USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 847 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 67 TYR OH : rot 180:sc= 0.491 USER MOD Set 1.2: A 78 THR OG1 : rot 179:sc= 0.587 USER MOD Single : A 1 GLY N :NH3+ 175:sc= 1.15 (180deg=1.12) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ -168:sc= 1.18 (180deg=0.85) USER MOD Single : A 8 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.127) USER MOD Single : A 12 GLN : amide:sc=-0.000655 X(o=-0.00065,f=0) USER MOD Single : A 13 LYS NZ :NH3+ -161:sc= 0.0028 (180deg=-0.233) USER MOD Single : A 14 CYS SG : rot 116:sc= 0.42 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 17 CYS SG : rot 180:sc= -0.975 USER MOD Single : A 18 HIS : no HE2:sc= 0.695 K(o=0.7,f=-2.3!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ -136:sc= 1 (180deg=-1.29!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0.968 K(o=0.97,f=-5.3!) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 130:sc= 0.569 USER MOD Single : A 42 GLN : amide:sc= -0.099 K(o=-0.099,f=-1.6) USER MOD Single : A 47 THR OG1 : rot 22:sc= 0.152 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0.0067 USER MOD Single : A 52 ASN : amide:sc= -0.146 K(o=-0.15,f=-3.9!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 175:sc= 0.143 (180deg=0.114) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot -161:sc= 0.539 USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 ASN : amide:sc= 0.406 K(o=0.41,f=-3.5!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ -160:sc= 1.28 (180deg=0.989) USER MOD Single : A 74 TYR OH : rot 165:sc= -0.0986 USER MOD Single : A 79 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0334) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.108 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -89:sc= 1.21 USER MOD Single : A 103 ASN : amide:sc= -0.271 K(o=-0.27,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.515 -4.421 -15.509 1.00 10.00 N ATOM 2 CA GLY A 1 -4.122 -4.280 -15.159 1.00 10.00 C ATOM 3 C GLY A 1 -3.548 -5.674 -15.335 1.00 10.00 C ATOM 4 O GLY A 1 -4.240 -6.651 -15.054 1.00 10.00 O ATOM 0 H1 GLY A 1 -6.009 -3.523 -15.334 1.00 10.00 H new ATOM 0 H2 GLY A 1 -5.597 -4.671 -16.515 1.00 10.00 H new ATOM 0 H3 GLY A 1 -5.944 -5.171 -14.930 1.00 10.00 H new ATOM 0 HA2 GLY A 1 -3.621 -3.559 -15.805 1.00 10.00 H new ATOM 0 HA3 GLY A 1 -4.003 -3.927 -14.135 1.00 10.00 H new ATOM 10 N ASP A 2 -2.364 -5.767 -15.907 1.00 10.00 N ATOM 11 CA ASP A 2 -1.627 -7.016 -16.015 1.00 10.00 C ATOM 12 C ASP A 2 -1.155 -7.481 -14.636 1.00 10.00 C ATOM 13 O ASP A 2 -0.440 -6.760 -13.943 1.00 10.00 O ATOM 14 CB ASP A 2 -0.400 -6.836 -16.900 1.00 10.00 C ATOM 15 CG ASP A 2 0.358 -8.149 -17.059 1.00 10.00 C ATOM 16 OD1 ASP A 2 -0.200 -9.207 -16.690 1.00 10.00 O ATOM 17 OD2 ASP A 2 1.543 -8.072 -17.440 1.00 10.00 O ATOM 0 H ASP A 2 -1.878 -4.969 -16.316 1.00 10.00 H new ATOM 0 HA ASP A 2 -2.296 -7.758 -16.450 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -0.705 -6.467 -17.879 1.00 10.00 H new ATOM 0 HB3 ASP A 2 0.258 -6.083 -16.467 1.00 10.00 H new ATOM 22 N VAL A 3 -1.501 -8.710 -14.261 1.00 10.00 N ATOM 23 CA VAL A 3 -0.980 -9.352 -13.067 1.00 10.00 C ATOM 24 C VAL A 3 0.532 -9.570 -13.185 1.00 10.00 C ATOM 25 O VAL A 3 1.245 -9.392 -12.197 1.00 10.00 O ATOM 26 CB VAL A 3 -1.758 -10.660 -12.822 1.00 10.00 C ATOM 27 CG1 VAL A 3 -1.117 -11.558 -11.756 1.00 10.00 C ATOM 28 CG2 VAL A 3 -3.201 -10.354 -12.392 1.00 10.00 C ATOM 0 H VAL A 3 -2.157 -9.289 -14.785 1.00 10.00 H new ATOM 0 HA VAL A 3 -1.125 -8.709 -12.199 1.00 10.00 H new ATOM 0 HB VAL A 3 -1.739 -11.197 -13.770 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -1.715 -12.461 -11.633 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -0.109 -11.830 -12.068 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -1.071 -11.022 -10.808 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -3.736 -11.288 -12.223 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -3.190 -9.770 -11.471 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -3.702 -9.786 -13.176 1.00 10.00 H new ATOM 38 N GLU A 4 1.044 -9.949 -14.362 1.00 10.00 N ATOM 39 CA GLU A 4 2.470 -10.214 -14.500 1.00 10.00 C ATOM 40 C GLU A 4 3.254 -8.921 -14.322 1.00 10.00 C ATOM 41 O GLU A 4 4.084 -8.808 -13.418 1.00 10.00 O ATOM 42 CB GLU A 4 2.800 -10.881 -15.843 1.00 10.00 C ATOM 43 CG GLU A 4 2.876 -12.411 -15.705 1.00 10.00 C ATOM 44 CD GLU A 4 3.985 -12.873 -14.760 1.00 10.00 C ATOM 45 OE1 GLU A 4 5.173 -12.580 -15.014 1.00 10.00 O ATOM 46 OE2 GLU A 4 3.642 -13.492 -13.728 1.00 10.00 O ATOM 0 H GLU A 4 0.499 -10.076 -15.215 1.00 10.00 H new ATOM 0 HA GLU A 4 2.763 -10.916 -13.720 1.00 10.00 H new ATOM 0 HB2 GLU A 4 2.040 -10.618 -16.578 1.00 10.00 H new ATOM 0 HB3 GLU A 4 3.750 -10.500 -16.217 1.00 10.00 H new ATOM 0 HG2 GLU A 4 1.919 -12.785 -15.343 1.00 10.00 H new ATOM 0 HG3 GLU A 4 3.038 -12.851 -16.689 1.00 10.00 H new ATOM 53 N LYS A 5 2.995 -7.923 -15.164 1.00 10.00 N ATOM 54 CA LYS A 5 3.644 -6.641 -15.016 1.00 10.00 C ATOM 55 C LYS A 5 3.380 -6.094 -13.621 1.00 10.00 C ATOM 56 O LYS A 5 4.313 -5.619 -12.987 1.00 10.00 O ATOM 57 CB LYS A 5 3.271 -5.661 -16.126 1.00 10.00 C ATOM 58 CG LYS A 5 4.059 -5.903 -17.423 1.00 10.00 C ATOM 59 CD LYS A 5 4.445 -4.566 -18.071 1.00 10.00 C ATOM 60 CE LYS A 5 5.570 -3.858 -17.290 1.00 10.00 C ATOM 61 NZ LYS A 5 5.759 -2.461 -17.734 1.00 10.00 N ATOM 0 H LYS A 5 2.344 -7.985 -15.947 1.00 10.00 H new ATOM 0 HA LYS A 5 4.719 -6.782 -15.124 1.00 10.00 H new ATOM 0 HB2 LYS A 5 2.204 -5.743 -16.334 1.00 10.00 H new ATOM 0 HB3 LYS A 5 3.451 -4.643 -15.781 1.00 10.00 H new ATOM 0 HG2 LYS A 5 4.957 -6.483 -17.208 1.00 10.00 H new ATOM 0 HG3 LYS A 5 3.458 -6.491 -18.117 1.00 10.00 H new ATOM 0 HD2 LYS A 5 4.768 -4.739 -19.098 1.00 10.00 H new ATOM 0 HD3 LYS A 5 3.570 -3.918 -18.117 1.00 10.00 H new ATOM 0 HE2 LYS A 5 5.336 -3.871 -16.225 1.00 10.00 H new ATOM 0 HE3 LYS A 5 6.502 -4.408 -17.418 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 6.524 -2.022 -17.183 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 6.008 -2.448 -18.744 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 4.878 -1.928 -17.588 1.00 10.00 H new ATOM 75 N GLY A 6 2.158 -6.226 -13.105 1.00 10.00 N ATOM 76 CA GLY A 6 1.841 -5.868 -11.736 1.00 10.00 C ATOM 77 C GLY A 6 2.810 -6.475 -10.720 1.00 10.00 C ATOM 78 O GLY A 6 3.316 -5.778 -9.838 1.00 10.00 O ATOM 0 H GLY A 6 1.362 -6.586 -13.632 1.00 10.00 H new ATOM 0 HA2 GLY A 6 1.853 -4.782 -11.638 1.00 10.00 H new ATOM 0 HA3 GLY A 6 0.828 -6.197 -11.505 1.00 10.00 H new ATOM 82 N LYS A 7 3.077 -7.779 -10.848 1.00 10.00 N ATOM 83 CA LYS A 7 3.982 -8.513 -9.990 1.00 10.00 C ATOM 84 C LYS A 7 5.347 -7.856 -10.100 1.00 10.00 C ATOM 85 O LYS A 7 5.965 -7.511 -9.095 1.00 10.00 O ATOM 86 CB LYS A 7 4.001 -9.985 -10.422 1.00 10.00 C ATOM 87 CG LYS A 7 4.900 -10.875 -9.558 1.00 10.00 C ATOM 88 CD LYS A 7 4.880 -12.320 -10.083 1.00 10.00 C ATOM 89 CE LYS A 7 5.757 -12.452 -11.339 1.00 10.00 C ATOM 90 NZ LYS A 7 5.572 -13.735 -12.045 1.00 10.00 N ATOM 0 H LYS A 7 2.653 -8.358 -11.573 1.00 10.00 H new ATOM 0 HA LYS A 7 3.667 -8.491 -8.947 1.00 10.00 H new ATOM 0 HB2 LYS A 7 2.984 -10.375 -10.392 1.00 10.00 H new ATOM 0 HB3 LYS A 7 4.335 -10.045 -11.458 1.00 10.00 H new ATOM 0 HG2 LYS A 7 5.920 -10.491 -9.567 1.00 10.00 H new ATOM 0 HG3 LYS A 7 4.560 -10.852 -8.523 1.00 10.00 H new ATOM 0 HD2 LYS A 7 5.239 -12.999 -9.309 1.00 10.00 H new ATOM 0 HD3 LYS A 7 3.856 -12.614 -10.315 1.00 10.00 H new ATOM 0 HE2 LYS A 7 5.529 -11.633 -12.021 1.00 10.00 H new ATOM 0 HE3 LYS A 7 6.804 -12.348 -11.056 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 6.323 -13.852 -12.754 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 5.616 -14.517 -11.361 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 4.646 -13.741 -12.518 1.00 10.00 H new ATOM 104 N LYS A 8 5.832 -7.671 -11.330 1.00 10.00 N ATOM 105 CA LYS A 8 7.156 -7.113 -11.493 1.00 10.00 C ATOM 106 C LYS A 8 7.222 -5.709 -10.906 1.00 10.00 C ATOM 107 O LYS A 8 8.174 -5.402 -10.203 1.00 10.00 O ATOM 108 CB LYS A 8 7.653 -7.161 -12.940 1.00 10.00 C ATOM 109 CG LYS A 8 7.438 -8.517 -13.625 1.00 10.00 C ATOM 110 CD LYS A 8 7.738 -9.773 -12.788 1.00 10.00 C ATOM 111 CE LYS A 8 9.230 -10.142 -12.731 1.00 10.00 C ATOM 112 NZ LYS A 8 9.993 -9.303 -11.783 1.00 10.00 N ATOM 0 H LYS A 8 5.340 -7.894 -12.195 1.00 10.00 H new ATOM 0 HA LYS A 8 7.843 -7.746 -10.932 1.00 10.00 H new ATOM 0 HB2 LYS A 8 7.142 -6.389 -13.515 1.00 10.00 H new ATOM 0 HB3 LYS A 8 8.716 -6.920 -12.957 1.00 10.00 H new ATOM 0 HG2 LYS A 8 6.401 -8.569 -13.956 1.00 10.00 H new ATOM 0 HG3 LYS A 8 8.060 -8.548 -14.519 1.00 10.00 H new ATOM 0 HD2 LYS A 8 7.373 -9.617 -11.773 1.00 10.00 H new ATOM 0 HD3 LYS A 8 7.181 -10.614 -13.201 1.00 10.00 H new ATOM 0 HE2 LYS A 8 9.330 -11.189 -12.444 1.00 10.00 H new ATOM 0 HE3 LYS A 8 9.662 -10.042 -13.727 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 10.915 -9.745 -11.592 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 10.140 -8.359 -12.195 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 9.462 -9.213 -10.893 1.00 10.00 H new ATOM 126 N ILE A 9 6.218 -4.873 -11.154 1.00 10.00 N ATOM 127 CA ILE A 9 6.156 -3.524 -10.640 1.00 10.00 C ATOM 128 C ILE A 9 6.257 -3.570 -9.121 1.00 10.00 C ATOM 129 O ILE A 9 7.161 -2.964 -8.556 1.00 10.00 O ATOM 130 CB ILE A 9 4.871 -2.845 -11.145 1.00 10.00 C ATOM 131 CG1 ILE A 9 4.944 -2.585 -12.661 1.00 10.00 C ATOM 132 CG2 ILE A 9 4.636 -1.518 -10.426 1.00 10.00 C ATOM 133 CD1 ILE A 9 3.550 -2.386 -13.266 1.00 10.00 C ATOM 0 H ILE A 9 5.414 -5.126 -11.729 1.00 10.00 H new ATOM 0 HA ILE A 9 6.991 -2.923 -11.000 1.00 10.00 H new ATOM 0 HB ILE A 9 4.043 -3.522 -10.934 1.00 10.00 H new ATOM 0 HG12 ILE A 9 5.553 -1.701 -12.850 1.00 10.00 H new ATOM 0 HG13 ILE A 9 5.438 -3.424 -13.151 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.722 -1.058 -10.801 1.00 10.00 H new ATOM 0 HG22 ILE A 9 4.540 -1.697 -9.355 1.00 10.00 H new ATOM 0 HG23 ILE A 9 5.479 -0.851 -10.608 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.641 -2.205 -14.337 1.00 10.00 H new ATOM 0 HD12 ILE A 9 2.950 -3.280 -13.099 1.00 10.00 H new ATOM 0 HD13 ILE A 9 3.067 -1.531 -12.793 1.00 10.00 H new ATOM 145 N PHE A 10 5.367 -4.313 -8.466 1.00 10.00 N ATOM 146 CA PHE A 10 5.409 -4.508 -7.025 1.00 10.00 C ATOM 147 C PHE A 10 6.846 -4.794 -6.548 1.00 10.00 C ATOM 148 O PHE A 10 7.356 -4.142 -5.633 1.00 10.00 O ATOM 149 CB PHE A 10 4.435 -5.639 -6.676 1.00 10.00 C ATOM 150 CG PHE A 10 4.425 -6.008 -5.214 1.00 10.00 C ATOM 151 CD1 PHE A 10 3.785 -5.167 -4.289 1.00 10.00 C ATOM 152 CD2 PHE A 10 5.111 -7.155 -4.773 1.00 10.00 C ATOM 153 CE1 PHE A 10 3.839 -5.465 -2.921 1.00 10.00 C ATOM 154 CE2 PHE A 10 5.147 -7.465 -3.406 1.00 10.00 C ATOM 155 CZ PHE A 10 4.521 -6.614 -2.485 1.00 10.00 C ATOM 0 H PHE A 10 4.595 -4.797 -8.925 1.00 10.00 H new ATOM 0 HA PHE A 10 5.101 -3.601 -6.504 1.00 10.00 H new ATOM 0 HB2 PHE A 10 3.429 -5.343 -6.973 1.00 10.00 H new ATOM 0 HB3 PHE A 10 4.693 -6.521 -7.261 1.00 10.00 H new ATOM 0 HD1 PHE A 10 3.252 -4.292 -4.632 1.00 10.00 H new ATOM 0 HD2 PHE A 10 5.609 -7.795 -5.486 1.00 10.00 H new ATOM 0 HE1 PHE A 10 3.359 -4.815 -2.205 1.00 10.00 H new ATOM 0 HE2 PHE A 10 5.655 -8.355 -3.065 1.00 10.00 H new ATOM 0 HZ PHE A 10 4.563 -6.843 -1.430 1.00 10.00 H new ATOM 165 N VAL A 11 7.525 -5.729 -7.222 1.00 10.00 N ATOM 166 CA VAL A 11 8.883 -6.144 -6.878 1.00 10.00 C ATOM 167 C VAL A 11 9.951 -5.114 -7.280 1.00 10.00 C ATOM 168 O VAL A 11 11.039 -5.085 -6.715 1.00 10.00 O ATOM 169 CB VAL A 11 9.167 -7.527 -7.491 1.00 10.00 C ATOM 170 CG1 VAL A 11 10.572 -8.056 -7.170 1.00 10.00 C ATOM 171 CG2 VAL A 11 8.155 -8.538 -6.949 1.00 10.00 C ATOM 0 H VAL A 11 7.141 -6.221 -8.028 1.00 10.00 H new ATOM 0 HA VAL A 11 8.944 -6.211 -5.792 1.00 10.00 H new ATOM 0 HB VAL A 11 9.089 -7.407 -8.572 1.00 10.00 H new ATOM 0 HG11 VAL A 11 10.707 -9.034 -7.632 1.00 10.00 H new ATOM 0 HG12 VAL A 11 11.319 -7.365 -7.560 1.00 10.00 H new ATOM 0 HG13 VAL A 11 10.689 -8.145 -6.090 1.00 10.00 H new ATOM 0 HG21 VAL A 11 8.353 -9.519 -7.381 1.00 10.00 H new ATOM 0 HG22 VAL A 11 8.243 -8.595 -5.864 1.00 10.00 H new ATOM 0 HG23 VAL A 11 7.146 -8.222 -7.215 1.00 10.00 H new ATOM 181 N GLN A 12 9.683 -4.293 -8.289 1.00 10.00 N ATOM 182 CA GLN A 12 10.625 -3.314 -8.814 1.00 10.00 C ATOM 183 C GLN A 12 10.417 -1.945 -8.167 1.00 10.00 C ATOM 184 O GLN A 12 11.230 -1.045 -8.373 1.00 10.00 O ATOM 185 CB GLN A 12 10.472 -3.248 -10.335 1.00 10.00 C ATOM 186 CG GLN A 12 10.901 -4.574 -10.988 1.00 10.00 C ATOM 187 CD GLN A 12 12.403 -4.660 -11.223 1.00 10.00 C ATOM 188 OE1 GLN A 12 12.883 -4.340 -12.305 1.00 10.00 O ATOM 189 NE2 GLN A 12 13.155 -5.125 -10.230 1.00 10.00 N ATOM 0 H GLN A 12 8.786 -4.290 -8.774 1.00 10.00 H new ATOM 0 HA GLN A 12 11.642 -3.621 -8.572 1.00 10.00 H new ATOM 0 HB2 GLN A 12 9.435 -3.031 -10.591 1.00 10.00 H new ATOM 0 HB3 GLN A 12 11.076 -2.431 -10.730 1.00 10.00 H new ATOM 0 HG2 GLN A 12 10.590 -5.403 -10.353 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.382 -4.689 -11.940 1.00 10.00 H new ATOM 0 HE21 GLN A 12 12.725 -5.382 -9.342 1.00 10.00 H new ATOM 0 HE22 GLN A 12 14.162 -5.224 -10.356 1.00 10.00 H new ATOM 198 N LYS A 13 9.322 -1.772 -7.421 1.00 10.00 N ATOM 199 CA LYS A 13 8.968 -0.524 -6.772 1.00 10.00 C ATOM 200 C LYS A 13 8.996 -0.644 -5.248 1.00 10.00 C ATOM 201 O LYS A 13 9.578 0.223 -4.600 1.00 10.00 O ATOM 202 CB LYS A 13 7.592 -0.065 -7.260 1.00 10.00 C ATOM 203 CG LYS A 13 7.554 0.194 -8.773 1.00 10.00 C ATOM 204 CD LYS A 13 8.551 1.236 -9.298 1.00 10.00 C ATOM 205 CE LYS A 13 8.568 2.531 -8.470 1.00 10.00 C ATOM 206 NZ LYS A 13 9.550 3.499 -9.001 1.00 10.00 N ATOM 0 H LYS A 13 8.647 -2.518 -7.253 1.00 10.00 H new ATOM 0 HA LYS A 13 9.713 0.224 -7.042 1.00 10.00 H new ATOM 0 HB2 LYS A 13 6.850 -0.823 -7.007 1.00 10.00 H new ATOM 0 HB3 LYS A 13 7.310 0.846 -6.733 1.00 10.00 H new ATOM 0 HG2 LYS A 13 7.738 -0.749 -9.289 1.00 10.00 H new ATOM 0 HG3 LYS A 13 6.547 0.514 -9.043 1.00 10.00 H new ATOM 0 HD2 LYS A 13 9.551 0.802 -9.302 1.00 10.00 H new ATOM 0 HD3 LYS A 13 8.304 1.477 -10.332 1.00 10.00 H new ATOM 0 HE2 LYS A 13 7.575 2.980 -8.473 1.00 10.00 H new ATOM 0 HE3 LYS A 13 8.809 2.298 -7.433 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 9.775 4.203 -8.269 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 10.418 2.997 -9.277 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 9.149 3.980 -9.832 1.00 10.00 H new ATOM 220 N CYS A 14 8.347 -1.666 -4.674 1.00 10.00 N ATOM 221 CA CYS A 14 8.272 -1.841 -3.227 1.00 10.00 C ATOM 222 C CYS A 14 9.224 -2.970 -2.803 1.00 10.00 C ATOM 223 O CYS A 14 10.297 -2.690 -2.276 1.00 10.00 O ATOM 224 CB CYS A 14 6.840 -2.016 -2.730 1.00 10.00 C ATOM 225 SG CYS A 14 5.532 -1.892 -4.008 1.00 10.00 S ATOM 0 H CYS A 14 7.862 -2.391 -5.203 1.00 10.00 H new ATOM 0 HA CYS A 14 8.607 -0.926 -2.738 1.00 10.00 H new ATOM 0 HB2 CYS A 14 6.759 -2.990 -2.248 1.00 10.00 H new ATOM 0 HB3 CYS A 14 6.647 -1.264 -1.965 1.00 10.00 H new ATOM 0 HG CYS A 14 4.919 -3.033 -4.113 1.00 10.00 H new ATOM 230 N ALA A 15 8.844 -4.231 -3.043 1.00 10.00 N ATOM 231 CA ALA A 15 9.544 -5.455 -2.631 1.00 10.00 C ATOM 232 C ALA A 15 10.163 -5.426 -1.231 1.00 10.00 C ATOM 233 O ALA A 15 9.595 -5.967 -0.286 1.00 10.00 O ATOM 234 CB ALA A 15 10.588 -5.872 -3.673 1.00 10.00 C ATOM 0 H ALA A 15 7.989 -4.437 -3.560 1.00 10.00 H new ATOM 0 HA ALA A 15 8.756 -6.206 -2.572 1.00 10.00 H new ATOM 0 HB1 ALA A 15 11.090 -6.781 -3.341 1.00 10.00 H new ATOM 0 HB2 ALA A 15 10.095 -6.057 -4.628 1.00 10.00 H new ATOM 0 HB3 ALA A 15 11.322 -5.075 -3.792 1.00 10.00 H new ATOM 240 N GLN A 16 11.329 -4.800 -1.054 1.00 10.00 N ATOM 241 CA GLN A 16 11.945 -4.643 0.248 1.00 10.00 C ATOM 242 C GLN A 16 11.254 -3.507 1.006 1.00 10.00 C ATOM 243 O GLN A 16 11.902 -2.651 1.603 1.00 10.00 O ATOM 244 CB GLN A 16 13.449 -4.411 0.081 1.00 10.00 C ATOM 245 CG GLN A 16 14.196 -5.700 -0.287 1.00 10.00 C ATOM 246 CD GLN A 16 15.693 -5.563 -0.021 1.00 10.00 C ATOM 247 OE1 GLN A 16 16.255 -4.478 -0.115 1.00 10.00 O ATOM 248 NE2 GLN A 16 16.355 -6.654 0.356 1.00 10.00 N ATOM 0 H GLN A 16 11.867 -4.390 -1.817 1.00 10.00 H new ATOM 0 HA GLN A 16 11.823 -5.550 0.840 1.00 10.00 H new ATOM 0 HB2 GLN A 16 13.616 -3.662 -0.694 1.00 10.00 H new ATOM 0 HB3 GLN A 16 13.858 -4.008 1.007 1.00 10.00 H new ATOM 0 HG2 GLN A 16 13.796 -6.533 0.290 1.00 10.00 H new ATOM 0 HG3 GLN A 16 14.030 -5.932 -1.339 1.00 10.00 H new ATOM 0 HE21 GLN A 16 15.867 -7.547 0.428 1.00 10.00 H new ATOM 0 HE22 GLN A 16 17.350 -6.597 0.573 1.00 10.00 H new ATOM 257 N CYS A 17 9.923 -3.551 1.034 1.00 10.00 N ATOM 258 CA CYS A 17 9.130 -2.827 1.997 1.00 10.00 C ATOM 259 C CYS A 17 7.812 -3.558 2.196 1.00 10.00 C ATOM 260 O CYS A 17 7.433 -3.727 3.342 1.00 10.00 O ATOM 261 CB CYS A 17 8.958 -1.365 1.661 1.00 10.00 C ATOM 262 SG CYS A 17 8.815 -0.478 3.246 1.00 10.00 S ATOM 0 H CYS A 17 9.369 -4.100 0.377 1.00 10.00 H new ATOM 0 HA CYS A 17 9.668 -2.809 2.945 1.00 10.00 H new ATOM 0 HB2 CYS A 17 9.808 -0.997 1.087 1.00 10.00 H new ATOM 0 HB3 CYS A 17 8.069 -1.210 1.049 1.00 10.00 H new ATOM 0 HG CYS A 17 8.666 0.793 3.020 1.00 10.00 H new ATOM 267 N HIS A 18 7.140 -4.034 1.136 1.00 10.00 N ATOM 268 CA HIS A 18 5.942 -4.846 1.280 1.00 10.00 C ATOM 269 C HIS A 18 6.138 -6.194 0.623 1.00 10.00 C ATOM 270 O HIS A 18 6.828 -6.312 -0.383 1.00 10.00 O ATOM 271 CB HIS A 18 4.761 -4.190 0.588 1.00 10.00 C ATOM 272 CG HIS A 18 4.182 -3.050 1.360 1.00 10.00 C ATOM 273 ND1 HIS A 18 3.144 -3.110 2.263 1.00 10.00 N ATOM 274 CD2 HIS A 18 4.355 -1.751 1.007 1.00 10.00 C ATOM 275 CE1 HIS A 18 2.661 -1.861 2.391 1.00 10.00 C ATOM 276 NE2 HIS A 18 3.388 -0.993 1.656 1.00 10.00 N ATOM 0 H HIS A 18 7.415 -3.864 0.169 1.00 10.00 H new ATOM 0 HA HIS A 18 5.753 -4.953 2.348 1.00 10.00 H new ATOM 0 HB2 HIS A 18 5.076 -3.833 -0.393 1.00 10.00 H new ATOM 0 HB3 HIS A 18 3.986 -4.938 0.421 1.00 10.00 H new ATOM 0 HD1 HIS A 18 2.806 -3.944 2.744 1.00 10.00 H new ATOM 0 HD2 HIS A 18 5.113 -1.372 0.338 1.00 10.00 H new ATOM 0 HE1 HIS A 18 1.810 -1.590 2.998 1.00 10.00 H new ATOM 284 N THR A 19 5.428 -7.179 1.166 1.00 10.00 N ATOM 285 CA THR A 19 5.432 -8.553 0.700 1.00 10.00 C ATOM 286 C THR A 19 4.022 -9.016 0.312 1.00 10.00 C ATOM 287 O THR A 19 3.868 -9.844 -0.575 1.00 10.00 O ATOM 288 CB THR A 19 5.989 -9.401 1.836 1.00 10.00 C ATOM 289 OG1 THR A 19 7.206 -8.865 2.318 1.00 10.00 O ATOM 290 CG2 THR A 19 6.236 -10.831 1.376 1.00 10.00 C ATOM 0 H THR A 19 4.816 -7.033 1.969 1.00 10.00 H new ATOM 0 HA THR A 19 6.044 -8.650 -0.196 1.00 10.00 H new ATOM 0 HB THR A 19 5.247 -9.397 2.635 1.00 10.00 H new ATOM 0 HG1 THR A 19 7.544 -9.425 3.048 1.00 10.00 H new ATOM 0 HG21 THR A 19 6.634 -11.416 2.205 1.00 10.00 H new ATOM 0 HG22 THR A 19 5.298 -11.272 1.038 1.00 10.00 H new ATOM 0 HG23 THR A 19 6.953 -10.830 0.555 1.00 10.00 H new ATOM 298 N VAL A 20 3.011 -8.498 1.019 1.00 10.00 N ATOM 299 CA VAL A 20 1.587 -8.779 0.889 1.00 10.00 C ATOM 300 C VAL A 20 1.205 -10.223 1.209 1.00 10.00 C ATOM 301 O VAL A 20 0.069 -10.623 0.967 1.00 10.00 O ATOM 302 CB VAL A 20 0.973 -8.259 -0.421 1.00 10.00 C ATOM 303 CG1 VAL A 20 1.352 -6.803 -0.702 1.00 10.00 C ATOM 304 CG2 VAL A 20 1.261 -9.086 -1.687 1.00 10.00 C ATOM 0 H VAL A 20 3.189 -7.816 1.756 1.00 10.00 H new ATOM 0 HA VAL A 20 1.120 -8.189 1.678 1.00 10.00 H new ATOM 0 HB VAL A 20 -0.095 -8.356 -0.224 1.00 10.00 H new ATOM 0 HG11 VAL A 20 0.894 -6.482 -1.638 1.00 10.00 H new ATOM 0 HG12 VAL A 20 0.996 -6.171 0.112 1.00 10.00 H new ATOM 0 HG13 VAL A 20 2.436 -6.718 -0.780 1.00 10.00 H new ATOM 0 HG21 VAL A 20 0.776 -8.620 -2.544 1.00 10.00 H new ATOM 0 HG22 VAL A 20 2.337 -9.128 -1.857 1.00 10.00 H new ATOM 0 HG23 VAL A 20 0.875 -10.097 -1.557 1.00 10.00 H new ATOM 314 N GLU A 21 2.140 -10.977 1.786 1.00 10.00 N ATOM 315 CA GLU A 21 2.036 -12.410 1.950 1.00 10.00 C ATOM 316 C GLU A 21 1.900 -12.763 3.429 1.00 10.00 C ATOM 317 O GLU A 21 2.124 -11.925 4.295 1.00 10.00 O ATOM 318 CB GLU A 21 3.296 -13.044 1.355 1.00 10.00 C ATOM 319 CG GLU A 21 2.987 -14.339 0.605 1.00 10.00 C ATOM 320 CD GLU A 21 4.265 -15.075 0.238 1.00 10.00 C ATOM 321 OE1 GLU A 21 5.329 -14.425 0.204 1.00 10.00 O ATOM 322 OE2 GLU A 21 4.143 -16.308 0.076 1.00 10.00 O ATOM 0 H GLU A 21 3.008 -10.591 2.158 1.00 10.00 H new ATOM 0 HA GLU A 21 1.152 -12.789 1.438 1.00 10.00 H new ATOM 0 HB2 GLU A 21 3.771 -12.336 0.676 1.00 10.00 H new ATOM 0 HB3 GLU A 21 4.010 -13.249 2.153 1.00 10.00 H new ATOM 0 HG2 GLU A 21 2.359 -14.980 1.223 1.00 10.00 H new ATOM 0 HG3 GLU A 21 2.421 -14.114 -0.299 1.00 10.00 H new ATOM 329 N LYS A 22 1.616 -14.024 3.744 1.00 10.00 N ATOM 330 CA LYS A 22 1.452 -14.455 5.126 1.00 10.00 C ATOM 331 C LYS A 22 2.783 -14.681 5.857 1.00 10.00 C ATOM 332 O LYS A 22 2.787 -14.892 7.066 1.00 10.00 O ATOM 333 CB LYS A 22 0.491 -15.650 5.213 1.00 10.00 C ATOM 334 CG LYS A 22 1.021 -17.013 4.743 1.00 10.00 C ATOM 335 CD LYS A 22 1.101 -17.250 3.223 1.00 10.00 C ATOM 336 CE LYS A 22 2.549 -17.517 2.777 1.00 10.00 C ATOM 337 NZ LYS A 22 2.653 -17.857 1.341 1.00 10.00 N ATOM 0 H LYS A 22 1.495 -14.767 3.056 1.00 10.00 H new ATOM 0 HA LYS A 22 0.989 -13.632 5.670 1.00 10.00 H new ATOM 0 HB2 LYS A 22 0.171 -15.751 6.250 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -0.397 -15.413 4.627 1.00 10.00 H new ATOM 0 HG2 LYS A 22 2.019 -17.149 5.159 1.00 10.00 H new ATOM 0 HG3 LYS A 22 0.387 -17.789 5.173 1.00 10.00 H new ATOM 0 HD2 LYS A 22 0.472 -18.097 2.951 1.00 10.00 H new ATOM 0 HD3 LYS A 22 0.710 -16.380 2.696 1.00 10.00 H new ATOM 0 HE2 LYS A 22 3.156 -16.635 2.982 1.00 10.00 H new ATOM 0 HE3 LYS A 22 2.962 -18.333 3.370 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 3.301 -18.661 1.221 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 1.713 -18.112 0.976 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 3.018 -17.037 0.816 1.00 10.00 H new ATOM 351 N GLY A 23 3.909 -14.644 5.135 1.00 10.00 N ATOM 352 CA GLY A 23 5.243 -14.881 5.683 1.00 10.00 C ATOM 353 C GLY A 23 6.230 -13.780 5.298 1.00 10.00 C ATOM 354 O GLY A 23 7.438 -14.009 5.271 1.00 10.00 O ATOM 0 H GLY A 23 3.915 -14.444 4.135 1.00 10.00 H new ATOM 0 HA2 GLY A 23 5.181 -14.947 6.769 1.00 10.00 H new ATOM 0 HA3 GLY A 23 5.615 -15.841 5.326 1.00 10.00 H new ATOM 358 N GLY A 24 5.730 -12.572 5.029 1.00 10.00 N ATOM 359 CA GLY A 24 6.562 -11.459 4.590 1.00 10.00 C ATOM 360 C GLY A 24 7.392 -10.825 5.702 1.00 10.00 C ATOM 361 O GLY A 24 8.215 -9.951 5.439 1.00 10.00 O ATOM 0 H GLY A 24 4.740 -12.342 5.110 1.00 10.00 H new ATOM 0 HA2 GLY A 24 7.233 -11.808 3.805 1.00 10.00 H new ATOM 0 HA3 GLY A 24 5.923 -10.695 4.147 1.00 10.00 H new ATOM 365 N LYS A 25 7.169 -11.254 6.945 1.00 10.00 N ATOM 366 CA LYS A 25 7.666 -10.588 8.135 1.00 10.00 C ATOM 367 C LYS A 25 7.009 -9.210 8.265 1.00 10.00 C ATOM 368 O LYS A 25 6.091 -8.885 7.515 1.00 10.00 O ATOM 369 CB LYS A 25 9.207 -10.552 8.184 1.00 10.00 C ATOM 370 CG LYS A 25 9.832 -11.899 7.776 1.00 10.00 C ATOM 371 CD LYS A 25 10.945 -12.320 8.748 1.00 10.00 C ATOM 372 CE LYS A 25 11.446 -13.742 8.452 1.00 10.00 C ATOM 373 NZ LYS A 25 12.265 -13.818 7.223 1.00 10.00 N ATOM 0 H LYS A 25 6.626 -12.093 7.150 1.00 10.00 H new ATOM 0 HA LYS A 25 7.381 -11.167 9.013 1.00 10.00 H new ATOM 0 HB2 LYS A 25 9.572 -9.768 7.521 1.00 10.00 H new ATOM 0 HB3 LYS A 25 9.531 -10.293 9.192 1.00 10.00 H new ATOM 0 HG2 LYS A 25 9.059 -12.667 7.751 1.00 10.00 H new ATOM 0 HG3 LYS A 25 10.238 -11.822 6.767 1.00 10.00 H new ATOM 0 HD2 LYS A 25 11.776 -11.618 8.676 1.00 10.00 H new ATOM 0 HD3 LYS A 25 10.573 -12.270 9.771 1.00 10.00 H new ATOM 0 HE2 LYS A 25 12.034 -14.098 9.298 1.00 10.00 H new ATOM 0 HE3 LYS A 25 10.591 -14.411 8.355 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 12.575 -14.799 7.073 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 11.699 -13.505 6.409 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 13.098 -13.203 7.322 1.00 10.00 H new ATOM 387 N HIS A 26 7.456 -8.422 9.245 1.00 10.00 N ATOM 388 CA HIS A 26 6.851 -7.134 9.547 1.00 10.00 C ATOM 389 C HIS A 26 7.559 -6.057 8.730 1.00 10.00 C ATOM 390 O HIS A 26 6.980 -5.492 7.810 1.00 10.00 O ATOM 391 CB HIS A 26 6.913 -6.867 11.062 1.00 10.00 C ATOM 392 CG HIS A 26 6.532 -8.063 11.899 1.00 10.00 C ATOM 393 ND1 HIS A 26 7.411 -8.935 12.503 1.00 10.00 N ATOM 394 CD2 HIS A 26 5.264 -8.524 12.133 1.00 10.00 C ATOM 395 CE1 HIS A 26 6.683 -9.900 13.092 1.00 10.00 C ATOM 396 NE2 HIS A 26 5.372 -9.693 12.892 1.00 10.00 N ATOM 0 H HIS A 26 8.244 -8.662 9.846 1.00 10.00 H new ATOM 0 HA HIS A 26 5.797 -7.127 9.271 1.00 10.00 H new ATOM 0 HB2 HIS A 26 7.923 -6.555 11.327 1.00 10.00 H new ATOM 0 HB3 HIS A 26 6.249 -6.037 11.304 1.00 10.00 H new ATOM 0 HD2 HIS A 26 4.346 -8.067 11.793 1.00 10.00 H new ATOM 0 HE1 HIS A 26 7.096 -10.728 13.649 1.00 10.00 H new ATOM 0 HE2 HIS A 26 4.605 -10.275 13.228 1.00 10.00 H new ATOM 404 N LYS A 27 8.831 -5.806 9.058 1.00 10.00 N ATOM 405 CA LYS A 27 9.633 -4.743 8.474 1.00 10.00 C ATOM 406 C LYS A 27 8.911 -3.383 8.522 1.00 10.00 C ATOM 407 O LYS A 27 7.993 -3.193 9.317 1.00 10.00 O ATOM 408 CB LYS A 27 10.145 -5.157 7.084 1.00 10.00 C ATOM 409 CG LYS A 27 11.126 -6.334 7.203 1.00 10.00 C ATOM 410 CD LYS A 27 11.873 -6.543 5.873 1.00 10.00 C ATOM 411 CE LYS A 27 13.352 -6.923 6.078 1.00 10.00 C ATOM 412 NZ LYS A 27 14.222 -6.330 5.039 1.00 10.00 N ATOM 0 H LYS A 27 9.337 -6.353 9.754 1.00 10.00 H new ATOM 0 HA LYS A 27 10.523 -4.591 9.084 1.00 10.00 H new ATOM 0 HB2 LYS A 27 9.305 -5.438 6.449 1.00 10.00 H new ATOM 0 HB3 LYS A 27 10.638 -4.311 6.604 1.00 10.00 H new ATOM 0 HG2 LYS A 27 11.841 -6.141 8.003 1.00 10.00 H new ATOM 0 HG3 LYS A 27 10.585 -7.242 7.471 1.00 10.00 H new ATOM 0 HD2 LYS A 27 11.376 -7.327 5.301 1.00 10.00 H new ATOM 0 HD3 LYS A 27 11.815 -5.630 5.280 1.00 10.00 H new ATOM 0 HE2 LYS A 27 13.680 -6.587 7.062 1.00 10.00 H new ATOM 0 HE3 LYS A 27 13.454 -8.008 6.061 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 15.209 -6.609 5.212 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 13.925 -6.670 4.102 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 14.145 -5.293 5.072 1.00 10.00 H new ATOM 426 N THR A 28 9.360 -2.415 7.717 1.00 10.00 N ATOM 427 CA THR A 28 8.703 -1.130 7.564 1.00 10.00 C ATOM 428 C THR A 28 7.283 -1.317 7.026 1.00 10.00 C ATOM 429 O THR A 28 6.326 -1.054 7.746 1.00 10.00 O ATOM 430 CB THR A 28 9.588 -0.229 6.699 1.00 10.00 C ATOM 431 OG1 THR A 28 10.853 -0.099 7.314 1.00 10.00 O ATOM 432 CG2 THR A 28 8.983 1.162 6.512 1.00 10.00 C ATOM 0 H THR A 28 10.202 -2.511 7.149 1.00 10.00 H new ATOM 0 HA THR A 28 8.581 -0.633 8.526 1.00 10.00 H new ATOM 0 HB THR A 28 9.676 -0.692 5.716 1.00 10.00 H new ATOM 0 HG1 THR A 28 11.426 0.476 6.765 1.00 10.00 H new ATOM 0 HG21 THR A 28 9.645 1.766 5.892 1.00 10.00 H new ATOM 0 HG22 THR A 28 8.011 1.074 6.026 1.00 10.00 H new ATOM 0 HG23 THR A 28 8.861 1.639 7.484 1.00 10.00 H new ATOM 440 N GLY A 29 7.128 -1.735 5.767 1.00 10.00 N ATOM 441 CA GLY A 29 5.814 -1.926 5.179 1.00 10.00 C ATOM 442 C GLY A 29 5.248 -3.261 5.654 1.00 10.00 C ATOM 443 O GLY A 29 5.849 -4.302 5.402 1.00 10.00 O ATOM 0 H GLY A 29 7.904 -1.946 5.139 1.00 10.00 H new ATOM 0 HA2 GLY A 29 5.150 -1.111 5.468 1.00 10.00 H new ATOM 0 HA3 GLY A 29 5.882 -1.911 4.091 1.00 10.00 H new ATOM 447 N PRO A 30 4.100 -3.286 6.341 1.00 10.00 N ATOM 448 CA PRO A 30 3.542 -4.551 6.746 1.00 10.00 C ATOM 449 C PRO A 30 3.194 -5.383 5.512 1.00 10.00 C ATOM 450 O PRO A 30 2.827 -4.874 4.443 1.00 10.00 O ATOM 451 CB PRO A 30 2.329 -4.257 7.628 1.00 10.00 C ATOM 452 CG PRO A 30 2.145 -2.738 7.587 1.00 10.00 C ATOM 453 CD PRO A 30 3.258 -2.167 6.709 1.00 10.00 C ATOM 0 HA PRO A 30 4.255 -5.142 7.321 1.00 10.00 H new ATOM 0 HB2 PRO A 30 1.441 -4.769 7.256 1.00 10.00 H new ATOM 0 HB3 PRO A 30 2.493 -4.604 8.648 1.00 10.00 H new ATOM 0 HG2 PRO A 30 1.166 -2.481 7.182 1.00 10.00 H new ATOM 0 HG3 PRO A 30 2.195 -2.318 8.592 1.00 10.00 H new ATOM 0 HD2 PRO A 30 2.845 -1.683 5.824 1.00 10.00 H new ATOM 0 HD3 PRO A 30 3.829 -1.411 7.248 1.00 10.00 H new ATOM 461 N ASN A 31 3.313 -6.694 5.679 1.00 10.00 N ATOM 462 CA ASN A 31 2.882 -7.683 4.721 1.00 10.00 C ATOM 463 C ASN A 31 1.362 -7.637 4.601 1.00 10.00 C ATOM 464 O ASN A 31 0.664 -8.405 5.253 1.00 10.00 O ATOM 465 CB ASN A 31 3.397 -9.059 5.145 1.00 10.00 C ATOM 466 CG ASN A 31 2.995 -9.486 6.562 1.00 10.00 C ATOM 467 OD1 ASN A 31 3.039 -8.691 7.498 1.00 10.00 O ATOM 468 ND2 ASN A 31 2.633 -10.750 6.746 1.00 10.00 N ATOM 0 H ASN A 31 3.727 -7.104 6.516 1.00 10.00 H new ATOM 0 HA ASN A 31 3.295 -7.472 3.734 1.00 10.00 H new ATOM 0 HB2 ASN A 31 3.029 -9.803 4.438 1.00 10.00 H new ATOM 0 HB3 ASN A 31 4.485 -9.062 5.074 1.00 10.00 H new ATOM 0 HD21 ASN A 31 2.384 -11.079 7.679 1.00 10.00 H new ATOM 0 HD22 ASN A 31 2.604 -11.392 5.954 1.00 10.00 H new ATOM 475 N LEU A 32 0.880 -6.705 3.772 1.00 10.00 N ATOM 476 CA LEU A 32 -0.509 -6.273 3.712 1.00 10.00 C ATOM 477 C LEU A 32 -1.526 -7.402 3.926 1.00 10.00 C ATOM 478 O LEU A 32 -2.242 -7.379 4.921 1.00 10.00 O ATOM 479 CB LEU A 32 -0.791 -5.529 2.402 1.00 10.00 C ATOM 480 CG LEU A 32 -0.574 -4.016 2.447 1.00 10.00 C ATOM 481 CD1 LEU A 32 -0.614 -3.506 1.002 1.00 10.00 C ATOM 482 CD2 LEU A 32 -1.641 -3.345 3.313 1.00 10.00 C ATOM 0 H LEU A 32 1.474 -6.216 3.102 1.00 10.00 H new ATOM 0 HA LEU A 32 -0.643 -5.591 4.552 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -0.154 -5.947 1.622 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -1.823 -5.722 2.109 1.00 10.00 H new ATOM 0 HG LEU A 32 0.388 -3.774 2.898 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -0.462 -2.427 0.993 1.00 10.00 H new ATOM 0 HD12 LEU A 32 0.174 -3.988 0.424 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -1.583 -3.740 0.560 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -1.470 -2.269 3.333 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -2.628 -3.548 2.897 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -1.587 -3.740 4.328 1.00 10.00 H new ATOM 494 N HIS A 33 -1.580 -8.356 2.983 1.00 10.00 N ATOM 495 CA HIS A 33 -2.310 -9.621 3.078 1.00 10.00 C ATOM 496 C HIS A 33 -3.782 -9.440 3.502 1.00 10.00 C ATOM 497 O HIS A 33 -4.118 -9.412 4.683 1.00 10.00 O ATOM 498 CB HIS A 33 -1.517 -10.592 3.964 1.00 10.00 C ATOM 499 CG HIS A 33 -2.072 -11.993 3.993 1.00 10.00 C ATOM 500 ND1 HIS A 33 -2.014 -12.941 2.992 1.00 10.00 N ATOM 501 CD2 HIS A 33 -2.700 -12.564 5.063 1.00 10.00 C ATOM 502 CE1 HIS A 33 -2.654 -14.036 3.439 1.00 10.00 C ATOM 503 NE2 HIS A 33 -3.072 -13.861 4.704 1.00 10.00 N ATOM 0 H HIS A 33 -1.091 -8.257 2.093 1.00 10.00 H new ATOM 0 HA HIS A 33 -2.387 -10.062 2.084 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -0.486 -10.629 3.612 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -1.493 -10.201 4.981 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -2.878 -12.095 6.019 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -2.811 -14.934 2.860 1.00 10.00 H new ATOM 0 HE2 HIS A 33 -3.563 -14.540 5.286 1.00 10.00 H new ATOM 511 N GLY A 34 -4.669 -9.337 2.510 1.00 10.00 N ATOM 512 CA GLY A 34 -6.091 -9.068 2.673 1.00 10.00 C ATOM 513 C GLY A 34 -6.362 -7.570 2.581 1.00 10.00 C ATOM 514 O GLY A 34 -7.179 -7.039 3.330 1.00 10.00 O ATOM 0 H GLY A 34 -4.400 -9.444 1.532 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.658 -9.594 1.905 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.431 -9.447 3.637 1.00 10.00 H new ATOM 518 N LEU A 35 -5.673 -6.888 1.656 1.00 10.00 N ATOM 519 CA LEU A 35 -5.750 -5.441 1.540 1.00 10.00 C ATOM 520 C LEU A 35 -7.181 -5.028 1.188 1.00 10.00 C ATOM 521 O LEU A 35 -7.813 -4.255 1.908 1.00 10.00 O ATOM 522 CB LEU A 35 -4.737 -4.920 0.493 1.00 10.00 C ATOM 523 CG LEU A 35 -4.849 -3.408 0.192 1.00 10.00 C ATOM 524 CD1 LEU A 35 -4.354 -2.533 1.347 1.00 10.00 C ATOM 525 CD2 LEU A 35 -4.099 -3.020 -1.079 1.00 10.00 C ATOM 0 H LEU A 35 -5.053 -7.328 0.976 1.00 10.00 H new ATOM 0 HA LEU A 35 -5.487 -4.991 2.497 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -3.728 -5.134 0.844 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -4.876 -5.474 -0.435 1.00 10.00 H new ATOM 0 HG LEU A 35 -5.914 -3.225 0.053 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -4.457 -1.482 1.077 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -4.946 -2.739 2.239 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -3.306 -2.755 1.548 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -4.205 -1.949 -1.251 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -3.043 -3.267 -0.968 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -4.512 -3.567 -1.927 1.00 10.00 H new ATOM 537 N PHE A 36 -7.682 -5.539 0.059 1.00 10.00 N ATOM 538 CA PHE A 36 -8.984 -5.173 -0.484 1.00 10.00 C ATOM 539 C PHE A 36 -10.120 -5.808 0.314 1.00 10.00 C ATOM 540 O PHE A 36 -10.834 -6.671 -0.194 1.00 10.00 O ATOM 541 CB PHE A 36 -9.089 -5.561 -1.963 1.00 10.00 C ATOM 542 CG PHE A 36 -8.012 -4.970 -2.841 1.00 10.00 C ATOM 543 CD1 PHE A 36 -8.165 -3.685 -3.395 1.00 10.00 C ATOM 544 CD2 PHE A 36 -6.855 -5.716 -3.113 1.00 10.00 C ATOM 545 CE1 PHE A 36 -7.190 -3.178 -4.271 1.00 10.00 C ATOM 546 CE2 PHE A 36 -5.850 -5.173 -3.921 1.00 10.00 C ATOM 547 CZ PHE A 36 -6.024 -3.918 -4.528 1.00 10.00 C ATOM 0 H PHE A 36 -7.185 -6.227 -0.507 1.00 10.00 H new ATOM 0 HA PHE A 36 -9.079 -4.090 -0.402 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -9.052 -6.647 -2.045 1.00 10.00 H new ATOM 0 HB3 PHE A 36 -10.062 -5.246 -2.340 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -9.031 -3.089 -3.147 1.00 10.00 H new ATOM 0 HD2 PHE A 36 -6.741 -6.707 -2.700 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -7.337 -2.220 -4.747 1.00 10.00 H new ATOM 0 HE2 PHE A 36 -4.934 -5.723 -4.079 1.00 10.00 H new ATOM 0 HZ PHE A 36 -5.266 -3.524 -5.188 1.00 10.00 H new ATOM 557 N GLY A 37 -10.300 -5.373 1.557 1.00 10.00 N ATOM 558 CA GLY A 37 -11.364 -5.853 2.420 1.00 10.00 C ATOM 559 C GLY A 37 -11.022 -5.558 3.871 1.00 10.00 C ATOM 560 O GLY A 37 -11.005 -6.463 4.708 1.00 10.00 O ATOM 0 H GLY A 37 -9.703 -4.671 1.994 1.00 10.00 H new ATOM 0 HA2 GLY A 37 -12.305 -5.372 2.154 1.00 10.00 H new ATOM 0 HA3 GLY A 37 -11.503 -6.925 2.280 1.00 10.00 H new ATOM 564 N ARG A 38 -10.738 -4.282 4.155 1.00 10.00 N ATOM 565 CA ARG A 38 -10.358 -3.783 5.463 1.00 10.00 C ATOM 566 C ARG A 38 -10.269 -2.261 5.398 1.00 10.00 C ATOM 567 O ARG A 38 -10.326 -1.681 4.312 1.00 10.00 O ATOM 568 CB ARG A 38 -9.027 -4.418 5.908 1.00 10.00 C ATOM 569 CG ARG A 38 -9.278 -5.416 7.043 1.00 10.00 C ATOM 570 CD ARG A 38 -8.158 -6.456 7.116 1.00 10.00 C ATOM 571 NE ARG A 38 -8.379 -7.393 8.227 1.00 10.00 N ATOM 572 CZ ARG A 38 -9.329 -8.344 8.260 1.00 10.00 C ATOM 573 NH1 ARG A 38 -10.147 -8.520 7.213 1.00 10.00 N ATOM 574 NH2 ARG A 38 -9.461 -9.106 9.353 1.00 10.00 N ATOM 0 H ARG A 38 -10.770 -3.548 3.447 1.00 10.00 H new ATOM 0 HA ARG A 38 -11.107 -4.056 6.206 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -8.556 -4.924 5.065 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -8.337 -3.642 6.240 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -9.347 -4.884 7.992 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -10.234 -5.916 6.888 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -8.106 -7.006 6.177 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -7.199 -5.954 7.244 1.00 10.00 H new ATOM 0 HE ARG A 38 -7.763 -7.316 9.036 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -10.051 -7.931 6.386 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -10.866 -9.243 7.243 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -8.844 -8.963 10.152 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -10.179 -9.830 9.386 1.00 10.00 H new ATOM 588 N LYS A 39 -10.153 -1.639 6.575 1.00 10.00 N ATOM 589 CA LYS A 39 -9.839 -0.228 6.723 1.00 10.00 C ATOM 590 C LYS A 39 -8.321 -0.065 6.841 1.00 10.00 C ATOM 591 O LYS A 39 -7.583 -1.045 6.899 1.00 10.00 O ATOM 592 CB LYS A 39 -10.546 0.349 7.967 1.00 10.00 C ATOM 593 CG LYS A 39 -11.722 1.277 7.636 1.00 10.00 C ATOM 594 CD LYS A 39 -12.990 0.526 7.205 1.00 10.00 C ATOM 595 CE LYS A 39 -14.209 1.185 7.874 1.00 10.00 C ATOM 596 NZ LYS A 39 -15.481 0.523 7.517 1.00 10.00 N ATOM 0 H LYS A 39 -10.279 -2.119 7.466 1.00 10.00 H new ATOM 0 HA LYS A 39 -10.193 0.320 5.850 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -10.907 -0.475 8.583 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -9.819 0.899 8.565 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -11.950 1.888 8.509 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -11.424 1.959 6.839 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -13.094 0.553 6.120 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -12.923 -0.523 7.493 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -14.082 1.160 8.956 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -14.256 2.234 7.582 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -16.269 1.006 7.994 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -15.619 0.569 6.487 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -15.451 -0.472 7.818 1.00 10.00 H new ATOM 610 N THR A 40 -7.861 1.183 6.919 1.00 10.00 N ATOM 611 CA THR A 40 -6.475 1.521 7.212 1.00 10.00 C ATOM 612 C THR A 40 -6.063 0.957 8.577 1.00 10.00 C ATOM 613 O THR A 40 -5.121 0.179 8.692 1.00 10.00 O ATOM 614 CB THR A 40 -6.333 3.045 7.137 1.00 10.00 C ATOM 615 OG1 THR A 40 -7.085 3.691 8.158 1.00 10.00 O ATOM 616 CG2 THR A 40 -6.817 3.565 5.778 1.00 10.00 C ATOM 0 H THR A 40 -8.455 2.000 6.777 1.00 10.00 H new ATOM 0 HA THR A 40 -5.802 1.071 6.482 1.00 10.00 H new ATOM 0 HB THR A 40 -5.276 3.272 7.272 1.00 10.00 H new ATOM 0 HG1 THR A 40 -6.515 4.336 8.626 1.00 10.00 H new ATOM 0 HG21 THR A 40 -6.708 4.649 5.744 1.00 10.00 H new ATOM 0 HG22 THR A 40 -6.222 3.115 4.983 1.00 10.00 H new ATOM 0 HG23 THR A 40 -7.865 3.301 5.640 1.00 10.00 H new ATOM 624 N GLY A 41 -6.819 1.330 9.614 1.00 10.00 N ATOM 625 CA GLY A 41 -6.625 0.913 10.999 1.00 10.00 C ATOM 626 C GLY A 41 -7.025 -0.539 11.246 1.00 10.00 C ATOM 627 O GLY A 41 -7.803 -0.817 12.155 1.00 10.00 O ATOM 0 H GLY A 41 -7.616 1.957 9.503 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -5.578 1.047 11.270 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -7.208 1.561 11.653 1.00 10.00 H new ATOM 631 N GLN A 42 -6.494 -1.463 10.443 1.00 10.00 N ATOM 632 CA GLN A 42 -6.704 -2.899 10.565 1.00 10.00 C ATOM 633 C GLN A 42 -5.424 -3.644 10.168 1.00 10.00 C ATOM 634 O GLN A 42 -5.422 -4.444 9.234 1.00 10.00 O ATOM 635 CB GLN A 42 -7.889 -3.337 9.689 1.00 10.00 C ATOM 636 CG GLN A 42 -9.262 -2.836 10.165 1.00 10.00 C ATOM 637 CD GLN A 42 -9.732 -3.511 11.453 1.00 10.00 C ATOM 638 OE1 GLN A 42 -9.052 -4.364 12.015 1.00 10.00 O ATOM 639 NE2 GLN A 42 -10.936 -3.178 11.907 1.00 10.00 N ATOM 0 H GLN A 42 -5.884 -1.218 9.663 1.00 10.00 H new ATOM 0 HA GLN A 42 -6.940 -3.143 11.601 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -7.721 -2.983 8.672 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -7.909 -4.426 9.648 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -9.214 -1.759 10.323 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -9.998 -3.011 9.380 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -11.484 -2.466 11.424 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -11.312 -3.634 12.738 1.00 10.00 H new ATOM 648 N ALA A 43 -4.333 -3.386 10.891 1.00 10.00 N ATOM 649 CA ALA A 43 -3.059 -4.057 10.666 1.00 10.00 C ATOM 650 C ALA A 43 -3.039 -5.427 11.357 1.00 10.00 C ATOM 651 O ALA A 43 -3.639 -5.575 12.424 1.00 10.00 O ATOM 652 CB ALA A 43 -1.933 -3.182 11.209 1.00 10.00 C ATOM 0 H ALA A 43 -4.312 -2.704 11.649 1.00 10.00 H new ATOM 0 HA ALA A 43 -2.922 -4.214 9.596 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -0.976 -3.677 11.045 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -1.938 -2.221 10.694 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -2.080 -3.022 12.277 1.00 10.00 H new ATOM 658 N PRO A 44 -2.333 -6.429 10.802 1.00 10.00 N ATOM 659 CA PRO A 44 -2.218 -7.739 11.422 1.00 10.00 C ATOM 660 C PRO A 44 -1.261 -7.662 12.618 1.00 10.00 C ATOM 661 O PRO A 44 -0.108 -8.076 12.532 1.00 10.00 O ATOM 662 CB PRO A 44 -1.707 -8.662 10.309 1.00 10.00 C ATOM 663 CG PRO A 44 -0.861 -7.729 9.442 1.00 10.00 C ATOM 664 CD PRO A 44 -1.605 -6.395 9.538 1.00 10.00 C ATOM 0 HA PRO A 44 -3.160 -8.114 11.822 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -1.116 -9.486 10.709 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -2.528 -9.103 9.743 1.00 10.00 H new ATOM 0 HG2 PRO A 44 0.160 -7.649 9.814 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -0.798 -8.082 8.413 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -0.908 -5.557 9.512 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -2.288 -6.268 8.698 1.00 10.00 H new ATOM 672 N GLY A 45 -1.715 -7.088 13.735 1.00 10.00 N ATOM 673 CA GLY A 45 -0.961 -7.047 14.987 1.00 10.00 C ATOM 674 C GLY A 45 0.173 -6.015 14.990 1.00 10.00 C ATOM 675 O GLY A 45 0.478 -5.454 16.040 1.00 10.00 O ATOM 0 H GLY A 45 -2.627 -6.634 13.794 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -1.645 -6.824 15.806 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -0.542 -8.034 15.181 1.00 10.00 H new ATOM 679 N PHE A 46 0.788 -5.758 13.828 1.00 10.00 N ATOM 680 CA PHE A 46 1.683 -4.627 13.599 1.00 10.00 C ATOM 681 C PHE A 46 1.093 -3.335 14.196 1.00 10.00 C ATOM 682 O PHE A 46 -0.123 -3.208 14.355 1.00 10.00 O ATOM 683 CB PHE A 46 1.962 -4.490 12.091 1.00 10.00 C ATOM 684 CG PHE A 46 2.555 -3.162 11.644 1.00 10.00 C ATOM 685 CD1 PHE A 46 3.919 -2.880 11.849 1.00 10.00 C ATOM 686 CD2 PHE A 46 1.719 -2.164 11.108 1.00 10.00 C ATOM 687 CE1 PHE A 46 4.434 -1.612 11.520 1.00 10.00 C ATOM 688 CE2 PHE A 46 2.230 -0.894 10.792 1.00 10.00 C ATOM 689 CZ PHE A 46 3.588 -0.615 11.001 1.00 10.00 C ATOM 0 H PHE A 46 0.671 -6.348 13.004 1.00 10.00 H new ATOM 0 HA PHE A 46 2.631 -4.805 14.106 1.00 10.00 H new ATOM 0 HB2 PHE A 46 2.642 -5.288 11.793 1.00 10.00 H new ATOM 0 HB3 PHE A 46 1.028 -4.649 11.552 1.00 10.00 H new ATOM 0 HD1 PHE A 46 4.571 -3.637 12.259 1.00 10.00 H new ATOM 0 HD2 PHE A 46 0.674 -2.377 10.938 1.00 10.00 H new ATOM 0 HE1 PHE A 46 5.483 -1.404 11.667 1.00 10.00 H new ATOM 0 HE2 PHE A 46 1.578 -0.134 10.389 1.00 10.00 H new ATOM 0 HZ PHE A 46 3.983 0.362 10.764 1.00 10.00 H new ATOM 699 N THR A 47 1.969 -2.389 14.541 1.00 10.00 N ATOM 700 CA THR A 47 1.637 -1.130 15.184 1.00 10.00 C ATOM 701 C THR A 47 0.737 -0.267 14.282 1.00 10.00 C ATOM 702 O THR A 47 0.395 -0.637 13.161 1.00 10.00 O ATOM 703 CB THR A 47 2.969 -0.444 15.537 1.00 10.00 C ATOM 704 OG1 THR A 47 3.799 -0.454 14.395 1.00 10.00 O ATOM 705 CG2 THR A 47 3.713 -1.192 16.655 1.00 10.00 C ATOM 0 H THR A 47 2.969 -2.490 14.370 1.00 10.00 H new ATOM 0 HA THR A 47 1.058 -1.289 16.094 1.00 10.00 H new ATOM 0 HB THR A 47 2.746 0.569 15.872 1.00 10.00 H new ATOM 0 HG1 THR A 47 3.248 -0.550 13.591 1.00 10.00 H new ATOM 0 HG21 THR A 47 4.648 -0.678 16.877 1.00 10.00 H new ATOM 0 HG22 THR A 47 3.092 -1.218 17.551 1.00 10.00 H new ATOM 0 HG23 THR A 47 3.927 -2.211 16.332 1.00 10.00 H new ATOM 713 N TYR A 48 0.311 0.896 14.780 1.00 10.00 N ATOM 714 CA TYR A 48 -0.638 1.749 14.079 1.00 10.00 C ATOM 715 C TYR A 48 -0.047 3.154 14.009 1.00 10.00 C ATOM 716 O TYR A 48 -0.357 4.007 14.838 1.00 10.00 O ATOM 717 CB TYR A 48 -1.992 1.701 14.809 1.00 10.00 C ATOM 718 CG TYR A 48 -2.388 0.328 15.324 1.00 10.00 C ATOM 719 CD1 TYR A 48 -2.826 -0.667 14.432 1.00 10.00 C ATOM 720 CD2 TYR A 48 -2.202 0.014 16.685 1.00 10.00 C ATOM 721 CE1 TYR A 48 -3.080 -1.969 14.900 1.00 10.00 C ATOM 722 CE2 TYR A 48 -2.437 -1.291 17.146 1.00 10.00 C ATOM 723 CZ TYR A 48 -2.845 -2.290 16.248 1.00 10.00 C ATOM 724 OH TYR A 48 -3.053 -3.558 16.700 1.00 10.00 O ATOM 0 H TYR A 48 0.616 1.268 15.679 1.00 10.00 H new ATOM 0 HA TYR A 48 -0.817 1.409 13.059 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -1.961 2.394 15.650 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -2.768 2.057 14.131 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -2.967 -0.432 13.388 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -1.878 0.779 17.375 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -3.456 -2.722 14.223 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -2.304 -1.526 18.192 1.00 10.00 H new ATOM 0 HH TYR A 48 -2.840 -3.604 17.656 1.00 10.00 H new ATOM 734 N THR A 49 0.843 3.378 13.041 1.00 10.00 N ATOM 735 CA THR A 49 1.418 4.685 12.778 1.00 10.00 C ATOM 736 C THR A 49 0.294 5.703 12.551 1.00 10.00 C ATOM 737 O THR A 49 -0.759 5.355 12.009 1.00 10.00 O ATOM 738 CB THR A 49 2.358 4.558 11.568 1.00 10.00 C ATOM 739 OG1 THR A 49 3.268 3.501 11.817 1.00 10.00 O ATOM 740 CG2 THR A 49 3.146 5.841 11.289 1.00 10.00 C ATOM 0 H THR A 49 1.184 2.647 12.416 1.00 10.00 H new ATOM 0 HA THR A 49 2.001 5.044 13.626 1.00 10.00 H new ATOM 0 HB THR A 49 1.744 4.362 10.689 1.00 10.00 H new ATOM 0 HG1 THR A 49 3.875 3.405 11.053 1.00 10.00 H new ATOM 0 HG21 THR A 49 3.792 5.690 10.424 1.00 10.00 H new ATOM 0 HG22 THR A 49 2.452 6.657 11.086 1.00 10.00 H new ATOM 0 HG23 THR A 49 3.755 6.090 12.158 1.00 10.00 H new ATOM 748 N ASP A 50 0.512 6.952 12.983 1.00 10.00 N ATOM 749 CA ASP A 50 -0.454 8.044 12.899 1.00 10.00 C ATOM 750 C ASP A 50 -0.684 8.444 11.443 1.00 10.00 C ATOM 751 O ASP A 50 -0.230 9.482 10.969 1.00 10.00 O ATOM 752 CB ASP A 50 0.002 9.222 13.769 1.00 10.00 C ATOM 753 CG ASP A 50 -0.355 8.980 15.227 1.00 10.00 C ATOM 754 OD1 ASP A 50 -1.575 8.967 15.511 1.00 10.00 O ATOM 755 OD2 ASP A 50 0.592 8.783 16.017 1.00 10.00 O ATOM 0 H ASP A 50 1.393 7.234 13.413 1.00 10.00 H new ATOM 0 HA ASP A 50 -1.415 7.709 13.290 1.00 10.00 H new ATOM 0 HB2 ASP A 50 1.079 9.358 13.670 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -0.469 10.142 13.421 1.00 10.00 H new ATOM 760 N ALA A 51 -1.399 7.571 10.739 1.00 10.00 N ATOM 761 CA ALA A 51 -1.571 7.569 9.305 1.00 10.00 C ATOM 762 C ALA A 51 -2.503 6.421 8.948 1.00 10.00 C ATOM 763 O ALA A 51 -3.582 6.636 8.406 1.00 10.00 O ATOM 764 CB ALA A 51 -0.217 7.365 8.621 1.00 10.00 C ATOM 0 H ALA A 51 -1.900 6.805 11.189 1.00 10.00 H new ATOM 0 HA ALA A 51 -1.990 8.519 8.972 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -0.352 7.364 7.539 1.00 10.00 H new ATOM 0 HB2 ALA A 51 0.458 8.174 8.902 1.00 10.00 H new ATOM 0 HB3 ALA A 51 0.209 6.412 8.934 1.00 10.00 H new ATOM 770 N ASN A 52 -2.118 5.196 9.309 1.00 10.00 N ATOM 771 CA ASN A 52 -2.864 3.987 8.991 1.00 10.00 C ATOM 772 C ASN A 52 -3.730 3.608 10.187 1.00 10.00 C ATOM 773 O ASN A 52 -3.814 2.451 10.577 1.00 10.00 O ATOM 774 CB ASN A 52 -1.939 2.846 8.545 1.00 10.00 C ATOM 775 CG ASN A 52 -1.110 2.262 9.685 1.00 10.00 C ATOM 776 OD1 ASN A 52 -0.362 2.974 10.347 1.00 10.00 O ATOM 777 ND2 ASN A 52 -1.255 0.969 9.953 1.00 10.00 N ATOM 0 H ASN A 52 -1.265 5.018 9.839 1.00 10.00 H new ATOM 0 HA ASN A 52 -3.517 4.180 8.140 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -2.540 2.054 8.099 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -1.268 3.213 7.768 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -0.738 0.547 10.724 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -1.883 0.398 9.387 1.00 10.00 H new ATOM 784 N LYS A 53 -4.393 4.606 10.770 1.00 10.00 N ATOM 785 CA LYS A 53 -5.267 4.426 11.917 1.00 10.00 C ATOM 786 C LYS A 53 -6.330 5.515 11.916 1.00 10.00 C ATOM 787 O LYS A 53 -7.519 5.222 11.838 1.00 10.00 O ATOM 788 CB LYS A 53 -4.459 4.442 13.224 1.00 10.00 C ATOM 789 CG LYS A 53 -5.235 3.713 14.331 1.00 10.00 C ATOM 790 CD LYS A 53 -4.729 4.106 15.727 1.00 10.00 C ATOM 791 CE LYS A 53 -5.619 5.209 16.325 1.00 10.00 C ATOM 792 NZ LYS A 53 -5.135 5.666 17.644 1.00 10.00 N ATOM 0 H LYS A 53 -4.334 5.573 10.451 1.00 10.00 H new ATOM 0 HA LYS A 53 -5.757 3.455 11.848 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -3.493 3.962 13.070 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -4.260 5.470 13.525 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -6.296 3.948 14.248 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -5.136 2.636 14.197 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -4.730 3.234 16.381 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -3.698 4.455 15.663 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -5.654 6.056 15.640 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -6.639 4.837 16.424 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -5.766 6.409 18.007 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -5.126 4.865 18.307 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -4.172 6.047 17.548 1.00 10.00 H new ATOM 806 N ASN A 54 -5.891 6.776 11.984 1.00 10.00 N ATOM 807 CA ASN A 54 -6.804 7.912 12.036 1.00 10.00 C ATOM 808 C ASN A 54 -7.607 8.031 10.740 1.00 10.00 C ATOM 809 O ASN A 54 -8.691 8.603 10.744 1.00 10.00 O ATOM 810 CB ASN A 54 -6.040 9.212 12.349 1.00 10.00 C ATOM 811 CG ASN A 54 -6.220 9.625 13.809 1.00 10.00 C ATOM 812 OD1 ASN A 54 -7.243 10.195 14.169 1.00 10.00 O ATOM 813 ND2 ASN A 54 -5.247 9.344 14.673 1.00 10.00 N ATOM 0 H ASN A 54 -4.904 7.032 12.004 1.00 10.00 H new ATOM 0 HA ASN A 54 -7.514 7.742 12.845 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -4.980 9.073 12.136 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -6.394 10.010 11.697 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -5.346 9.604 15.654 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -4.403 8.869 14.354 1.00 10.00 H new ATOM 820 N LYS A 55 -7.075 7.508 9.629 1.00 10.00 N ATOM 821 CA LYS A 55 -7.712 7.654 8.325 1.00 10.00 C ATOM 822 C LYS A 55 -9.088 6.977 8.276 1.00 10.00 C ATOM 823 O LYS A 55 -10.094 7.624 7.998 1.00 10.00 O ATOM 824 CB LYS A 55 -6.771 7.085 7.266 1.00 10.00 C ATOM 825 CG LYS A 55 -6.862 7.808 5.923 1.00 10.00 C ATOM 826 CD LYS A 55 -5.778 7.186 5.038 1.00 10.00 C ATOM 827 CE LYS A 55 -5.773 7.796 3.642 1.00 10.00 C ATOM 828 NZ LYS A 55 -4.877 7.051 2.729 1.00 10.00 N ATOM 0 H LYS A 55 -6.203 6.980 9.612 1.00 10.00 H new ATOM 0 HA LYS A 55 -7.893 8.711 8.130 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -5.746 7.142 7.633 1.00 10.00 H new ATOM 0 HB3 LYS A 55 -6.998 6.029 7.118 1.00 10.00 H new ATOM 0 HG2 LYS A 55 -7.849 7.683 5.478 1.00 10.00 H new ATOM 0 HG3 LYS A 55 -6.700 8.879 6.044 1.00 10.00 H new ATOM 0 HD2 LYS A 55 -4.802 7.330 5.502 1.00 10.00 H new ATOM 0 HD3 LYS A 55 -5.940 6.111 4.965 1.00 10.00 H new ATOM 0 HE2 LYS A 55 -6.786 7.796 3.240 1.00 10.00 H new ATOM 0 HE3 LYS A 55 -5.453 8.836 3.699 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 -4.961 7.439 1.768 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 -3.894 7.144 3.055 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 -5.146 6.046 2.722 1.00 10.00 H new ATOM 842 N GLY A 56 -9.129 5.660 8.503 1.00 10.00 N ATOM 843 CA GLY A 56 -10.371 4.908 8.596 1.00 10.00 C ATOM 844 C GLY A 56 -11.128 4.829 7.268 1.00 10.00 C ATOM 845 O GLY A 56 -12.357 4.802 7.253 1.00 10.00 O ATOM 0 H GLY A 56 -8.293 5.089 8.627 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -10.152 3.898 8.943 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -11.013 5.370 9.346 1.00 10.00 H new ATOM 849 N ILE A 57 -10.394 4.723 6.158 1.00 10.00 N ATOM 850 CA ILE A 57 -10.938 4.576 4.811 1.00 10.00 C ATOM 851 C ILE A 57 -10.767 3.133 4.338 1.00 10.00 C ATOM 852 O ILE A 57 -9.904 2.422 4.852 1.00 10.00 O ATOM 853 CB ILE A 57 -10.265 5.565 3.847 1.00 10.00 C ATOM 854 CG1 ILE A 57 -8.764 5.312 3.665 1.00 10.00 C ATOM 855 CG2 ILE A 57 -10.560 7.004 4.285 1.00 10.00 C ATOM 856 CD1 ILE A 57 -8.290 5.733 2.279 1.00 10.00 C ATOM 0 H ILE A 57 -9.374 4.738 6.175 1.00 10.00 H new ATOM 0 HA ILE A 57 -12.003 4.807 4.828 1.00 10.00 H new ATOM 0 HB ILE A 57 -10.698 5.403 2.860 1.00 10.00 H new ATOM 0 HG12 ILE A 57 -8.207 5.862 4.424 1.00 10.00 H new ATOM 0 HG13 ILE A 57 -8.551 4.254 3.817 1.00 10.00 H new ATOM 0 HG21 ILE A 57 -10.080 7.700 3.597 1.00 10.00 H new ATOM 0 HG22 ILE A 57 -11.637 7.173 4.279 1.00 10.00 H new ATOM 0 HG23 ILE A 57 -10.174 7.164 5.292 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -7.221 5.539 2.186 1.00 10.00 H new ATOM 0 HD12 ILE A 57 -8.830 5.164 1.522 1.00 10.00 H new ATOM 0 HD13 ILE A 57 -8.480 6.797 2.137 1.00 10.00 H new ATOM 868 N THR A 58 -11.586 2.712 3.371 1.00 10.00 N ATOM 869 CA THR A 58 -11.549 1.369 2.803 1.00 10.00 C ATOM 870 C THR A 58 -10.577 1.317 1.618 1.00 10.00 C ATOM 871 O THR A 58 -10.292 2.335 0.985 1.00 10.00 O ATOM 872 CB THR A 58 -12.975 0.938 2.417 1.00 10.00 C ATOM 873 OG1 THR A 58 -13.809 1.079 3.553 1.00 10.00 O ATOM 874 CG2 THR A 58 -13.048 -0.523 1.953 1.00 10.00 C ATOM 0 H THR A 58 -12.304 3.307 2.957 1.00 10.00 H new ATOM 0 HA THR A 58 -11.178 0.661 3.543 1.00 10.00 H new ATOM 0 HB THR A 58 -13.295 1.570 1.589 1.00 10.00 H new ATOM 0 HG1 THR A 58 -14.723 0.810 3.323 1.00 10.00 H new ATOM 0 HG21 THR A 58 -14.077 -0.771 1.694 1.00 10.00 H new ATOM 0 HG22 THR A 58 -12.411 -0.660 1.079 1.00 10.00 H new ATOM 0 HG23 THR A 58 -12.708 -1.177 2.756 1.00 10.00 H new ATOM 882 N TRP A 59 -10.072 0.123 1.310 1.00 10.00 N ATOM 883 CA TRP A 59 -9.185 -0.120 0.185 1.00 10.00 C ATOM 884 C TRP A 59 -9.951 -0.804 -0.945 1.00 10.00 C ATOM 885 O TRP A 59 -10.158 -2.012 -0.913 1.00 10.00 O ATOM 886 CB TRP A 59 -7.994 -0.930 0.683 1.00 10.00 C ATOM 887 CG TRP A 59 -7.250 -0.247 1.787 1.00 10.00 C ATOM 888 CD1 TRP A 59 -7.308 -0.601 3.089 1.00 10.00 C ATOM 889 CD2 TRP A 59 -6.431 0.966 1.732 1.00 10.00 C ATOM 890 NE1 TRP A 59 -6.510 0.246 3.828 1.00 10.00 N ATOM 891 CE2 TRP A 59 -5.966 1.249 3.048 1.00 10.00 C ATOM 892 CE3 TRP A 59 -6.051 1.873 0.716 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -5.148 2.356 3.322 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -5.218 2.976 0.984 1.00 10.00 C ATOM 895 CH2 TRP A 59 -4.753 3.210 2.285 1.00 10.00 C ATOM 0 H TRP A 59 -10.276 -0.717 1.851 1.00 10.00 H new ATOM 0 HA TRP A 59 -8.805 0.814 -0.230 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -8.342 -1.902 1.032 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -7.313 -1.115 -0.148 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -7.889 -1.419 3.489 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -6.341 0.145 4.829 1.00 10.00 H new ATOM 0 HE3 TRP A 59 -6.409 1.716 -0.291 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -4.823 2.549 4.334 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 -4.936 3.644 0.184 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -4.095 4.043 2.486 1.00 10.00 H new ATOM 906 N LYS A 60 -10.385 -0.030 -1.943 1.00 10.00 N ATOM 907 CA LYS A 60 -11.083 -0.520 -3.117 1.00 10.00 C ATOM 908 C LYS A 60 -10.409 0.096 -4.352 1.00 10.00 C ATOM 909 O LYS A 60 -11.065 0.656 -5.214 1.00 10.00 O ATOM 910 CB LYS A 60 -12.585 -0.209 -2.940 1.00 10.00 C ATOM 911 CG LYS A 60 -13.375 -0.265 -4.248 1.00 10.00 C ATOM 912 CD LYS A 60 -14.861 -0.593 -4.115 1.00 10.00 C ATOM 913 CE LYS A 60 -15.550 -0.026 -5.369 1.00 10.00 C ATOM 914 NZ LYS A 60 -16.911 -0.558 -5.566 1.00 10.00 N ATOM 0 H LYS A 60 -10.253 0.981 -1.949 1.00 10.00 H new ATOM 0 HA LYS A 60 -11.022 -1.600 -3.254 1.00 10.00 H new ATOM 0 HB2 LYS A 60 -13.015 -0.919 -2.234 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -12.694 0.783 -2.501 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -13.279 0.698 -4.750 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -12.915 -1.010 -4.897 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -15.015 -1.670 -4.041 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -15.276 -0.149 -3.210 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -15.598 1.060 -5.291 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -14.945 -0.257 -6.246 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -17.326 -0.142 -6.424 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -16.868 -1.592 -5.669 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -17.501 -0.316 -4.744 1.00 10.00 H new ATOM 928 N GLU A 61 -9.080 0.003 -4.421 1.00 10.00 N ATOM 929 CA GLU A 61 -8.247 0.443 -5.538 1.00 10.00 C ATOM 930 C GLU A 61 -8.252 1.964 -5.761 1.00 10.00 C ATOM 931 O GLU A 61 -7.183 2.552 -5.752 1.00 10.00 O ATOM 932 CB GLU A 61 -8.455 -0.427 -6.795 1.00 10.00 C ATOM 933 CG GLU A 61 -9.418 0.066 -7.886 1.00 10.00 C ATOM 934 CD GLU A 61 -9.731 -1.035 -8.900 1.00 10.00 C ATOM 935 OE1 GLU A 61 -10.021 -2.171 -8.458 1.00 10.00 O ATOM 936 OE2 GLU A 61 -9.669 -0.729 -10.108 1.00 10.00 O ATOM 0 H GLU A 61 -8.530 -0.401 -3.662 1.00 10.00 H new ATOM 0 HA GLU A 61 -7.211 0.261 -5.252 1.00 10.00 H new ATOM 0 HB2 GLU A 61 -7.480 -0.576 -7.258 1.00 10.00 H new ATOM 0 HB3 GLU A 61 -8.804 -1.406 -6.465 1.00 10.00 H new ATOM 0 HG2 GLU A 61 -10.344 0.412 -7.426 1.00 10.00 H new ATOM 0 HG3 GLU A 61 -8.979 0.921 -8.400 1.00 10.00 H new ATOM 943 N GLU A 62 -9.407 2.617 -5.894 1.00 10.00 N ATOM 944 CA GLU A 62 -9.584 4.066 -5.940 1.00 10.00 C ATOM 945 C GLU A 62 -8.783 4.804 -4.861 1.00 10.00 C ATOM 946 O GLU A 62 -8.189 5.846 -5.129 1.00 10.00 O ATOM 947 CB GLU A 62 -11.079 4.374 -5.781 1.00 10.00 C ATOM 948 CG GLU A 62 -11.841 4.188 -7.099 1.00 10.00 C ATOM 949 CD GLU A 62 -13.344 4.088 -6.862 1.00 10.00 C ATOM 950 OE1 GLU A 62 -13.829 4.832 -5.982 1.00 10.00 O ATOM 951 OE2 GLU A 62 -13.980 3.250 -7.535 1.00 10.00 O ATOM 0 H GLU A 62 -10.293 2.119 -5.977 1.00 10.00 H new ATOM 0 HA GLU A 62 -9.206 4.420 -6.899 1.00 10.00 H new ATOM 0 HB2 GLU A 62 -11.506 3.722 -5.019 1.00 10.00 H new ATOM 0 HB3 GLU A 62 -11.204 5.398 -5.430 1.00 10.00 H new ATOM 0 HG2 GLU A 62 -11.631 5.026 -7.764 1.00 10.00 H new ATOM 0 HG3 GLU A 62 -11.489 3.286 -7.601 1.00 10.00 H new ATOM 958 N THR A 63 -8.785 4.302 -3.626 1.00 10.00 N ATOM 959 CA THR A 63 -8.085 4.973 -2.546 1.00 10.00 C ATOM 960 C THR A 63 -6.574 4.790 -2.707 1.00 10.00 C ATOM 961 O THR A 63 -5.821 5.765 -2.808 1.00 10.00 O ATOM 962 CB THR A 63 -8.603 4.456 -1.202 1.00 10.00 C ATOM 963 OG1 THR A 63 -8.581 3.045 -1.158 1.00 10.00 O ATOM 964 CG2 THR A 63 -10.055 4.877 -0.958 1.00 10.00 C ATOM 0 H THR A 63 -9.261 3.441 -3.356 1.00 10.00 H new ATOM 0 HA THR A 63 -8.279 6.045 -2.580 1.00 10.00 H new ATOM 0 HB THR A 63 -7.947 4.883 -0.443 1.00 10.00 H new ATOM 0 HG1 THR A 63 -9.182 2.730 -0.451 1.00 10.00 H new ATOM 0 HG21 THR A 63 -10.388 4.492 0.006 1.00 10.00 H new ATOM 0 HG22 THR A 63 -10.123 5.965 -0.957 1.00 10.00 H new ATOM 0 HG23 THR A 63 -10.688 4.474 -1.748 1.00 10.00 H new ATOM 972 N LEU A 64 -6.121 3.530 -2.739 1.00 10.00 N ATOM 973 CA LEU A 64 -4.713 3.238 -2.941 1.00 10.00 C ATOM 974 C LEU A 64 -4.171 3.954 -4.184 1.00 10.00 C ATOM 975 O LEU A 64 -3.111 4.552 -4.105 1.00 10.00 O ATOM 976 CB LEU A 64 -4.340 1.744 -2.854 1.00 10.00 C ATOM 977 CG LEU A 64 -5.237 0.667 -3.443 1.00 10.00 C ATOM 978 CD1 LEU A 64 -4.376 -0.491 -3.955 1.00 10.00 C ATOM 979 CD2 LEU A 64 -6.266 0.133 -2.440 1.00 10.00 C ATOM 0 H LEU A 64 -6.713 2.707 -2.627 1.00 10.00 H new ATOM 0 HA LEU A 64 -4.190 3.658 -2.082 1.00 10.00 H new ATOM 0 HB2 LEU A 64 -3.362 1.634 -3.323 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -4.215 1.509 -1.797 1.00 10.00 H new ATOM 0 HG LEU A 64 -5.793 1.125 -4.261 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -5.019 -1.263 -4.377 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -3.695 -0.126 -4.723 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -3.801 -0.909 -3.129 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -6.877 -0.633 -2.918 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -5.749 -0.298 -1.583 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -6.905 0.950 -2.105 1.00 10.00 H new ATOM 991 N MET A 65 -4.904 3.969 -5.297 1.00 10.00 N ATOM 992 CA MET A 65 -4.582 4.698 -6.519 1.00 10.00 C ATOM 993 C MET A 65 -3.946 6.062 -6.252 1.00 10.00 C ATOM 994 O MET A 65 -2.922 6.364 -6.860 1.00 10.00 O ATOM 995 CB MET A 65 -5.837 4.858 -7.394 1.00 10.00 C ATOM 996 CG MET A 65 -5.971 3.760 -8.455 1.00 10.00 C ATOM 997 SD MET A 65 -5.224 4.214 -10.044 1.00 10.00 S ATOM 998 CE MET A 65 -5.452 2.693 -10.990 1.00 10.00 C ATOM 0 H MET A 65 -5.778 3.449 -5.373 1.00 10.00 H new ATOM 0 HA MET A 65 -3.839 4.103 -7.050 1.00 10.00 H new ATOM 0 HB2 MET A 65 -6.721 4.850 -6.757 1.00 10.00 H new ATOM 0 HB3 MET A 65 -5.808 5.830 -7.886 1.00 10.00 H new ATOM 0 HG2 MET A 65 -5.502 2.848 -8.087 1.00 10.00 H new ATOM 0 HG3 MET A 65 -7.027 3.536 -8.607 1.00 10.00 H new ATOM 0 HE1 MET A 65 -5.040 2.822 -11.991 1.00 10.00 H new ATOM 0 HE2 MET A 65 -4.938 1.873 -10.489 1.00 10.00 H new ATOM 0 HE3 MET A 65 -6.515 2.465 -11.062 1.00 10.00 H new ATOM 1008 N GLU A 66 -4.508 6.896 -5.374 1.00 10.00 N ATOM 1009 CA GLU A 66 -3.845 8.160 -5.083 1.00 10.00 C ATOM 1010 C GLU A 66 -2.694 7.885 -4.124 1.00 10.00 C ATOM 1011 O GLU A 66 -1.570 8.281 -4.401 1.00 10.00 O ATOM 1012 CB GLU A 66 -4.829 9.221 -4.577 1.00 10.00 C ATOM 1013 CG GLU A 66 -5.680 9.794 -5.724 1.00 10.00 C ATOM 1014 CD GLU A 66 -4.918 10.809 -6.574 1.00 10.00 C ATOM 1015 OE1 GLU A 66 -4.162 10.373 -7.470 1.00 10.00 O ATOM 1016 OE2 GLU A 66 -5.101 12.020 -6.303 1.00 10.00 O ATOM 0 H GLU A 66 -5.381 6.728 -4.874 1.00 10.00 H new ATOM 0 HA GLU A 66 -3.434 8.588 -5.997 1.00 10.00 H new ATOM 0 HB2 GLU A 66 -5.482 8.783 -3.822 1.00 10.00 H new ATOM 0 HB3 GLU A 66 -4.279 10.028 -4.093 1.00 10.00 H new ATOM 0 HG2 GLU A 66 -6.022 8.978 -6.360 1.00 10.00 H new ATOM 0 HG3 GLU A 66 -6.569 10.269 -5.309 1.00 10.00 H new ATOM 1023 N TYR A 67 -2.943 7.172 -3.024 1.00 10.00 N ATOM 1024 CA TYR A 67 -1.933 6.923 -1.998 1.00 10.00 C ATOM 1025 C TYR A 67 -0.585 6.442 -2.572 1.00 10.00 C ATOM 1026 O TYR A 67 0.470 6.895 -2.137 1.00 10.00 O ATOM 1027 CB TYR A 67 -2.504 5.956 -0.945 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.818 5.977 0.416 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -1.574 7.205 1.057 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -1.476 4.777 1.076 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -0.887 7.241 2.279 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -0.826 4.817 2.328 1.00 10.00 C ATOM 1033 CZ TYR A 67 -0.483 6.054 2.904 1.00 10.00 C ATOM 1034 OH TYR A 67 0.214 6.150 4.071 1.00 10.00 O ATOM 0 H TYR A 67 -3.850 6.752 -2.821 1.00 10.00 H new ATOM 0 HA TYR A 67 -1.701 7.873 -1.516 1.00 10.00 H new ATOM 0 HB2 TYR A 67 -3.560 6.186 -0.802 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -2.450 4.943 -1.343 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.917 8.124 0.606 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -1.712 3.826 0.622 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -0.668 8.192 2.742 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -0.592 3.898 2.844 1.00 10.00 H new ATOM 0 HH TYR A 67 0.431 5.252 4.398 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.612 5.551 -3.565 1.00 10.00 N ATOM 1045 CA LEU A 68 0.565 4.980 -4.207 1.00 10.00 C ATOM 1046 C LEU A 68 1.360 6.020 -4.995 1.00 10.00 C ATOM 1047 O LEU A 68 2.587 5.940 -5.032 1.00 10.00 O ATOM 1048 CB LEU A 68 0.162 3.840 -5.155 1.00 10.00 C ATOM 1049 CG LEU A 68 -0.509 2.633 -4.485 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -0.618 1.486 -5.493 1.00 10.00 C ATOM 1051 CD2 LEU A 68 0.213 2.171 -3.222 1.00 10.00 C ATOM 0 H LEU A 68 -1.486 5.198 -3.955 1.00 10.00 H new ATOM 0 HA LEU A 68 1.200 4.598 -3.407 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -0.517 4.240 -5.909 1.00 10.00 H new ATOM 0 HB3 LEU A 68 1.053 3.494 -5.680 1.00 10.00 H new ATOM 0 HG LEU A 68 -1.503 2.948 -4.168 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -1.094 0.628 -5.018 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -1.216 1.807 -6.346 1.00 10.00 H new ATOM 0 HD13 LEU A 68 0.379 1.205 -5.834 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -0.311 1.315 -2.796 1.00 10.00 H new ATOM 0 HD22 LEU A 68 1.235 1.884 -3.471 1.00 10.00 H new ATOM 0 HD23 LEU A 68 0.231 2.983 -2.496 1.00 10.00 H new ATOM 1063 N GLU A 69 0.674 6.955 -5.661 1.00 10.00 N ATOM 1064 CA GLU A 69 1.300 7.973 -6.494 1.00 10.00 C ATOM 1065 C GLU A 69 1.129 9.363 -5.892 1.00 10.00 C ATOM 1066 O GLU A 69 1.250 10.381 -6.567 1.00 10.00 O ATOM 1067 CB GLU A 69 0.749 7.832 -7.914 1.00 10.00 C ATOM 1068 CG GLU A 69 1.771 8.102 -9.023 1.00 10.00 C ATOM 1069 CD GLU A 69 1.767 9.548 -9.503 1.00 10.00 C ATOM 1070 OE1 GLU A 69 0.700 9.943 -10.031 1.00 10.00 O ATOM 1071 OE2 GLU A 69 2.824 10.199 -9.379 1.00 10.00 O ATOM 0 H GLU A 69 -0.343 7.022 -5.633 1.00 10.00 H new ATOM 0 HA GLU A 69 2.379 7.828 -6.540 1.00 10.00 H new ATOM 0 HB2 GLU A 69 0.355 6.823 -8.039 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -0.089 8.519 -8.035 1.00 10.00 H new ATOM 0 HG2 GLU A 69 2.767 7.849 -8.660 1.00 10.00 H new ATOM 0 HG3 GLU A 69 1.563 7.445 -9.868 1.00 10.00 H new ATOM 1078 N ASN A 70 0.824 9.403 -4.597 1.00 10.00 N ATOM 1079 CA ASN A 70 0.507 10.612 -3.878 1.00 10.00 C ATOM 1080 C ASN A 70 0.325 10.267 -2.402 1.00 10.00 C ATOM 1081 O ASN A 70 -0.761 10.457 -1.849 1.00 10.00 O ATOM 1082 CB ASN A 70 -0.755 11.267 -4.466 1.00 10.00 C ATOM 1083 CG ASN A 70 -0.657 12.775 -4.317 1.00 10.00 C ATOM 1084 OD1 ASN A 70 -0.337 13.281 -3.239 1.00 10.00 O ATOM 1085 ND2 ASN A 70 -0.896 13.498 -5.408 1.00 10.00 N ATOM 0 H ASN A 70 0.793 8.568 -4.013 1.00 10.00 H new ATOM 0 HA ASN A 70 1.319 11.333 -3.975 1.00 10.00 H new ATOM 0 HB2 ASN A 70 -0.860 11.001 -5.518 1.00 10.00 H new ATOM 0 HB3 ASN A 70 -1.643 10.897 -3.953 1.00 10.00 H new ATOM 0 HD21 ASN A 70 -0.817 14.514 -5.374 1.00 10.00 H new ATOM 0 HD22 ASN A 70 -1.158 13.036 -6.279 1.00 10.00 H new ATOM 1092 N PRO A 71 1.376 9.787 -1.714 1.00 10.00 N ATOM 1093 CA PRO A 71 1.285 9.444 -0.303 1.00 10.00 C ATOM 1094 C PRO A 71 1.344 10.711 0.552 1.00 10.00 C ATOM 1095 O PRO A 71 2.116 10.790 1.505 1.00 10.00 O ATOM 1096 CB PRO A 71 2.468 8.499 -0.060 1.00 10.00 C ATOM 1097 CG PRO A 71 3.525 9.013 -1.039 1.00 10.00 C ATOM 1098 CD PRO A 71 2.689 9.446 -2.245 1.00 10.00 C ATOM 0 HA PRO A 71 0.346 8.962 -0.031 1.00 10.00 H new ATOM 0 HB2 PRO A 71 2.817 8.546 0.972 1.00 10.00 H new ATOM 0 HB3 PRO A 71 2.203 7.461 -0.260 1.00 10.00 H new ATOM 0 HG2 PRO A 71 4.093 9.844 -0.621 1.00 10.00 H new ATOM 0 HG3 PRO A 71 4.243 8.237 -1.303 1.00 10.00 H new ATOM 0 HD2 PRO A 71 3.141 10.300 -2.748 1.00 10.00 H new ATOM 0 HD3 PRO A 71 2.618 8.644 -2.980 1.00 10.00 H new ATOM 1106 N LYS A 72 0.556 11.722 0.172 1.00 10.00 N ATOM 1107 CA LYS A 72 0.456 12.994 0.844 1.00 10.00 C ATOM 1108 C LYS A 72 -0.963 13.541 0.707 1.00 10.00 C ATOM 1109 O LYS A 72 -1.563 13.833 1.734 1.00 10.00 O ATOM 1110 CB LYS A 72 1.488 14.017 0.335 1.00 10.00 C ATOM 1111 CG LYS A 72 2.919 13.732 0.813 1.00 10.00 C ATOM 1112 CD LYS A 72 3.726 12.814 -0.121 1.00 10.00 C ATOM 1113 CE LYS A 72 4.650 13.549 -1.104 1.00 10.00 C ATOM 1114 NZ LYS A 72 3.966 13.902 -2.364 1.00 10.00 N ATOM 0 H LYS A 72 -0.049 11.660 -0.647 1.00 10.00 H new ATOM 0 HA LYS A 72 0.681 12.827 1.897 1.00 10.00 H new ATOM 0 HB2 LYS A 72 1.472 14.026 -0.755 1.00 10.00 H new ATOM 0 HB3 LYS A 72 1.194 15.013 0.666 1.00 10.00 H new ATOM 0 HG2 LYS A 72 3.449 14.678 0.921 1.00 10.00 H new ATOM 0 HG3 LYS A 72 2.875 13.277 1.802 1.00 10.00 H new ATOM 0 HD2 LYS A 72 4.328 12.139 0.487 1.00 10.00 H new ATOM 0 HD3 LYS A 72 3.031 12.196 -0.690 1.00 10.00 H new ATOM 0 HE2 LYS A 72 5.029 14.456 -0.633 1.00 10.00 H new ATOM 0 HE3 LYS A 72 5.513 12.921 -1.326 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 4.631 14.396 -2.993 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 3.627 13.036 -2.829 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 3.158 14.523 -2.158 1.00 10.00 H new ATOM 1128 N LYS A 73 -1.518 13.651 -0.516 1.00 10.00 N ATOM 1129 CA LYS A 73 -2.892 14.137 -0.716 1.00 10.00 C ATOM 1130 C LYS A 73 -3.854 13.542 0.313 1.00 10.00 C ATOM 1131 O LYS A 73 -4.697 14.239 0.870 1.00 10.00 O ATOM 1132 CB LYS A 73 -3.413 13.804 -2.129 1.00 10.00 C ATOM 1133 CG LYS A 73 -3.161 14.945 -3.123 1.00 10.00 C ATOM 1134 CD LYS A 73 -3.748 14.649 -4.514 1.00 10.00 C ATOM 1135 CE LYS A 73 -5.280 14.767 -4.563 1.00 10.00 C ATOM 1136 NZ LYS A 73 -5.796 14.527 -5.927 1.00 10.00 N ATOM 0 H LYS A 73 -1.033 13.409 -1.380 1.00 10.00 H new ATOM 0 HA LYS A 73 -2.854 15.219 -0.592 1.00 10.00 H new ATOM 0 HB2 LYS A 73 -2.928 12.897 -2.489 1.00 10.00 H new ATOM 0 HB3 LYS A 73 -4.482 13.596 -2.081 1.00 10.00 H new ATOM 0 HG2 LYS A 73 -3.598 15.865 -2.735 1.00 10.00 H new ATOM 0 HG3 LYS A 73 -2.088 15.115 -3.213 1.00 10.00 H new ATOM 0 HD2 LYS A 73 -3.314 15.338 -5.238 1.00 10.00 H new ATOM 0 HD3 LYS A 73 -3.458 13.643 -4.817 1.00 10.00 H new ATOM 0 HE2 LYS A 73 -5.724 14.049 -3.873 1.00 10.00 H new ATOM 0 HE3 LYS A 73 -5.581 15.760 -4.228 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 -6.750 14.932 -6.014 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 -5.165 14.976 -6.621 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 -5.837 13.504 -6.107 1.00 10.00 H new ATOM 1150 N TYR A 74 -3.720 12.237 0.544 1.00 10.00 N ATOM 1151 CA TYR A 74 -4.589 11.506 1.441 1.00 10.00 C ATOM 1152 C TYR A 74 -4.323 11.805 2.924 1.00 10.00 C ATOM 1153 O TYR A 74 -5.275 11.884 3.693 1.00 10.00 O ATOM 1154 CB TYR A 74 -4.483 10.008 1.123 1.00 10.00 C ATOM 1155 CG TYR A 74 -5.750 9.424 0.529 1.00 10.00 C ATOM 1156 CD1 TYR A 74 -6.979 9.584 1.199 1.00 10.00 C ATOM 1157 CD2 TYR A 74 -5.723 8.821 -0.742 1.00 10.00 C ATOM 1158 CE1 TYR A 74 -8.174 9.163 0.596 1.00 10.00 C ATOM 1159 CE2 TYR A 74 -6.923 8.410 -1.345 1.00 10.00 C ATOM 1160 CZ TYR A 74 -8.149 8.607 -0.693 1.00 10.00 C ATOM 1161 OH TYR A 74 -9.307 8.264 -1.319 1.00 10.00 O ATOM 0 H TYR A 74 -2.999 11.662 0.108 1.00 10.00 H new ATOM 0 HA TYR A 74 -5.612 11.841 1.273 1.00 10.00 H new ATOM 0 HB2 TYR A 74 -3.659 9.850 0.427 1.00 10.00 H new ATOM 0 HB3 TYR A 74 -4.237 9.467 2.037 1.00 10.00 H new ATOM 0 HD1 TYR A 74 -7.001 10.033 2.181 1.00 10.00 H new ATOM 0 HD2 TYR A 74 -4.782 8.675 -1.252 1.00 10.00 H new ATOM 0 HE1 TYR A 74 -9.111 9.266 1.122 1.00 10.00 H new ATOM 0 HE2 TYR A 74 -6.902 7.939 -2.317 1.00 10.00 H new ATOM 0 HH TYR A 74 -9.134 8.124 -2.273 1.00 10.00 H new ATOM 1171 N ILE A 75 -3.053 11.903 3.333 1.00 10.00 N ATOM 1172 CA ILE A 75 -2.612 12.114 4.717 1.00 10.00 C ATOM 1173 C ILE A 75 -1.225 12.781 4.668 1.00 10.00 C ATOM 1174 O ILE A 75 -0.212 12.079 4.645 1.00 10.00 O ATOM 1175 CB ILE A 75 -2.594 10.794 5.539 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -2.189 9.585 4.670 1.00 10.00 C ATOM 1177 CG2 ILE A 75 -3.931 10.533 6.256 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -2.010 8.276 5.450 1.00 10.00 C ATOM 0 H ILE A 75 -2.271 11.835 2.681 1.00 10.00 H new ATOM 0 HA ILE A 75 -3.320 12.762 5.234 1.00 10.00 H new ATOM 0 HB ILE A 75 -1.834 10.922 6.310 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -2.947 9.435 3.901 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.256 9.818 4.156 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -3.867 9.600 6.816 1.00 10.00 H new ATOM 0 HG22 ILE A 75 -4.143 11.354 6.941 1.00 10.00 H new ATOM 0 HG23 ILE A 75 -4.731 10.460 5.519 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -1.726 7.479 4.763 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -1.230 8.403 6.201 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -2.947 8.014 5.942 1.00 10.00 H new ATOM 1190 N PRO A 76 -1.145 14.123 4.629 1.00 10.00 N ATOM 1191 CA PRO A 76 0.104 14.840 4.393 1.00 10.00 C ATOM 1192 C PRO A 76 0.955 14.939 5.668 1.00 10.00 C ATOM 1193 O PRO A 76 1.323 16.024 6.109 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.316 16.195 3.811 1.00 10.00 C ATOM 1195 CG PRO A 76 -1.691 16.440 4.431 1.00 10.00 C ATOM 1196 CD PRO A 76 -2.278 15.036 4.589 1.00 10.00 C ATOM 0 HA PRO A 76 0.760 14.319 3.695 1.00 10.00 H new ATOM 0 HB2 PRO A 76 0.390 16.982 4.077 1.00 10.00 H new ATOM 0 HB3 PRO A 76 -0.366 16.166 2.723 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -1.611 16.950 5.391 1.00 10.00 H new ATOM 0 HG3 PRO A 76 -2.313 17.064 3.789 1.00 10.00 H new ATOM 0 HD2 PRO A 76 -2.870 14.962 5.501 1.00 10.00 H new ATOM 0 HD3 PRO A 76 -2.942 14.796 3.758 1.00 10.00 H new ATOM 1204 N GLY A 77 1.305 13.781 6.230 1.00 10.00 N ATOM 1205 CA GLY A 77 2.247 13.626 7.333 1.00 10.00 C ATOM 1206 C GLY A 77 2.329 12.158 7.748 1.00 10.00 C ATOM 1207 O GLY A 77 2.400 11.855 8.934 1.00 10.00 O ATOM 0 H GLY A 77 0.922 12.890 5.914 1.00 10.00 H new ATOM 0 HA2 GLY A 77 3.232 13.983 7.034 1.00 10.00 H new ATOM 0 HA3 GLY A 77 1.931 14.235 8.180 1.00 10.00 H new ATOM 1211 N THR A 78 2.309 11.245 6.769 1.00 10.00 N ATOM 1212 CA THR A 78 2.360 9.810 7.018 1.00 10.00 C ATOM 1213 C THR A 78 3.811 9.371 7.196 1.00 10.00 C ATOM 1214 O THR A 78 4.165 8.665 8.136 1.00 10.00 O ATOM 1215 CB THR A 78 1.616 9.053 5.895 1.00 10.00 C ATOM 1216 OG1 THR A 78 1.669 7.661 6.120 1.00 10.00 O ATOM 1217 CG2 THR A 78 2.111 9.318 4.467 1.00 10.00 C ATOM 0 H THR A 78 2.257 11.488 5.780 1.00 10.00 H new ATOM 0 HA THR A 78 1.844 9.564 7.946 1.00 10.00 H new ATOM 0 HB THR A 78 0.600 9.444 5.949 1.00 10.00 H new ATOM 0 HG1 THR A 78 1.184 7.196 5.407 1.00 10.00 H new ATOM 0 HG21 THR A 78 1.518 8.735 3.762 1.00 10.00 H new ATOM 0 HG22 THR A 78 2.009 10.379 4.237 1.00 10.00 H new ATOM 0 HG23 THR A 78 3.159 9.029 4.386 1.00 10.00 H new ATOM 1225 N LYS A 79 4.654 9.826 6.270 1.00 10.00 N ATOM 1226 CA LYS A 79 6.021 9.384 6.105 1.00 10.00 C ATOM 1227 C LYS A 79 6.639 10.260 5.018 1.00 10.00 C ATOM 1228 O LYS A 79 7.672 10.878 5.248 1.00 10.00 O ATOM 1229 CB LYS A 79 6.016 7.884 5.757 1.00 10.00 C ATOM 1230 CG LYS A 79 7.282 7.443 5.021 1.00 10.00 C ATOM 1231 CD LYS A 79 7.407 5.915 4.995 1.00 10.00 C ATOM 1232 CE LYS A 79 7.716 5.372 6.402 1.00 10.00 C ATOM 1233 NZ LYS A 79 8.920 4.519 6.418 1.00 10.00 N ATOM 0 H LYS A 79 4.385 10.540 5.593 1.00 10.00 H new ATOM 0 HA LYS A 79 6.619 9.488 7.011 1.00 10.00 H new ATOM 0 HB2 LYS A 79 5.913 7.303 6.674 1.00 10.00 H new ATOM 0 HB3 LYS A 79 5.146 7.662 5.139 1.00 10.00 H new ATOM 0 HG2 LYS A 79 7.264 7.826 4.001 1.00 10.00 H new ATOM 0 HG3 LYS A 79 8.157 7.873 5.508 1.00 10.00 H new ATOM 0 HD2 LYS A 79 6.481 5.475 4.625 1.00 10.00 H new ATOM 0 HD3 LYS A 79 8.197 5.621 4.304 1.00 10.00 H new ATOM 0 HE2 LYS A 79 7.855 6.207 7.089 1.00 10.00 H new ATOM 0 HE3 LYS A 79 6.862 4.799 6.764 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 9.051 4.121 7.370 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 8.807 3.745 5.732 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 9.752 5.088 6.163 1.00 10.00 H new ATOM 1247 N MET A 80 5.967 10.305 3.858 1.00 10.00 N ATOM 1248 CA MET A 80 6.406 10.948 2.626 1.00 10.00 C ATOM 1249 C MET A 80 7.576 10.169 2.027 1.00 10.00 C ATOM 1250 O MET A 80 8.546 9.874 2.719 1.00 10.00 O ATOM 1251 CB MET A 80 6.739 12.440 2.823 1.00 10.00 C ATOM 1252 CG MET A 80 7.006 13.152 1.485 1.00 10.00 C ATOM 1253 SD MET A 80 8.543 14.105 1.358 1.00 10.00 S ATOM 1254 CE MET A 80 8.047 15.633 2.183 1.00 10.00 C ATOM 0 H MET A 80 5.052 9.867 3.756 1.00 10.00 H new ATOM 0 HA MET A 80 5.577 10.927 1.918 1.00 10.00 H new ATOM 0 HB2 MET A 80 5.913 12.931 3.337 1.00 10.00 H new ATOM 0 HB3 MET A 80 7.615 12.534 3.465 1.00 10.00 H new ATOM 0 HG2 MET A 80 7.006 12.401 0.695 1.00 10.00 H new ATOM 0 HG3 MET A 80 6.172 13.825 1.286 1.00 10.00 H new ATOM 0 HE1 MET A 80 8.884 16.331 2.190 1.00 10.00 H new ATOM 0 HE2 MET A 80 7.208 16.079 1.649 1.00 10.00 H new ATOM 0 HE3 MET A 80 7.749 15.413 3.208 1.00 10.00 H new ATOM 1264 N ILE A 81 7.489 9.832 0.736 1.00 10.00 N ATOM 1265 CA ILE A 81 8.619 9.281 0.012 1.00 10.00 C ATOM 1266 C ILE A 81 8.647 9.785 -1.433 1.00 10.00 C ATOM 1267 O ILE A 81 8.006 10.795 -1.727 1.00 10.00 O ATOM 1268 CB ILE A 81 8.675 7.731 0.142 1.00 10.00 C ATOM 1269 CG1 ILE A 81 7.318 7.102 -0.226 1.00 10.00 C ATOM 1270 CG2 ILE A 81 9.132 7.252 1.523 1.00 10.00 C ATOM 1271 CD1 ILE A 81 7.400 5.578 -0.384 1.00 10.00 C ATOM 0 H ILE A 81 6.642 9.935 0.178 1.00 10.00 H new ATOM 0 HA ILE A 81 9.538 9.645 0.471 1.00 10.00 H new ATOM 0 HB ILE A 81 9.432 7.395 -0.567 1.00 10.00 H new ATOM 0 HG12 ILE A 81 6.587 7.345 0.545 1.00 10.00 H new ATOM 0 HG13 ILE A 81 6.958 7.542 -1.156 1.00 10.00 H new ATOM 0 HG21 ILE A 81 9.148 6.162 1.543 1.00 10.00 H new ATOM 0 HG22 ILE A 81 10.132 7.633 1.728 1.00 10.00 H new ATOM 0 HG23 ILE A 81 8.441 7.619 2.282 1.00 10.00 H new ATOM 0 HD11 ILE A 81 6.417 5.186 -0.643 1.00 10.00 H new ATOM 0 HD12 ILE A 81 8.109 5.332 -1.174 1.00 10.00 H new ATOM 0 HD13 ILE A 81 7.733 5.132 0.553 1.00 10.00 H new ATOM 1283 N PHE A 82 9.420 9.103 -2.294 1.00 10.00 N ATOM 1284 CA PHE A 82 9.540 9.325 -3.730 1.00 10.00 C ATOM 1285 C PHE A 82 8.198 9.667 -4.379 1.00 10.00 C ATOM 1286 O PHE A 82 7.146 9.289 -3.866 1.00 10.00 O ATOM 1287 CB PHE A 82 10.179 8.095 -4.412 1.00 10.00 C ATOM 1288 CG PHE A 82 9.237 6.946 -4.760 1.00 10.00 C ATOM 1289 CD1 PHE A 82 8.338 6.439 -3.803 1.00 10.00 C ATOM 1290 CD2 PHE A 82 9.192 6.442 -6.075 1.00 10.00 C ATOM 1291 CE1 PHE A 82 7.355 5.504 -4.166 1.00 10.00 C ATOM 1292 CE2 PHE A 82 8.233 5.476 -6.426 1.00 10.00 C ATOM 1293 CZ PHE A 82 7.303 5.017 -5.480 1.00 10.00 C ATOM 0 H PHE A 82 10.012 8.335 -1.978 1.00 10.00 H new ATOM 0 HA PHE A 82 10.190 10.188 -3.872 1.00 10.00 H new ATOM 0 HB2 PHE A 82 10.666 8.427 -5.329 1.00 10.00 H new ATOM 0 HB3 PHE A 82 10.961 7.709 -3.758 1.00 10.00 H new ATOM 0 HD1 PHE A 82 8.405 6.773 -2.778 1.00 10.00 H new ATOM 0 HD2 PHE A 82 9.895 6.798 -6.814 1.00 10.00 H new ATOM 0 HE1 PHE A 82 6.640 5.160 -3.434 1.00 10.00 H new ATOM 0 HE2 PHE A 82 8.212 5.084 -7.432 1.00 10.00 H new ATOM 0 HZ PHE A 82 6.552 4.294 -5.762 1.00 10.00 H new ATOM 1303 N ALA A 83 8.264 10.365 -5.520 1.00 10.00 N ATOM 1304 CA ALA A 83 7.109 10.841 -6.271 1.00 10.00 C ATOM 1305 C ALA A 83 5.966 9.830 -6.246 1.00 10.00 C ATOM 1306 O ALA A 83 4.888 10.128 -5.731 1.00 10.00 O ATOM 1307 CB ALA A 83 7.525 11.152 -7.712 1.00 10.00 C ATOM 0 H ALA A 83 9.152 10.618 -5.954 1.00 10.00 H new ATOM 0 HA ALA A 83 6.744 11.752 -5.797 1.00 10.00 H new ATOM 0 HB1 ALA A 83 6.660 11.508 -8.272 1.00 10.00 H new ATOM 0 HB2 ALA A 83 8.297 11.921 -7.710 1.00 10.00 H new ATOM 0 HB3 ALA A 83 7.914 10.249 -8.181 1.00 10.00 H new ATOM 1313 N GLY A 84 6.225 8.631 -6.774 1.00 10.00 N ATOM 1314 CA GLY A 84 5.219 7.601 -6.838 1.00 10.00 C ATOM 1315 C GLY A 84 5.481 6.632 -7.977 1.00 10.00 C ATOM 1316 O GLY A 84 6.553 6.633 -8.587 1.00 10.00 O ATOM 0 H GLY A 84 7.130 8.362 -7.161 1.00 10.00 H new ATOM 0 HA2 GLY A 84 5.195 7.056 -5.894 1.00 10.00 H new ATOM 0 HA3 GLY A 84 4.238 8.058 -6.967 1.00 10.00 H new ATOM 1320 N ILE A 85 4.486 5.792 -8.262 1.00 10.00 N ATOM 1321 CA ILE A 85 4.498 4.896 -9.400 1.00 10.00 C ATOM 1322 C ILE A 85 4.682 5.685 -10.697 1.00 10.00 C ATOM 1323 O ILE A 85 4.367 6.867 -10.784 1.00 10.00 O ATOM 1324 CB ILE A 85 3.214 4.042 -9.382 1.00 10.00 C ATOM 1325 CG1 ILE A 85 3.445 2.736 -8.626 1.00 10.00 C ATOM 1326 CG2 ILE A 85 2.609 3.752 -10.757 1.00 10.00 C ATOM 1327 CD1 ILE A 85 4.199 1.670 -9.416 1.00 10.00 C ATOM 0 H ILE A 85 3.641 5.720 -7.696 1.00 10.00 H new ATOM 0 HA ILE A 85 5.345 4.213 -9.340 1.00 10.00 H new ATOM 0 HB ILE A 85 2.478 4.656 -8.863 1.00 10.00 H new ATOM 0 HG12 ILE A 85 3.999 2.953 -7.713 1.00 10.00 H new ATOM 0 HG13 ILE A 85 2.479 2.331 -8.324 1.00 10.00 H new ATOM 0 HG21 ILE A 85 1.711 3.146 -10.639 1.00 10.00 H new ATOM 0 HG22 ILE A 85 2.351 4.691 -11.247 1.00 10.00 H new ATOM 0 HG23 ILE A 85 3.333 3.212 -11.367 1.00 10.00 H new ATOM 0 HD11 ILE A 85 4.318 0.778 -8.802 1.00 10.00 H new ATOM 0 HD12 ILE A 85 3.638 1.419 -10.316 1.00 10.00 H new ATOM 0 HD13 ILE A 85 5.181 2.051 -9.696 1.00 10.00 H new ATOM 1339 N LYS A 86 5.197 4.984 -11.708 1.00 10.00 N ATOM 1340 CA LYS A 86 5.501 5.510 -13.028 1.00 10.00 C ATOM 1341 C LYS A 86 4.369 6.388 -13.571 1.00 10.00 C ATOM 1342 O LYS A 86 4.640 7.477 -14.069 1.00 10.00 O ATOM 1343 CB LYS A 86 5.808 4.357 -13.996 1.00 10.00 C ATOM 1344 CG LYS A 86 6.768 3.318 -13.393 1.00 10.00 C ATOM 1345 CD LYS A 86 7.419 2.454 -14.489 1.00 10.00 C ATOM 1346 CE LYS A 86 8.635 3.155 -15.117 1.00 10.00 C ATOM 1347 NZ LYS A 86 9.233 2.358 -16.210 1.00 10.00 N ATOM 0 H LYS A 86 5.421 3.993 -11.620 1.00 10.00 H new ATOM 0 HA LYS A 86 6.382 6.145 -12.938 1.00 10.00 H new ATOM 0 HB2 LYS A 86 4.876 3.866 -14.277 1.00 10.00 H new ATOM 0 HB3 LYS A 86 6.243 4.761 -14.910 1.00 10.00 H new ATOM 0 HG2 LYS A 86 7.543 3.826 -12.819 1.00 10.00 H new ATOM 0 HG3 LYS A 86 6.225 2.678 -12.698 1.00 10.00 H new ATOM 0 HD2 LYS A 86 7.729 1.499 -14.064 1.00 10.00 H new ATOM 0 HD3 LYS A 86 6.685 2.235 -15.264 1.00 10.00 H new ATOM 0 HE2 LYS A 86 8.333 4.129 -15.502 1.00 10.00 H new ATOM 0 HE3 LYS A 86 9.386 3.336 -14.348 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 10.049 2.868 -16.605 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 9.546 1.438 -15.838 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 8.525 2.207 -16.957 1.00 10.00 H new ATOM 1361 N LYS A 87 3.127 5.889 -13.508 1.00 10.00 N ATOM 1362 CA LYS A 87 1.909 6.559 -13.920 1.00 10.00 C ATOM 1363 C LYS A 87 0.700 5.664 -13.620 1.00 10.00 C ATOM 1364 O LYS A 87 0.836 4.545 -13.123 1.00 10.00 O ATOM 1365 CB LYS A 87 1.974 6.909 -15.410 1.00 10.00 C ATOM 1366 CG LYS A 87 2.065 5.656 -16.289 1.00 10.00 C ATOM 1367 CD LYS A 87 2.835 5.906 -17.587 1.00 10.00 C ATOM 1368 CE LYS A 87 4.343 6.024 -17.319 1.00 10.00 C ATOM 1369 NZ LYS A 87 5.120 6.052 -18.573 1.00 10.00 N ATOM 0 H LYS A 87 2.947 4.953 -13.146 1.00 10.00 H new ATOM 0 HA LYS A 87 1.802 7.488 -13.360 1.00 10.00 H new ATOM 0 HB2 LYS A 87 1.090 7.483 -15.687 1.00 10.00 H new ATOM 0 HB3 LYS A 87 2.839 7.546 -15.596 1.00 10.00 H new ATOM 0 HG2 LYS A 87 2.552 4.858 -15.729 1.00 10.00 H new ATOM 0 HG3 LYS A 87 1.059 5.310 -16.528 1.00 10.00 H new ATOM 0 HD2 LYS A 87 2.649 5.091 -18.287 1.00 10.00 H new ATOM 0 HD3 LYS A 87 2.473 6.820 -18.058 1.00 10.00 H new ATOM 0 HE2 LYS A 87 4.541 6.931 -16.748 1.00 10.00 H new ATOM 0 HE3 LYS A 87 4.671 5.184 -16.707 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 6.133 6.132 -18.352 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 4.950 5.175 -19.106 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 4.825 6.868 -19.146 1.00 10.00 H new ATOM 1383 N LYS A 88 -0.490 6.167 -13.950 1.00 10.00 N ATOM 1384 CA LYS A 88 -1.773 5.512 -13.729 1.00 10.00 C ATOM 1385 C LYS A 88 -1.797 4.093 -14.314 1.00 10.00 C ATOM 1386 O LYS A 88 -2.260 3.159 -13.665 1.00 10.00 O ATOM 1387 CB LYS A 88 -2.894 6.420 -14.254 1.00 10.00 C ATOM 1388 CG LYS A 88 -2.847 6.676 -15.769 1.00 10.00 C ATOM 1389 CD LYS A 88 -3.711 7.897 -16.110 1.00 10.00 C ATOM 1390 CE LYS A 88 -3.760 8.136 -17.629 1.00 10.00 C ATOM 1391 NZ LYS A 88 -5.124 8.460 -18.096 1.00 10.00 N ATOM 0 H LYS A 88 -0.587 7.079 -14.396 1.00 10.00 H new ATOM 0 HA LYS A 88 -1.937 5.370 -12.661 1.00 10.00 H new ATOM 0 HB2 LYS A 88 -3.855 5.972 -14.003 1.00 10.00 H new ATOM 0 HB3 LYS A 88 -2.843 7.377 -13.734 1.00 10.00 H new ATOM 0 HG2 LYS A 88 -1.818 6.845 -16.088 1.00 10.00 H new ATOM 0 HG3 LYS A 88 -3.208 5.800 -16.308 1.00 10.00 H new ATOM 0 HD2 LYS A 88 -4.722 7.749 -15.730 1.00 10.00 H new ATOM 0 HD3 LYS A 88 -3.310 8.780 -15.613 1.00 10.00 H new ATOM 0 HE2 LYS A 88 -3.085 8.951 -17.889 1.00 10.00 H new ATOM 0 HE3 LYS A 88 -3.401 7.247 -18.147 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 -5.112 8.613 -19.125 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 -5.764 7.672 -17.871 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 -5.458 9.323 -17.621 1.00 10.00 H new ATOM 1405 N THR A 89 -1.266 3.941 -15.529 1.00 10.00 N ATOM 1406 CA THR A 89 -1.137 2.685 -16.247 1.00 10.00 C ATOM 1407 C THR A 89 -0.501 1.617 -15.351 1.00 10.00 C ATOM 1408 O THR A 89 -1.156 0.653 -14.954 1.00 10.00 O ATOM 1409 CB THR A 89 -0.300 2.979 -17.505 1.00 10.00 C ATOM 1410 OG1 THR A 89 -0.707 4.231 -18.039 1.00 10.00 O ATOM 1411 CG2 THR A 89 -0.471 1.888 -18.557 1.00 10.00 C ATOM 0 H THR A 89 -0.899 4.732 -16.058 1.00 10.00 H new ATOM 0 HA THR A 89 -2.108 2.285 -16.539 1.00 10.00 H new ATOM 0 HB THR A 89 0.754 3.007 -17.227 1.00 10.00 H new ATOM 0 HG1 THR A 89 -0.180 4.432 -18.841 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.134 2.128 -19.431 1.00 10.00 H new ATOM 0 HG22 THR A 89 -0.150 0.931 -18.145 1.00 10.00 H new ATOM 0 HG23 THR A 89 -1.520 1.824 -18.848 1.00 10.00 H new ATOM 1419 N GLU A 90 0.768 1.830 -14.992 1.00 10.00 N ATOM 1420 CA GLU A 90 1.485 0.999 -14.053 1.00 10.00 C ATOM 1421 C GLU A 90 0.692 0.777 -12.772 1.00 10.00 C ATOM 1422 O GLU A 90 0.627 -0.350 -12.299 1.00 10.00 O ATOM 1423 CB GLU A 90 2.821 1.660 -13.725 1.00 10.00 C ATOM 1424 CG GLU A 90 3.971 1.098 -14.574 1.00 10.00 C ATOM 1425 CD GLU A 90 3.977 1.537 -16.033 1.00 10.00 C ATOM 1426 OE1 GLU A 90 3.308 2.551 -16.340 1.00 10.00 O ATOM 1427 OE2 GLU A 90 4.721 0.877 -16.797 1.00 10.00 O ATOM 0 H GLU A 90 1.325 2.601 -15.359 1.00 10.00 H new ATOM 0 HA GLU A 90 1.645 0.024 -14.512 1.00 10.00 H new ATOM 0 HB2 GLU A 90 2.742 2.735 -13.889 1.00 10.00 H new ATOM 0 HB3 GLU A 90 3.047 1.514 -12.669 1.00 10.00 H new ATOM 0 HG2 GLU A 90 4.916 1.395 -14.118 1.00 10.00 H new ATOM 0 HG3 GLU A 90 3.928 0.009 -14.539 1.00 10.00 H new ATOM 1434 N ARG A 91 0.129 1.839 -12.186 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.684 1.710 -10.978 1.00 10.00 C ATOM 1436 C ARG A 91 -1.726 0.602 -11.176 1.00 10.00 C ATOM 1437 O ARG A 91 -1.866 -0.280 -10.334 1.00 10.00 O ATOM 1438 CB ARG A 91 -1.370 3.046 -10.643 1.00 10.00 C ATOM 1439 CG ARG A 91 -0.875 3.654 -9.329 1.00 10.00 C ATOM 1440 CD ARG A 91 -1.545 5.003 -9.056 1.00 10.00 C ATOM 1441 NE ARG A 91 -1.164 6.036 -10.034 1.00 10.00 N ATOM 1442 CZ ARG A 91 -1.536 7.330 -9.989 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -2.425 7.764 -9.088 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -0.966 8.189 -10.835 1.00 10.00 N ATOM 0 H ARG A 91 0.223 2.795 -12.530 1.00 10.00 H new ATOM 0 HA ARG A 91 -0.038 1.444 -10.141 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -1.194 3.753 -11.454 1.00 10.00 H new ATOM 0 HB3 ARG A 91 -2.447 2.891 -10.583 1.00 10.00 H new ATOM 0 HG2 ARG A 91 -1.083 2.969 -8.507 1.00 10.00 H new ATOM 0 HG3 ARG A 91 0.206 3.784 -9.370 1.00 10.00 H new ATOM 0 HD2 ARG A 91 -2.627 4.876 -9.071 1.00 10.00 H new ATOM 0 HD3 ARG A 91 -1.278 5.341 -8.055 1.00 10.00 H new ATOM 0 HE ARG A 91 -0.569 5.748 -10.810 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -2.834 7.111 -8.419 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -2.694 8.748 -9.070 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -0.264 7.861 -11.498 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -1.232 9.173 -10.819 1.00 10.00 H new ATOM 1458 N GLU A 92 -2.434 0.646 -12.304 1.00 10.00 N ATOM 1459 CA GLU A 92 -3.506 -0.296 -12.609 1.00 10.00 C ATOM 1460 C GLU A 92 -2.947 -1.727 -12.627 1.00 10.00 C ATOM 1461 O GLU A 92 -3.392 -2.590 -11.870 1.00 10.00 O ATOM 1462 CB GLU A 92 -4.197 0.115 -13.924 1.00 10.00 C ATOM 1463 CG GLU A 92 -5.721 -0.076 -13.893 1.00 10.00 C ATOM 1464 CD GLU A 92 -6.132 -1.539 -13.963 1.00 10.00 C ATOM 1465 OE1 GLU A 92 -6.136 -2.214 -12.915 1.00 10.00 O ATOM 1466 OE2 GLU A 92 -6.392 -2.000 -15.096 1.00 10.00 O ATOM 0 H GLU A 92 -2.278 1.340 -13.035 1.00 10.00 H new ATOM 0 HA GLU A 92 -4.273 -0.273 -11.835 1.00 10.00 H new ATOM 0 HB2 GLU A 92 -3.973 1.161 -14.133 1.00 10.00 H new ATOM 0 HB3 GLU A 92 -3.781 -0.470 -14.744 1.00 10.00 H new ATOM 0 HG2 GLU A 92 -6.120 0.366 -12.980 1.00 10.00 H new ATOM 0 HG3 GLU A 92 -6.167 0.463 -14.729 1.00 10.00 H new ATOM 1473 N ASP A 93 -1.917 -1.966 -13.448 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.199 -3.245 -13.479 1.00 10.00 C ATOM 1475 C ASP A 93 -0.855 -3.693 -12.047 1.00 10.00 C ATOM 1476 O ASP A 93 -1.147 -4.815 -11.637 1.00 10.00 O ATOM 1477 CB ASP A 93 0.082 -3.115 -14.322 1.00 10.00 C ATOM 1478 CG ASP A 93 -0.132 -3.117 -15.831 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -1.289 -3.330 -16.261 1.00 10.00 O ATOM 1480 OD2 ASP A 93 0.884 -2.925 -16.533 1.00 10.00 O ATOM 0 H ASP A 93 -1.558 -1.278 -14.110 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.840 -3.998 -13.936 1.00 10.00 H new ATOM 0 HB2 ASP A 93 0.589 -2.191 -14.044 1.00 10.00 H new ATOM 0 HB3 ASP A 93 0.752 -3.935 -14.065 1.00 10.00 H new ATOM 1485 N LEU A 94 -0.258 -2.794 -11.263 1.00 10.00 N ATOM 1486 CA LEU A 94 0.096 -3.023 -9.867 1.00 10.00 C ATOM 1487 C LEU A 94 -1.096 -3.567 -9.085 1.00 10.00 C ATOM 1488 O LEU A 94 -1.011 -4.637 -8.478 1.00 10.00 O ATOM 1489 CB LEU A 94 0.590 -1.717 -9.232 1.00 10.00 C ATOM 1490 CG LEU A 94 1.800 -1.908 -8.324 1.00 10.00 C ATOM 1491 CD1 LEU A 94 2.207 -0.541 -7.799 1.00 10.00 C ATOM 1492 CD2 LEU A 94 1.576 -2.870 -7.168 1.00 10.00 C ATOM 0 H LEU A 94 -0.002 -1.863 -11.593 1.00 10.00 H new ATOM 0 HA LEU A 94 0.894 -3.764 -9.832 1.00 10.00 H new ATOM 0 HB2 LEU A 94 0.845 -1.011 -10.022 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -0.221 -1.272 -8.656 1.00 10.00 H new ATOM 0 HG LEU A 94 2.588 -2.367 -8.921 1.00 10.00 H new ATOM 0 HD11 LEU A 94 3.072 -0.645 -7.145 1.00 10.00 H new ATOM 0 HD12 LEU A 94 2.461 0.109 -8.636 1.00 10.00 H new ATOM 0 HD13 LEU A 94 1.379 -0.105 -7.239 1.00 10.00 H new ATOM 0 HD21 LEU A 94 2.488 -2.945 -6.575 1.00 10.00 H new ATOM 0 HD22 LEU A 94 0.764 -2.502 -6.540 1.00 10.00 H new ATOM 0 HD23 LEU A 94 1.315 -3.854 -7.559 1.00 10.00 H new ATOM 1504 N ILE A 95 -2.206 -2.822 -9.104 1.00 10.00 N ATOM 1505 CA ILE A 95 -3.443 -3.229 -8.467 1.00 10.00 C ATOM 1506 C ILE A 95 -3.823 -4.621 -8.948 1.00 10.00 C ATOM 1507 O ILE A 95 -4.203 -5.447 -8.132 1.00 10.00 O ATOM 1508 CB ILE A 95 -4.564 -2.190 -8.685 1.00 10.00 C ATOM 1509 CG1 ILE A 95 -4.506 -1.108 -7.603 1.00 10.00 C ATOM 1510 CG2 ILE A 95 -5.962 -2.825 -8.624 1.00 10.00 C ATOM 1511 CD1 ILE A 95 -3.364 -0.109 -7.740 1.00 10.00 C ATOM 0 H ILE A 95 -2.262 -1.915 -9.567 1.00 10.00 H new ATOM 0 HA ILE A 95 -3.295 -3.275 -7.388 1.00 10.00 H new ATOM 0 HB ILE A 95 -4.401 -1.766 -9.676 1.00 10.00 H new ATOM 0 HG12 ILE A 95 -5.448 -0.560 -7.610 1.00 10.00 H new ATOM 0 HG13 ILE A 95 -4.427 -1.594 -6.631 1.00 10.00 H new ATOM 0 HG21 ILE A 95 -6.718 -2.056 -8.783 1.00 10.00 H new ATOM 0 HG22 ILE A 95 -6.050 -3.586 -9.399 1.00 10.00 H new ATOM 0 HG23 ILE A 95 -6.111 -3.284 -7.647 1.00 10.00 H new ATOM 0 HD11 ILE A 95 -3.413 0.614 -6.926 1.00 10.00 H new ATOM 0 HD12 ILE A 95 -2.412 -0.637 -7.699 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -3.449 0.412 -8.693 1.00 10.00 H new ATOM 1523 N ALA A 96 -3.730 -4.903 -10.244 1.00 10.00 N ATOM 1524 CA ALA A 96 -4.066 -6.222 -10.767 1.00 10.00 C ATOM 1525 C ALA A 96 -3.323 -7.342 -10.046 1.00 10.00 C ATOM 1526 O ALA A 96 -3.948 -8.319 -9.632 1.00 10.00 O ATOM 1527 CB ALA A 96 -3.793 -6.305 -12.256 1.00 10.00 C ATOM 0 H ALA A 96 -3.424 -4.235 -10.951 1.00 10.00 H new ATOM 0 HA ALA A 96 -5.132 -6.359 -10.588 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -4.053 -7.300 -12.619 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.394 -5.560 -12.778 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -2.736 -6.115 -12.443 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.002 -7.207 -9.891 1.00 10.00 N ATOM 1534 CA TYR A 97 -1.254 -8.162 -9.084 1.00 10.00 C ATOM 1535 C TYR A 97 -1.832 -8.183 -7.679 1.00 10.00 C ATOM 1536 O TYR A 97 -2.327 -9.212 -7.223 1.00 10.00 O ATOM 1537 CB TYR A 97 0.236 -7.818 -9.041 1.00 10.00 C ATOM 1538 CG TYR A 97 1.041 -8.685 -8.092 1.00 10.00 C ATOM 1539 CD1 TYR A 97 1.210 -10.053 -8.373 1.00 10.00 C ATOM 1540 CD2 TYR A 97 1.594 -8.142 -6.916 1.00 10.00 C ATOM 1541 CE1 TYR A 97 1.973 -10.862 -7.514 1.00 10.00 C ATOM 1542 CE2 TYR A 97 2.336 -8.958 -6.044 1.00 10.00 C ATOM 1543 CZ TYR A 97 2.539 -10.314 -6.351 1.00 10.00 C ATOM 1544 OH TYR A 97 3.266 -11.111 -5.520 1.00 10.00 O ATOM 0 H TYR A 97 -1.443 -6.461 -10.306 1.00 10.00 H new ATOM 0 HA TYR A 97 -1.345 -9.149 -9.538 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.650 -7.914 -10.045 1.00 10.00 H new ATOM 0 HB3 TYR A 97 0.349 -6.774 -8.748 1.00 10.00 H new ATOM 0 HD1 TYR A 97 0.752 -10.483 -9.252 1.00 10.00 H new ATOM 0 HD2 TYR A 97 1.448 -7.097 -6.684 1.00 10.00 H new ATOM 0 HE1 TYR A 97 2.124 -11.905 -7.748 1.00 10.00 H new ATOM 0 HE2 TYR A 97 2.750 -8.542 -5.137 1.00 10.00 H new ATOM 0 HH TYR A 97 3.590 -10.583 -4.761 1.00 10.00 H new ATOM 1554 N LEU A 98 -1.766 -7.029 -7.013 1.00 10.00 N ATOM 1555 CA LEU A 98 -2.217 -6.847 -5.644 1.00 10.00 C ATOM 1556 C LEU A 98 -3.556 -7.548 -5.372 1.00 10.00 C ATOM 1557 O LEU A 98 -3.651 -8.293 -4.403 1.00 10.00 O ATOM 1558 CB LEU A 98 -2.195 -5.350 -5.278 1.00 10.00 C ATOM 1559 CG LEU A 98 -1.172 -5.023 -4.172 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -0.064 -4.127 -4.700 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -1.852 -4.332 -2.988 1.00 10.00 C ATOM 0 H LEU A 98 -1.387 -6.177 -7.427 1.00 10.00 H new ATOM 0 HA LEU A 98 -1.519 -7.344 -4.971 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -1.961 -4.766 -6.168 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -3.189 -5.046 -4.950 1.00 10.00 H new ATOM 0 HG LEU A 98 -0.740 -5.967 -3.840 1.00 10.00 H new ATOM 0 HD11 LEU A 98 0.643 -3.912 -3.899 1.00 10.00 H new ATOM 0 HD12 LEU A 98 0.454 -4.631 -5.516 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -0.493 -3.194 -5.065 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -1.110 -4.111 -2.221 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -2.313 -3.404 -3.325 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -2.618 -4.988 -2.574 1.00 10.00 H new ATOM 1573 N LYS A 99 -4.574 -7.355 -6.216 1.00 10.00 N ATOM 1574 CA LYS A 99 -5.891 -7.981 -6.102 1.00 10.00 C ATOM 1575 C LYS A 99 -5.773 -9.464 -5.777 1.00 10.00 C ATOM 1576 O LYS A 99 -6.443 -9.951 -4.870 1.00 10.00 O ATOM 1577 CB LYS A 99 -6.696 -7.803 -7.400 1.00 10.00 C ATOM 1578 CG LYS A 99 -7.267 -6.386 -7.524 1.00 10.00 C ATOM 1579 CD LYS A 99 -7.862 -6.125 -8.915 1.00 10.00 C ATOM 1580 CE LYS A 99 -9.363 -6.417 -8.924 1.00 10.00 C ATOM 1581 NZ LYS A 99 -9.975 -6.088 -10.229 1.00 10.00 N ATOM 0 H LYS A 99 -4.499 -6.737 -7.024 1.00 10.00 H new ATOM 0 HA LYS A 99 -6.415 -7.485 -5.285 1.00 10.00 H new ATOM 0 HB2 LYS A 99 -6.056 -8.014 -8.257 1.00 10.00 H new ATOM 0 HB3 LYS A 99 -7.511 -8.527 -7.425 1.00 10.00 H new ATOM 0 HG2 LYS A 99 -8.037 -6.238 -6.767 1.00 10.00 H new ATOM 0 HG3 LYS A 99 -6.480 -5.659 -7.324 1.00 10.00 H new ATOM 0 HD2 LYS A 99 -7.686 -5.088 -9.203 1.00 10.00 H new ATOM 0 HD3 LYS A 99 -7.360 -6.750 -9.654 1.00 10.00 H new ATOM 0 HE2 LYS A 99 -9.530 -7.470 -8.698 1.00 10.00 H new ATOM 0 HE3 LYS A 99 -9.851 -5.841 -8.138 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 -10.993 -6.299 -10.198 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 -9.837 -5.078 -10.432 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 -9.526 -6.656 -10.976 1.00 10.00 H new ATOM 1595 N LYS A 100 -4.937 -10.184 -6.525 1.00 10.00 N ATOM 1596 CA LYS A 100 -4.742 -11.601 -6.279 1.00 10.00 C ATOM 1597 C LYS A 100 -3.788 -11.765 -5.105 1.00 10.00 C ATOM 1598 O LYS A 100 -4.113 -12.421 -4.130 1.00 10.00 O ATOM 1599 CB LYS A 100 -4.242 -12.297 -7.551 1.00 10.00 C ATOM 1600 CG LYS A 100 -5.214 -12.000 -8.703 1.00 10.00 C ATOM 1601 CD LYS A 100 -5.652 -13.270 -9.448 1.00 10.00 C ATOM 1602 CE LYS A 100 -6.860 -12.953 -10.344 1.00 10.00 C ATOM 1603 NZ LYS A 100 -7.282 -14.115 -11.154 1.00 10.00 N ATOM 0 H LYS A 100 -4.390 -9.807 -7.299 1.00 10.00 H new ATOM 0 HA LYS A 100 -5.686 -12.079 -6.017 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -3.242 -11.945 -7.803 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -4.170 -13.372 -7.388 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -6.094 -11.492 -8.309 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -4.740 -11.316 -9.407 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -4.829 -13.651 -10.052 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -5.912 -14.051 -8.734 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -7.693 -12.625 -9.723 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -6.610 -12.124 -11.006 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -8.099 -13.851 -11.741 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -6.497 -14.414 -11.768 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -7.547 -14.899 -10.524 1.00 10.00 H new ATOM 1617 N ALA A 101 -2.637 -11.107 -5.183 1.00 10.00 N ATOM 1618 CA ALA A 101 -1.482 -11.373 -4.334 1.00 10.00 C ATOM 1619 C ALA A 101 -1.805 -11.171 -2.858 1.00 10.00 C ATOM 1620 O ALA A 101 -1.313 -11.878 -1.988 1.00 10.00 O ATOM 1621 CB ALA A 101 -0.345 -10.446 -4.753 1.00 10.00 C ATOM 0 H ALA A 101 -2.477 -10.356 -5.854 1.00 10.00 H new ATOM 0 HA ALA A 101 -1.190 -12.415 -4.460 1.00 10.00 H new ATOM 0 HB1 ALA A 101 0.527 -10.633 -4.126 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -0.089 -10.633 -5.796 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -0.659 -9.409 -4.637 1.00 10.00 H new ATOM 1627 N THR A 102 -2.601 -10.145 -2.574 1.00 10.00 N ATOM 1628 CA THR A 102 -2.992 -9.827 -1.215 1.00 10.00 C ATOM 1629 C THR A 102 -4.139 -10.728 -0.772 1.00 10.00 C ATOM 1630 O THR A 102 -4.272 -10.997 0.417 1.00 10.00 O ATOM 1631 CB THR A 102 -3.343 -8.342 -1.112 1.00 10.00 C ATOM 1632 OG1 THR A 102 -4.499 -8.049 -1.871 1.00 10.00 O ATOM 1633 CG2 THR A 102 -2.168 -7.501 -1.616 1.00 10.00 C ATOM 0 H THR A 102 -2.988 -9.517 -3.278 1.00 10.00 H new ATOM 0 HA THR A 102 -2.159 -10.015 -0.537 1.00 10.00 H new ATOM 0 HB THR A 102 -3.544 -8.102 -0.068 1.00 10.00 H new ATOM 0 HG1 THR A 102 -4.239 -7.813 -2.786 1.00 10.00 H new ATOM 0 HG21 THR A 102 -2.420 -6.443 -1.542 1.00 10.00 H new ATOM 0 HG22 THR A 102 -1.286 -7.708 -1.010 1.00 10.00 H new ATOM 0 HG23 THR A 102 -1.960 -7.753 -2.656 1.00 10.00 H new ATOM 1641 N ASN A 103 -4.977 -11.172 -1.712 1.00 10.00 N ATOM 1642 CA ASN A 103 -6.035 -12.130 -1.440 1.00 10.00 C ATOM 1643 C ASN A 103 -5.401 -13.465 -1.031 1.00 10.00 C ATOM 1644 O ASN A 103 -5.779 -14.019 -0.002 1.00 10.00 O ATOM 1645 CB ASN A 103 -6.956 -12.212 -2.668 1.00 10.00 C ATOM 1646 CG ASN A 103 -8.130 -13.174 -2.530 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -7.987 -14.311 -2.104 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -9.318 -12.738 -2.943 1.00 10.00 N ATOM 0 H ASN A 103 -4.935 -10.872 -2.686 1.00 10.00 H new ATOM 0 HA ASN A 103 -6.665 -11.823 -0.605 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -7.345 -11.216 -2.879 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -6.360 -12.511 -3.531 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -10.129 -13.356 -2.907 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -9.418 -11.786 -3.295 1.00 10.00 H new ATOM 1655 N GLU A 104 -4.413 -13.927 -1.806 1.00 10.00 N ATOM 1656 CA GLU A 104 -3.688 -15.176 -1.638 1.00 10.00 C ATOM 1657 C GLU A 104 -2.338 -15.032 -2.353 1.00 10.00 C ATOM 1658 O GLU A 104 -1.305 -15.346 -1.720 1.00 10.00 O ATOM 1659 CB GLU A 104 -4.513 -16.316 -2.262 1.00 10.00 C ATOM 1660 CG GLU A 104 -5.248 -17.159 -1.210 1.00 10.00 C ATOM 1661 CD GLU A 104 -4.329 -18.205 -0.590 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -4.050 -19.195 -1.302 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -3.933 -18.015 0.581 1.00 10.00 O ATOM 1664 OXT GLU A 104 -2.367 -14.614 -3.533 1.00 10.00 O ATOM 0 H GLU A 104 -4.084 -13.400 -2.615 1.00 10.00 H new ATOM 0 HA GLU A 104 -3.523 -15.403 -0.585 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -5.240 -15.895 -2.957 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -3.853 -16.961 -2.843 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -5.639 -16.507 -0.428 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -6.104 -17.652 -1.671 1.00 10.00 H new