00 N ATOM 1097 CA PRO A 74 -10.358 4.557 -1.647 1.00 0.00 C ATOM 1098 C PRO A 74 -11.552 4.921 -0.771 1.00 0.00 C ATOM 1099 O PRO A 74 -12.701 4.833 -1.205 1.00 0.00 O ATOM 1100 CB PRO A 74 -9.447 5.772 -1.841 1.00 0.00 C ATOM 1101 CG PRO A 74 -9.889 6.374 -3.131 1.00 0.00 C ATOM 1102 CD PRO A 74 -10.335 5.225 -3.992 1.00 0.00 C ATOM 0 HA PRO A 74 -9.876 3.723 -1.137 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -9.550 6.479 -1.018 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -8.398 5.478 -1.880 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -10.702 7.082 -2.973 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -9.075 6.924 -3.604 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -11.155 5.511 -4.650 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -9.527 4.863 -4.628 1.00 0.00 H new ATOM 1110 N SER A 75 -11.273 5.330 0.462 1.00 0.00 N ATOM 1111 CA SER A 75 -12.326 5.704 1.400 1.00 0.00 C ATOM 1112 C SER A 75 -12.516 7.217 1.428 1.00 0.00 C ATOM 1113 O SER A 75 -13.639 7.712 1.504 1.00 0.00 O ATOM 1114 CB SER A 75 -11.992 5.194 2.803 1.00 0.00 C ATOM 1115 OG SER A 75 -12.909 5.698 3.760 1.00 0.00 O ATOM 0 H SER A 75 -10.327 5.411 0.835 1.00 0.00 H new ATOM 0 HA SER A 75 -13.257 5.245 1.066 1.00 0.00 H new ATOM 0 HB2 SER A 75 -12.014 4.104 2.812 1.00 0.00 H new ATOM 0 HB3 SER A 75 -10.979 5.495 3.071 1.00 0.00 H new ATOM 0 HG SER A 75 -12.675 5.357 4.648 1.00 0.00 H new ATOM 1121 N GLY A 76 -11.406 7.948 1.366 1.00 0.00 N ATOM 1122 CA GLY A 76 -11.471 9.398 1.385 1.00 0.00 C ATOM 1123 C GLY A 76 -10.100 10.040 1.315 1.00 0.00 C ATOM 1124 O GLY A 76 -9.117 9.473 1.790 1.00 0.00 O ATOM 0 H GLY A 76 -10.464 7.562 1.303 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.074 9.743 0.545 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.976 9.724 2.294 1.00 0.00 H new ATOM 1128 N ASN A 77 -10.034 11.227 0.720 1.00 0.00 N ATOM 1129 CA ASN A 77 -8.772 11.946 0.588 1.00 0.00 C ATOM 1130 C ASN A 77 -8.581 12.926 1.741 1.00 0.00 C ATOM 1131 O ASN A 77 -8.156 14.065 1.540 1.00 0.00 O ATOM 1132 CB ASN A 77 -8.725 12.694 -0.746 1.00 0.00 C ATOM 1133 CG ASN A 77 -9.011 11.788 -1.928 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -10.150 11.377 -2.148 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -7.974 11.472 -2.695 1.00 0.00 N ATOM 0 H ASN A 77 -10.839 11.711 0.322 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.962 11.217 0.617 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.452 13.506 -0.730 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -7.742 13.149 -0.870 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -8.105 10.865 -3.505 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -7.047 11.836 -2.475 1.00 0.00 H new ATOM 1142 N THR A 78 -8.898 12.477 2.952 1.00 0.00 N ATOM 1143 CA THR A 78 -8.762 13.314 4.137 1.00 0.00 C ATOM 1144 C THR A 78 -8.402 12.479 5.361 1.00 0.00 C ATOM 1145 O THR A 78 -8.994 11.427 5.603 1.00 0.00 O ATOM 1146 CB THR A 78 -10.059 14.094 4.425 1.00 0.00 C ATOM 1147 OG1 THR A 78 -10.383 14.934 3.312 1.00 0.00 O ATOM 1148 CG2 THR A 78 -9.913 14.941 5.680 1.00 0.00 C ATOM 0 H THR A 78 -9.251 11.538 3.137 1.00 0.00 H new ATOM 0 HA THR A 78 -7.958 14.022 3.934 1.00 0.00 H new ATOM 0 HB THR A 78 -10.862 13.374 4.582 1.00 0.00 H new ATOM 0 HG1 THR A 78 -11.209 15.425 3.502 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.841 15.483 5.863 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.695 14.296 6.531 1.00 0.00 H new ATOM 0 HG23 THR A 78 -9.098 15.652 5.546 1.00 0.00 H new ATOM 1156 N VAL A 79 -7.428 12.954 6.130 1.00 0.00 N ATOM 1157 CA VAL A 79 -6.991 12.252 7.331 1.00 0.00 C ATOM 1158 C VAL A 79 -6.841 13.213 8.506 1.00 0.00 C ATOM 1159 O VAL A 79 -6.236 14.279 8.394 1.00 0.00 O ATOM 1160 CB VAL A 79 -5.651 11.528 7.101 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -5.170 10.874 8.387 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -5.787 10.499 5.988 1.00 0.00 C ATOM 0 H VAL A 79 -6.926 13.822 5.943 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.759 11.515 7.564 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.907 12.264 6.796 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -4.222 10.367 8.205 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.033 11.637 9.154 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.910 10.149 8.725 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.831 9.997 5.838 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.544 9.764 6.262 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -6.083 10.998 5.065 1.00 0.00 H new ATOM 1172 N PRO A 80 -7.405 12.828 9.660 1.00 0.00 N ATOM 1173 CA PRO A 80 -7.347 13.640 10.879 1.00 0.00 C ATOM 1174 C PRO A 80 -5.943 13.699 11.470 1.00 0.00 C ATOM 1175 O PRO A 80 -5.208 12.711 11.449 1.00 0.00 O ATOM 1176 CB PRO A 80 -8.300 12.916 11.834 1.00 0.00 C ATOM 1177 CG PRO A 80 -8.312 11.504 11.358 1.00 0.00 C ATOM 1178 CD PRO A 80 -8.142 11.569 9.865 1.00 0.00 C ATOM 0 HA PRO A 80 -7.619 14.678 10.690 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -7.954 12.983 12.865 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.298 13.353 11.804 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.507 10.930 11.818 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.247 11.011 11.623 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -7.586 10.712 9.486 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -9.103 11.578 9.351 1.00 0.00 H new ATOM 1186 N ALA A 81 -5.576 14.862 11.999 1.00 0.00 N ATOM 1187 CA ALA A 81 -4.261 15.047 12.599 1.00 0.00 C ATOM 1188 C ALA A 81 -4.172 14.353 13.953 1.00 0.00 C ATOM 1189 O ALA A 81 -3.116 14.340 14.587 1.00 0.00 O ATOM 1190 CB ALA A 81 -3.951 16.530 12.743 1.00 0.00 C ATOM 0 H ALA A 81 -6.171 15.690 12.024 1.00 0.00 H new ATOM 0 HA ALA A 81 -3.521 14.594 11.939 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.966 16.654 13.193 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.963 17.001 11.760 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.702 16.998 13.380 1.00 0.00 H new ATOM 1196 N ARG A 82 -5.286 13.776 14.392 1.00 0.00 N ATOM 1197 CA ARG A 82 -5.334 13.081 15.672 1.00 0.00 C ATOM 1198 C ARG A 82 -5.620 11.595 15.474 1.00 0.00 C ATOM 1199 O ARG A 82 -6.292 10.968 16.292 1.00 0.00 O ATOM 1200 CB ARG A 82 -6.402 13.701 16.574 1.00 0.00 C ATOM 1201 CG ARG A 82 -6.178 15.177 16.858 1.00 0.00 C ATOM 1202 CD ARG A 82 -5.086 15.385 17.896 1.00 0.00 C ATOM 1203 NE ARG A 82 -5.619 15.399 19.256 1.00 0.00 N ATOM 1204 CZ ARG A 82 -4.891 15.689 20.328 1.00 0.00 C ATOM 1205 NH1 ARG A 82 -3.606 15.988 20.199 1.00 0.00 N ATOM 1206 NH2 ARG A 82 -5.448 15.680 21.532 1.00 0.00 N ATOM 0 H ARG A 82 -6.168 13.776 13.879 1.00 0.00 H new ATOM 0 HA ARG A 82 -4.360 13.185 16.150 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -7.378 13.574 16.107 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -6.428 13.158 17.519 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.906 15.689 15.935 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.107 15.626 17.210 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -4.344 14.592 17.806 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -4.572 16.326 17.698 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.605 15.174 19.390 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -3.174 15.996 19.275 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -3.049 16.210 21.024 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -6.436 15.450 21.635 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -4.888 15.903 22.355 1.00 0.00 H new ATOM 1220 N GLY A 83 -5.106 11.039 14.381 1.00 0.00 N ATOM 1221 CA GLY A 83 -5.318 9.632 14.095 1.00 0.00 C ATOM 1222 C GLY A 83 -6.718 9.348 13.589 1.00 0.00 C ATOM 1223 O GLY A 83 -6.897 8.889 12.462 1.00 0.00 O ATOM 0 H GLY A 83 -4.547 11.538 13.689 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -4.592 9.302 13.351 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.136 9.049 14.998 1.00 0.00 H new ATOM 1227 N GLY A 84 -7.715 9.619 14.426 1.00 0.00 N ATOM 1228 CA GLY A 84 -9.094 9.382 14.040 1.00 0.00 C ATOM 1229 C GLY A 84 -9.264 8.091 13.265 1.00 0.00 C ATOM 1230 O GLY A 84 -9.348 7.011 13.853 1.00 0.00 O ATOM 0 H GLY A 84 -7.592 9.999 15.365 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.718 9.351 14.933 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.447 10.216 13.433 1.00 0.00 H new ATOM 1234 N LEU A 85 -9.318 8.200 11.942 1.00 0.00 N ATOM 1235 CA LEU A 85 -9.482 7.031 11.084 1.00 0.00 C ATOM 1236 C LEU A 85 -8.607 7.143 9.840 1.00 0.00 C ATOM 1237 O LEU A 85 -8.803 8.010 8.988 1.00 0.00 O ATOM 1238 CB LEU A 85 -10.948 6.874 10.678 1.00 0.00 C ATOM 1239 CG LEU A 85 -11.975 7.026 11.801 1.00 0.00 C ATOM 1240 CD1 LEU A 85 -12.335 8.490 12.000 1.00 0.00 C ATOM 1241 CD2 LEU A 85 -13.221 6.205 11.499 1.00 0.00 C ATOM 0 H LEU A 85 -9.251 9.085 11.440 1.00 0.00 H new ATOM 0 HA LEU A 85 -9.171 6.151 11.647 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.171 7.611 9.906 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.076 5.890 10.226 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.533 6.653 12.725 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -13.067 8.579 12.803 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.439 9.053 12.262 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.758 8.889 11.078 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.941 6.325 12.309 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.665 6.548 10.565 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -12.950 5.153 11.407 1.00 0.00 H new ATOM 1253 N PRO A 86 -7.619 6.243 9.728 1.00 0.00 N ATOM 1254 CA PRO A 86 -6.696 6.218 8.589 1.00 0.00 C ATOM 1255 C PRO A 86 -7.378 5.774 7.300 1.00 0.00 C ATOM 1256 O PRO A 86 -8.543 5.374 7.309 1.00 0.00 O ATOM 1257 CB PRO A 86 -5.637 5.196 9.013 1.00 0.00 C ATOM 1258 CG PRO A 86 -6.335 4.308 9.985 1.00 0.00 C ATOM 1259 CD PRO A 86 -7.326 5.180 10.705 1.00 0.00 C ATOM 0 HA PRO A 86 -6.291 7.206 8.371 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.266 4.632 8.157 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.776 5.684 9.470 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.837 3.487 9.473 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -5.627 3.862 10.684 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.224 4.626 10.978 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -6.909 5.585 11.627 1.00 0.00 H new ATOM 1267 N ILE A 87 -6.646 5.846 6.194 1.00 0.00 N ATOM 1268 CA ILE A 87 -7.181 5.449 4.897 1.00 0.00 C ATOM 1269 C ILE A 87 -6.692 4.060 4.501 1.00 0.00 C ATOM 1270 O ILE A 87 -5.504 3.754 4.609 1.00 0.00 O ATOM 1271 CB ILE A 87 -6.789 6.452 3.796 1.00 0.00 C ATOM 1272 CG1 ILE A 87 -7.328 7.845 4.129 1.00 0.00 C ATOM 1273 CG2 ILE A 87 -7.310 5.986 2.445 1.00 0.00 C ATOM 1274 CD1 ILE A 87 -6.682 8.951 3.325 1.00 0.00 C ATOM 0 H ILE A 87 -5.681 6.175 6.170 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.266 5.434 4.995 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.702 6.506 3.745 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.404 7.861 3.954 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.174 8.041 5.190 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.025 6.705 1.677 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -6.883 5.012 2.206 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.396 5.906 2.482 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -7.113 9.910 3.614 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.609 8.962 3.518 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.858 8.779 2.263 1.00 0.00 H new ATOM 1286 N THR A 88 -7.615 3.222 4.041 1.00 0.00 N ATOM 1287 CA THR A 88 -7.278 1.866 3.628 1.00 0.00 C ATOM 1288 C THR A 88 -7.769 1.584 2.213 1.00 0.00 C ATOM 1289 O THR A 88 -8.932 1.824 1.890 1.00 0.00 O ATOM 1290 CB THR A 88 -7.882 0.821 4.586 1.00 0.00 C ATOM 1291 OG1 THR A 88 -9.295 1.020 4.701 1.00 0.00 O ATOM 1292 CG2 THR A 88 -7.238 0.912 5.961 1.00 0.00 C ATOM 0 H THR A 88 -8.602 3.459 3.945 1.00 0.00 H new ATOM 0 HA THR A 88 -6.191 1.788 3.655 1.00 0.00 H new ATOM 0 HB THR A 88 -7.688 -0.170 4.176 1.00 0.00 H new ATOM 0 HG1 THR A 88 -9.658 1.297 3.834 1.00 0.00 H new ATOM 0 HG21 THR A 88 -7.680 0.165 6.620 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.167 0.730 5.874 1.00 0.00 H new ATOM 0 HG23 THR A 88 -7.405 1.906 6.376 1.00 0.00 H new ATOM 1300 N GLN A 89 -6.875 1.073 1.373 1.00 0.00 N ATOM 1301 CA GLN A 89 -7.218 0.758 -0.009 1.00 0.00 C ATOM 1302 C GLN A 89 -6.911 -0.701 -0.328 1.00 0.00 C ATOM 1303 O GLN A 89 -6.190 -1.371 0.413 1.00 0.00 O ATOM 1304 CB GLN A 89 -6.454 1.673 -0.968 1.00 0.00 C ATOM 1305 CG GLN A 89 -6.754 3.150 -0.768 1.00 0.00 C ATOM 1306 CD GLN A 89 -6.531 3.967 -2.025 1.00 0.00 C ATOM 1307 OE1 GLN A 89 -5.865 5.002 -1.998 1.00 0.00 O ATOM 1308 NE2 GLN A 89 -7.089 3.504 -3.138 1.00 0.00 N ATOM 0 H GLN A 89 -5.908 0.868 1.625 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.288 0.921 -0.137 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -5.384 1.507 -0.840 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -6.699 1.397 -1.993 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -7.788 3.266 -0.443 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -6.123 3.540 0.031 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.633 2.642 -3.115 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -6.973 4.011 -4.016 1.00 0.00 H new ATOM 1317 N LEU A 90 -7.463 -1.189 -1.433 1.00 0.00 N ATOM 1318 CA LEU A 90 -7.249 -2.570 -1.851 1.00 0.00 C ATOM 1319 C LEU A 90 -6.443 -2.630 -3.144 1.00 0.00 C ATOM 1320 O LEU A 90 -6.559 -1.754 -4.001 1.00 0.00 O ATOM 1321 CB LEU A 90 -8.590 -3.280 -2.040 1.00 0.00 C ATOM 1322 CG LEU A 90 -8.573 -4.520 -2.935 1.00 0.00 C ATOM 1323 CD1 LEU A 90 -7.894 -5.681 -2.226 1.00 0.00 C ATOM 1324 CD2 LEU A 90 -9.988 -4.899 -3.349 1.00 0.00 C ATOM 0 H LEU A 90 -8.063 -0.648 -2.056 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.683 -3.076 -1.069 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -8.966 -3.570 -1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.301 -2.566 -2.456 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.003 -4.287 -3.834 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -7.891 -6.554 -2.878 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.868 -5.408 -1.981 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.436 -5.914 -1.309 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -9.956 -5.783 -3.985 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -10.582 -5.112 -2.460 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.440 -4.073 -3.898 1.00 0.00 H new ATOM 1336 N PHE A 91 -5.626 -3.669 -3.279 1.00 0.00 N ATOM 1337 CA PHE A 91 -4.801 -3.844 -4.468 1.00 0.00 C ATOM 1338 C PHE A 91 -4.738 -5.313 -4.876 1.00 0.00 C ATOM 1339 O PHE A 91 -4.233 -6.154 -4.132 1.00 0.00 O ATOM 1340 CB PHE A 91 -3.388 -3.312 -4.218 1.00 0.00 C ATOM 1341 CG PHE A 91 -3.349 -1.847 -3.890 1.00 0.00 C ATOM 1342 CD1 PHE A 91 -3.612 -1.403 -2.604 1.00 0.00 C ATOM 1343 CD2 PHE A 91 -3.048 -0.913 -4.868 1.00 0.00 C ATOM 1344 CE1 PHE A 91 -3.577 -0.056 -2.301 1.00 0.00 C ATOM 1345 CE2 PHE A 91 -3.011 0.437 -4.571 1.00 0.00 C ATOM 1346 CZ PHE A 91 -3.275 0.865 -3.285 1.00 0.00 C ATOM 0 H PHE A 91 -5.518 -4.403 -2.579 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.256 -3.278 -5.281 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -2.937 -3.872 -3.399 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.778 -3.495 -5.102 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -3.847 -2.118 -1.830 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -2.840 -1.243 -5.875 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.786 0.277 -1.295 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -2.776 1.155 -5.343 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.245 1.918 -3.049 1.00 0.00 H new ATOM 1356 N ARG A 92 -5.256 -5.615 -6.062 1.00 0.00 N ATOM 1357 CA ARG A 92 -5.262 -6.982 -6.568 1.00 0.00 C ATOM 1358 C ARG A 92 -3.944 -7.309 -7.264 1.00 0.00 C ATOM 1359 O ARG A 92 -3.430 -6.510 -8.049 1.00 0.00 O ATOM 1360 CB ARG A 92 -6.427 -7.184 -7.538 1.00 0.00 C ATOM 1361 CG ARG A 92 -7.738 -7.531 -6.852 1.00 0.00 C ATOM 1362 CD ARG A 92 -8.772 -8.033 -7.847 1.00 0.00 C ATOM 1363 NE ARG A 92 -8.981 -7.090 -8.942 1.00 0.00 N ATOM 1364 CZ ARG A 92 -10.094 -7.039 -9.666 1.00 0.00 C ATOM 1365 NH1 ARG A 92 -11.093 -7.873 -9.412 1.00 0.00 N ATOM 1366 NH2 ARG A 92 -10.209 -6.152 -10.646 1.00 0.00 N ATOM 0 H ARG A 92 -5.677 -4.931 -6.691 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.383 -7.657 -5.720 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -6.563 -6.275 -8.124 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.172 -7.979 -8.238 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.562 -8.293 -6.093 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.124 -6.651 -6.337 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -8.450 -8.992 -8.252 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.717 -8.205 -7.332 1.00 0.00 H new ATOM 0 HE ARG A 92 -8.232 -6.434 -9.163 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.008 -8.556 -8.659 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -11.946 -7.832 -9.969 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -9.443 -5.509 -10.844 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -11.064 -6.114 -11.201 1.00 0.00 H new ATOM 1380 N ILE A 93 -3.402 -8.486 -6.971 1.00 0.00 N ATOM 1381 CA ILE A 93 -2.145 -8.918 -7.569 1.00 0.00 C ATOM 1382 C ILE A 93 -2.162 -10.414 -7.865 1.00 0.00 C ATOM 1383 O ILE A 93 -2.568 -11.219 -7.026 1.00 0.00 O ATOM 1384 CB ILE A 93 -0.948 -8.601 -6.654 1.00 0.00 C ATOM 1385 CG1 ILE A 93 -0.714 -7.091 -6.588 1.00 0.00 C ATOM 1386 CG2 ILE A 93 0.301 -9.315 -7.149 1.00 0.00 C ATOM 1387 CD1 ILE A 93 -0.114 -6.628 -5.278 1.00 0.00 C ATOM 0 H ILE A 93 -3.814 -9.158 -6.323 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.034 -8.367 -8.503 1.00 0.00 H new ATOM 0 HB ILE A 93 -1.173 -8.959 -5.649 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.054 -6.798 -7.404 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.662 -6.577 -6.745 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.138 -9.081 -6.492 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.129 -10.391 -7.148 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.531 -8.985 -8.162 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.024 -5.547 -5.303 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.783 -6.890 -4.459 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.850 -7.113 -5.128 1.00 0.00 H new ATOM 1399 N LEU A 94 -1.718 -10.779 -9.063 1.00 0.00 N ATOM 1400 CA LEU A 94 -1.680 -12.180 -9.470 1.00 0.00 C ATOM 1401 C LEU A 94 -0.251 -12.712 -9.456 1.00 0.00 C ATOM 1402 O LEU A 94 0.611 -12.223 -10.186 1.00 0.00 O ATOM 1403 CB LEU A 94 -2.284 -12.342 -10.866 1.00 0.00 C ATOM 1404 CG LEU A 94 -3.788 -12.611 -10.920 1.00 0.00 C ATOM 1405 CD1 LEU A 94 -4.133 -13.869 -10.139 1.00 0.00 C ATOM 1406 CD2 LEU A 94 -4.563 -11.417 -10.381 1.00 0.00 C ATOM 0 H LEU A 94 -1.380 -10.125 -9.769 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.269 -12.757 -8.757 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.076 -11.437 -11.437 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.770 -13.161 -11.369 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.073 -12.764 -11.961 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.208 -14.045 -10.188 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.606 -14.720 -10.569 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.833 -13.745 -9.098 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.632 -11.626 -10.427 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.274 -11.232 -9.346 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.339 -10.536 -10.983 1.00 0.00 H new ATOM 1418 N ASN A 95 -0.008 -13.719 -8.623 1.00 0.00 N ATOM 1419 CA ASN A 95 1.317 -14.319 -8.516 1.00 0.00 C ATOM 1420 C ASN A 95 1.282 -15.789 -8.923 1.00 0.00 C ATOM 1421 O ASN A 95 1.851 -16.657 -8.259 1.00 0.00 O ATOM 1422 CB ASN A 95 1.846 -14.187 -7.087 1.00 0.00 C ATOM 1423 CG ASN A 95 3.361 -14.221 -7.025 1.00 0.00 C ATOM 1424 OD1 ASN A 95 4.008 -13.198 -6.802 1.00 0.00 O ATOM 1425 ND2 ASN A 95 3.934 -15.402 -7.224 1.00 0.00 N ATOM 0 H ASN A 95 -0.711 -14.136 -8.013 1.00 0.00 H new ATOM 0 HA ASN A 95 1.985 -13.788 -9.194 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.488 -13.252 -6.655 1.00 0.00 H new ATOM 0 HB3 ASN A 95 1.442 -14.995 -6.477 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.950 -15.487 -7.195 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.358 -16.224 -7.406 1.00 0.00 H new ATOM 1432 N PRO A 96 0.600 -16.078 -10.041 1.00 0.00 N ATOM 1433 CA PRO A 96 0.475 -17.442 -10.563 1.00 0.00 C ATOM 1434 C PRO A 96 1.794 -17.975 -11.113 1.00 0.00 C ATOM 1435 O PRO A 96 1.968 -19.183 -11.272 1.00 0.00 O ATOM 1436 CB PRO A 96 -0.554 -17.300 -11.686 1.00 0.00 C ATOM 1437 CG PRO A 96 -0.450 -15.878 -12.118 1.00 0.00 C ATOM 1438 CD PRO A 96 -0.102 -15.094 -10.883 1.00 0.00 C ATOM 0 HA PRO A 96 0.184 -18.150 -9.787 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -0.338 -17.981 -12.509 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -1.559 -17.534 -11.334 1.00 0.00 H new ATOM 0 HG2 PRO A 96 0.315 -15.758 -12.885 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.389 -15.531 -12.548 1.00 0.00 H new ATOM 0 HD2 PRO A 96 0.532 -14.239 -11.115 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -0.993 -14.705 -10.389 1.00 0.00 H new ATOM 1446 N ASN A 97 2.720 -17.066 -11.402 1.00 0.00 N ATOM 1447 CA ASN A 97 4.023 -17.446 -11.935 1.00 0.00 C ATOM 1448 C ASN A 97 4.969 -17.865 -10.813 1.00 0.00 C ATOM 1449 O ASN A 97 6.176 -17.990 -11.017 1.00 0.00 O ATOM 1450 CB ASN A 97 4.633 -16.285 -12.723 1.00 0.00 C ATOM 1451 CG ASN A 97 4.241 -16.313 -14.188 1.00 0.00 C ATOM 1452 OD1 ASN A 97 4.972 -16.840 -15.027 1.00 0.00 O ATOM 1453 ND2 ASN A 97 3.083 -15.743 -14.502 1.00 0.00 N ATOM 0 H ASN A 97 2.592 -16.062 -11.276 1.00 0.00 H new ATOM 0 HA ASN A 97 3.881 -18.296 -12.603 1.00 0.00 H new ATOM 0 HB2 ASN A 97 4.312 -15.341 -12.282 1.00 0.00 H new ATOM 0 HB3 ASN A 97 5.719 -16.323 -12.639 1.00 0.00 H new ATOM 0 HD21 ASN A 97 2.767 -15.730 -15.472 1.00 0.00 H new ATOM 0 HD22 ASN A 97 2.509 -15.318 -13.773 1.00 0.00 H new ATOM 1460 N LYS A 98 4.411 -18.080 -9.626 1.00 0.00 N ATOM 1461 CA LYS A 98 5.202 -18.487 -8.471 1.00 0.00 C ATOM 1462 C LYS A 98 6.493 -17.680 -8.384 1.00 0.00 C ATOM 1463 O LYS A 98 7.536 -18.201 -7.989 1.00 0.00 O ATOM 1464 CB LYS A 98 5.525 -19.981 -8.549 1.00 0.00 C ATOM 1465 CG LYS A 98 4.327 -20.877 -8.288 1.00 0.00 C ATOM 1466 CD LYS A 98 4.756 -22.268 -7.852 1.00 0.00 C ATOM 1467 CE LYS A 98 3.559 -23.128 -7.475 1.00 0.00 C ATOM 1468 NZ LYS A 98 3.955 -24.290 -6.633 1.00 0.00 N ATOM 0 H LYS A 98 3.413 -17.979 -9.439 1.00 0.00 H new ATOM 0 HA LYS A 98 4.614 -18.295 -7.573 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.928 -20.206 -9.537 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.306 -20.213 -7.825 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.699 -20.431 -7.517 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.721 -20.948 -9.191 1.00 0.00 H new ATOM 0 HD2 LYS A 98 5.311 -22.748 -8.658 1.00 0.00 H new ATOM 0 HD3 LYS A 98 5.433 -22.191 -7.001 1.00 0.00 H new ATOM 0 HE2 LYS A 98 2.831 -22.521 -6.937 1.00 0.00 H new ATOM 0 HE3 LYS A 98 3.069 -23.486 -8.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 3.112 -24.851 -6.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 4.631 -24.883 -7.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 4.400 -23.948 -5.757 1.00 0.00 H new ATOM 1482 N ALA A 99 6.416 -16.406 -8.755 1.00 0.00 N ATOM 1483 CA ALA A 99 7.578 -15.527 -8.716 1.00 0.00 C ATOM 1484 C ALA A 99 7.431 -14.472 -7.624 1.00 0.00 C ATOM 1485 O ALA A 99 6.687 -13.501 -7.763 1.00 0.00 O ATOM 1486 CB ALA A 99 7.784 -14.864 -10.069 1.00 0.00 C ATOM 0 H ALA A 99 5.561 -15.960 -9.086 1.00 0.00 H new ATOM 0 HA ALA A 99 8.454 -16.133 -8.484 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.655 -14.210 -10.025 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.942 -15.629 -10.829 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.902 -14.276 -10.324 1.00 0.00 H new ATOM 1492 N PRO A 100 8.156 -14.665 -6.513 1.00 0.00 N ATOM 1493 CA PRO A 100 8.123 -13.740 -5.376 1.00 0.00 C ATOM 1494 C PRO A 100 8.788 -12.405 -5.695 1.00 0.00 C ATOM 1495 O PRO A 100 9.982 -12.222 -5.458 1.00 0.00 O ATOM 1496 CB PRO A 100 8.909 -14.482 -4.292 1.00 0.00 C ATOM 1497 CG PRO A 100 9.814 -15.398 -5.040 1.00 0.00 C ATOM 1498 CD PRO A 100 9.064 -15.800 -6.280 1.00 0.00 C ATOM 0 HA PRO A 100 7.103 -13.488 -5.086 1.00 0.00 H new ATOM 0 HB2 PRO A 100 9.474 -13.789 -3.669 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.244 -15.036 -3.630 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.750 -14.900 -5.294 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.070 -16.270 -4.439 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.737 -15.956 -7.123 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.515 -16.730 -6.134 1.00 0.00 H new ATOM 1506 N LEU A 101 8.007 -11.475 -6.235 1.00 0.00 N ATOM 1507 CA LEU A 101 8.520 -10.155 -6.586 1.00 0.00 C ATOM 1508 C LEU A 101 8.203 -9.139 -5.494 1.00 0.00 C ATOM 1509 O LEU A 101 7.612 -9.479 -4.469 1.00 0.00 O ATOM 1510 CB LEU A 101 7.924 -9.693 -7.917 1.00 0.00 C ATOM 1511 CG LEU A 101 8.708 -10.076 -9.173 1.00 0.00 C ATOM 1512 CD1 LEU A 101 10.015 -9.302 -9.243 1.00 0.00 C ATOM 1513 CD2 LEU A 101 8.971 -11.575 -9.201 1.00 0.00 C ATOM 0 H LEU A 101 7.017 -11.611 -6.439 1.00 0.00 H new ATOM 0 HA LEU A 101 9.603 -10.228 -6.685 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.917 -10.102 -8.003 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.826 -8.608 -7.891 1.00 0.00 H new ATOM 0 HG LEU A 101 8.109 -9.816 -10.046 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.559 -9.588 -10.143 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.804 -8.233 -9.271 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.620 -9.530 -8.366 1.00 0.00 H new ATOM 0 HD21 LEU A 101 9.530 -11.830 -10.102 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.550 -11.859 -8.322 1.00 0.00 H new ATOM 0 HD23 LEU A 101 8.022 -12.111 -9.199 1.00 0.00 H new ATOM 1525 N ARG A 102 8.600 -7.891 -5.721 1.00 0.00 N ATOM 1526 CA ARG A 102 8.357 -6.825 -4.757 1.00 0.00 C ATOM 1527 C ARG A 102 7.282 -5.868 -5.262 1.00 0.00 C ATOM 1528 O ARG A 102 6.836 -5.967 -6.406 1.00 0.00 O ATOM 1529 CB ARG A 102 9.650 -6.055 -4.480 1.00 0.00 C ATOM 1530 CG ARG A 102 10.142 -5.244 -5.667 1.00 0.00 C ATOM 1531 CD ARG A 102 11.498 -4.615 -5.388 1.00 0.00 C ATOM 1532 NE ARG A 102 11.946 -3.768 -6.491 1.00 0.00 N ATOM 1533 CZ ARG A 102 12.478 -4.242 -7.612 1.00 0.00 C ATOM 1534 NH1 ARG A 102 12.627 -5.549 -7.778 1.00 0.00 N ATOM 1535 NH2 ARG A 102 12.861 -3.408 -8.570 1.00 0.00 N ATOM 0 H ARG A 102 9.091 -7.594 -6.564 1.00 0.00 H new ATOM 0 HA ARG A 102 8.007 -7.281 -3.831 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.490 -5.386 -3.635 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.427 -6.760 -4.186 1.00 0.00 H new ATOM 0 HG2 ARG A 102 10.211 -5.887 -6.545 1.00 0.00 H new ATOM 0 HG3 ARG A 102 9.418 -4.463 -5.900 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.442 -4.022 -4.475 1.00 0.00 H new ATOM 0 HD3 ARG A 102 12.233 -5.401 -5.213 1.00 0.00 H new ATOM 0 HE ARG A 102 11.845 -2.758 -6.395 1.00 0.00 H new ATOM 0 HH11 ARG A 102 12.333 -6.193 -7.044 1.00 0.00 H new ATOM 0 HH12 ARG A 102 13.036 -5.910 -8.640 1.00 0.00 H new ATOM 0 HH21 ARG A 102 12.747 -2.402 -8.446 1.00 0.00 H new ATOM 0 HH22 ARG A 102 13.269 -3.773 -9.431 1.00 0.00 H new ATOM 1549 N LEU A 103 6.868 -4.943 -4.403 1.00 0.00 N ATOM 1550 CA LEU A 103 5.844 -3.969 -4.762 1.00 0.00 C ATOM 1551 C LEU A 103 6.323 -2.548 -4.482 1.00 0.00 C ATOM 1552 O LEU A 103 6.997 -2.293 -3.484 1.00 0.00 O ATOM 1553 CB LEU A 103 4.554 -4.246 -3.988 1.00 0.00 C ATOM 1554 CG LEU A 103 3.606 -3.059 -3.816 1.00 0.00 C ATOM 1555 CD1 LEU A 103 2.845 -2.792 -5.105 1.00 0.00 C ATOM 1556 CD2 LEU A 103 2.641 -3.310 -2.666 1.00 0.00 C ATOM 0 H LEU A 103 7.226 -4.847 -3.453 1.00 0.00 H new ATOM 0 HA LEU A 103 5.647 -4.063 -5.830 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.014 -5.046 -4.495 1.00 0.00 H new ATOM 0 HB3 LEU A 103 4.820 -4.619 -2.999 1.00 0.00 H new ATOM 0 HG LEU A 103 4.199 -2.176 -3.580 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.175 -1.944 -4.963 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.551 -2.567 -5.904 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.262 -3.673 -5.373 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.974 -2.455 -2.558 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.054 -4.205 -2.872 1.00 0.00 H new ATOM 0 HD23 LEU A 103 3.204 -3.450 -1.743 1.00 0.00 H new ATOM 1568 N LYS A 104 5.968 -1.624 -5.369 1.00 0.00 N ATOM 1569 CA LYS A 104 6.358 -0.227 -5.216 1.00 0.00 C ATOM 1570 C LYS A 104 5.202 0.604 -4.668 1.00 0.00 C ATOM 1571 O LYS A 104 4.047 0.408 -5.049 1.00 0.00 O ATOM 1572 CB LYS A 104 6.818 0.345 -6.559 1.00 0.00 C ATOM 1573 CG LYS A 104 7.314 1.778 -6.472 1.00 0.00 C ATOM 1574 CD LYS A 104 8.214 2.128 -7.646 1.00 0.00 C ATOM 1575 CE LYS A 104 8.462 3.627 -7.729 1.00 0.00 C ATOM 1576 NZ LYS A 104 9.533 3.958 -8.710 1.00 0.00 N ATOM 0 H LYS A 104 5.411 -1.817 -6.201 1.00 0.00 H new ATOM 0 HA LYS A 104 7.184 -0.182 -4.506 1.00 0.00 H new ATOM 0 HB2 LYS A 104 7.615 -0.283 -6.958 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.990 0.298 -7.267 1.00 0.00 H new ATOM 0 HG2 LYS A 104 6.463 2.458 -6.449 1.00 0.00 H new ATOM 0 HG3 LYS A 104 7.860 1.919 -5.539 1.00 0.00 H new ATOM 0 HD2 LYS A 104 9.165 1.605 -7.545 1.00 0.00 H new ATOM 0 HD3 LYS A 104 7.757 1.782 -8.573 1.00 0.00 H new ATOM 0 HE2 LYS A 104 7.539 4.133 -8.014 1.00 0.00 H new ATOM 0 HE3 LYS A 104 8.741 4.004 -6.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 9.672 4.988 -8.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 10.420 3.496 -8.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 9.255 3.621 -9.654 1.00 0.00 H new ATOM 1590 N LEU A 105 5.519 1.532 -3.772 1.00 0.00 N ATOM 1591 CA LEU A 105 4.507 2.394 -3.172 1.00 0.00 C ATOM 1592 C LEU A 105 4.972 3.847 -3.152 1.00 0.00 C ATOM 1593 O LEU A 105 6.099 4.143 -2.757 1.00 0.00 O ATOM 1594 CB LEU A 105 4.191 1.928 -1.749 1.00 0.00 C ATOM 1595 CG LEU A 105 3.395 0.628 -1.630 1.00 0.00 C ATOM 1596 CD1 LEU A 105 3.452 0.096 -0.207 1.00 0.00 C ATOM 1597 CD2 LEU A 105 1.952 0.844 -2.064 1.00 0.00 C ATOM 0 H LEU A 105 6.469 1.707 -3.445 1.00 0.00 H new ATOM 0 HA LEU A 105 3.604 2.329 -3.778 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.131 1.806 -1.211 1.00 0.00 H new ATOM 0 HB3 LEU A 105 3.635 2.718 -1.244 1.00 0.00 H new ATOM 0 HG LEU A 105 3.845 -0.113 -2.291 1.00 0.00 H new ATOM 0 HD11 LEU A 105 2.880 -0.830 -0.141 1.00 0.00 H new ATOM 0 HD12 LEU A 105 4.489 -0.098 0.068 1.00 0.00 H new ATOM 0 HD13 LEU A 105 3.028 0.834 0.474 1.00 0.00 H new ATOM 0 HD21 LEU A 105 1.401 -0.092 -1.973 1.00 0.00 H new ATOM 0 HD22 LEU A 105 1.491 1.601 -1.429 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.930 1.178 -3.101 1.00 0.00 H new ATOM 1609 N ARG A 106 4.094 4.749 -3.579 1.00 0.00 N ATOM 1610 CA ARG A 106 4.414 6.171 -3.609 1.00 0.00 C ATOM 1611 C ARG A 106 3.347 6.984 -2.881 1.00 0.00 C ATOM 1612 O ARG A 106 2.182 6.587 -2.821 1.00 0.00 O ATOM 1613 CB ARG A 106 4.541 6.656 -5.054 1.00 0.00 C ATOM 1614 CG ARG A 106 4.450 8.166 -5.200 1.00 0.00 C ATOM 1615 CD ARG A 106 4.485 8.588 -6.661 1.00 0.00 C ATOM 1616 NE ARG A 106 5.668 8.079 -7.349 1.00 0.00 N ATOM 1617 CZ ARG A 106 6.186 8.643 -8.435 1.00 0.00 C ATOM 1618 NH1 ARG A 106 5.628 9.729 -8.952 1.00 0.00 N ATOM 1619 NH2 ARG A 106 7.265 8.121 -9.004 1.00 0.00 N ATOM 0 H ARG A 106 3.156 4.520 -3.909 1.00 0.00 H new ATOM 0 HA ARG A 106 5.367 6.314 -3.099 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.494 6.317 -5.460 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.757 6.194 -5.654 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.529 8.522 -4.739 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.276 8.635 -4.665 1.00 0.00 H new ATOM 0 HD2 ARG A 106 3.589 8.226 -7.165 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.469 9.676 -6.725 1.00 0.00 H new ATOM 0 HE ARG A 106 6.121 7.245 -6.976 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.799 10.133 -8.516 1.00 0.00 H new ATOM 0 HH12 ARG A 106 6.028 10.160 -9.786 1.00 0.00 H new ATOM 0 HH21 ARG A 106 7.697 7.286 -8.608 1.00 0.00 H new ATOM 0 HH22 ARG A 106 7.662 8.554 -9.838 1.00 0.00 H new ATOM 1633 N LEU A 107 3.753 8.121 -2.328 1.00 0.00 N ATOM 1634 CA LEU A 107 2.832 8.990 -1.602 1.00 0.00 C ATOM 1635 C LEU A 107 3.050 10.452 -1.981 1.00 0.00 C ATOM 1636 O LEU A 107 4.186 10.912 -2.097 1.00 0.00 O ATOM 1637 CB LEU A 107 3.012 8.811 -0.094 1.00 0.00 C ATOM 1638 CG LEU A 107 2.714 7.416 0.456 1.00 0.00 C ATOM 1639 CD1 LEU A 107 3.185 7.298 1.897 1.00 0.00 C ATOM 1640 CD2 LEU A 107 1.227 7.109 0.353 1.00 0.00 C ATOM 0 H LEU A 107 4.713 8.463 -2.368 1.00 0.00 H new ATOM 0 HA LEU A 107 1.815 8.710 -1.876 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.040 9.069 0.162 1.00 0.00 H new ATOM 0 HB3 LEU A 107 2.367 9.526 0.416 1.00 0.00 H new ATOM 0 HG LEU A 107 3.258 6.686 -0.143 1.00 0.00 H new ATOM 0 HD11 LEU A 107 2.964 6.298 2.271 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.260 7.474 1.944 1.00 0.00 H new ATOM 0 HD13 LEU A 107 2.669 8.037 2.510 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.033 6.112 0.749 1.00 0.00 H new ATOM 0 HD22 LEU A 107 0.663 7.844 0.928 1.00 0.00 H new ATOM 0 HD23 LEU A 107 0.918 7.151 -0.692 1.00 0.00 H new ATOM 1652 N THR A 108 1.953 11.178 -2.172 1.00 0.00 N ATOM 1653 CA THR A 108 2.023 12.587 -2.537 1.00 0.00 C ATOM 1654 C THR A 108 0.807 13.349 -2.025 1.00 0.00 C ATOM 1655 O THR A 108 -0.321 13.095 -2.449 1.00 0.00 O ATOM 1656 CB THR A 108 2.123 12.768 -4.064 1.00 0.00 C ATOM 1657 OG1 THR A 108 1.270 11.827 -4.725 1.00 0.00 O ATOM 1658 CG2 THR A 108 3.556 12.582 -4.538 1.00 0.00 C ATOM 0 H THR A 108 1.005 10.813 -2.080 1.00 0.00 H new ATOM 0 HA THR A 108 2.923 12.989 -2.071 1.00 0.00 H new ATOM 0 HB THR A 108 1.805 13.781 -4.310 1.00 0.00 H new ATOM 0 HG1 THR A 108 1.338 11.949 -5.695 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.602 12.714 -5.619 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.198 13.319 -4.055 1.00 0.00 H new ATOM 0 HG23 THR A 108 3.897 11.579 -4.281 1.00 0.00 H new ATOM 1666 N TYR A 109 1.042 14.284 -1.111 1.00 0.00 N ATOM 1667 CA TYR A 109 -0.036 15.083 -0.540 1.00 0.00 C ATOM 1668 C TYR A 109 0.500 16.388 0.040 1.00 0.00 C ATOM 1669 O TYR A 109 1.692 16.682 -0.062 1.00 0.00 O ATOM 1670 CB TYR A 109 -0.765 14.290 0.547 1.00 0.00 C ATOM 1671 CG TYR A 109 0.164 13.635 1.544 1.00 0.00 C ATOM 1672 CD1 TYR A 109 1.059 14.391 2.291 1.00 0.00 C ATOM 1673 CD2 TYR A 109 0.145 12.260 1.740 1.00 0.00 C ATOM 1674 CE1 TYR A 109 1.910 13.796 3.202 1.00 0.00 C ATOM 1675 CE2 TYR A 109 0.991 11.656 2.651 1.00 0.00 C ATOM 1676 CZ TYR A 109 1.872 12.429 3.379 1.00 0.00 C ATOM 1677 OH TYR A 109 2.717 11.833 4.287 1.00 0.00 O ATOM 0 H TYR A 109 1.969 14.507 -0.750 1.00 0.00 H new ATOM 0 HA TYR A 109 -0.738 15.324 -1.339 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -1.443 14.957 1.079 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -1.378 13.522 0.075 1.00 0.00 H new ATOM 0 HD1 TYR A 109 1.090 15.462 2.157 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -0.543 11.652 1.171 1.00 0.00 H new ATOM 0 HE1 TYR A 109 2.601 14.398 3.773 1.00 0.00 H new ATOM 0 HE2 TYR A 109 0.963 10.586 2.792 1.00 0.00 H new ATOM 0 HH TYR A 109 2.563 10.865 4.291 1.00 0.00 H new ATOM 1687 N ASP A 110 -0.387 17.166 0.649 1.00 0.00 N ATOM 1688 CA ASP A 110 -0.004 18.439 1.248 1.00 0.00 C ATOM 1689 C ASP A 110 0.047 18.331 2.769 1.00 0.00 C ATOM 1690 O ASP A 110 -0.960 18.038 3.414 1.00 0.00 O ATOM 1691 CB ASP A 110 -0.985 19.537 0.834 1.00 0.00 C ATOM 1692 CG ASP A 110 -0.977 19.788 -0.661 1.00 0.00 C ATOM 1693 OD1 ASP A 110 -1.089 18.809 -1.428 1.00 0.00 O ATOM 1694 OD2 ASP A 110 -0.858 20.964 -1.064 1.00 0.00 O ATOM 0 H ASP A 110 -1.377 16.938 0.741 1.00 0.00 H new ATOM 0 HA ASP A 110 0.992 18.697 0.887 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.991 19.258 1.147 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -0.733 20.460 1.356 1.00 0.00 H new ATOM 1699 N HIS A 111 1.225 18.570 3.335 1.00 0.00 N ATOM 1700 CA HIS A 111 1.407 18.499 4.780 1.00 0.00 C ATOM 1701 C HIS A 111 1.992 19.802 5.319 1.00 0.00 C ATOM 1702 O HIS A 111 3.043 20.256 4.865 1.00 0.00 O ATOM 1703 CB HIS A 111 2.320 17.328 5.144 1.00 0.00 C ATOM 1704 CG HIS A 111 2.026 16.733 6.487 1.00 0.00 C ATOM 1705 ND1 HIS A 111 2.828 15.782 7.081 1.00 0.00 N ATOM 1706 CD2 HIS A 111 1.011 16.962 7.353 1.00 0.00 C ATOM 1707 CE1 HIS A 111 2.318 15.450 8.253 1.00 0.00 C ATOM 1708 NE2 HIS A 111 1.215 16.152 8.443 1.00 0.00 N ATOM 0 H HIS A 111 2.068 18.815 2.815 1.00 0.00 H new ATOM 0 HA HIS A 111 0.430 18.343 5.237 1.00 0.00 H new ATOM 0 HB2 HIS A 111 2.224 16.553 4.384 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.356 17.666 5.125 1.00 0.00 H new ATOM 0 HD2 HIS A 111 0.193 17.653 7.213 1.00 0.00 H new ATOM 0 HE1 HIS A 111 2.732 14.727 8.940 1.00 0.00 H new ATOM 0 HE2 HIS A 111 0.613 16.101 9.265 1.00 0.00 H new ATOM 1716 N PHE A 112 1.305 20.397 6.287 1.00 0.00 N ATOM 1717 CA PHE A 112 1.755 21.648 6.886 1.00 0.00 C ATOM 1718 C PHE A 112 1.835 22.755 5.839 1.00 0.00 C ATOM 1719 O PHE A 112 2.754 23.575 5.855 1.00 0.00 O ATOM 1720 CB PHE A 112 3.121 21.458 7.549 1.00 0.00 C ATOM 1721 CG PHE A 112 3.046 20.818 8.906 1.00 0.00 C ATOM 1722 CD1 PHE A 112 2.847 19.453 9.031 1.00 0.00 C ATOM 1723 CD2 PHE A 112 3.172 21.582 10.055 1.00 0.00 C ATOM 1724 CE1 PHE A 112 2.777 18.860 10.278 1.00 0.00 C ATOM 1725 CE2 PHE A 112 3.104 20.994 11.304 1.00 0.00 C ATOM 1726 CZ PHE A 112 2.905 19.632 11.416 1.00 0.00 C ATOM 0 H PHE A 112 0.434 20.033 6.674 1.00 0.00 H new ATOM 0 HA PHE A 112 1.028 21.941 7.644 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.748 20.845 6.901 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.610 22.428 7.640 1.00 0.00 H new ATOM 0 HD1 PHE A 112 2.745 18.845 8.144 1.00 0.00 H new ATOM 0 HD2 PHE A 112 3.325 22.648 9.974 1.00 0.00 H new ATOM 0 HE1 PHE A 112 2.622 17.794 10.362 1.00 0.00 H new ATOM 0 HE2 PHE A 112 3.206 21.600 12.192 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.850 19.172 12.391 1.00 0.00 H new ATOM 1736 N HIS A 113 0.867 22.771 4.928 1.00 0.00 N ATOM 1737 CA HIS A 113 0.827 23.776 3.872 1.00 0.00 C ATOM 1738 C HIS A 113 2.048 23.660 2.965 1.00 0.00 C ATOM 1739 O HIS A 113 2.646 24.666 2.583 1.00 0.00 O ATOM 1740 CB HIS A 113 0.758 25.179 4.477 1.00 0.00 C ATOM 1741 CG HIS A 113 -0.638 25.642 4.759 1.00 0.00 C ATOM 1742 ND1 HIS A 113 -1.618 25.712 3.791 1.00 0.00 N ATOM 1743 CD2 HIS A 113 -1.218 26.058 5.909 1.00 0.00 C ATOM 1744 CE1 HIS A 113 -2.739 26.153 4.333 1.00 0.00 C ATOM 1745 NE2 HIS A 113 -2.523 26.370 5.618 1.00 0.00 N ATOM 0 H HIS A 113 0.100 22.099 4.900 1.00 0.00 H new ATOM 0 HA HIS A 113 -0.067 23.602 3.273 1.00 0.00 H new ATOM 0 HB2 HIS A 113 1.331 25.195 5.404 1.00 0.00 H new ATOM 0 HB3 HIS A 113 1.235 25.883 3.795 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -0.743 26.131 6.876 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -3.673 26.309 3.814 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -3.213 26.714 6.286 1.00 0.00 H new ATOM 1753 N GLN A 114 2.411 22.428 2.625 1.00 0.00 N ATOM 1754 CA GLN A 114 3.562 22.181 1.764 1.00 0.00 C ATOM 1755 C GLN A 114 3.395 20.877 0.992 1.00 0.00 C ATOM 1756 O GLN A 114 2.692 19.968 1.435 1.00 0.00 O ATOM 1757 CB GLN A 114 4.846 22.136 2.593 1.00 0.00 C ATOM 1758 CG GLN A 114 5.303 23.501 3.082 1.00 0.00 C ATOM 1759 CD GLN A 114 6.514 23.421 3.990 1.00 0.00 C ATOM 1760 OE1 GLN A 114 6.389 23.180 5.191 1.00 0.00 O ATOM 1761 NE2 GLN A 114 7.696 23.622 3.420 1.00 0.00 N ATOM 0 H GLN A 114 1.925 21.585 2.932 1.00 0.00 H new ATOM 0 HA GLN A 114 3.629 23.000 1.047 1.00 0.00 H new ATOM 0 HB2 GLN A 114 4.691 21.485 3.453 1.00 0.00 H new ATOM 0 HB3 GLN A 114 5.640 21.689 1.994 1.00 0.00 H new ATOM 0 HG2 GLN A 114 5.538 24.130 2.223 1.00 0.00 H new ATOM 0 HG3 GLN A 114 4.485 23.984 3.616 1.00 0.00 H new ATOM 0 HE21 GLN A 114 7.753 23.819 2.421 1.00 0.00 H new ATOM 0 HE22 GLN A 114 8.547 23.579 3.981 1.00 0.00 H new ATOM 1770 N SER A 115 4.045 20.791 -0.164 1.00 0.00 N ATOM 1771 CA SER A 115 3.965 19.599 -1.000 1.00 0.00 C ATOM 1772 C SER A 115 4.975 18.549 -0.546 1.00 0.00 C ATOM 1773 O SER A 115 6.172 18.821 -0.455 1.00 0.00 O ATOM 1774 CB SER A 115 4.211 19.960 -2.466 1.00 0.00 C ATOM 1775 OG SER A 115 5.517 20.476 -2.652 1.00 0.00 O ATOM 0 H SER A 115 4.633 21.533 -0.543 1.00 0.00 H new ATOM 0 HA SER A 115 2.963 19.182 -0.900 1.00 0.00 H new ATOM 0 HB2 SER A 115 4.074 19.076 -3.089 1.00 0.00 H new ATOM 0 HB3 SER A 115 3.476 20.697 -2.791 1.00 0.00 H new ATOM 0 HG SER A 115 6.136 20.029 -2.038 1.00 0.00 H new ATOM 1781 N VAL A 116 4.483 17.347 -0.263 1.00 0.00 N ATOM 1782 CA VAL A 116 5.341 16.255 0.179 1.00 0.00 C ATOM 1783 C VAL A 116 5.270 15.075 -0.784 1.00 0.00 C ATOM 1784 O VAL A 116 4.194 14.535 -1.041 1.00 0.00 O ATOM 1785 CB VAL A 116 4.955 15.775 1.591 1.00 0.00 C ATOM 1786 CG1 VAL A 116 5.802 14.578 1.999 1.00 0.00 C ATOM 1787 CG2 VAL A 116 5.099 16.907 2.596 1.00 0.00 C ATOM 0 H VAL A 116 3.494 17.105 -0.332 1.00 0.00 H new ATOM 0 HA VAL A 116 6.360 16.642 0.200 1.00 0.00 H new ATOM 0 HB VAL A 116 3.911 15.463 1.577 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.515 14.253 2.999 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.644 13.763 1.293 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.855 14.860 1.997 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.822 16.550 3.588 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.133 17.252 2.610 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.445 17.731 2.312 1.00 0.00 H new ATOM 1797 N GLN A 117 6.424 14.680 -1.312 1.00 0.00 N ATOM 1798 CA GLN A 117 6.492 13.563 -2.248 1.00 0.00 C ATOM 1799 C GLN A 117 7.559 12.560 -1.821 1.00 0.00 C ATOM 1800 O GLN A 117 8.754 12.814 -1.963 1.00 0.00 O ATOM 1801 CB GLN A 117 6.787 14.071 -3.660 1.00 0.00 C ATOM 1802 CG GLN A 117 7.125 12.964 -4.646 1.00 0.00 C ATOM 1803 CD GLN A 117 8.584 12.556 -4.588 1.00 0.00 C ATOM 1804 OE1 GLN A 117 8.928 11.515 -4.027 1.00 0.00 O ATOM 1805 NE2 GLN A 117 9.452 13.376 -5.169 1.00 0.00 N ATOM 0 H GLN A 117 7.323 15.116 -1.108 1.00 0.00 H new ATOM 0 HA GLN A 117 5.525 13.060 -2.246 1.00 0.00 H new ATOM 0 HB2 GLN A 117 5.921 14.622 -4.027 1.00 0.00 H new ATOM 0 HB3 GLN A 117 7.618 14.775 -3.618 1.00 0.00 H new ATOM 0 HG2 GLN A 117 6.500 12.095 -4.439 1.00 0.00 H new ATOM 0 HG3 GLN A 117 6.884 13.296 -5.656 1.00 0.00 H new ATOM 0 HE21 GLN A 117 9.123 14.228 -5.623 1.00 0.00 H new ATOM 0 HE22 GLN A 117 10.447 13.153 -5.162 1.00 0.00 H new ATOM 1814 N GLU A 118 7.117 11.420 -1.299 1.00 0.00 N ATOM 1815 CA GLU A 118 8.036 10.380 -0.851 1.00 0.00 C ATOM 1816 C GLU A 118 7.788 9.075 -1.602 1.00 0.00 C ATOM 1817 O GLU A 118 6.701 8.500 -1.527 1.00 0.00 O ATOM 1818 CB GLU A 118 7.886 10.151 0.655 1.00 0.00 C ATOM 1819 CG GLU A 118 8.439 11.286 1.501 1.00 0.00 C ATOM 1820 CD GLU A 118 9.947 11.226 1.644 1.00 0.00 C ATOM 1821 OE1 GLU A 118 10.515 10.124 1.495 1.00 0.00 O ATOM 1822 OE2 GLU A 118 10.559 12.282 1.906 1.00 0.00 O ATOM 0 H GLU A 118 6.130 11.193 -1.176 1.00 0.00 H new ATOM 0 HA GLU A 118 9.052 10.713 -1.062 1.00 0.00 H new ATOM 0 HB2 GLU A 118 6.830 10.015 0.890 1.00 0.00 H new ATOM 0 HB3 GLU A 118 8.395 9.226 0.926 1.00 0.00 H new ATOM 0 HG2 GLU A 118 8.158 12.239 1.052 1.00 0.00 H new ATOM 0 HG3 GLU A 118 7.982 11.253 2.490 1.00 0.00 H new ATOM 1829 N ILE A 119 8.802 8.614 -2.326 1.00 0.00 N ATOM 1830 CA ILE A 119 8.695 7.378 -3.091 1.00 0.00 C ATOM 1831 C ILE A 119 9.690 6.336 -2.593 1.00 0.00 C ATOM 1832 O ILE A 119 10.899 6.571 -2.583 1.00 0.00 O ATOM 1833 CB ILE A 119 8.933 7.622 -4.593 1.00 0.00 C ATOM 1834 CG1 ILE A 119 7.883 8.587 -5.147 1.00 0.00 C ATOM 1835 CG2 ILE A 119 8.904 6.306 -5.354 1.00 0.00 C ATOM 1836 CD1 ILE A 119 8.384 9.427 -6.301 1.00 0.00 C ATOM 0 H ILE A 119 9.707 9.078 -2.399 1.00 0.00 H new ATOM 0 HA ILE A 119 7.680 7.006 -2.949 1.00 0.00 H new ATOM 0 HB ILE A 119 9.917 8.072 -4.722 1.00 0.00 H new ATOM 0 HG12 ILE A 119 7.014 8.017 -5.474 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.549 9.247 -4.346 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.074 6.495 -6.414 1.00 0.00 H new ATOM 0 HG22 ILE A 119 9.685 5.648 -4.973 1.00 0.00 H new ATOM 0 HG23 ILE A 119 7.932 5.830 -5.221 1.00 0.00 H new ATOM 0 HD11 ILE A 119 7.587 10.087 -6.643 1.00 0.00 H new ATOM 0 HD12 ILE A 119 9.235 10.024 -5.974 1.00 0.00 H new ATOM 0 HD13 ILE A 119 8.691 8.775 -7.119 1.00 0.00 H new ATOM 1848 N PHE A 120 9.175 5.182 -2.181 1.00 0.00 N ATOM 1849 CA PHE A 120 10.018 4.102 -1.683 1.00 0.00 C ATOM 1850 C PHE A 120 9.535 2.751 -2.201 1.00 0.00 C ATOM 1851 O PHE A 120 8.391 2.613 -2.631 1.00 0.00 O ATOM 1852 CB PHE A 120 10.029 4.100 -0.153 1.00 0.00 C ATOM 1853 CG PHE A 120 8.658 4.030 0.457 1.00 0.00 C ATOM 1854 CD1 PHE A 120 7.943 5.187 0.721 1.00 0.00 C ATOM 1855 CD2 PHE A 120 8.084 2.807 0.764 1.00 0.00 C ATOM 1856 CE1 PHE A 120 6.682 5.124 1.283 1.00 0.00 C ATOM 1857 CE2 PHE A 120 6.823 2.738 1.325 1.00 0.00 C ATOM 1858 CZ PHE A 120 6.120 3.899 1.584 1.00 0.00 C ATOM 0 H PHE A 120 8.177 4.971 -2.182 1.00 0.00 H new ATOM 0 HA PHE A 120 11.032 4.269 -2.047 1.00 0.00 H new ATOM 0 HB2 PHE A 120 10.617 3.252 0.197 1.00 0.00 H new ATOM 0 HB3 PHE A 120 10.529 5.002 0.200 1.00 0.00 H new ATOM 0 HD1 PHE A 120 8.376 6.148 0.485 1.00 0.00 H new ATOM 0 HD2 PHE A 120 8.629 1.896 0.562 1.00 0.00 H new ATOM 0 HE1 PHE A 120 6.136 6.033 1.487 1.00 0.00 H new ATOM 0 HE2 PHE A 120 6.388 1.778 1.561 1.00 0.00 H new ATOM 0 HZ PHE A 120 5.134 3.849 2.021 1.00 0.00 H new ATOM 1868 N GLU A 121 10.417 1.757 -2.156 1.00 0.00 N ATOM 1869 CA GLU A 121 10.081 0.417 -2.622 1.00 0.00 C ATOM 1870 C GLU A 121 10.300 -0.614 -1.519 1.00 0.00 C ATOM 1871 O GLU A 121 11.358 -0.651 -0.890 1.00 0.00 O ATOM 1872 CB GLU A 121 10.920 0.054 -3.849 1.00 0.00 C ATOM 1873 CG GLU A 121 10.656 0.944 -5.052 1.00 0.00 C ATOM 1874 CD GLU A 121 11.464 0.536 -6.269 1.00 0.00 C ATOM 1875 OE1 GLU A 121 11.618 -0.682 -6.498 1.00 0.00 O ATOM 1876 OE2 GLU A 121 11.941 1.435 -6.992 1.00 0.00 O ATOM 0 H GLU A 121 11.369 1.855 -1.802 1.00 0.00 H new ATOM 0 HA GLU A 121 9.026 0.410 -2.897 1.00 0.00 H new ATOM 0 HB2 GLU A 121 11.976 0.115 -3.587 1.00 0.00 H new ATOM 0 HB3 GLU A 121 10.719 -0.982 -4.123 1.00 0.00 H new ATOM 0 HG2 GLU A 121 9.595 0.911 -5.298 1.00 0.00 H new ATOM 0 HG3 GLU A 121 10.891 1.977 -4.794 1.00 0.00 H new ATOM 1883 N VAL A 122 9.293 -1.451 -1.290 1.00 0.00 N ATOM 1884 CA VAL A 122 9.376 -2.484 -0.264 1.00 0.00 C ATOM 1885 C VAL A 122 10.258 -3.641 -0.718 1.00 0.00 C ATOM 1886 O VAL A 122 10.113 -4.145 -1.831 1.00 0.00 O ATOM 1887 CB VAL A 122 7.981 -3.027 0.098 1.00 0.00 C ATOM 1888 CG1 VAL A 122 8.084 -4.070 1.201 1.00 0.00 C ATOM 1889 CG2 VAL A 122 7.058 -1.891 0.513 1.00 0.00 C ATOM 0 H VAL A 122 8.410 -1.434 -1.801 1.00 0.00 H new ATOM 0 HA VAL A 122 9.818 -2.020 0.618 1.00 0.00 H new ATOM 0 HB VAL A 122 7.557 -3.506 -0.784 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.089 -4.442 1.444 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.708 -4.897 0.863 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.529 -3.619 2.088 1.00 0.00 H new ATOM 0 HG21 VAL A 122 6.077 -2.293 0.765 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.476 -1.382 1.381 1.00 0.00 H new ATOM 0 HG23 VAL A 122 6.959 -1.183 -0.310 1.00 0.00 H new ATOM 1899 N ASN A 123 11.172 -4.058 0.152 1.00 0.00 N ATOM 1900 CA ASN A 123 12.079 -5.157 -0.160 1.00 0.00 C ATOM 1901 C ASN A 123 12.038 -6.222 0.932 1.00 0.00 C ATOM 1902 O ASN A 123 12.273 -7.401 0.671 1.00 0.00 O ATOM 1903 CB ASN A 123 13.507 -4.635 -0.326 1.00 0.00 C ATOM 1904 CG ASN A 123 14.021 -3.947 0.924 1.00 0.00 C ATOM 1905 OD1 ASN A 123 13.763 -2.764 1.145 1.00 0.00 O ATOM 1906 ND2 ASN A 123 14.752 -4.688 1.748 1.00 0.00 N ATOM 0 H ASN A 123 11.304 -3.652 1.078 1.00 0.00 H new ATOM 0 HA ASN A 123 11.754 -5.610 -1.097 1.00 0.00 H new ATOM 0 HB2 ASN A 123 14.167 -5.465 -0.578 1.00 0.00 H new ATOM 0 HB3 ASN A 123 13.540 -3.936 -1.162 1.00 0.00 H new ATOM 0 HD21 ASN A 123 15.125 -4.280 2.605 1.00 0.00 H new ATOM 0 HD22 ASN A 123 14.940 -5.665 1.524 1.00 0.00 H new ATOM 1913 N ASN A 124 11.737 -5.797 2.155 1.00 0.00 N ATOM 1914 CA ASN A 124 11.666 -6.714 3.286 1.00 0.00 C ATOM 1915 C ASN A 124 10.301 -7.394 3.350 1.00 0.00 C ATOM 1916 O ASN A 124 9.696 -7.497 4.418 1.00 0.00 O ATOM 1917 CB ASN A 124 11.937 -5.966 4.593 1.00 0.00 C ATOM 1918 CG ASN A 124 12.526 -6.866 5.663 1.00 0.00 C ATOM 1919 OD1 ASN A 124 13.437 -7.649 5.398 1.00 0.00 O ATOM 1920 ND2 ASN A 124 12.005 -6.757 6.879 1.00 0.00 N ATOM 0 H ASN A 124 11.539 -4.824 2.388 1.00 0.00 H new ATOM 0 HA ASN A 124 12.428 -7.481 3.149 1.00 0.00 H new ATOM 0 HB2 ASN A 124 12.621 -5.140 4.400 1.00 0.00 H new ATOM 0 HB3 ASN A 124 11.007 -5.531 4.959 1.00 0.00 H new ATOM 0 HD21 ASN A 124 12.360 -7.337 7.640 1.00 0.00 H new ATOM 0 HD22 ASN A 124 11.250 -6.093 7.053 1.00 0.00 H new ATOM 1927 N LEU A 125 9.823 -7.857 2.200 1.00 0.00 N ATOM 1928 CA LEU A 125 8.530 -8.528 2.124 1.00 0.00 C ATOM 1929 C LEU A 125 8.576 -9.879 2.830 1.00 0.00 C ATOM 1930 O LEU A 125 9.630 -10.502 2.963 1.00 0.00 O ATOM 1931 CB LEU A 125 8.116 -8.716 0.664 1.00 0.00 C ATOM 1932 CG LEU A 125 7.527 -7.488 -0.030 1.00 0.00 C ATOM 1933 CD1 LEU A 125 7.462 -7.704 -1.534 1.00 0.00 C ATOM 1934 CD2 LEU A 125 6.145 -7.174 0.525 1.00 0.00 C ATOM 0 H LEU A 125 10.311 -7.780 1.308 1.00 0.00 H new ATOM 0 HA LEU A 125 7.793 -7.901 2.626 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.989 -9.044 0.099 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.384 -9.522 0.616 1.00 0.00 H new ATOM 0 HG LEU A 125 8.178 -6.636 0.166 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.040 -6.819 -2.011 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.466 -7.880 -1.920 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.833 -8.568 -1.751 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.741 -6.297 0.020 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.484 -8.025 0.359 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.219 -6.975 1.594 1.00 0.00 H new ATOM 1946 N PRO A 126 7.407 -10.346 3.292 1.00 0.00 N ATOM 1947 CA PRO A 126 7.286 -11.630 3.989 1.00 0.00 C ATOM 1948 C PRO A 126 7.505 -12.818 3.058 1.00 0.00 C ATOM 1949 O PRO A 126 7.322 -12.711 1.846 1.00 0.00 O ATOM 1950 CB PRO A 126 5.847 -11.617 4.511 1.00 0.00 C ATOM 1951 CG PRO A 126 5.117 -10.705 3.586 1.00 0.00 C ATOM 1952 CD PRO A 126 6.111 -9.657 3.168 1.00 0.00 C ATOM 0 HA PRO A 126 8.036 -11.741 4.772 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.414 -12.617 4.504 1.00 0.00 H new ATOM 0 HB3 PRO A 126 5.802 -11.257 5.539 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.736 -11.249 2.721 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.258 -10.253 4.081 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.932 -9.318 2.148 1.00 0.00 H new ATOM 0 HD3 PRO A 126 6.061 -8.777 3.809 1.00 0.00 H new ATOM 1960 N VAL A 127 7.897 -13.951 3.634 1.00 0.00 N ATOM 1961 CA VAL A 127 8.139 -15.159 2.855 1.00 0.00 C ATOM 1962 C VAL A 127 6.866 -15.988 2.717 1.00 0.00 C ATOM 1963 O VAL A 127 6.692 -16.717 1.741 1.00 0.00 O ATOM 1964 CB VAL A 127 9.237 -16.029 3.496 1.00 0.00 C ATOM 1965 CG1 VAL A 127 8.775 -16.569 4.840 1.00 0.00 C ATOM 1966 CG2 VAL A 127 9.629 -17.164 2.562 1.00 0.00 C ATOM 0 H VAL A 127 8.053 -14.057 4.636 1.00 0.00 H new ATOM 0 HA VAL A 127 8.470 -14.838 1.867 1.00 0.00 H new ATOM 0 HB VAL A 127 10.116 -15.407 3.665 1.00 0.00 H new ATOM 0 HG11 VAL A 127 9.564 -17.181 5.277 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.549 -15.738 5.508 1.00 0.00 H new ATOM 0 HG13 VAL A 127 7.881 -17.176 4.700 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.406 -17.769 3.030 1.00 0.00 H new ATOM 0 HG22 VAL A 127 8.757 -17.786 2.360 1.00 0.00 H new ATOM 0 HG23 VAL A 127 10.005 -16.751 1.626 1.00 0.00 H new ATOM 1976 N GLU A 128 5.980 -15.869 3.701 1.00 0.00 N ATOM 1977 CA GLU A 128 4.723 -16.608 3.688 1.00 0.00 C ATOM 1978 C GLU A 128 3.921 -16.296 2.428 1.00 0.00 C ATOM 1979 O GLU A 128 3.262 -17.171 1.866 1.00 0.00 O ATOM 1980 CB GLU A 128 3.895 -16.271 4.930 1.00 0.00 C ATOM 1981 CG GLU A 128 4.310 -17.047 6.168 1.00 0.00 C ATOM 1982 CD GLU A 128 5.394 -16.343 6.961 1.00 0.00 C ATOM 1983 OE1 GLU A 128 6.331 -15.803 6.337 1.00 0.00 O ATOM 1984 OE2 GLU A 128 5.305 -16.332 8.207 1.00 0.00 O ATOM 0 H GLU A 128 6.109 -15.269 4.516 1.00 0.00 H new ATOM 0 HA GLU A 128 4.957 -17.673 3.694 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.981 -15.204 5.135 1.00 0.00 H new ATOM 0 HB3 GLU A 128 2.844 -16.472 4.721 1.00 0.00 H new ATOM 0 HG2 GLU A 128 3.439 -17.199 6.806 1.00 0.00 H new ATOM 0 HG3 GLU A 128 4.665 -18.034 5.872 1.00 0.00 H new ATOM 1991 N SER A 129 3.981 -15.042 1.991 1.00 0.00 N ATOM 1992 CA SER A 129 3.257 -14.613 0.800 1.00 0.00 C ATOM 1993 C SER A 129 3.343 -15.668 -0.298 1.00 0.00 C ATOM 1994 O SER A 129 2.325 -16.102 -0.838 1.00 0.00 O ATOM 1995 CB SER A 129 3.817 -13.283 0.290 1.00 0.00 C ATOM 1996 OG SER A 129 5.203 -13.385 0.014 1.00 0.00 O ATOM 0 H SER A 129 4.523 -14.306 2.443 1.00 0.00 H new ATOM 0 HA SER A 129 2.209 -14.480 1.070 1.00 0.00 H new ATOM 0 HB2 SER A 129 3.285 -12.983 -0.613 1.00 0.00 H new ATOM 0 HB3 SER A 129 3.648 -12.504 1.034 1.00 0.00 H new ATOM 0 HG SER A 129 5.715 -13.095 0.798 1.00 0.00 H new ATOM 2002 N TRP A 130 4.564 -16.077 -0.624 1.00 0.00 N ATOM 2003 CA TRP A 130 4.783 -17.081 -1.658 1.00 0.00 C ATOM 2004 C TRP A 130 4.879 -18.476 -1.050 1.00 0.00 C ATOM 2005 O TRP A 130 4.307 -19.432 -1.575 1.00 0.00 O ATOM 2006 CB TRP A 130 6.057 -16.765 -2.443 1.00 0.00 C ATOM 2007 CG TRP A 130 7.308 -16.917 -1.631 1.00 0.00 C ATOM 2008 CD1 TRP A 130 8.017 -15.920 -1.024 1.00 0.00 C ATOM 2009 CD2 TRP A 130 7.998 -18.137 -1.340 1.00 0.00 C ATOM 2010 NE1 TRP A 130 9.106 -16.447 -0.372 1.00 0.00 N ATOM 2011 CE2 TRP A 130 9.117 -17.805 -0.550 1.00 0.00 C ATOM 2012 CE3 TRP A 130 7.779 -19.478 -1.667 1.00 0.00 C ATOM 2013 CZ2 TRP A 130 10.012 -18.765 -0.087 1.00 0.00 C ATOM 2014 CZ3 TRP A 130 8.669 -20.430 -1.206 1.00 0.00 C ATOM 2015 CH2 TRP A 130 9.773 -20.070 -0.422 1.00 0.00 C ATOM 0 H TRP A 130 5.417 -15.729 -0.187 1.00 0.00 H new ATOM 0 HA TRP A 130 3.931 -17.059 -2.338 1.00 0.00 H new ATOM 0 HB2 TRP A 130 6.113 -17.423 -3.310 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.999 -15.744 -2.820 1.00 0.00 H new ATOM 0 HD1 TRP A 130 7.760 -14.871 -1.052 1.00 0.00 H new ATOM 0 HE1 TRP A 130 9.795 -15.913 0.159 1.00 0.00 H new ATOM 0 HE3 TRP A 130 6.930 -19.765 -2.269 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 10.865 -18.490 0.515 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 8.511 -21.469 -1.454 1.00 0.00 H new ATOM 0 HH2 TRP A 130 10.449 -20.838 -0.075 1.00 0.00 H new ATOM 2026 N GLN A 131 5.603 -18.586 0.059 1.00 0.00 N ATOM 2027 CA GLN A 131 5.773 -19.865 0.737 1.00 0.00 C ATOM 2028 C GLN A 131 4.421 -20.486 1.075 1.00 0.00 C ATOM 2029 O GLN A 131 3.912 -20.324 2.184 1.00 0.00 O ATOM 2030 CB GLN A 131 6.598 -19.685 2.013 1.00 0.00 C ATOM 2031 CG GLN A 131 6.818 -20.977 2.783 1.00 0.00 C ATOM 2032 CD GLN A 131 7.937 -20.867 3.800 1.00 0.00 C ATOM 2033 OE1 GLN A 131 7.691 -20.759 5.001 1.00 0.00 O ATOM 2034 NE2 GLN A 131 9.176 -20.895 3.322 1.00 0.00 N ATOM 0 H GLN A 131 6.081 -17.804 0.507 1.00 0.00 H new ATOM 0 HA GLN A 131 6.303 -20.537 0.062 1.00 0.00 H new ATOM 0 HB2 GLN A 131 7.566 -19.258 1.752 1.00 0.00 H new ATOM 0 HB3 GLN A 131 6.097 -18.966 2.661 1.00 0.00 H new ATOM 0 HG2 GLN A 131 5.895 -21.253 3.293 1.00 0.00 H new ATOM 0 HG3 GLN A 131 7.047 -21.779 2.081 1.00 0.00 H new ATOM 0 HE21 GLN A 131 9.333 -20.986 2.318 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.970 -20.826 3.959 1.00 0.00 H new TER 2043 GLN A 131