USER MOD reduce.3.24.130724 H: found=0, std=0, add=907, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 905 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 2 SER OG : rot -124:sc= 0.471 USER MOD Set 1.2: A 5 GLN : amide:sc= 0.438 K(o=0.91,f=0) USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.0761 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.152 X(o=-0.15,f=-0.38) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -2.59! C(o=-2.6!,f=-4.7!) USER MOD Single : A 11 THR OG1 : rot 157:sc= -5.36! USER MOD Single : A 14 HIS : no HD1:sc= -7.2! C(o=-7.2!,f=-13!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot -15:sc= -1.1 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot -67:sc= 1.13 USER MOD Single : A 62 GLN : amide:sc= -0.0647 X(o=-0.065,f=0) USER MOD Single : A 63 ASN : amide:sc= -1.96 K(o=-2,f=-2.8) USER MOD Single : A 64 GLN : amide:sc= -1.98! C(o=-2!,f=-11!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 CYS SG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -98:sc= 0.874 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.002 USER MOD Single : A 92 THR OG1 : rot 160:sc= 0.0564 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.796 28.305 -19.911 1.00 0.00 N ATOM 2 CA GLY A 1 8.220 27.940 -18.586 1.00 0.00 C ATOM 3 C GLY A 1 7.300 29.062 -18.100 1.00 0.00 C ATOM 4 O GLY A 1 7.418 30.197 -18.515 1.00 0.00 O ATOM 0 H1 GLY A 1 8.490 27.613 -20.625 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.466 29.253 -20.184 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.834 28.304 -19.850 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.662 27.007 -18.665 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.019 27.773 -17.864 1.00 0.00 H new ATOM 10 N SER A 2 6.384 28.754 -17.224 1.00 0.00 N ATOM 11 CA SER A 2 5.458 29.807 -16.714 1.00 0.00 C ATOM 12 C SER A 2 5.927 30.305 -15.344 1.00 0.00 C ATOM 13 O SER A 2 5.376 31.234 -14.788 1.00 0.00 O ATOM 14 CB SER A 2 4.099 29.119 -16.602 1.00 0.00 C ATOM 15 OG SER A 2 3.072 30.056 -16.899 1.00 0.00 O ATOM 0 H SER A 2 6.236 27.821 -16.839 1.00 0.00 H new ATOM 0 HA SER A 2 5.419 30.677 -17.370 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.048 28.276 -17.291 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.963 28.719 -15.597 1.00 0.00 H new ATOM 0 HG SER A 2 2.440 30.097 -16.151 1.00 0.00 H new ATOM 21 N HIS A 3 6.942 29.694 -14.796 1.00 0.00 N ATOM 22 CA HIS A 3 7.447 30.132 -13.462 1.00 0.00 C ATOM 23 C HIS A 3 6.303 30.172 -12.446 1.00 0.00 C ATOM 24 O HIS A 3 5.161 29.911 -12.770 1.00 0.00 O ATOM 25 CB HIS A 3 8.001 31.539 -13.689 1.00 0.00 C ATOM 26 CG HIS A 3 9.503 31.489 -13.734 1.00 0.00 C ATOM 27 ND1 HIS A 3 10.194 30.363 -14.153 1.00 0.00 N ATOM 28 CD2 HIS A 3 10.462 32.419 -13.413 1.00 0.00 C ATOM 29 CE1 HIS A 3 11.509 30.641 -14.074 1.00 0.00 C ATOM 30 NE2 HIS A 3 11.727 31.881 -13.628 1.00 0.00 N ATOM 0 H HIS A 3 7.444 28.910 -15.214 1.00 0.00 H new ATOM 0 HA HIS A 3 8.201 29.451 -13.067 1.00 0.00 H new ATOM 0 HB2 HIS A 3 7.613 31.947 -14.622 1.00 0.00 H new ATOM 0 HB3 HIS A 3 7.673 32.203 -12.889 1.00 0.00 H new ATOM 0 HD2 HIS A 3 10.264 33.416 -13.049 1.00 0.00 H new ATOM 0 HE1 HIS A 3 12.292 29.946 -14.339 1.00 0.00 H new ATOM 0 HE2 HIS A 3 12.627 32.336 -13.477 1.00 0.00 H new ATOM 38 N MET A 4 6.602 30.501 -11.219 1.00 0.00 N ATOM 39 CA MET A 4 5.535 30.563 -10.180 1.00 0.00 C ATOM 40 C MET A 4 4.354 31.394 -10.689 1.00 0.00 C ATOM 41 O MET A 4 4.529 32.408 -11.335 1.00 0.00 O ATOM 42 CB MET A 4 6.195 31.240 -8.978 1.00 0.00 C ATOM 43 CG MET A 4 6.409 32.725 -9.280 1.00 0.00 C ATOM 44 SD MET A 4 7.152 33.531 -7.839 1.00 0.00 S ATOM 45 CE MET A 4 8.724 33.979 -8.613 1.00 0.00 C ATOM 0 H MET A 4 7.540 30.730 -10.891 1.00 0.00 H new ATOM 0 HA MET A 4 5.143 29.578 -9.926 1.00 0.00 H new ATOM 0 HB2 MET A 4 5.569 31.125 -8.093 1.00 0.00 H new ATOM 0 HB3 MET A 4 7.149 30.762 -8.757 1.00 0.00 H new ATOM 0 HG2 MET A 4 7.056 32.841 -10.149 1.00 0.00 H new ATOM 0 HG3 MET A 4 5.458 33.198 -9.525 1.00 0.00 H new ATOM 0 HE1 MET A 4 9.352 34.498 -7.888 1.00 0.00 H new ATOM 0 HE2 MET A 4 9.232 33.077 -8.953 1.00 0.00 H new ATOM 0 HE3 MET A 4 8.537 34.633 -9.465 1.00 0.00 H new ATOM 55 N GLN A 5 3.152 30.971 -10.405 1.00 0.00 N ATOM 56 CA GLN A 5 1.962 31.738 -10.876 1.00 0.00 C ATOM 57 C GLN A 5 1.221 32.351 -9.684 1.00 0.00 C ATOM 58 O GLN A 5 1.788 32.569 -8.632 1.00 0.00 O ATOM 59 CB GLN A 5 1.073 30.707 -11.582 1.00 0.00 C ATOM 60 CG GLN A 5 1.935 29.764 -12.427 1.00 0.00 C ATOM 61 CD GLN A 5 1.194 29.411 -13.720 1.00 0.00 C ATOM 62 OE1 GLN A 5 1.118 30.214 -14.628 1.00 0.00 O ATOM 63 NE2 GLN A 5 0.640 28.233 -13.844 1.00 0.00 N ATOM 0 H GLN A 5 2.942 30.129 -9.868 1.00 0.00 H new ATOM 0 HA GLN A 5 2.240 32.559 -11.537 1.00 0.00 H new ATOM 0 HB2 GLN A 5 0.509 30.135 -10.845 1.00 0.00 H new ATOM 0 HB3 GLN A 5 0.346 31.215 -12.216 1.00 0.00 H new ATOM 0 HG2 GLN A 5 2.889 30.238 -12.660 1.00 0.00 H new ATOM 0 HG3 GLN A 5 2.158 28.857 -11.865 1.00 0.00 H new ATOM 0 HE21 GLN A 5 0.703 27.557 -13.083 1.00 0.00 H new ATOM 0 HE22 GLN A 5 0.145 27.990 -14.702 1.00 0.00 H new ATOM 72 N VAL A 6 -0.046 32.621 -9.840 1.00 0.00 N ATOM 73 CA VAL A 6 -0.835 33.211 -8.719 1.00 0.00 C ATOM 74 C VAL A 6 -2.058 32.335 -8.438 1.00 0.00 C ATOM 75 O VAL A 6 -2.475 31.560 -9.276 1.00 0.00 O ATOM 76 CB VAL A 6 -1.255 34.597 -9.210 1.00 0.00 C ATOM 77 CG1 VAL A 6 -0.008 35.447 -9.459 1.00 0.00 C ATOM 78 CG2 VAL A 6 -2.046 34.463 -10.513 1.00 0.00 C ATOM 0 H VAL A 6 -0.572 32.458 -10.699 1.00 0.00 H new ATOM 0 HA VAL A 6 -0.266 33.275 -7.792 1.00 0.00 H new ATOM 0 HB VAL A 6 -1.879 35.074 -8.455 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -0.305 36.435 -9.809 1.00 0.00 H new ATOM 0 HG12 VAL A 6 0.557 35.545 -8.532 1.00 0.00 H new ATOM 0 HG13 VAL A 6 0.615 34.967 -10.214 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -2.344 35.452 -10.861 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -1.423 33.985 -11.269 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -2.935 33.857 -10.338 1.00 0.00 H new ATOM 88 N VAL A 7 -2.626 32.435 -7.262 1.00 0.00 N ATOM 89 CA VAL A 7 -3.812 31.589 -6.927 1.00 0.00 C ATOM 90 C VAL A 7 -4.737 31.458 -8.138 1.00 0.00 C ATOM 91 O VAL A 7 -5.432 32.383 -8.511 1.00 0.00 O ATOM 92 CB VAL A 7 -4.522 32.314 -5.785 1.00 0.00 C ATOM 93 CG1 VAL A 7 -5.690 31.456 -5.292 1.00 0.00 C ATOM 94 CG2 VAL A 7 -3.535 32.541 -4.637 1.00 0.00 C ATOM 0 H VAL A 7 -2.320 33.065 -6.521 1.00 0.00 H new ATOM 0 HA VAL A 7 -3.520 30.578 -6.643 1.00 0.00 H new ATOM 0 HB VAL A 7 -4.897 33.275 -6.137 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -6.200 31.969 -4.477 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.390 31.290 -6.111 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -5.313 30.497 -4.937 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.039 33.058 -3.821 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -3.162 31.580 -4.282 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.700 33.147 -4.989 1.00 0.00 H new ATOM 104 N LEU A 8 -4.741 30.310 -8.755 1.00 0.00 N ATOM 105 CA LEU A 8 -5.606 30.096 -9.949 1.00 0.00 C ATOM 106 C LEU A 8 -7.081 30.271 -9.586 1.00 0.00 C ATOM 107 O LEU A 8 -7.435 30.339 -8.426 1.00 0.00 O ATOM 108 CB LEU A 8 -5.337 28.650 -10.362 1.00 0.00 C ATOM 109 CG LEU A 8 -4.136 28.581 -11.312 1.00 0.00 C ATOM 110 CD1 LEU A 8 -3.053 29.569 -10.868 1.00 0.00 C ATOM 111 CD2 LEU A 8 -3.565 27.161 -11.289 1.00 0.00 C ATOM 0 H LEU A 8 -4.178 29.505 -8.482 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.391 30.809 -10.745 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.145 28.042 -9.478 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.219 28.234 -10.849 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.459 28.840 -12.320 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.205 29.511 -11.551 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -3.458 30.581 -10.878 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.724 29.319 -9.859 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.710 27.102 -11.962 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.248 26.913 -10.276 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.331 26.456 -11.612 1.00 0.00 H new ATOM 123 N PRO A 9 -7.895 30.323 -10.604 1.00 0.00 N ATOM 124 CA PRO A 9 -9.350 30.474 -10.407 1.00 0.00 C ATOM 125 C PRO A 9 -9.967 29.124 -10.038 1.00 0.00 C ATOM 126 O PRO A 9 -10.779 28.582 -10.761 1.00 0.00 O ATOM 127 CB PRO A 9 -9.849 30.947 -11.767 1.00 0.00 C ATOM 128 CG PRO A 9 -8.837 30.454 -12.756 1.00 0.00 C ATOM 129 CD PRO A 9 -7.533 30.249 -12.022 1.00 0.00 C ATOM 0 HA PRO A 9 -9.611 31.164 -9.604 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -10.839 30.545 -11.984 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -9.932 32.033 -11.799 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -9.170 29.521 -13.210 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -8.711 31.174 -13.564 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -7.086 29.286 -12.268 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -6.804 31.015 -12.286 1.00 0.00 H new ATOM 137 N ASN A 10 -9.581 28.579 -8.918 1.00 0.00 N ATOM 138 CA ASN A 10 -10.135 27.261 -8.489 1.00 0.00 C ATOM 139 C ASN A 10 -9.718 26.150 -9.464 1.00 0.00 C ATOM 140 O ASN A 10 -10.502 25.288 -9.805 1.00 0.00 O ATOM 141 CB ASN A 10 -11.656 27.446 -8.494 1.00 0.00 C ATOM 142 CG ASN A 10 -12.161 27.548 -7.053 1.00 0.00 C ATOM 143 OD1 ASN A 10 -13.239 27.081 -6.741 1.00 0.00 O ATOM 144 ND2 ASN A 10 -11.424 28.145 -6.157 1.00 0.00 N ATOM 0 H ASN A 10 -8.902 28.991 -8.277 1.00 0.00 H new ATOM 0 HA ASN A 10 -9.764 26.964 -7.508 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -11.922 28.346 -9.049 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -12.134 26.607 -9.000 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -11.752 28.220 -5.194 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -10.519 28.537 -6.419 1.00 0.00 H new ATOM 151 N THR A 11 -8.485 26.155 -9.903 1.00 0.00 N ATOM 152 CA THR A 11 -8.018 25.088 -10.843 1.00 0.00 C ATOM 153 C THR A 11 -6.869 24.300 -10.203 1.00 0.00 C ATOM 154 O THR A 11 -6.366 24.667 -9.162 1.00 0.00 O ATOM 155 CB THR A 11 -7.532 25.826 -12.093 1.00 0.00 C ATOM 156 OG1 THR A 11 -6.268 26.417 -11.831 1.00 0.00 O ATOM 157 CG2 THR A 11 -8.538 26.912 -12.475 1.00 0.00 C ATOM 0 H THR A 11 -7.782 26.850 -9.652 1.00 0.00 H new ATOM 0 HA THR A 11 -8.808 24.376 -11.082 1.00 0.00 H new ATOM 0 HB THR A 11 -7.439 25.119 -12.917 1.00 0.00 H new ATOM 0 HG1 THR A 11 -5.793 26.561 -12.676 1.00 0.00 H new ATOM 0 HG21 THR A 11 -8.188 27.435 -13.365 1.00 0.00 H new ATOM 0 HG22 THR A 11 -9.506 26.455 -12.679 1.00 0.00 H new ATOM 0 HG23 THR A 11 -8.637 27.621 -11.653 1.00 0.00 H new ATOM 165 N ALA A 12 -6.449 23.219 -10.807 1.00 0.00 N ATOM 166 CA ALA A 12 -5.334 22.422 -10.208 1.00 0.00 C ATOM 167 C ALA A 12 -4.447 21.819 -11.302 1.00 0.00 C ATOM 168 O ALA A 12 -4.837 21.720 -12.448 1.00 0.00 O ATOM 169 CB ALA A 12 -6.023 21.311 -9.416 1.00 0.00 C ATOM 0 H ALA A 12 -6.825 22.855 -11.682 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.687 23.038 -9.583 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.270 20.680 -8.944 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -6.659 21.752 -8.649 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.632 20.708 -10.090 1.00 0.00 H new ATOM 175 N LEU A 13 -3.253 21.413 -10.952 1.00 0.00 N ATOM 176 CA LEU A 13 -2.340 20.812 -11.971 1.00 0.00 C ATOM 177 C LEU A 13 -1.702 19.525 -11.427 1.00 0.00 C ATOM 178 O LEU A 13 -1.592 19.333 -10.232 1.00 0.00 O ATOM 179 CB LEU A 13 -1.299 21.910 -12.274 1.00 0.00 C ATOM 180 CG LEU A 13 -0.008 21.734 -11.455 1.00 0.00 C ATOM 181 CD1 LEU A 13 1.197 21.935 -12.372 1.00 0.00 C ATOM 182 CD2 LEU A 13 0.032 22.777 -10.338 1.00 0.00 C ATOM 0 H LEU A 13 -2.872 21.471 -10.008 1.00 0.00 H new ATOM 0 HA LEU A 13 -2.859 20.513 -12.881 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -1.057 21.895 -13.337 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.732 22.887 -12.060 1.00 0.00 H new ATOM 0 HG LEU A 13 0.018 20.734 -11.022 1.00 0.00 H new ATOM 0 HD11 LEU A 13 2.115 21.812 -11.798 1.00 0.00 H new ATOM 0 HD12 LEU A 13 1.170 21.199 -13.175 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.167 22.938 -12.798 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.946 22.653 -9.757 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.011 23.776 -10.772 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -0.832 22.646 -9.687 1.00 0.00 H new ATOM 194 N HIS A 14 -1.280 18.643 -12.295 1.00 0.00 N ATOM 195 CA HIS A 14 -0.650 17.370 -11.826 1.00 0.00 C ATOM 196 C HIS A 14 0.873 17.528 -11.718 1.00 0.00 C ATOM 197 O HIS A 14 1.539 17.881 -12.672 1.00 0.00 O ATOM 198 CB HIS A 14 -1.002 16.332 -12.894 1.00 0.00 C ATOM 199 CG HIS A 14 -2.493 16.281 -13.086 1.00 0.00 C ATOM 200 ND1 HIS A 14 -3.187 17.265 -13.773 1.00 0.00 N ATOM 201 CD2 HIS A 14 -3.435 15.363 -12.694 1.00 0.00 C ATOM 202 CE1 HIS A 14 -4.488 16.919 -13.772 1.00 0.00 C ATOM 203 NE2 HIS A 14 -4.694 15.768 -13.128 1.00 0.00 N ATOM 0 H HIS A 14 -1.344 18.748 -13.308 1.00 0.00 H new ATOM 0 HA HIS A 14 -1.008 17.081 -10.838 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -0.514 16.586 -13.835 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -0.631 15.351 -12.597 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -3.230 14.463 -12.134 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -5.270 17.502 -14.236 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -5.583 15.288 -12.985 1.00 0.00 H new ATOM 211 N LEU A 15 1.427 17.263 -10.561 1.00 0.00 N ATOM 212 CA LEU A 15 2.906 17.392 -10.385 1.00 0.00 C ATOM 213 C LEU A 15 3.541 16.010 -10.188 1.00 0.00 C ATOM 214 O LEU A 15 2.922 15.104 -9.666 1.00 0.00 O ATOM 215 CB LEU A 15 3.093 18.224 -9.113 1.00 0.00 C ATOM 216 CG LEU A 15 2.472 19.610 -9.287 1.00 0.00 C ATOM 217 CD1 LEU A 15 2.857 20.180 -10.652 1.00 0.00 C ATOM 218 CD2 LEU A 15 0.949 19.507 -9.183 1.00 0.00 C ATOM 0 H LEU A 15 0.918 16.963 -9.730 1.00 0.00 H new ATOM 0 HA LEU A 15 3.375 17.851 -11.255 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.631 17.715 -8.267 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.155 18.320 -8.886 1.00 0.00 H new ATOM 0 HG LEU A 15 2.843 20.272 -8.504 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.412 21.168 -10.772 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.942 20.260 -10.720 1.00 0.00 H new ATOM 0 HD13 LEU A 15 2.491 19.520 -11.438 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.508 20.496 -9.307 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.575 18.843 -9.962 1.00 0.00 H new ATOM 0 HD23 LEU A 15 0.677 19.109 -8.205 1.00 0.00 H new ATOM 230 N LYS A 16 4.777 15.845 -10.579 1.00 0.00 N ATOM 231 CA LYS A 16 5.444 14.524 -10.381 1.00 0.00 C ATOM 232 C LYS A 16 6.580 14.666 -9.370 1.00 0.00 C ATOM 233 O LYS A 16 7.531 15.391 -9.587 1.00 0.00 O ATOM 234 CB LYS A 16 5.994 14.119 -11.748 1.00 0.00 C ATOM 235 CG LYS A 16 5.483 12.720 -12.101 1.00 0.00 C ATOM 236 CD LYS A 16 6.185 12.224 -13.368 1.00 0.00 C ATOM 237 CE LYS A 16 7.469 11.483 -12.986 1.00 0.00 C ATOM 238 NZ LYS A 16 8.419 11.757 -14.100 1.00 0.00 N ATOM 0 H LYS A 16 5.350 16.562 -11.024 1.00 0.00 H new ATOM 0 HA LYS A 16 4.753 13.774 -9.997 1.00 0.00 H new ATOM 0 HB2 LYS A 16 5.680 14.836 -12.507 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.084 14.128 -11.732 1.00 0.00 H new ATOM 0 HG2 LYS A 16 5.672 12.033 -11.276 1.00 0.00 H new ATOM 0 HG3 LYS A 16 4.404 12.744 -12.256 1.00 0.00 H new ATOM 0 HD2 LYS A 16 5.524 11.562 -13.927 1.00 0.00 H new ATOM 0 HD3 LYS A 16 6.419 13.066 -14.020 1.00 0.00 H new ATOM 0 HE2 LYS A 16 7.863 11.841 -12.035 1.00 0.00 H new ATOM 0 HE3 LYS A 16 7.289 10.414 -12.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 9.324 11.281 -13.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 8.021 11.399 -14.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 8.577 12.782 -14.178 1.00 0.00 H new ATOM 252 N ALA A 17 6.487 13.988 -8.261 1.00 0.00 N ATOM 253 CA ALA A 17 7.558 14.095 -7.236 1.00 0.00 C ATOM 254 C ALA A 17 8.753 13.226 -7.624 1.00 0.00 C ATOM 255 O ALA A 17 8.683 12.008 -7.630 1.00 0.00 O ATOM 256 CB ALA A 17 6.925 13.596 -5.938 1.00 0.00 C ATOM 0 H ALA A 17 5.716 13.365 -8.021 1.00 0.00 H new ATOM 0 HA ALA A 17 7.930 15.115 -7.137 1.00 0.00 H new ATOM 0 HB1 ALA A 17 7.658 13.646 -5.133 1.00 0.00 H new ATOM 0 HB2 ALA A 17 6.068 14.221 -5.687 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.596 12.565 -6.066 1.00 0.00 H new ATOM 262 N LEU A 18 9.850 13.854 -7.947 1.00 0.00 N ATOM 263 CA LEU A 18 11.073 13.097 -8.335 1.00 0.00 C ATOM 264 C LEU A 18 12.083 13.131 -7.187 1.00 0.00 C ATOM 265 O LEU A 18 12.765 14.116 -6.981 1.00 0.00 O ATOM 266 CB LEU A 18 11.627 13.842 -9.548 1.00 0.00 C ATOM 267 CG LEU A 18 11.419 13.002 -10.809 1.00 0.00 C ATOM 268 CD1 LEU A 18 12.358 11.796 -10.778 1.00 0.00 C ATOM 269 CD2 LEU A 18 9.969 12.515 -10.864 1.00 0.00 C ATOM 0 H LEU A 18 9.952 14.869 -7.959 1.00 0.00 H new ATOM 0 HA LEU A 18 10.865 12.050 -8.558 1.00 0.00 H new ATOM 0 HB2 LEU A 18 11.128 14.805 -9.655 1.00 0.00 H new ATOM 0 HB3 LEU A 18 12.688 14.047 -9.407 1.00 0.00 H new ATOM 0 HG LEU A 18 11.633 13.609 -11.689 1.00 0.00 H new ATOM 0 HD11 LEU A 18 12.210 11.197 -11.676 1.00 0.00 H new ATOM 0 HD12 LEU A 18 13.391 12.140 -10.737 1.00 0.00 H new ATOM 0 HD13 LEU A 18 12.143 11.190 -9.898 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.820 11.916 -11.763 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.755 11.908 -9.984 1.00 0.00 H new ATOM 0 HD23 LEU A 18 9.297 13.373 -10.885 1.00 0.00 H new ATOM 281 N LEU A 19 12.184 12.074 -6.434 1.00 0.00 N ATOM 282 CA LEU A 19 13.149 12.070 -5.300 1.00 0.00 C ATOM 283 C LEU A 19 13.434 10.640 -4.842 1.00 0.00 C ATOM 284 O LEU A 19 12.578 9.779 -4.889 1.00 0.00 O ATOM 285 CB LEU A 19 12.449 12.854 -4.190 1.00 0.00 C ATOM 286 CG LEU A 19 13.492 13.571 -3.333 1.00 0.00 C ATOM 287 CD1 LEU A 19 14.143 14.691 -4.148 1.00 0.00 C ATOM 288 CD2 LEU A 19 12.812 14.167 -2.099 1.00 0.00 C ATOM 0 H LEU A 19 11.644 11.217 -6.552 1.00 0.00 H new ATOM 0 HA LEU A 19 14.108 12.508 -5.576 1.00 0.00 H new ATOM 0 HB2 LEU A 19 11.759 13.578 -4.622 1.00 0.00 H new ATOM 0 HB3 LEU A 19 11.857 12.179 -3.572 1.00 0.00 H new ATOM 0 HG LEU A 19 14.257 12.860 -3.021 1.00 0.00 H new ATOM 0 HD11 LEU A 19 14.886 15.202 -3.536 1.00 0.00 H new ATOM 0 HD12 LEU A 19 14.627 14.267 -5.028 1.00 0.00 H new ATOM 0 HD13 LEU A 19 13.380 15.404 -4.462 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.554 14.679 -1.486 1.00 0.00 H new ATOM 0 HD22 LEU A 19 12.047 14.878 -2.413 1.00 0.00 H new ATOM 0 HD23 LEU A 19 12.349 13.369 -1.518 1.00 0.00 H new ATOM 300 N ASP A 20 14.630 10.384 -4.390 1.00 0.00 N ATOM 301 CA ASP A 20 14.968 9.014 -3.918 1.00 0.00 C ATOM 302 C ASP A 20 14.645 8.890 -2.428 1.00 0.00 C ATOM 303 O ASP A 20 15.382 9.355 -1.582 1.00 0.00 O ATOM 304 CB ASP A 20 16.471 8.871 -4.156 1.00 0.00 C ATOM 305 CG ASP A 20 16.723 8.507 -5.620 1.00 0.00 C ATOM 306 OD1 ASP A 20 15.868 8.803 -6.438 1.00 0.00 O ATOM 307 OD2 ASP A 20 17.766 7.940 -5.898 1.00 0.00 O ATOM 0 H ASP A 20 15.387 11.065 -4.327 1.00 0.00 H new ATOM 0 HA ASP A 20 14.403 8.240 -4.438 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.979 9.803 -3.909 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.882 8.101 -3.503 1.00 0.00 H new ATOM 312 N PHE A 21 13.545 8.271 -2.101 1.00 0.00 N ATOM 313 CA PHE A 21 13.175 8.125 -0.665 1.00 0.00 C ATOM 314 C PHE A 21 13.240 6.657 -0.250 1.00 0.00 C ATOM 315 O PHE A 21 12.332 5.888 -0.511 1.00 0.00 O ATOM 316 CB PHE A 21 11.740 8.644 -0.570 1.00 0.00 C ATOM 317 CG PHE A 21 11.638 9.656 0.546 1.00 0.00 C ATOM 318 CD1 PHE A 21 12.667 10.584 0.745 1.00 0.00 C ATOM 319 CD2 PHE A 21 10.514 9.669 1.380 1.00 0.00 C ATOM 320 CE1 PHE A 21 12.573 11.524 1.778 1.00 0.00 C ATOM 321 CE2 PHE A 21 10.419 10.609 2.413 1.00 0.00 C ATOM 322 CZ PHE A 21 11.449 11.536 2.612 1.00 0.00 C ATOM 0 H PHE A 21 12.887 7.861 -2.764 1.00 0.00 H new ATOM 0 HA PHE A 21 13.851 8.672 -0.008 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.444 9.099 -1.515 1.00 0.00 H new ATOM 0 HB3 PHE A 21 11.055 7.816 -0.387 1.00 0.00 H new ATOM 0 HD1 PHE A 21 13.534 10.575 0.101 1.00 0.00 H new ATOM 0 HD2 PHE A 21 9.720 8.954 1.227 1.00 0.00 H new ATOM 0 HE1 PHE A 21 13.367 12.240 1.931 1.00 0.00 H new ATOM 0 HE2 PHE A 21 9.551 10.619 3.056 1.00 0.00 H new ATOM 0 HZ PHE A 21 11.376 12.261 3.409 1.00 0.00 H new ATOM 332 N GLU A 22 14.306 6.267 0.398 1.00 0.00 N ATOM 333 CA GLU A 22 14.440 4.850 0.842 1.00 0.00 C ATOM 334 C GLU A 22 14.126 4.738 2.336 1.00 0.00 C ATOM 335 O GLU A 22 14.831 5.270 3.170 1.00 0.00 O ATOM 336 CB GLU A 22 15.900 4.487 0.570 1.00 0.00 C ATOM 337 CG GLU A 22 15.988 3.023 0.131 1.00 0.00 C ATOM 338 CD GLU A 22 16.320 2.148 1.341 1.00 0.00 C ATOM 339 OE1 GLU A 22 17.491 2.037 1.664 1.00 0.00 O ATOM 340 OE2 GLU A 22 15.397 1.604 1.925 1.00 0.00 O ATOM 0 H GLU A 22 15.092 6.871 0.639 1.00 0.00 H new ATOM 0 HA GLU A 22 13.753 4.184 0.321 1.00 0.00 H new ATOM 0 HB2 GLU A 22 16.309 5.135 -0.205 1.00 0.00 H new ATOM 0 HB3 GLU A 22 16.499 4.646 1.467 1.00 0.00 H new ATOM 0 HG2 GLU A 22 15.043 2.707 -0.312 1.00 0.00 H new ATOM 0 HG3 GLU A 22 16.754 2.907 -0.636 1.00 0.00 H new ATOM 347 N ASP A 23 13.070 4.053 2.680 1.00 0.00 N ATOM 348 CA ASP A 23 12.710 3.911 4.120 1.00 0.00 C ATOM 349 C ASP A 23 12.647 2.431 4.513 1.00 0.00 C ATOM 350 O ASP A 23 12.101 1.612 3.801 1.00 0.00 O ATOM 351 CB ASP A 23 11.330 4.559 4.246 1.00 0.00 C ATOM 352 CG ASP A 23 11.410 5.759 5.191 1.00 0.00 C ATOM 353 OD1 ASP A 23 12.473 6.352 5.274 1.00 0.00 O ATOM 354 OD2 ASP A 23 10.408 6.065 5.815 1.00 0.00 O ATOM 0 H ASP A 23 12.441 3.586 2.027 1.00 0.00 H new ATOM 0 HA ASP A 23 13.444 4.379 4.776 1.00 0.00 H new ATOM 0 HB2 ASP A 23 10.976 4.878 3.266 1.00 0.00 H new ATOM 0 HB3 ASP A 23 10.610 3.833 4.624 1.00 0.00 H new ATOM 359 N LYS A 24 13.199 2.085 5.644 1.00 0.00 N ATOM 360 CA LYS A 24 13.167 0.661 6.086 1.00 0.00 C ATOM 361 C LYS A 24 11.813 0.343 6.728 1.00 0.00 C ATOM 362 O LYS A 24 11.499 -0.797 7.009 1.00 0.00 O ATOM 363 CB LYS A 24 14.294 0.541 7.114 1.00 0.00 C ATOM 364 CG LYS A 24 14.100 -0.729 7.945 1.00 0.00 C ATOM 365 CD LYS A 24 15.127 -0.761 9.079 1.00 0.00 C ATOM 366 CE LYS A 24 16.207 -1.798 8.761 1.00 0.00 C ATOM 367 NZ LYS A 24 15.846 -2.990 9.576 1.00 0.00 N ATOM 0 H LYS A 24 13.671 2.727 6.281 1.00 0.00 H new ATOM 0 HA LYS A 24 13.298 -0.036 5.258 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.259 0.513 6.608 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.301 1.416 7.765 1.00 0.00 H new ATOM 0 HG2 LYS A 24 13.090 -0.757 8.354 1.00 0.00 H new ATOM 0 HG3 LYS A 24 14.213 -1.610 7.313 1.00 0.00 H new ATOM 0 HD2 LYS A 24 15.578 0.223 9.203 1.00 0.00 H new ATOM 0 HD3 LYS A 24 14.637 -1.008 10.021 1.00 0.00 H new ATOM 0 HE2 LYS A 24 16.224 -2.037 7.698 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.199 -1.428 9.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 16.541 -3.746 9.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 15.844 -2.734 10.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 14.900 -3.324 9.302 1.00 0.00 H new ATOM 381 N ASP A 25 11.010 1.344 6.963 1.00 0.00 N ATOM 382 CA ASP A 25 9.678 1.101 7.588 1.00 0.00 C ATOM 383 C ASP A 25 8.817 0.217 6.681 1.00 0.00 C ATOM 384 O ASP A 25 7.949 -0.498 7.139 1.00 0.00 O ATOM 385 CB ASP A 25 9.054 2.489 7.730 1.00 0.00 C ATOM 386 CG ASP A 25 7.999 2.463 8.837 1.00 0.00 C ATOM 387 OD1 ASP A 25 8.074 1.585 9.681 1.00 0.00 O ATOM 388 OD2 ASP A 25 7.133 3.323 8.823 1.00 0.00 O ATOM 0 H ASP A 25 11.218 2.320 6.750 1.00 0.00 H new ATOM 0 HA ASP A 25 9.759 0.586 8.545 1.00 0.00 H new ATOM 0 HB2 ASP A 25 9.824 3.224 7.964 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.600 2.793 6.787 1.00 0.00 H new ATOM 393 N GLY A 26 9.049 0.262 5.398 1.00 0.00 N ATOM 394 CA GLY A 26 8.240 -0.574 4.466 1.00 0.00 C ATOM 395 C GLY A 26 7.686 0.301 3.339 1.00 0.00 C ATOM 396 O GLY A 26 7.028 -0.177 2.437 1.00 0.00 O ATOM 0 H GLY A 26 9.763 0.841 4.955 1.00 0.00 H new ATOM 0 HA2 GLY A 26 8.855 -1.372 4.051 1.00 0.00 H new ATOM 0 HA3 GLY A 26 7.422 -1.050 5.006 1.00 0.00 H new ATOM 400 N ASP A 27 7.948 1.579 3.380 1.00 0.00 N ATOM 401 CA ASP A 27 7.436 2.480 2.308 1.00 0.00 C ATOM 402 C ASP A 27 8.571 3.358 1.775 1.00 0.00 C ATOM 403 O ASP A 27 9.212 4.075 2.517 1.00 0.00 O ATOM 404 CB ASP A 27 6.367 3.338 2.986 1.00 0.00 C ATOM 405 CG ASP A 27 5.078 3.287 2.164 1.00 0.00 C ATOM 406 OD1 ASP A 27 4.643 2.192 1.847 1.00 0.00 O ATOM 407 OD2 ASP A 27 4.547 4.344 1.866 1.00 0.00 O ATOM 0 H ASP A 27 8.494 2.038 4.109 1.00 0.00 H new ATOM 0 HA ASP A 27 7.034 1.927 1.459 1.00 0.00 H new ATOM 0 HB2 ASP A 27 6.181 2.975 3.997 1.00 0.00 H new ATOM 0 HB3 ASP A 27 6.714 4.367 3.075 1.00 0.00 H new ATOM 412 N LYS A 28 8.827 3.304 0.497 1.00 0.00 N ATOM 413 CA LYS A 28 9.926 4.133 -0.076 1.00 0.00 C ATOM 414 C LYS A 28 9.627 4.481 -1.537 1.00 0.00 C ATOM 415 O LYS A 28 9.068 3.690 -2.271 1.00 0.00 O ATOM 416 CB LYS A 28 11.168 3.251 0.027 1.00 0.00 C ATOM 417 CG LYS A 28 11.130 2.174 -1.058 1.00 0.00 C ATOM 418 CD LYS A 28 12.122 1.061 -0.708 1.00 0.00 C ATOM 419 CE LYS A 28 11.653 0.336 0.557 1.00 0.00 C ATOM 420 NZ LYS A 28 12.658 -0.741 0.779 1.00 0.00 N ATOM 0 H LYS A 28 8.324 2.723 -0.174 1.00 0.00 H new ATOM 0 HA LYS A 28 10.050 5.080 0.449 1.00 0.00 H new ATOM 0 HB2 LYS A 28 12.067 3.858 -0.082 1.00 0.00 H new ATOM 0 HB3 LYS A 28 11.215 2.786 1.012 1.00 0.00 H new ATOM 0 HG2 LYS A 28 10.123 1.765 -1.144 1.00 0.00 H new ATOM 0 HG3 LYS A 28 11.381 2.609 -2.026 1.00 0.00 H new ATOM 0 HD2 LYS A 28 12.201 0.356 -1.536 1.00 0.00 H new ATOM 0 HD3 LYS A 28 13.116 1.481 -0.552 1.00 0.00 H new ATOM 0 HE2 LYS A 28 11.608 1.016 1.408 1.00 0.00 H new ATOM 0 HE3 LYS A 28 10.653 -0.078 0.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 12.404 -1.283 1.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 12.673 -1.376 -0.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 13.599 -0.317 0.906 1.00 0.00 H new ATOM 434 N VAL A 29 9.997 5.657 -1.968 1.00 0.00 N ATOM 435 CA VAL A 29 9.729 6.040 -3.387 1.00 0.00 C ATOM 436 C VAL A 29 11.048 6.181 -4.154 1.00 0.00 C ATOM 437 O VAL A 29 12.088 6.431 -3.578 1.00 0.00 O ATOM 438 CB VAL A 29 8.963 7.382 -3.335 1.00 0.00 C ATOM 439 CG1 VAL A 29 8.097 7.447 -2.074 1.00 0.00 C ATOM 440 CG2 VAL A 29 9.943 8.561 -3.327 1.00 0.00 C ATOM 0 H VAL A 29 10.469 6.365 -1.405 1.00 0.00 H new ATOM 0 HA VAL A 29 9.143 5.282 -3.907 1.00 0.00 H new ATOM 0 HB VAL A 29 8.330 7.445 -4.220 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.562 8.397 -2.048 1.00 0.00 H new ATOM 0 HG12 VAL A 29 7.379 6.627 -2.083 1.00 0.00 H new ATOM 0 HG13 VAL A 29 8.732 7.364 -1.192 1.00 0.00 H new ATOM 0 HG21 VAL A 29 9.386 9.497 -3.290 1.00 0.00 H new ATOM 0 HG22 VAL A 29 10.591 8.490 -2.453 1.00 0.00 H new ATOM 0 HG23 VAL A 29 10.550 8.536 -4.232 1.00 0.00 H new ATOM 450 N VAL A 30 11.013 6.032 -5.448 1.00 0.00 N ATOM 451 CA VAL A 30 12.263 6.168 -6.245 1.00 0.00 C ATOM 452 C VAL A 30 12.005 7.026 -7.483 1.00 0.00 C ATOM 453 O VAL A 30 11.784 6.523 -8.567 1.00 0.00 O ATOM 454 CB VAL A 30 12.639 4.744 -6.642 1.00 0.00 C ATOM 455 CG1 VAL A 30 13.021 3.958 -5.389 1.00 0.00 C ATOM 456 CG2 VAL A 30 11.446 4.071 -7.324 1.00 0.00 C ATOM 0 H VAL A 30 10.174 5.822 -5.988 1.00 0.00 H new ATOM 0 HA VAL A 30 13.062 6.654 -5.684 1.00 0.00 H new ATOM 0 HB VAL A 30 13.483 4.767 -7.332 1.00 0.00 H new ATOM 0 HG11 VAL A 30 13.291 2.939 -5.667 1.00 0.00 H new ATOM 0 HG12 VAL A 30 13.870 4.438 -4.903 1.00 0.00 H new ATOM 0 HG13 VAL A 30 12.175 3.935 -4.702 1.00 0.00 H new ATOM 0 HG21 VAL A 30 11.715 3.054 -7.607 1.00 0.00 H new ATOM 0 HG22 VAL A 30 10.601 4.044 -6.636 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.171 4.635 -8.215 1.00 0.00 H new ATOM 466 N ALA A 31 12.035 8.321 -7.325 1.00 0.00 N ATOM 467 CA ALA A 31 11.794 9.228 -8.485 1.00 0.00 C ATOM 468 C ALA A 31 10.658 8.686 -9.356 1.00 0.00 C ATOM 469 O ALA A 31 10.887 8.147 -10.422 1.00 0.00 O ATOM 470 CB ALA A 31 13.113 9.232 -9.259 1.00 0.00 C ATOM 0 H ALA A 31 12.217 8.793 -6.439 1.00 0.00 H new ATOM 0 HA ALA A 31 11.500 10.230 -8.174 1.00 0.00 H new ATOM 0 HB1 ALA A 31 13.021 9.878 -10.132 1.00 0.00 H new ATOM 0 HB2 ALA A 31 13.911 9.603 -8.616 1.00 0.00 H new ATOM 0 HB3 ALA A 31 13.349 8.218 -9.582 1.00 0.00 H new ATOM 476 N GLY A 32 9.435 8.819 -8.916 1.00 0.00 N ATOM 477 CA GLY A 32 8.301 8.304 -9.732 1.00 0.00 C ATOM 478 C GLY A 32 6.962 8.606 -9.050 1.00 0.00 C ATOM 479 O GLY A 32 5.990 7.905 -9.253 1.00 0.00 O ATOM 0 H GLY A 32 9.175 9.259 -8.033 1.00 0.00 H new ATOM 0 HA2 GLY A 32 8.322 8.760 -10.722 1.00 0.00 H new ATOM 0 HA3 GLY A 32 8.408 7.229 -9.875 1.00 0.00 H new ATOM 483 N ASP A 33 6.884 9.638 -8.251 1.00 0.00 N ATOM 484 CA ASP A 33 5.581 9.948 -7.588 1.00 0.00 C ATOM 485 C ASP A 33 4.850 11.055 -8.359 1.00 0.00 C ATOM 486 O ASP A 33 5.467 11.905 -8.967 1.00 0.00 O ATOM 487 CB ASP A 33 5.944 10.426 -6.182 1.00 0.00 C ATOM 488 CG ASP A 33 6.785 9.361 -5.476 1.00 0.00 C ATOM 489 OD1 ASP A 33 6.248 8.302 -5.191 1.00 0.00 O ATOM 490 OD2 ASP A 33 7.951 9.621 -5.230 1.00 0.00 O ATOM 0 H ASP A 33 7.653 10.271 -8.031 1.00 0.00 H new ATOM 0 HA ASP A 33 4.919 9.083 -7.560 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.498 11.363 -6.238 1.00 0.00 H new ATOM 0 HB3 ASP A 33 5.038 10.626 -5.610 1.00 0.00 H new ATOM 495 N GLU A 34 3.542 11.052 -8.345 1.00 0.00 N ATOM 496 CA GLU A 34 2.786 12.111 -9.079 1.00 0.00 C ATOM 497 C GLU A 34 1.428 12.360 -8.411 1.00 0.00 C ATOM 498 O GLU A 34 0.822 11.460 -7.866 1.00 0.00 O ATOM 499 CB GLU A 34 2.598 11.556 -10.492 1.00 0.00 C ATOM 500 CG GLU A 34 1.514 12.355 -11.217 1.00 0.00 C ATOM 501 CD GLU A 34 1.950 12.617 -12.660 1.00 0.00 C ATOM 502 OE1 GLU A 34 2.488 11.707 -13.269 1.00 0.00 O ATOM 503 OE2 GLU A 34 1.737 13.722 -13.131 1.00 0.00 O ATOM 0 H GLU A 34 2.966 10.365 -7.859 1.00 0.00 H new ATOM 0 HA GLU A 34 3.313 13.065 -9.082 1.00 0.00 H new ATOM 0 HB2 GLU A 34 3.536 11.613 -11.044 1.00 0.00 H new ATOM 0 HB3 GLU A 34 2.319 10.503 -10.446 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.573 11.805 -11.205 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.338 13.299 -10.702 1.00 0.00 H new ATOM 510 N TRP A 35 0.945 13.578 -8.446 1.00 0.00 N ATOM 511 CA TRP A 35 -0.373 13.869 -7.808 1.00 0.00 C ATOM 512 C TRP A 35 -0.974 15.174 -8.342 1.00 0.00 C ATOM 513 O TRP A 35 -0.340 15.915 -9.065 1.00 0.00 O ATOM 514 CB TRP A 35 -0.075 13.979 -6.309 1.00 0.00 C ATOM 515 CG TRP A 35 0.542 15.309 -6.000 1.00 0.00 C ATOM 516 CD1 TRP A 35 -0.103 16.349 -5.424 1.00 0.00 C ATOM 517 CD2 TRP A 35 1.909 15.753 -6.234 1.00 0.00 C ATOM 518 NE1 TRP A 35 0.783 17.405 -5.290 1.00 0.00 N ATOM 519 CE2 TRP A 35 2.036 17.086 -5.775 1.00 0.00 C ATOM 520 CE3 TRP A 35 3.038 15.136 -6.794 1.00 0.00 C ATOM 521 CZ2 TRP A 35 3.245 17.781 -5.869 1.00 0.00 C ATOM 522 CZ3 TRP A 35 4.254 15.831 -6.890 1.00 0.00 C ATOM 523 CH2 TRP A 35 4.358 17.149 -6.430 1.00 0.00 C ATOM 0 H TRP A 35 1.403 14.376 -8.885 1.00 0.00 H new ATOM 0 HA TRP A 35 -1.105 13.091 -8.024 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -0.995 13.855 -5.738 1.00 0.00 H new ATOM 0 HB3 TRP A 35 0.599 13.178 -6.005 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -1.139 16.355 -5.119 1.00 0.00 H new ATOM 0 HE1 TRP A 35 0.540 18.308 -4.883 1.00 0.00 H new ATOM 0 HE3 TRP A 35 2.971 14.120 -7.154 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 3.318 18.797 -5.511 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 5.116 15.345 -7.322 1.00 0.00 H new ATOM 0 HH2 TRP A 35 5.297 17.677 -6.509 1.00 0.00 H new ATOM 534 N LEU A 36 -2.200 15.450 -7.986 1.00 0.00 N ATOM 535 CA LEU A 36 -2.865 16.699 -8.461 1.00 0.00 C ATOM 536 C LEU A 36 -2.647 17.827 -7.448 1.00 0.00 C ATOM 537 O LEU A 36 -2.415 17.586 -6.281 1.00 0.00 O ATOM 538 CB LEU A 36 -4.348 16.334 -8.549 1.00 0.00 C ATOM 539 CG LEU A 36 -5.114 17.442 -9.275 1.00 0.00 C ATOM 540 CD1 LEU A 36 -4.390 17.805 -10.571 1.00 0.00 C ATOM 541 CD2 LEU A 36 -6.523 16.946 -9.606 1.00 0.00 C ATOM 0 H LEU A 36 -2.773 14.860 -7.383 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.470 17.050 -9.415 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -4.468 15.389 -9.079 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.757 16.192 -7.549 1.00 0.00 H new ATOM 0 HG LEU A 36 -5.172 18.322 -8.635 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.938 18.594 -11.085 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.383 18.154 -10.340 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -4.331 16.926 -11.213 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -7.073 17.732 -10.123 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.458 16.066 -10.247 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -7.043 16.686 -8.684 1.00 0.00 H new ATOM 553 N PHE A 37 -2.718 19.056 -7.882 1.00 0.00 N ATOM 554 CA PHE A 37 -2.512 20.191 -6.935 1.00 0.00 C ATOM 555 C PHE A 37 -3.587 21.262 -7.150 1.00 0.00 C ATOM 556 O PHE A 37 -3.609 21.942 -8.157 1.00 0.00 O ATOM 557 CB PHE A 37 -1.122 20.736 -7.278 1.00 0.00 C ATOM 558 CG PHE A 37 -0.714 21.810 -6.288 1.00 0.00 C ATOM 559 CD1 PHE A 37 -1.569 22.179 -5.239 1.00 0.00 C ATOM 560 CD2 PHE A 37 0.529 22.440 -6.427 1.00 0.00 C ATOM 561 CE1 PHE A 37 -1.180 23.175 -4.335 1.00 0.00 C ATOM 562 CE2 PHE A 37 0.917 23.435 -5.522 1.00 0.00 C ATOM 563 CZ PHE A 37 0.062 23.803 -4.477 1.00 0.00 C ATOM 0 H PHE A 37 -2.909 19.324 -8.848 1.00 0.00 H new ATOM 0 HA PHE A 37 -2.583 19.884 -5.892 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.394 19.925 -7.265 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.125 21.146 -8.288 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.528 21.695 -5.129 1.00 0.00 H new ATOM 0 HD2 PHE A 37 1.189 22.158 -7.234 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -1.839 23.459 -3.528 1.00 0.00 H new ATOM 0 HE2 PHE A 37 1.876 23.919 -5.630 1.00 0.00 H new ATOM 0 HZ PHE A 37 0.361 24.572 -3.780 1.00 0.00 H new ATOM 573 N GLU A 38 -4.480 21.414 -6.208 1.00 0.00 N ATOM 574 CA GLU A 38 -5.555 22.437 -6.352 1.00 0.00 C ATOM 575 C GLU A 38 -5.053 23.809 -5.892 1.00 0.00 C ATOM 576 O GLU A 38 -4.467 23.945 -4.836 1.00 0.00 O ATOM 577 CB GLU A 38 -6.686 21.950 -5.446 1.00 0.00 C ATOM 578 CG GLU A 38 -7.883 22.895 -5.569 1.00 0.00 C ATOM 579 CD GLU A 38 -7.630 24.150 -4.731 1.00 0.00 C ATOM 580 OE1 GLU A 38 -6.713 24.126 -3.927 1.00 0.00 O ATOM 581 OE2 GLU A 38 -8.358 25.113 -4.908 1.00 0.00 O ATOM 0 H GLU A 38 -4.511 20.873 -5.344 1.00 0.00 H new ATOM 0 HA GLU A 38 -5.878 22.551 -7.387 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -6.979 20.938 -5.724 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -6.346 21.910 -4.411 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -8.039 23.167 -6.613 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.791 22.395 -5.230 1.00 0.00 H new ATOM 588 N GLY A 39 -5.276 24.825 -6.680 1.00 0.00 N ATOM 589 CA GLY A 39 -4.814 26.189 -6.300 1.00 0.00 C ATOM 590 C GLY A 39 -3.282 26.245 -6.288 1.00 0.00 C ATOM 591 O GLY A 39 -2.696 26.816 -5.390 1.00 0.00 O ATOM 0 H GLY A 39 -5.761 24.768 -7.575 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -5.206 26.923 -7.004 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -5.202 26.451 -5.316 1.00 0.00 H new ATOM 595 N PRO A 40 -2.675 25.663 -7.295 1.00 0.00 N ATOM 596 CA PRO A 40 -1.191 25.669 -7.395 1.00 0.00 C ATOM 597 C PRO A 40 -0.672 27.030 -7.886 1.00 0.00 C ATOM 598 O PRO A 40 0.405 27.123 -8.436 1.00 0.00 O ATOM 599 CB PRO A 40 -0.902 24.604 -8.443 1.00 0.00 C ATOM 600 CG PRO A 40 -2.136 24.540 -9.286 1.00 0.00 C ATOM 601 CD PRO A 40 -3.296 24.939 -8.413 1.00 0.00 C ATOM 0 HA PRO A 40 -0.711 25.484 -6.434 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -0.029 24.866 -9.041 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -0.692 23.641 -7.978 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -2.052 25.209 -10.142 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -2.280 23.534 -9.681 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -4.002 25.570 -8.953 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -3.850 24.067 -8.064 1.00 0.00 H new ATOM 609 N GLY A 41 -1.420 28.082 -7.706 1.00 0.00 N ATOM 610 CA GLY A 41 -0.950 29.412 -8.176 1.00 0.00 C ATOM 611 C GLY A 41 0.474 29.665 -7.679 1.00 0.00 C ATOM 612 O GLY A 41 1.325 30.126 -8.412 1.00 0.00 O ATOM 0 H GLY A 41 -2.335 28.078 -7.255 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -0.977 29.453 -9.265 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -1.616 30.193 -7.810 1.00 0.00 H new ATOM 616 N THR A 42 0.739 29.374 -6.436 1.00 0.00 N ATOM 617 CA THR A 42 2.107 29.609 -5.893 1.00 0.00 C ATOM 618 C THR A 42 2.977 28.359 -6.059 1.00 0.00 C ATOM 619 O THR A 42 3.876 28.112 -5.279 1.00 0.00 O ATOM 620 CB THR A 42 1.891 29.922 -4.412 1.00 0.00 C ATOM 621 OG1 THR A 42 1.439 28.753 -3.744 1.00 0.00 O ATOM 622 CG2 THR A 42 0.845 31.028 -4.270 1.00 0.00 C ATOM 0 H THR A 42 0.069 28.984 -5.773 1.00 0.00 H new ATOM 0 HA THR A 42 2.623 30.416 -6.414 1.00 0.00 H new ATOM 0 HB THR A 42 2.830 30.254 -3.970 1.00 0.00 H new ATOM 0 HG1 THR A 42 1.302 28.951 -2.794 1.00 0.00 H new ATOM 0 HG21 THR A 42 0.692 31.250 -3.214 1.00 0.00 H new ATOM 0 HG22 THR A 42 1.192 31.925 -4.783 1.00 0.00 H new ATOM 0 HG23 THR A 42 -0.095 30.698 -4.712 1.00 0.00 H new ATOM 630 N TYR A 43 2.724 27.571 -7.069 1.00 0.00 N ATOM 631 CA TYR A 43 3.547 26.345 -7.278 1.00 0.00 C ATOM 632 C TYR A 43 4.774 26.674 -8.134 1.00 0.00 C ATOM 633 O TYR A 43 4.674 27.310 -9.164 1.00 0.00 O ATOM 634 CB TYR A 43 2.627 25.361 -8.010 1.00 0.00 C ATOM 635 CG TYR A 43 3.460 24.305 -8.702 1.00 0.00 C ATOM 636 CD1 TYR A 43 4.220 23.402 -7.948 1.00 0.00 C ATOM 637 CD2 TYR A 43 3.477 24.238 -10.100 1.00 0.00 C ATOM 638 CE1 TYR A 43 4.996 22.432 -8.593 1.00 0.00 C ATOM 639 CE2 TYR A 43 4.254 23.268 -10.745 1.00 0.00 C ATOM 640 CZ TYR A 43 5.013 22.366 -9.991 1.00 0.00 C ATOM 641 OH TYR A 43 5.779 21.410 -10.627 1.00 0.00 O ATOM 0 H TYR A 43 1.986 27.722 -7.756 1.00 0.00 H new ATOM 0 HA TYR A 43 3.915 25.931 -6.339 1.00 0.00 H new ATOM 0 HB2 TYR A 43 1.943 24.893 -7.303 1.00 0.00 H new ATOM 0 HB3 TYR A 43 2.016 25.893 -8.740 1.00 0.00 H new ATOM 0 HD1 TYR A 43 4.207 23.454 -6.869 1.00 0.00 H new ATOM 0 HD2 TYR A 43 2.891 24.934 -10.681 1.00 0.00 H new ATOM 0 HE1 TYR A 43 5.581 21.735 -8.012 1.00 0.00 H new ATOM 0 HE2 TYR A 43 4.268 23.216 -11.824 1.00 0.00 H new ATOM 0 HH TYR A 43 6.419 21.028 -9.991 1.00 0.00 H new ATOM 651 N ILE A 44 5.928 26.233 -7.719 1.00 0.00 N ATOM 652 CA ILE A 44 7.159 26.505 -8.510 1.00 0.00 C ATOM 653 C ILE A 44 7.844 25.182 -8.862 1.00 0.00 C ATOM 654 O ILE A 44 7.788 24.234 -8.104 1.00 0.00 O ATOM 655 CB ILE A 44 8.043 27.349 -7.593 1.00 0.00 C ATOM 656 CG1 ILE A 44 7.409 28.731 -7.412 1.00 0.00 C ATOM 657 CG2 ILE A 44 9.432 27.501 -8.217 1.00 0.00 C ATOM 658 CD1 ILE A 44 6.445 28.699 -6.225 1.00 0.00 C ATOM 0 H ILE A 44 6.072 25.695 -6.864 1.00 0.00 H new ATOM 0 HA ILE A 44 6.952 27.020 -9.448 1.00 0.00 H new ATOM 0 HB ILE A 44 8.136 26.859 -6.624 1.00 0.00 H new ATOM 0 HG12 ILE A 44 8.184 29.479 -7.245 1.00 0.00 H new ATOM 0 HG13 ILE A 44 6.877 29.020 -8.318 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.061 28.103 -7.562 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.882 26.517 -8.348 1.00 0.00 H new ATOM 0 HG23 ILE A 44 9.344 27.991 -9.186 1.00 0.00 H new ATOM 0 HD11 ILE A 44 5.994 29.683 -6.096 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.663 27.963 -6.411 1.00 0.00 H new ATOM 0 HD13 ILE A 44 6.990 28.429 -5.321 1.00 0.00 H new ATOM 670 N PRO A 45 8.461 25.158 -10.010 1.00 0.00 N ATOM 671 CA PRO A 45 9.154 23.932 -10.472 1.00 0.00 C ATOM 672 C PRO A 45 10.422 23.685 -9.649 1.00 0.00 C ATOM 673 O PRO A 45 11.432 24.335 -9.834 1.00 0.00 O ATOM 674 CB PRO A 45 9.492 24.241 -11.928 1.00 0.00 C ATOM 675 CG PRO A 45 9.540 25.734 -12.006 1.00 0.00 C ATOM 676 CD PRO A 45 8.574 26.257 -10.974 1.00 0.00 C ATOM 0 HA PRO A 45 8.550 23.031 -10.363 1.00 0.00 H new ATOM 0 HB2 PRO A 45 10.447 23.800 -12.214 1.00 0.00 H new ATOM 0 HB3 PRO A 45 8.739 23.835 -12.603 1.00 0.00 H new ATOM 0 HG2 PRO A 45 10.548 26.099 -11.811 1.00 0.00 H new ATOM 0 HG3 PRO A 45 9.264 26.078 -13.003 1.00 0.00 H new ATOM 0 HD2 PRO A 45 8.947 27.166 -10.502 1.00 0.00 H new ATOM 0 HD3 PRO A 45 7.609 26.501 -11.417 1.00 0.00 H new ATOM 684 N ARG A 46 10.373 22.747 -8.742 1.00 0.00 N ATOM 685 CA ARG A 46 11.571 22.449 -7.903 1.00 0.00 C ATOM 686 C ARG A 46 12.104 21.049 -8.225 1.00 0.00 C ATOM 687 O ARG A 46 11.349 20.123 -8.439 1.00 0.00 O ATOM 688 CB ARG A 46 11.069 22.515 -6.459 1.00 0.00 C ATOM 689 CG ARG A 46 11.833 23.602 -5.700 1.00 0.00 C ATOM 690 CD ARG A 46 11.242 23.759 -4.296 1.00 0.00 C ATOM 691 NE ARG A 46 9.795 24.038 -4.514 1.00 0.00 N ATOM 692 CZ ARG A 46 8.922 23.697 -3.605 1.00 0.00 C ATOM 693 NH1 ARG A 46 8.530 22.456 -3.510 1.00 0.00 N ATOM 694 NH2 ARG A 46 8.441 24.596 -2.790 1.00 0.00 N ATOM 0 H ARG A 46 9.553 22.173 -8.545 1.00 0.00 H new ATOM 0 HA ARG A 46 12.387 23.149 -8.082 1.00 0.00 H new ATOM 0 HB2 ARG A 46 10.000 22.729 -6.444 1.00 0.00 H new ATOM 0 HB3 ARG A 46 11.207 21.550 -5.971 1.00 0.00 H new ATOM 0 HG2 ARG A 46 12.889 23.340 -5.634 1.00 0.00 H new ATOM 0 HG3 ARG A 46 11.772 24.547 -6.239 1.00 0.00 H new ATOM 0 HD2 ARG A 46 11.385 22.854 -3.705 1.00 0.00 H new ATOM 0 HD3 ARG A 46 11.723 24.573 -3.754 1.00 0.00 H new ATOM 0 HE ARG A 46 9.487 24.495 -5.372 1.00 0.00 H new ATOM 0 HH11 ARG A 46 8.906 21.752 -4.146 1.00 0.00 H new ATOM 0 HH12 ARG A 46 7.848 22.190 -2.800 1.00 0.00 H new ATOM 0 HH21 ARG A 46 8.747 25.566 -2.863 1.00 0.00 H new ATOM 0 HH22 ARG A 46 7.759 24.328 -2.080 1.00 0.00 H new ATOM 708 N LYS A 47 13.400 20.887 -8.263 1.00 0.00 N ATOM 709 CA LYS A 47 13.979 19.546 -8.576 1.00 0.00 C ATOM 710 C LYS A 47 13.200 18.442 -7.853 1.00 0.00 C ATOM 711 O LYS A 47 13.037 17.351 -8.362 1.00 0.00 O ATOM 712 CB LYS A 47 15.420 19.606 -8.064 1.00 0.00 C ATOM 713 CG LYS A 47 16.326 18.795 -8.992 1.00 0.00 C ATOM 714 CD LYS A 47 17.791 19.045 -8.627 1.00 0.00 C ATOM 715 CE LYS A 47 18.545 17.713 -8.586 1.00 0.00 C ATOM 716 NZ LYS A 47 18.251 17.135 -7.242 1.00 0.00 N ATOM 0 H LYS A 47 14.083 21.625 -8.091 1.00 0.00 H new ATOM 0 HA LYS A 47 13.931 19.319 -9.641 1.00 0.00 H new ATOM 0 HB2 LYS A 47 15.759 20.641 -8.021 1.00 0.00 H new ATOM 0 HB3 LYS A 47 15.473 19.211 -7.050 1.00 0.00 H new ATOM 0 HG2 LYS A 47 16.095 17.733 -8.905 1.00 0.00 H new ATOM 0 HG3 LYS A 47 16.146 19.077 -10.030 1.00 0.00 H new ATOM 0 HD2 LYS A 47 18.250 19.712 -9.357 1.00 0.00 H new ATOM 0 HD3 LYS A 47 17.855 19.541 -7.658 1.00 0.00 H new ATOM 0 HE2 LYS A 47 18.211 17.047 -9.382 1.00 0.00 H new ATOM 0 HE3 LYS A 47 19.616 17.863 -8.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 18.736 16.220 -7.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 18.586 17.786 -6.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 17.225 16.996 -7.141 1.00 0.00 H new ATOM 730 N GLU A 48 12.723 18.713 -6.669 1.00 0.00 N ATOM 731 CA GLU A 48 11.961 17.675 -5.915 1.00 0.00 C ATOM 732 C GLU A 48 10.822 17.116 -6.773 1.00 0.00 C ATOM 733 O GLU A 48 10.548 15.934 -6.756 1.00 0.00 O ATOM 734 CB GLU A 48 11.406 18.400 -4.688 1.00 0.00 C ATOM 735 CG GLU A 48 11.598 17.525 -3.448 1.00 0.00 C ATOM 736 CD GLU A 48 11.864 18.413 -2.231 1.00 0.00 C ATOM 737 OE1 GLU A 48 12.522 19.427 -2.395 1.00 0.00 O ATOM 738 OE2 GLU A 48 11.404 18.065 -1.157 1.00 0.00 O ATOM 0 H GLU A 48 12.827 19.608 -6.190 1.00 0.00 H new ATOM 0 HA GLU A 48 12.588 16.828 -5.638 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.915 19.354 -4.555 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.348 18.620 -4.830 1.00 0.00 H new ATOM 0 HG2 GLU A 48 10.710 16.916 -3.279 1.00 0.00 H new ATOM 0 HG3 GLU A 48 12.431 16.839 -3.600 1.00 0.00 H new ATOM 745 N VAL A 49 10.161 17.954 -7.525 1.00 0.00 N ATOM 746 CA VAL A 49 9.043 17.468 -8.390 1.00 0.00 C ATOM 747 C VAL A 49 9.016 18.271 -9.696 1.00 0.00 C ATOM 748 O VAL A 49 9.746 19.227 -9.859 1.00 0.00 O ATOM 749 CB VAL A 49 7.757 17.689 -7.575 1.00 0.00 C ATOM 750 CG1 VAL A 49 8.020 17.395 -6.095 1.00 0.00 C ATOM 751 CG2 VAL A 49 7.285 19.139 -7.723 1.00 0.00 C ATOM 0 H VAL A 49 10.346 18.956 -7.579 1.00 0.00 H new ATOM 0 HA VAL A 49 9.155 16.418 -8.662 1.00 0.00 H new ATOM 0 HB VAL A 49 6.986 17.016 -7.950 1.00 0.00 H new ATOM 0 HG11 VAL A 49 7.105 17.554 -5.524 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.344 16.360 -5.981 1.00 0.00 H new ATOM 0 HG13 VAL A 49 8.799 18.061 -5.724 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.374 19.286 -7.143 1.00 0.00 H new ATOM 0 HG22 VAL A 49 8.060 19.813 -7.359 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.084 19.351 -8.773 1.00 0.00 H new ATOM 761 N GLU A 50 8.187 17.895 -10.631 1.00 0.00 N ATOM 762 CA GLU A 50 8.135 18.651 -11.917 1.00 0.00 C ATOM 763 C GLU A 50 6.695 18.753 -12.426 1.00 0.00 C ATOM 764 O GLU A 50 5.930 17.813 -12.347 1.00 0.00 O ATOM 765 CB GLU A 50 8.993 17.837 -12.886 1.00 0.00 C ATOM 766 CG GLU A 50 10.472 18.062 -12.568 1.00 0.00 C ATOM 767 CD GLU A 50 11.316 17.009 -13.288 1.00 0.00 C ATOM 768 OE1 GLU A 50 10.762 16.291 -14.105 1.00 0.00 O ATOM 769 OE2 GLU A 50 12.502 16.938 -13.011 1.00 0.00 O ATOM 0 H GLU A 50 7.547 17.103 -10.563 1.00 0.00 H new ATOM 0 HA GLU A 50 8.497 19.673 -11.807 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.749 16.778 -12.803 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.781 18.134 -13.913 1.00 0.00 H new ATOM 0 HG2 GLU A 50 10.774 19.061 -12.881 1.00 0.00 H new ATOM 0 HG3 GLU A 50 10.637 18.002 -11.492 1.00 0.00 H new ATOM 776 N VAL A 51 6.321 19.889 -12.952 1.00 0.00 N ATOM 777 CA VAL A 51 4.931 20.048 -13.470 1.00 0.00 C ATOM 778 C VAL A 51 4.629 18.960 -14.503 1.00 0.00 C ATOM 779 O VAL A 51 5.370 18.761 -15.445 1.00 0.00 O ATOM 780 CB VAL A 51 4.901 21.432 -14.117 1.00 0.00 C ATOM 781 CG1 VAL A 51 5.649 21.393 -15.450 1.00 0.00 C ATOM 782 CG2 VAL A 51 3.449 21.847 -14.361 1.00 0.00 C ATOM 0 H VAL A 51 6.916 20.712 -13.045 1.00 0.00 H new ATOM 0 HA VAL A 51 4.182 19.956 -12.683 1.00 0.00 H new ATOM 0 HB VAL A 51 5.381 22.152 -13.454 1.00 0.00 H new ATOM 0 HG11 VAL A 51 5.626 22.381 -15.909 1.00 0.00 H new ATOM 0 HG12 VAL A 51 6.684 21.097 -15.278 1.00 0.00 H new ATOM 0 HG13 VAL A 51 5.171 20.673 -16.114 1.00 0.00 H new ATOM 0 HG21 VAL A 51 3.425 22.834 -14.823 1.00 0.00 H new ATOM 0 HG22 VAL A 51 2.971 21.125 -15.023 1.00 0.00 H new ATOM 0 HG23 VAL A 51 2.915 21.878 -13.411 1.00 0.00 H new ATOM 792 N VAL A 52 3.549 18.251 -14.329 1.00 0.00 N ATOM 793 CA VAL A 52 3.201 17.171 -15.297 1.00 0.00 C ATOM 794 C VAL A 52 2.027 17.607 -16.174 1.00 0.00 C ATOM 795 O VAL A 52 2.123 17.645 -17.385 1.00 0.00 O ATOM 796 CB VAL A 52 2.799 15.974 -14.433 1.00 0.00 C ATOM 797 CG1 VAL A 52 2.869 14.695 -15.265 1.00 0.00 C ATOM 798 CG2 VAL A 52 3.753 15.853 -13.245 1.00 0.00 C ATOM 0 H VAL A 52 2.891 18.372 -13.559 1.00 0.00 H new ATOM 0 HA VAL A 52 4.031 16.935 -15.963 1.00 0.00 H new ATOM 0 HB VAL A 52 1.781 16.120 -14.071 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.582 13.843 -14.648 1.00 0.00 H new ATOM 0 HG12 VAL A 52 2.188 14.775 -16.113 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.887 14.553 -15.629 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.464 15.000 -12.632 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.771 15.710 -13.609 1.00 0.00 H new ATOM 0 HG23 VAL A 52 3.706 16.763 -12.646 1.00 0.00 H new ATOM 808 N GLU A 53 0.919 17.933 -15.570 1.00 0.00 N ATOM 809 CA GLU A 53 -0.266 18.364 -16.365 1.00 0.00 C ATOM 810 C GLU A 53 -0.982 19.521 -15.662 1.00 0.00 C ATOM 811 O GLU A 53 -0.686 19.851 -14.532 1.00 0.00 O ATOM 812 CB GLU A 53 -1.174 17.133 -16.420 1.00 0.00 C ATOM 813 CG GLU A 53 -0.350 15.897 -16.789 1.00 0.00 C ATOM 814 CD GLU A 53 0.121 16.012 -18.240 1.00 0.00 C ATOM 815 OE1 GLU A 53 0.056 17.104 -18.779 1.00 0.00 O ATOM 816 OE2 GLU A 53 0.537 15.004 -18.788 1.00 0.00 O ATOM 0 H GLU A 53 0.782 17.920 -14.559 1.00 0.00 H new ATOM 0 HA GLU A 53 0.010 18.715 -17.359 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -1.658 16.984 -15.455 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -1.965 17.286 -17.154 1.00 0.00 H new ATOM 0 HG2 GLU A 53 0.508 15.807 -16.123 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.949 14.996 -16.660 1.00 0.00 H new ATOM 823 N ILE A 54 -1.926 20.134 -16.322 1.00 0.00 N ATOM 824 CA ILE A 54 -2.668 21.265 -15.688 1.00 0.00 C ATOM 825 C ILE A 54 -4.174 21.067 -15.902 1.00 0.00 C ATOM 826 O ILE A 54 -4.595 20.476 -16.877 1.00 0.00 O ATOM 827 CB ILE A 54 -2.188 22.549 -16.387 1.00 0.00 C ATOM 828 CG1 ILE A 54 -0.770 22.367 -16.955 1.00 0.00 C ATOM 829 CG2 ILE A 54 -2.173 23.697 -15.374 1.00 0.00 C ATOM 830 CD1 ILE A 54 0.237 22.244 -15.808 1.00 0.00 C ATOM 0 H ILE A 54 -2.217 19.902 -17.272 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.486 21.320 -14.615 1.00 0.00 H new ATOM 0 HB ILE A 54 -2.869 22.772 -17.208 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.731 21.476 -17.582 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -0.511 23.215 -17.589 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -1.834 24.610 -15.864 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -3.178 23.848 -14.981 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.496 23.451 -14.556 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.239 22.115 -16.216 1.00 0.00 H new ATOM 0 HD12 ILE A 54 0.207 23.147 -15.199 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -0.017 21.382 -15.192 1.00 0.00 H new ATOM 842 N ILE A 55 -4.991 21.546 -15.001 1.00 0.00 N ATOM 843 CA ILE A 55 -6.464 21.365 -15.167 1.00 0.00 C ATOM 844 C ILE A 55 -7.215 22.631 -14.720 1.00 0.00 C ATOM 845 O ILE A 55 -6.956 23.178 -13.665 1.00 0.00 O ATOM 846 CB ILE A 55 -6.804 20.142 -14.291 1.00 0.00 C ATOM 847 CG1 ILE A 55 -7.632 19.147 -15.109 1.00 0.00 C ATOM 848 CG2 ILE A 55 -7.599 20.552 -13.044 1.00 0.00 C ATOM 849 CD1 ILE A 55 -8.998 19.756 -15.428 1.00 0.00 C ATOM 0 H ILE A 55 -4.705 22.052 -14.163 1.00 0.00 H new ATOM 0 HA ILE A 55 -6.761 21.203 -16.203 1.00 0.00 H new ATOM 0 HB ILE A 55 -5.869 19.684 -13.968 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -7.110 18.897 -16.032 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -7.758 18.219 -14.552 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -7.823 19.667 -12.448 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -7.009 21.250 -12.450 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -8.530 21.030 -13.347 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -9.586 19.046 -16.010 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.521 19.984 -14.499 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -8.863 20.672 -16.002 1.00 0.00 H new ATOM 861 N GLN A 56 -8.142 23.093 -15.517 1.00 0.00 N ATOM 862 CA GLN A 56 -8.912 24.318 -15.147 1.00 0.00 C ATOM 863 C GLN A 56 -10.165 23.942 -14.348 1.00 0.00 C ATOM 864 O GLN A 56 -10.435 22.783 -14.107 1.00 0.00 O ATOM 865 CB GLN A 56 -9.296 24.959 -16.481 1.00 0.00 C ATOM 866 CG GLN A 56 -8.034 25.197 -17.313 1.00 0.00 C ATOM 867 CD GLN A 56 -7.413 26.540 -16.926 1.00 0.00 C ATOM 868 OE1 GLN A 56 -7.747 27.563 -17.491 1.00 0.00 O ATOM 869 NE2 GLN A 56 -6.517 26.582 -15.977 1.00 0.00 N ATOM 0 H GLN A 56 -8.400 22.674 -16.411 1.00 0.00 H new ATOM 0 HA GLN A 56 -8.333 24.995 -14.519 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -9.985 24.312 -17.023 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -9.814 25.902 -16.308 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -7.318 24.392 -17.146 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -8.279 25.190 -18.375 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -6.236 25.724 -15.502 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -6.098 27.473 -15.710 1.00 0.00 H new ATOM 878 N ALA A 57 -10.929 24.917 -13.928 1.00 0.00 N ATOM 879 CA ALA A 57 -12.161 24.621 -13.136 1.00 0.00 C ATOM 880 C ALA A 57 -13.414 24.745 -14.011 1.00 0.00 C ATOM 881 O ALA A 57 -13.577 25.706 -14.735 1.00 0.00 O ATOM 882 CB ALA A 57 -12.178 25.681 -12.034 1.00 0.00 C ATOM 0 H ALA A 57 -10.753 25.907 -14.099 1.00 0.00 H new ATOM 0 HA ALA A 57 -12.157 23.606 -12.739 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -13.055 25.536 -11.403 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -11.276 25.591 -11.428 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.215 26.673 -12.484 1.00 0.00 H new ATOM 888 N THR A 58 -14.306 23.788 -13.939 1.00 0.00 N ATOM 889 CA THR A 58 -15.553 23.862 -14.759 1.00 0.00 C ATOM 890 C THR A 58 -16.370 22.569 -14.636 1.00 0.00 C ATOM 891 O THR A 58 -16.578 21.871 -15.609 1.00 0.00 O ATOM 892 CB THR A 58 -15.074 24.042 -16.203 1.00 0.00 C ATOM 893 OG1 THR A 58 -16.161 23.814 -17.090 1.00 0.00 O ATOM 894 CG2 THR A 58 -13.955 23.043 -16.500 1.00 0.00 C ATOM 0 H THR A 58 -14.224 22.960 -13.349 1.00 0.00 H new ATOM 0 HA THR A 58 -16.199 24.676 -14.429 1.00 0.00 H new ATOM 0 HB THR A 58 -14.698 25.056 -16.338 1.00 0.00 H new ATOM 0 HG1 THR A 58 -16.420 22.869 -17.055 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.615 23.172 -17.528 1.00 0.00 H new ATOM 0 HG22 THR A 58 -13.122 23.216 -15.818 1.00 0.00 H new ATOM 0 HG23 THR A 58 -14.329 22.028 -16.366 1.00 0.00 H new ATOM 902 N ILE A 59 -16.849 22.241 -13.463 1.00 0.00 N ATOM 903 CA ILE A 59 -17.659 20.992 -13.335 1.00 0.00 C ATOM 904 C ILE A 59 -18.318 20.878 -11.948 1.00 0.00 C ATOM 905 O ILE A 59 -19.394 20.329 -11.818 1.00 0.00 O ATOM 906 CB ILE A 59 -16.670 19.843 -13.608 1.00 0.00 C ATOM 907 CG1 ILE A 59 -17.388 18.752 -14.406 1.00 0.00 C ATOM 908 CG2 ILE A 59 -16.132 19.238 -12.304 1.00 0.00 C ATOM 909 CD1 ILE A 59 -16.392 18.054 -15.334 1.00 0.00 C ATOM 0 H ILE A 59 -16.718 22.773 -12.603 1.00 0.00 H new ATOM 0 HA ILE A 59 -18.492 20.974 -14.038 1.00 0.00 H new ATOM 0 HB ILE A 59 -15.826 20.244 -14.169 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -17.837 18.027 -13.727 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -18.199 19.188 -14.989 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -15.438 18.431 -12.537 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -15.615 20.008 -11.732 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -16.961 18.845 -11.716 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -16.906 17.278 -15.901 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -15.964 18.783 -16.022 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -15.596 17.604 -14.741 1.00 0.00 H new ATOM 921 N ILE A 60 -17.699 21.382 -10.914 1.00 0.00 N ATOM 922 CA ILE A 60 -18.331 21.274 -9.562 1.00 0.00 C ATOM 923 C ILE A 60 -19.313 22.428 -9.337 1.00 0.00 C ATOM 924 O ILE A 60 -19.495 23.276 -10.188 1.00 0.00 O ATOM 925 CB ILE A 60 -17.180 21.340 -8.554 1.00 0.00 C ATOM 926 CG1 ILE A 60 -16.031 20.448 -9.028 1.00 0.00 C ATOM 927 CG2 ILE A 60 -17.672 20.847 -7.192 1.00 0.00 C ATOM 928 CD1 ILE A 60 -14.918 20.445 -7.979 1.00 0.00 C ATOM 0 H ILE A 60 -16.797 21.857 -10.942 1.00 0.00 H new ATOM 0 HA ILE A 60 -18.898 20.349 -9.457 1.00 0.00 H new ATOM 0 HB ILE A 60 -16.830 22.369 -8.470 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -16.390 19.433 -9.195 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -15.645 20.810 -9.981 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -16.855 20.893 -6.472 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -18.492 21.479 -6.851 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -18.020 19.818 -7.281 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -14.100 19.809 -8.318 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -14.552 21.461 -7.834 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -15.308 20.062 -7.036 1.00 0.00 H new ATOM 940 N ARG A 61 -19.954 22.462 -8.199 1.00 0.00 N ATOM 941 CA ARG A 61 -20.931 23.556 -7.924 1.00 0.00 C ATOM 942 C ARG A 61 -20.413 24.474 -6.812 1.00 0.00 C ATOM 943 O ARG A 61 -19.223 24.608 -6.607 1.00 0.00 O ATOM 944 CB ARG A 61 -22.207 22.843 -7.480 1.00 0.00 C ATOM 945 CG ARG A 61 -22.656 21.876 -8.578 1.00 0.00 C ATOM 946 CD ARG A 61 -24.036 22.290 -9.090 1.00 0.00 C ATOM 947 NE ARG A 61 -24.816 21.024 -9.159 1.00 0.00 N ATOM 948 CZ ARG A 61 -25.951 20.921 -8.523 1.00 0.00 C ATOM 949 NH1 ARG A 61 -25.966 20.574 -7.265 1.00 0.00 N ATOM 950 NH2 ARG A 61 -27.071 21.169 -9.145 1.00 0.00 N ATOM 0 H ARG A 61 -19.844 21.780 -7.448 1.00 0.00 H new ATOM 0 HA ARG A 61 -21.096 24.187 -8.798 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -22.029 22.300 -6.552 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -22.992 23.571 -7.278 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -21.937 21.880 -9.397 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -22.691 20.858 -8.189 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -24.507 23.008 -8.419 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -23.968 22.766 -10.068 1.00 0.00 H new ATOM 0 HE ARG A 61 -24.463 20.237 -9.703 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -25.090 20.383 -6.778 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -26.853 20.494 -6.769 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -27.059 21.443 -10.127 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -27.959 21.089 -8.649 1.00 0.00 H new ATOM 964 N GLN A 62 -21.301 25.112 -6.097 1.00 0.00 N ATOM 965 CA GLN A 62 -20.866 26.028 -5.004 1.00 0.00 C ATOM 966 C GLN A 62 -20.765 25.274 -3.675 1.00 0.00 C ATOM 967 O GLN A 62 -20.217 25.770 -2.710 1.00 0.00 O ATOM 968 CB GLN A 62 -21.955 27.100 -4.935 1.00 0.00 C ATOM 969 CG GLN A 62 -21.700 28.017 -3.737 1.00 0.00 C ATOM 970 CD GLN A 62 -22.842 29.029 -3.620 1.00 0.00 C ATOM 971 OE1 GLN A 62 -22.613 30.222 -3.600 1.00 0.00 O ATOM 972 NE2 GLN A 62 -24.072 28.600 -3.541 1.00 0.00 N ATOM 0 H GLN A 62 -22.310 25.038 -6.223 1.00 0.00 H new ATOM 0 HA GLN A 62 -19.881 26.454 -5.193 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -21.964 27.683 -5.856 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -22.935 26.631 -4.845 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -21.626 27.428 -2.823 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -20.750 28.537 -3.859 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -24.265 27.599 -3.558 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -24.840 29.266 -3.463 1.00 0.00 H new ATOM 981 N ASN A 63 -21.292 24.083 -3.614 1.00 0.00 N ATOM 982 CA ASN A 63 -21.227 23.305 -2.342 1.00 0.00 C ATOM 983 C ASN A 63 -20.885 21.834 -2.612 1.00 0.00 C ATOM 984 O ASN A 63 -20.361 21.146 -1.760 1.00 0.00 O ATOM 985 CB ASN A 63 -22.626 23.423 -1.736 1.00 0.00 C ATOM 986 CG ASN A 63 -23.675 23.181 -2.822 1.00 0.00 C ATOM 987 OD1 ASN A 63 -23.936 22.053 -3.191 1.00 0.00 O ATOM 988 ND2 ASN A 63 -24.291 24.200 -3.355 1.00 0.00 N ATOM 0 H ASN A 63 -21.764 23.614 -4.387 1.00 0.00 H new ATOM 0 HA ASN A 63 -20.452 23.685 -1.676 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -22.747 22.699 -0.931 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -22.762 24.412 -1.298 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -24.991 24.050 -4.081 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -24.072 25.147 -3.046 1.00 0.00 H new ATOM 995 N GLN A 64 -21.179 21.340 -3.783 1.00 0.00 N ATOM 996 CA GLN A 64 -20.869 19.914 -4.083 1.00 0.00 C ATOM 997 C GLN A 64 -19.391 19.620 -3.820 1.00 0.00 C ATOM 998 O GLN A 64 -18.516 20.357 -4.229 1.00 0.00 O ATOM 999 CB GLN A 64 -21.197 19.740 -5.567 1.00 0.00 C ATOM 1000 CG GLN A 64 -20.572 18.440 -6.079 1.00 0.00 C ATOM 1001 CD GLN A 64 -21.069 17.267 -5.232 1.00 0.00 C ATOM 1002 OE1 GLN A 64 -20.292 16.428 -4.821 1.00 0.00 O ATOM 1003 NE2 GLN A 64 -22.339 17.172 -4.951 1.00 0.00 N ATOM 0 H GLN A 64 -21.619 21.860 -4.542 1.00 0.00 H new ATOM 0 HA GLN A 64 -21.440 19.230 -3.456 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -22.277 19.718 -5.711 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -20.816 20.588 -6.136 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -20.836 18.285 -7.125 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -19.485 18.503 -6.030 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -22.992 17.876 -5.296 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -22.680 16.394 -4.386 1.00 0.00 H new ATOM 1012 N ALA A 65 -19.109 18.539 -3.147 1.00 0.00 N ATOM 1013 CA ALA A 65 -17.692 18.179 -2.860 1.00 0.00 C ATOM 1014 C ALA A 65 -17.387 16.804 -3.458 1.00 0.00 C ATOM 1015 O ALA A 65 -18.280 16.012 -3.697 1.00 0.00 O ATOM 1016 CB ALA A 65 -17.588 18.142 -1.335 1.00 0.00 C ATOM 0 H ALA A 65 -19.803 17.886 -2.782 1.00 0.00 H new ATOM 0 HA ALA A 65 -16.982 18.886 -3.290 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -16.570 17.883 -1.046 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -17.842 19.121 -0.929 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -18.278 17.396 -0.941 1.00 0.00 H new ATOM 1022 N LEU A 66 -16.141 16.513 -3.715 1.00 0.00 N ATOM 1023 CA LEU A 66 -15.806 15.186 -4.314 1.00 0.00 C ATOM 1024 C LEU A 66 -14.759 14.457 -3.468 1.00 0.00 C ATOM 1025 O LEU A 66 -13.618 14.866 -3.386 1.00 0.00 O ATOM 1026 CB LEU A 66 -15.237 15.486 -5.709 1.00 0.00 C ATOM 1027 CG LEU A 66 -15.877 16.753 -6.290 1.00 0.00 C ATOM 1028 CD1 LEU A 66 -15.223 17.087 -7.631 1.00 0.00 C ATOM 1029 CD2 LEU A 66 -17.373 16.515 -6.498 1.00 0.00 C ATOM 0 H LEU A 66 -15.347 17.128 -3.539 1.00 0.00 H new ATOM 0 HA LEU A 66 -16.685 14.543 -4.362 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -14.156 15.613 -5.648 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -15.422 14.641 -6.373 1.00 0.00 H new ATOM 0 HG LEU A 66 -15.732 17.584 -5.600 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -15.678 17.987 -8.044 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -14.156 17.254 -7.484 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -15.368 16.257 -8.323 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -17.830 17.414 -6.911 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -17.517 15.685 -7.189 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -17.840 16.277 -5.542 1.00 0.00 H new ATOM 1041 N ARG A 67 -15.134 13.367 -2.854 1.00 0.00 N ATOM 1042 CA ARG A 67 -14.154 12.598 -2.032 1.00 0.00 C ATOM 1043 C ARG A 67 -13.490 11.531 -2.905 1.00 0.00 C ATOM 1044 O ARG A 67 -14.152 10.693 -3.484 1.00 0.00 O ATOM 1045 CB ARG A 67 -14.982 11.949 -0.923 1.00 0.00 C ATOM 1046 CG ARG A 67 -14.059 11.539 0.226 1.00 0.00 C ATOM 1047 CD ARG A 67 -14.238 10.048 0.521 1.00 0.00 C ATOM 1048 NE ARG A 67 -15.059 9.999 1.762 1.00 0.00 N ATOM 1049 CZ ARG A 67 -15.134 8.895 2.453 1.00 0.00 C ATOM 1050 NH1 ARG A 67 -14.734 7.768 1.931 1.00 0.00 N ATOM 1051 NH2 ARG A 67 -15.611 8.917 3.669 1.00 0.00 N ATOM 0 H ARG A 67 -16.075 12.976 -2.886 1.00 0.00 H new ATOM 0 HA ARG A 67 -13.363 13.226 -1.622 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -15.740 12.646 -0.565 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -15.509 11.077 -1.310 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -13.021 11.746 -0.036 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -14.286 12.126 1.116 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -14.738 9.539 -0.304 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -13.276 9.555 0.664 1.00 0.00 H new ATOM 0 HE ARG A 67 -15.563 10.829 2.072 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -14.362 7.749 0.981 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -14.793 6.906 2.473 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -15.925 9.797 4.078 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -15.670 8.054 4.209 1.00 0.00 H new ATOM 1065 N LEU A 68 -12.191 11.563 -3.023 1.00 0.00 N ATOM 1066 CA LEU A 68 -11.501 10.555 -3.883 1.00 0.00 C ATOM 1067 C LEU A 68 -10.537 9.698 -3.053 1.00 0.00 C ATOM 1068 O LEU A 68 -10.003 10.133 -2.050 1.00 0.00 O ATOM 1069 CB LEU A 68 -10.726 11.372 -4.926 1.00 0.00 C ATOM 1070 CG LEU A 68 -11.523 12.621 -5.321 1.00 0.00 C ATOM 1071 CD1 LEU A 68 -10.728 13.433 -6.344 1.00 0.00 C ATOM 1072 CD2 LEU A 68 -12.862 12.202 -5.934 1.00 0.00 C ATOM 0 H LEU A 68 -11.579 12.238 -2.565 1.00 0.00 H new ATOM 0 HA LEU A 68 -12.211 9.869 -4.345 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -9.756 11.663 -4.523 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -10.534 10.761 -5.808 1.00 0.00 H new ATOM 0 HG LEU A 68 -11.703 13.229 -4.435 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -11.295 14.321 -6.624 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -9.775 13.734 -5.909 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -10.546 12.824 -7.230 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -13.428 13.091 -6.214 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -12.682 11.592 -6.819 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -13.431 11.625 -5.205 1.00 0.00 H new ATOM 1084 N ARG A 69 -10.307 8.481 -3.475 1.00 0.00 N ATOM 1085 CA ARG A 69 -9.375 7.584 -2.729 1.00 0.00 C ATOM 1086 C ARG A 69 -8.240 7.132 -3.653 1.00 0.00 C ATOM 1087 O ARG A 69 -8.385 7.110 -4.859 1.00 0.00 O ATOM 1088 CB ARG A 69 -10.232 6.390 -2.305 1.00 0.00 C ATOM 1089 CG ARG A 69 -9.417 5.476 -1.388 1.00 0.00 C ATOM 1090 CD ARG A 69 -9.486 4.039 -1.909 1.00 0.00 C ATOM 1091 NE ARG A 69 -10.707 3.463 -1.284 1.00 0.00 N ATOM 1092 CZ ARG A 69 -10.601 2.693 -0.237 1.00 0.00 C ATOM 1093 NH1 ARG A 69 -10.455 1.405 -0.386 1.00 0.00 N ATOM 1094 NH2 ARG A 69 -10.641 3.212 0.960 1.00 0.00 N ATOM 0 H ARG A 69 -10.727 8.069 -4.308 1.00 0.00 H new ATOM 0 HA ARG A 69 -8.915 8.077 -1.872 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -11.127 6.737 -1.788 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.565 5.838 -3.184 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -8.381 5.811 -1.350 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -9.805 5.524 -0.370 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -9.551 4.016 -2.997 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -8.596 3.475 -1.631 1.00 0.00 H new ATOM 0 HE ARG A 69 -11.626 3.670 -1.674 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -10.424 1.000 -1.322 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -10.372 0.803 0.433 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -10.755 4.219 1.076 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -10.558 2.611 1.780 1.00 0.00 H new ATOM 1108 N ALA A 70 -7.110 6.777 -3.101 1.00 0.00 N ATOM 1109 CA ALA A 70 -5.967 6.337 -3.956 1.00 0.00 C ATOM 1110 C ALA A 70 -6.302 5.031 -4.685 1.00 0.00 C ATOM 1111 O ALA A 70 -7.088 4.230 -4.220 1.00 0.00 O ATOM 1112 CB ALA A 70 -4.806 6.119 -2.985 1.00 0.00 C ATOM 0 H ALA A 70 -6.929 6.772 -2.097 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.731 7.073 -4.725 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -3.925 5.793 -3.538 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -4.585 7.052 -2.467 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.080 5.356 -2.256 1.00 0.00 H new ATOM 1118 N ARG A 71 -5.700 4.811 -5.824 1.00 0.00 N ATOM 1119 CA ARG A 71 -5.968 3.556 -6.587 1.00 0.00 C ATOM 1120 C ARG A 71 -4.698 2.704 -6.648 1.00 0.00 C ATOM 1121 O ARG A 71 -4.753 1.493 -6.746 1.00 0.00 O ATOM 1122 CB ARG A 71 -6.373 4.014 -7.987 1.00 0.00 C ATOM 1123 CG ARG A 71 -6.816 2.802 -8.809 1.00 0.00 C ATOM 1124 CD ARG A 71 -8.338 2.664 -8.736 1.00 0.00 C ATOM 1125 NE ARG A 71 -8.694 1.739 -9.846 1.00 0.00 N ATOM 1126 CZ ARG A 71 -9.828 1.092 -9.817 1.00 0.00 C ATOM 1127 NH1 ARG A 71 -10.949 1.749 -9.702 1.00 0.00 N ATOM 1128 NH2 ARG A 71 -9.838 -0.210 -9.904 1.00 0.00 N ATOM 0 H ARG A 71 -5.033 5.448 -6.260 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.744 2.947 -6.123 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -7.183 4.740 -7.924 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.535 4.512 -8.475 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.500 2.917 -9.846 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -6.340 1.898 -8.429 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -8.652 2.263 -7.772 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -8.828 3.630 -8.855 1.00 0.00 H new ATOM 0 HE ARG A 71 -8.053 1.610 -10.629 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -10.939 2.767 -9.635 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -11.835 1.245 -9.679 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -8.960 -0.722 -9.995 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -10.723 -0.716 -9.881 1.00 0.00 H new ATOM 1142 N LYS A 72 -3.554 3.329 -6.579 1.00 0.00 N ATOM 1143 CA LYS A 72 -2.277 2.560 -6.621 1.00 0.00 C ATOM 1144 C LYS A 72 -1.622 2.570 -5.234 1.00 0.00 C ATOM 1145 O LYS A 72 -1.939 1.761 -4.387 1.00 0.00 O ATOM 1146 CB LYS A 72 -1.399 3.294 -7.641 1.00 0.00 C ATOM 1147 CG LYS A 72 -1.983 3.127 -9.046 1.00 0.00 C ATOM 1148 CD LYS A 72 -1.835 1.671 -9.488 1.00 0.00 C ATOM 1149 CE LYS A 72 -0.355 1.356 -9.710 1.00 0.00 C ATOM 1150 NZ LYS A 72 -0.342 0.044 -10.413 1.00 0.00 N ATOM 0 H LYS A 72 -3.448 4.340 -6.495 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.426 1.517 -6.899 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.338 4.352 -7.387 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.383 2.899 -7.610 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -3.034 3.415 -9.051 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -1.469 3.785 -9.746 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -2.250 1.006 -8.731 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -2.397 1.499 -10.406 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.128 2.129 -10.308 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.183 1.302 -8.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.641 -0.240 -10.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -0.802 -0.674 -9.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.856 0.127 -11.313 1.00 0.00 H new ATOM 1164 N GLU A 73 -0.720 3.488 -4.998 1.00 0.00 N ATOM 1165 CA GLU A 73 -0.042 3.568 -3.664 1.00 0.00 C ATOM 1166 C GLU A 73 1.217 4.444 -3.753 1.00 0.00 C ATOM 1167 O GLU A 73 2.172 4.241 -3.031 1.00 0.00 O ATOM 1168 CB GLU A 73 0.347 2.130 -3.301 1.00 0.00 C ATOM 1169 CG GLU A 73 0.838 1.395 -4.551 1.00 0.00 C ATOM 1170 CD GLU A 73 1.894 0.363 -4.154 1.00 0.00 C ATOM 1171 OE1 GLU A 73 2.976 0.772 -3.766 1.00 0.00 O ATOM 1172 OE2 GLU A 73 1.604 -0.818 -4.244 1.00 0.00 O ATOM 0 H GLU A 73 -0.421 4.190 -5.674 1.00 0.00 H new ATOM 0 HA GLU A 73 -0.697 4.012 -2.914 1.00 0.00 H new ATOM 0 HB2 GLU A 73 1.128 2.136 -2.541 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -0.510 1.608 -2.874 1.00 0.00 H new ATOM 0 HG2 GLU A 73 0.002 0.903 -5.048 1.00 0.00 H new ATOM 0 HG3 GLU A 73 1.258 2.106 -5.262 1.00 0.00 H new ATOM 1179 N CYS A 74 1.231 5.411 -4.631 1.00 0.00 N ATOM 1180 CA CYS A 74 2.435 6.285 -4.756 1.00 0.00 C ATOM 1181 C CYS A 74 2.028 7.754 -4.939 1.00 0.00 C ATOM 1182 O CYS A 74 2.860 8.640 -4.937 1.00 0.00 O ATOM 1183 CB CYS A 74 3.164 5.774 -5.999 1.00 0.00 C ATOM 1184 SG CYS A 74 4.512 4.674 -5.498 1.00 0.00 S ATOM 0 H CYS A 74 0.464 5.634 -5.265 1.00 0.00 H new ATOM 0 HA CYS A 74 3.060 6.246 -3.864 1.00 0.00 H new ATOM 0 HB2 CYS A 74 2.469 5.242 -6.649 1.00 0.00 H new ATOM 0 HB3 CYS A 74 3.559 6.613 -6.573 1.00 0.00 H new ATOM 0 HG CYS A 74 5.131 4.237 -6.554 1.00 0.00 H new ATOM 1190 N TRP A 75 0.759 8.021 -5.100 1.00 0.00 N ATOM 1191 CA TRP A 75 0.306 9.428 -5.285 1.00 0.00 C ATOM 1192 C TRP A 75 0.305 10.169 -3.939 1.00 0.00 C ATOM 1193 O TRP A 75 -0.505 9.902 -3.074 1.00 0.00 O ATOM 1194 CB TRP A 75 -1.114 9.290 -5.864 1.00 0.00 C ATOM 1195 CG TRP A 75 -2.017 10.369 -5.343 1.00 0.00 C ATOM 1196 CD1 TRP A 75 -2.005 11.650 -5.764 1.00 0.00 C ATOM 1197 CD2 TRP A 75 -3.056 10.284 -4.322 1.00 0.00 C ATOM 1198 NE1 TRP A 75 -2.966 12.362 -5.071 1.00 0.00 N ATOM 1199 CE2 TRP A 75 -3.642 11.564 -4.171 1.00 0.00 C ATOM 1200 CE3 TRP A 75 -3.545 9.234 -3.522 1.00 0.00 C ATOM 1201 CZ2 TRP A 75 -4.672 11.795 -3.259 1.00 0.00 C ATOM 1202 CZ3 TRP A 75 -4.583 9.465 -2.603 1.00 0.00 C ATOM 1203 CH2 TRP A 75 -5.145 10.742 -2.473 1.00 0.00 C ATOM 0 H TRP A 75 0.016 7.322 -5.111 1.00 0.00 H new ATOM 0 HA TRP A 75 0.956 10.008 -5.941 1.00 0.00 H new ATOM 0 HB2 TRP A 75 -1.073 9.340 -6.952 1.00 0.00 H new ATOM 0 HB3 TRP A 75 -1.522 8.313 -5.605 1.00 0.00 H new ATOM 0 HD1 TRP A 75 -1.350 12.055 -6.521 1.00 0.00 H new ATOM 0 HE1 TRP A 75 -3.153 13.355 -5.208 1.00 0.00 H new ATOM 0 HE3 TRP A 75 -3.120 8.245 -3.615 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 -5.101 12.781 -3.161 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 -4.950 8.653 -1.993 1.00 0.00 H new ATOM 0 HH2 TRP A 75 -5.943 10.912 -1.766 1.00 0.00 H new ATOM 1214 N ASP A 76 1.204 11.100 -3.762 1.00 0.00 N ATOM 1215 CA ASP A 76 1.249 11.860 -2.478 1.00 0.00 C ATOM 1216 C ASP A 76 0.423 13.146 -2.599 1.00 0.00 C ATOM 1217 O ASP A 76 0.548 13.886 -3.555 1.00 0.00 O ATOM 1218 CB ASP A 76 2.727 12.188 -2.269 1.00 0.00 C ATOM 1219 CG ASP A 76 3.263 12.925 -3.497 1.00 0.00 C ATOM 1220 OD1 ASP A 76 3.095 14.131 -3.560 1.00 0.00 O ATOM 1221 OD2 ASP A 76 3.831 12.269 -4.356 1.00 0.00 O ATOM 0 H ASP A 76 1.908 11.367 -4.450 1.00 0.00 H new ATOM 0 HA ASP A 76 0.835 11.294 -1.644 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.852 12.804 -1.378 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.294 11.272 -2.105 1.00 0.00 H new ATOM 1226 N ARG A 77 -0.423 13.419 -1.641 1.00 0.00 N ATOM 1227 CA ARG A 77 -1.256 14.657 -1.711 1.00 0.00 C ATOM 1228 C ARG A 77 -0.441 15.875 -1.266 1.00 0.00 C ATOM 1229 O ARG A 77 -0.271 16.824 -2.005 1.00 0.00 O ATOM 1230 CB ARG A 77 -2.419 14.424 -0.746 1.00 0.00 C ATOM 1231 CG ARG A 77 -2.997 13.023 -0.953 1.00 0.00 C ATOM 1232 CD ARG A 77 -2.982 12.269 0.377 1.00 0.00 C ATOM 1233 NE ARG A 77 -3.874 13.054 1.275 1.00 0.00 N ATOM 1234 CZ ARG A 77 -3.453 13.419 2.455 1.00 0.00 C ATOM 1235 NH1 ARG A 77 -3.149 12.517 3.347 1.00 0.00 N ATOM 1236 NH2 ARG A 77 -3.337 14.686 2.742 1.00 0.00 N ATOM 0 H ARG A 77 -0.574 12.840 -0.815 1.00 0.00 H new ATOM 0 HA ARG A 77 -1.601 14.852 -2.726 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -2.077 14.537 0.283 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -3.193 15.174 -0.909 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -4.016 13.090 -1.335 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -2.413 12.482 -1.697 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -3.344 11.248 0.256 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -1.972 12.204 0.782 1.00 0.00 H new ATOM 0 HE ARG A 77 -4.813 13.306 0.968 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -3.240 11.526 3.122 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -2.820 12.802 4.269 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -3.575 15.391 2.044 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -3.008 14.972 3.664 1.00 0.00 H new ATOM 1250 N ASP A 78 0.057 15.858 -0.060 1.00 0.00 N ATOM 1251 CA ASP A 78 0.852 17.019 0.436 1.00 0.00 C ATOM 1252 C ASP A 78 2.352 16.739 0.302 1.00 0.00 C ATOM 1253 O ASP A 78 3.172 17.401 0.906 1.00 0.00 O ATOM 1254 CB ASP A 78 0.461 17.159 1.908 1.00 0.00 C ATOM 1255 CG ASP A 78 0.864 18.546 2.413 1.00 0.00 C ATOM 1256 OD1 ASP A 78 2.054 18.800 2.501 1.00 0.00 O ATOM 1257 OD2 ASP A 78 -0.025 19.329 2.704 1.00 0.00 O ATOM 0 H ASP A 78 -0.052 15.091 0.604 1.00 0.00 H new ATOM 0 HA ASP A 78 0.653 17.928 -0.131 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.613 17.015 2.025 1.00 0.00 H new ATOM 0 HB3 ASP A 78 0.952 16.387 2.501 1.00 0.00 H new ATOM 1262 N GLY A 79 2.717 15.766 -0.486 1.00 0.00 N ATOM 1263 CA GLY A 79 4.163 15.450 -0.655 1.00 0.00 C ATOM 1264 C GLY A 79 4.516 14.216 0.176 1.00 0.00 C ATOM 1265 O GLY A 79 5.671 13.936 0.432 1.00 0.00 O ATOM 0 H GLY A 79 2.078 15.177 -1.019 1.00 0.00 H new ATOM 0 HA2 GLY A 79 4.386 15.269 -1.707 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.771 16.299 -0.341 1.00 0.00 H new ATOM 1269 N LYS A 80 3.530 13.475 0.602 1.00 0.00 N ATOM 1270 CA LYS A 80 3.810 12.260 1.419 1.00 0.00 C ATOM 1271 C LYS A 80 3.366 11.003 0.668 1.00 0.00 C ATOM 1272 O LYS A 80 2.234 10.575 0.768 1.00 0.00 O ATOM 1273 CB LYS A 80 2.985 12.445 2.692 1.00 0.00 C ATOM 1274 CG LYS A 80 3.610 13.552 3.542 1.00 0.00 C ATOM 1275 CD LYS A 80 4.929 13.055 4.133 1.00 0.00 C ATOM 1276 CE LYS A 80 5.609 14.194 4.895 1.00 0.00 C ATOM 1277 NZ LYS A 80 7.066 13.902 4.798 1.00 0.00 N ATOM 0 H LYS A 80 2.543 13.658 0.420 1.00 0.00 H new ATOM 0 HA LYS A 80 4.872 12.140 1.634 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.956 12.702 2.439 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.951 11.513 3.256 1.00 0.00 H new ATOM 0 HG2 LYS A 80 3.783 14.439 2.933 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.927 13.842 4.341 1.00 0.00 H new ATOM 0 HD2 LYS A 80 4.746 12.214 4.802 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.582 12.694 3.339 1.00 0.00 H new ATOM 0 HE2 LYS A 80 5.370 15.162 4.455 1.00 0.00 H new ATOM 0 HE3 LYS A 80 5.281 14.226 5.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 7.602 14.640 5.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.264 12.977 5.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 7.351 13.884 3.798 1.00 0.00 H new ATOM 1291 N GLU A 81 4.251 10.407 -0.084 1.00 0.00 N ATOM 1292 CA GLU A 81 3.878 9.177 -0.841 1.00 0.00 C ATOM 1293 C GLU A 81 3.059 8.236 0.046 1.00 0.00 C ATOM 1294 O GLU A 81 3.592 7.535 0.883 1.00 0.00 O ATOM 1295 CB GLU A 81 5.209 8.530 -1.226 1.00 0.00 C ATOM 1296 CG GLU A 81 4.960 7.412 -2.239 1.00 0.00 C ATOM 1297 CD GLU A 81 4.713 6.097 -1.497 1.00 0.00 C ATOM 1298 OE1 GLU A 81 5.680 5.498 -1.056 1.00 0.00 O ATOM 1299 OE2 GLU A 81 3.561 5.712 -1.382 1.00 0.00 O ATOM 0 H GLU A 81 5.215 10.718 -0.207 1.00 0.00 H new ATOM 0 HA GLU A 81 3.266 9.400 -1.715 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.879 9.277 -1.651 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.700 8.129 -0.339 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.100 7.657 -2.863 1.00 0.00 H new ATOM 0 HG3 GLU A 81 5.818 7.311 -2.904 1.00 0.00 H new ATOM 1306 N ARG A 82 1.766 8.217 -0.131 1.00 0.00 N ATOM 1307 CA ARG A 82 0.910 7.323 0.700 1.00 0.00 C ATOM 1308 C ARG A 82 0.536 6.065 -0.089 1.00 0.00 C ATOM 1309 O ARG A 82 0.917 5.902 -1.231 1.00 0.00 O ATOM 1310 CB ARG A 82 -0.335 8.152 1.013 1.00 0.00 C ATOM 1311 CG ARG A 82 -0.567 8.174 2.525 1.00 0.00 C ATOM 1312 CD ARG A 82 0.553 8.970 3.202 1.00 0.00 C ATOM 1313 NE ARG A 82 0.244 8.908 4.657 1.00 0.00 N ATOM 1314 CZ ARG A 82 0.718 9.818 5.464 1.00 0.00 C ATOM 1315 NH1 ARG A 82 2.004 9.898 5.673 1.00 0.00 N ATOM 1316 NH2 ARG A 82 -0.092 10.648 6.061 1.00 0.00 N ATOM 0 H ARG A 82 1.265 8.783 -0.816 1.00 0.00 H new ATOM 0 HA ARG A 82 1.416 6.988 1.606 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -0.212 9.168 0.639 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -1.203 7.729 0.507 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -1.534 8.624 2.749 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -0.591 7.156 2.915 1.00 0.00 H new ATOM 0 HD2 ARG A 82 1.530 8.537 2.987 1.00 0.00 H new ATOM 0 HD3 ARG A 82 0.575 10.000 2.847 1.00 0.00 H new ATOM 0 HE ARG A 82 -0.338 8.155 5.023 1.00 0.00 H new ATOM 0 HH11 ARG A 82 2.638 9.250 5.206 1.00 0.00 H new ATOM 0 HH12 ARG A 82 2.375 10.609 6.303 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -1.097 10.586 5.897 1.00 0.00 H new ATOM 0 HH22 ARG A 82 0.280 11.359 6.691 1.00 0.00 H new ATOM 1330 N VAL A 83 -0.203 5.172 0.512 1.00 0.00 N ATOM 1331 CA VAL A 83 -0.596 3.922 -0.203 1.00 0.00 C ATOM 1332 C VAL A 83 -2.014 4.047 -0.766 1.00 0.00 C ATOM 1333 O VAL A 83 -2.659 5.069 -0.636 1.00 0.00 O ATOM 1334 CB VAL A 83 -0.540 2.824 0.858 1.00 0.00 C ATOM 1335 CG1 VAL A 83 0.819 2.859 1.558 1.00 0.00 C ATOM 1336 CG2 VAL A 83 -1.651 3.054 1.885 1.00 0.00 C ATOM 0 H VAL A 83 -0.552 5.253 1.467 1.00 0.00 H new ATOM 0 HA VAL A 83 0.061 3.712 -1.047 1.00 0.00 H new ATOM 0 HB VAL A 83 -0.677 1.852 0.384 1.00 0.00 H new ATOM 0 HG11 VAL A 83 0.859 2.076 2.315 1.00 0.00 H new ATOM 0 HG12 VAL A 83 1.610 2.696 0.826 1.00 0.00 H new ATOM 0 HG13 VAL A 83 0.959 3.830 2.033 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -1.613 2.272 2.643 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.513 4.026 2.359 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -2.619 3.028 1.385 1.00 0.00 H new ATOM 1346 N THR A 84 -2.498 3.011 -1.394 1.00 0.00 N ATOM 1347 CA THR A 84 -3.870 3.056 -1.975 1.00 0.00 C ATOM 1348 C THR A 84 -4.907 3.360 -0.888 1.00 0.00 C ATOM 1349 O THR A 84 -5.970 3.881 -1.159 1.00 0.00 O ATOM 1350 CB THR A 84 -4.110 1.656 -2.547 1.00 0.00 C ATOM 1351 OG1 THR A 84 -2.916 0.890 -2.456 1.00 0.00 O ATOM 1352 CG2 THR A 84 -4.536 1.771 -4.009 1.00 0.00 C ATOM 0 H THR A 84 -2.000 2.131 -1.530 1.00 0.00 H new ATOM 0 HA THR A 84 -3.961 3.835 -2.732 1.00 0.00 H new ATOM 0 HB THR A 84 -4.897 1.162 -1.977 1.00 0.00 H new ATOM 0 HG1 THR A 84 -2.449 0.908 -3.317 1.00 0.00 H new ATOM 0 HG21 THR A 84 -4.707 0.775 -4.418 1.00 0.00 H new ATOM 0 HG22 THR A 84 -5.455 2.353 -4.075 1.00 0.00 H new ATOM 0 HG23 THR A 84 -3.750 2.267 -4.579 1.00 0.00 H new ATOM 1360 N GLY A 85 -4.608 3.026 0.337 1.00 0.00 N ATOM 1361 CA GLY A 85 -5.578 3.279 1.442 1.00 0.00 C ATOM 1362 C GLY A 85 -5.707 4.782 1.690 1.00 0.00 C ATOM 1363 O GLY A 85 -6.661 5.242 2.285 1.00 0.00 O ATOM 0 H GLY A 85 -3.732 2.588 0.622 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.551 2.859 1.186 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.244 2.779 2.351 1.00 0.00 H new ATOM 1367 N GLU A 86 -4.756 5.552 1.242 1.00 0.00 N ATOM 1368 CA GLU A 86 -4.828 7.024 1.456 1.00 0.00 C ATOM 1369 C GLU A 86 -5.881 7.645 0.532 1.00 0.00 C ATOM 1370 O GLU A 86 -6.055 7.229 -0.596 1.00 0.00 O ATOM 1371 CB GLU A 86 -3.430 7.538 1.111 1.00 0.00 C ATOM 1372 CG GLU A 86 -3.481 9.044 0.852 1.00 0.00 C ATOM 1373 CD GLU A 86 -4.229 9.738 1.991 1.00 0.00 C ATOM 1374 OE1 GLU A 86 -3.945 9.428 3.136 1.00 0.00 O ATOM 1375 OE2 GLU A 86 -5.073 10.569 1.699 1.00 0.00 O ATOM 0 H GLU A 86 -3.932 5.226 0.737 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.117 7.283 2.475 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.742 7.323 1.929 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.050 7.021 0.230 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -2.470 9.443 0.772 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -3.979 9.243 -0.097 1.00 0.00 H new ATOM 1382 N GLU A 87 -6.587 8.637 1.006 1.00 0.00 N ATOM 1383 CA GLU A 87 -7.632 9.287 0.161 1.00 0.00 C ATOM 1384 C GLU A 87 -7.772 10.766 0.537 1.00 0.00 C ATOM 1385 O GLU A 87 -7.460 11.166 1.641 1.00 0.00 O ATOM 1386 CB GLU A 87 -8.920 8.528 0.481 1.00 0.00 C ATOM 1387 CG GLU A 87 -9.418 8.930 1.872 1.00 0.00 C ATOM 1388 CD GLU A 87 -10.123 7.742 2.528 1.00 0.00 C ATOM 1389 OE1 GLU A 87 -9.438 6.922 3.116 1.00 0.00 O ATOM 1390 OE2 GLU A 87 -11.337 7.673 2.432 1.00 0.00 O ATOM 0 H GLU A 87 -6.485 9.026 1.943 1.00 0.00 H new ATOM 0 HA GLU A 87 -7.389 9.252 -0.901 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -9.681 8.750 -0.267 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -8.740 7.454 0.444 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -8.580 9.255 2.489 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -10.103 9.774 1.794 1.00 0.00 H new ATOM 1397 N TRP A 88 -8.242 11.582 -0.368 1.00 0.00 N ATOM 1398 CA TRP A 88 -8.399 13.030 -0.048 1.00 0.00 C ATOM 1399 C TRP A 88 -9.745 13.547 -0.582 1.00 0.00 C ATOM 1400 O TRP A 88 -10.305 13.003 -1.513 1.00 0.00 O ATOM 1401 CB TRP A 88 -7.189 13.713 -0.720 1.00 0.00 C ATOM 1402 CG TRP A 88 -7.608 14.559 -1.887 1.00 0.00 C ATOM 1403 CD1 TRP A 88 -8.336 14.125 -2.940 1.00 0.00 C ATOM 1404 CD2 TRP A 88 -7.332 15.968 -2.132 1.00 0.00 C ATOM 1405 NE1 TRP A 88 -8.524 15.178 -3.817 1.00 0.00 N ATOM 1406 CE2 TRP A 88 -7.925 16.336 -3.363 1.00 0.00 C ATOM 1407 CE3 TRP A 88 -6.632 16.953 -1.412 1.00 0.00 C ATOM 1408 CZ2 TRP A 88 -7.825 17.636 -3.862 1.00 0.00 C ATOM 1409 CZ3 TRP A 88 -6.529 18.262 -1.912 1.00 0.00 C ATOM 1410 CH2 TRP A 88 -7.125 18.602 -3.135 1.00 0.00 C ATOM 0 H TRP A 88 -8.523 11.310 -1.310 1.00 0.00 H new ATOM 0 HA TRP A 88 -8.414 13.236 1.022 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -6.668 14.332 0.010 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -6.482 12.954 -1.056 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -8.710 13.121 -3.075 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -9.042 15.107 -4.693 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -6.171 16.701 -0.468 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -8.286 17.893 -4.804 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -5.988 19.010 -1.352 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -7.043 19.610 -3.515 1.00 0.00 H new ATOM 1421 N LEU A 89 -10.269 14.587 0.011 1.00 0.00 N ATOM 1422 CA LEU A 89 -11.580 15.130 -0.453 1.00 0.00 C ATOM 1423 C LEU A 89 -11.406 16.540 -1.027 1.00 0.00 C ATOM 1424 O LEU A 89 -10.740 17.378 -0.450 1.00 0.00 O ATOM 1425 CB LEU A 89 -12.455 15.156 0.808 1.00 0.00 C ATOM 1426 CG LEU A 89 -13.655 16.096 0.619 1.00 0.00 C ATOM 1427 CD1 LEU A 89 -13.218 17.543 0.848 1.00 0.00 C ATOM 1428 CD2 LEU A 89 -14.225 15.952 -0.797 1.00 0.00 C ATOM 0 H LEU A 89 -9.847 15.084 0.796 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.022 14.529 -1.247 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -12.808 14.149 1.032 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.861 15.484 1.661 1.00 0.00 H new ATOM 0 HG LEU A 89 -14.427 15.829 1.341 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -14.072 18.207 0.713 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -12.832 17.650 1.862 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -12.438 17.805 0.133 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -15.075 16.624 -0.917 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -13.456 16.206 -1.526 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -14.550 14.924 -0.956 1.00 0.00 H new ATOM 1440 N VAL A 90 -12.005 16.810 -2.157 1.00 0.00 N ATOM 1441 CA VAL A 90 -11.879 18.169 -2.761 1.00 0.00 C ATOM 1442 C VAL A 90 -13.126 19.002 -2.451 1.00 0.00 C ATOM 1443 O VAL A 90 -14.244 18.566 -2.653 1.00 0.00 O ATOM 1444 CB VAL A 90 -11.757 17.932 -4.268 1.00 0.00 C ATOM 1445 CG1 VAL A 90 -10.742 16.820 -4.534 1.00 0.00 C ATOM 1446 CG2 VAL A 90 -13.119 17.525 -4.834 1.00 0.00 C ATOM 0 H VAL A 90 -12.575 16.150 -2.687 1.00 0.00 H new ATOM 0 HA VAL A 90 -11.022 18.715 -2.366 1.00 0.00 H new ATOM 0 HB VAL A 90 -11.422 18.850 -4.751 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -10.658 16.654 -5.608 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.771 17.111 -4.134 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -11.073 15.901 -4.050 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -13.031 17.356 -5.907 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -13.455 16.609 -4.349 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -13.842 18.320 -4.649 1.00 0.00 H new ATOM 1456 N THR A 91 -12.942 20.199 -1.964 1.00 0.00 N ATOM 1457 CA THR A 91 -14.113 21.066 -1.642 1.00 0.00 C ATOM 1458 C THR A 91 -14.042 22.365 -2.449 1.00 0.00 C ATOM 1459 O THR A 91 -14.092 23.450 -1.903 1.00 0.00 O ATOM 1460 CB THR A 91 -13.998 21.362 -0.144 1.00 0.00 C ATOM 1461 OG1 THR A 91 -12.760 20.865 0.348 1.00 0.00 O ATOM 1462 CG2 THR A 91 -15.153 20.691 0.602 1.00 0.00 C ATOM 0 H THR A 91 -12.030 20.615 -1.775 1.00 0.00 H new ATOM 0 HA THR A 91 -15.060 20.585 -1.888 1.00 0.00 H new ATOM 0 HB THR A 91 -14.043 22.439 0.015 1.00 0.00 H new ATOM 0 HG1 THR A 91 -12.688 21.057 1.306 1.00 0.00 H new ATOM 0 HG21 THR A 91 -15.069 20.903 1.668 1.00 0.00 H new ATOM 0 HG22 THR A 91 -16.101 21.078 0.228 1.00 0.00 H new ATOM 0 HG23 THR A 91 -15.112 19.614 0.442 1.00 0.00 H new ATOM 1470 N THR A 92 -13.920 22.265 -3.744 1.00 0.00 N ATOM 1471 CA THR A 92 -13.839 23.495 -4.583 1.00 0.00 C ATOM 1472 C THR A 92 -15.242 24.004 -4.923 1.00 0.00 C ATOM 1473 O THR A 92 -16.212 23.277 -4.855 1.00 0.00 O ATOM 1474 CB THR A 92 -13.107 23.060 -5.854 1.00 0.00 C ATOM 1475 OG1 THR A 92 -12.319 21.911 -5.575 1.00 0.00 O ATOM 1476 CG2 THR A 92 -12.205 24.194 -6.342 1.00 0.00 C ATOM 0 H THR A 92 -13.873 21.385 -4.258 1.00 0.00 H new ATOM 0 HA THR A 92 -13.324 24.307 -4.070 1.00 0.00 H new ATOM 0 HB THR A 92 -13.836 22.822 -6.629 1.00 0.00 H new ATOM 0 HG1 THR A 92 -12.112 21.445 -6.412 1.00 0.00 H new ATOM 0 HG21 THR A 92 -11.685 23.881 -7.247 1.00 0.00 H new ATOM 0 HG22 THR A 92 -12.811 25.074 -6.557 1.00 0.00 H new ATOM 0 HG23 THR A 92 -11.475 24.436 -5.570 1.00 0.00 H new ATOM 1484 N VAL A 93 -15.352 25.250 -5.297 1.00 0.00 N ATOM 1485 CA VAL A 93 -16.688 25.810 -5.651 1.00 0.00 C ATOM 1486 C VAL A 93 -16.761 26.062 -7.159 1.00 0.00 C ATOM 1487 O VAL A 93 -16.521 27.158 -7.626 1.00 0.00 O ATOM 1488 CB VAL A 93 -16.785 27.128 -4.882 1.00 0.00 C ATOM 1489 CG1 VAL A 93 -18.079 27.845 -5.266 1.00 0.00 C ATOM 1490 CG2 VAL A 93 -16.786 26.842 -3.379 1.00 0.00 C ATOM 0 H VAL A 93 -14.574 25.905 -5.373 1.00 0.00 H new ATOM 0 HA VAL A 93 -17.504 25.133 -5.396 1.00 0.00 H new ATOM 0 HB VAL A 93 -15.932 27.759 -5.130 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -18.150 28.785 -4.719 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -18.079 28.048 -6.337 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -18.932 27.214 -5.016 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -16.855 27.781 -2.830 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -17.640 26.212 -3.129 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -15.864 26.329 -3.106 1.00 0.00 H new ATOM 1500 N GLY A 94 -17.079 25.055 -7.925 1.00 0.00 N ATOM 1501 CA GLY A 94 -17.155 25.237 -9.402 1.00 0.00 C ATOM 1502 C GLY A 94 -15.768 25.008 -10.005 1.00 0.00 C ATOM 1503 O GLY A 94 -15.049 25.940 -10.308 1.00 0.00 O ATOM 0 H GLY A 94 -17.289 24.114 -7.592 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -17.872 24.537 -9.831 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -17.508 26.241 -9.640 1.00 0.00 H new ATOM 1507 N ALA A 95 -15.383 23.772 -10.174 1.00 0.00 N ATOM 1508 CA ALA A 95 -14.042 23.478 -10.745 1.00 0.00 C ATOM 1509 C ALA A 95 -13.976 22.036 -11.248 1.00 0.00 C ATOM 1510 O ALA A 95 -14.932 21.511 -11.781 1.00 0.00 O ATOM 1511 CB ALA A 95 -13.070 23.683 -9.583 1.00 0.00 C ATOM 0 H ALA A 95 -15.943 22.952 -9.940 1.00 0.00 H new ATOM 0 HA ALA A 95 -13.809 24.117 -11.597 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -12.053 23.485 -9.920 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.141 24.711 -9.226 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -13.323 22.999 -8.772 1.00 0.00 H new ATOM 1517 N TYR A 96 -12.845 21.402 -11.085 1.00 0.00 N ATOM 1518 CA TYR A 96 -12.683 19.994 -11.549 1.00 0.00 C ATOM 1519 C TYR A 96 -11.244 19.538 -11.292 1.00 0.00 C ATOM 1520 O TYR A 96 -10.329 19.927 -11.989 1.00 0.00 O ATOM 1521 CB TYR A 96 -12.974 20.025 -13.050 1.00 0.00 C ATOM 1522 CG TYR A 96 -12.719 18.657 -13.637 1.00 0.00 C ATOM 1523 CD1 TYR A 96 -13.058 17.510 -12.909 1.00 0.00 C ATOM 1524 CD2 TYR A 96 -12.144 18.536 -14.907 1.00 0.00 C ATOM 1525 CE1 TYR A 96 -12.822 16.241 -13.451 1.00 0.00 C ATOM 1526 CE2 TYR A 96 -11.908 17.267 -15.450 1.00 0.00 C ATOM 1527 CZ TYR A 96 -12.247 16.120 -14.722 1.00 0.00 C ATOM 1528 OH TYR A 96 -12.016 14.869 -15.258 1.00 0.00 O ATOM 0 H TYR A 96 -12.018 21.805 -10.645 1.00 0.00 H new ATOM 0 HA TYR A 96 -13.347 19.304 -11.029 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -14.008 20.321 -13.225 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -12.342 20.767 -13.539 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -13.502 17.604 -11.929 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -11.882 19.421 -15.468 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -13.083 15.356 -12.889 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -11.465 17.173 -16.430 1.00 0.00 H new ATOM 0 HH TYR A 96 -11.614 14.963 -16.147 1.00 0.00 H new ATOM 1538 N LEU A 97 -11.030 18.731 -10.289 1.00 0.00 N ATOM 1539 CA LEU A 97 -9.640 18.277 -9.990 1.00 0.00 C ATOM 1540 C LEU A 97 -9.509 16.760 -10.156 1.00 0.00 C ATOM 1541 O LEU A 97 -9.680 16.015 -9.211 1.00 0.00 O ATOM 1542 CB LEU A 97 -9.403 18.675 -8.531 1.00 0.00 C ATOM 1543 CG LEU A 97 -9.919 20.095 -8.296 1.00 0.00 C ATOM 1544 CD1 LEU A 97 -9.566 20.536 -6.875 1.00 0.00 C ATOM 1545 CD2 LEU A 97 -9.266 21.044 -9.302 1.00 0.00 C ATOM 0 H LEU A 97 -11.752 18.368 -9.666 1.00 0.00 H new ATOM 0 HA LEU A 97 -8.913 18.725 -10.668 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -9.912 17.978 -7.866 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.340 18.620 -8.297 1.00 0.00 H new ATOM 0 HG LEU A 97 -11.001 20.117 -8.424 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -9.933 21.548 -6.706 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -10.029 19.858 -6.158 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -8.484 20.517 -6.746 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -9.632 22.057 -9.137 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -8.184 21.023 -9.172 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -9.516 20.729 -10.315 1.00 0.00 H new ATOM 1557 N PRO A 98 -9.194 16.353 -11.357 1.00 0.00 N ATOM 1558 CA PRO A 98 -9.020 14.913 -11.651 1.00 0.00 C ATOM 1559 C PRO A 98 -7.652 14.442 -11.149 1.00 0.00 C ATOM 1560 O PRO A 98 -6.626 14.783 -11.702 1.00 0.00 O ATOM 1561 CB PRO A 98 -9.087 14.846 -13.171 1.00 0.00 C ATOM 1562 CG PRO A 98 -8.672 16.204 -13.644 1.00 0.00 C ATOM 1563 CD PRO A 98 -8.977 17.189 -12.541 1.00 0.00 C ATOM 0 HA PRO A 98 -9.766 14.280 -11.170 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -8.423 14.074 -13.560 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -10.094 14.602 -13.510 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -7.609 16.217 -13.884 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -9.208 16.472 -14.555 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -8.152 17.885 -12.390 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -9.859 17.786 -12.773 1.00 0.00 H new ATOM 1571 N ALA A 99 -7.628 13.668 -10.100 1.00 0.00 N ATOM 1572 CA ALA A 99 -6.324 13.186 -9.558 1.00 0.00 C ATOM 1573 C ALA A 99 -5.627 12.265 -10.564 1.00 0.00 C ATOM 1574 O ALA A 99 -6.056 12.117 -11.691 1.00 0.00 O ATOM 1575 CB ALA A 99 -6.688 12.412 -8.291 1.00 0.00 C ATOM 0 H ALA A 99 -8.454 13.348 -9.594 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.636 14.007 -9.358 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -5.781 12.022 -7.829 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -7.194 13.077 -7.591 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.349 11.584 -8.548 1.00 0.00 H new ATOM 1581 N VAL A 100 -4.558 11.636 -10.155 1.00 0.00 N ATOM 1582 CA VAL A 100 -3.832 10.710 -11.078 1.00 0.00 C ATOM 1583 C VAL A 100 -4.015 9.265 -10.604 1.00 0.00 C ATOM 1584 O VAL A 100 -4.488 8.420 -11.337 1.00 0.00 O ATOM 1585 CB VAL A 100 -2.345 11.118 -11.049 1.00 0.00 C ATOM 1586 CG1 VAL A 100 -2.045 12.015 -12.251 1.00 0.00 C ATOM 1587 CG2 VAL A 100 -2.006 11.882 -9.762 1.00 0.00 C ATOM 0 H VAL A 100 -4.155 11.722 -9.222 1.00 0.00 H new ATOM 0 HA VAL A 100 -4.219 10.774 -12.095 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.740 10.212 -11.087 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.995 12.306 -12.235 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.257 11.472 -13.172 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -2.669 12.907 -12.204 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.951 12.157 -9.769 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -2.616 12.784 -9.703 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -2.210 11.249 -8.899 1.00 0.00 H new ATOM 1597 N PHE A 101 -3.663 8.972 -9.379 1.00 0.00 N ATOM 1598 CA PHE A 101 -3.844 7.581 -8.870 1.00 0.00 C ATOM 1599 C PHE A 101 -5.092 7.514 -7.989 1.00 0.00 C ATOM 1600 O PHE A 101 -5.581 6.450 -7.665 1.00 0.00 O ATOM 1601 CB PHE A 101 -2.605 7.283 -8.024 1.00 0.00 C ATOM 1602 CG PHE A 101 -1.394 7.073 -8.901 1.00 0.00 C ATOM 1603 CD1 PHE A 101 -1.524 6.481 -10.164 1.00 0.00 C ATOM 1604 CD2 PHE A 101 -0.131 7.462 -8.440 1.00 0.00 C ATOM 1605 CE1 PHE A 101 -0.394 6.283 -10.963 1.00 0.00 C ATOM 1606 CE2 PHE A 101 0.999 7.262 -9.238 1.00 0.00 C ATOM 1607 CZ PHE A 101 0.867 6.672 -10.500 1.00 0.00 C ATOM 0 H PHE A 101 -3.261 9.632 -8.713 1.00 0.00 H new ATOM 0 HA PHE A 101 -3.963 6.865 -9.683 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.422 8.108 -7.336 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -2.779 6.394 -7.417 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -2.497 6.178 -10.520 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -0.029 7.917 -7.466 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -0.495 5.830 -11.938 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.973 7.563 -8.881 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.740 6.517 -11.117 1.00 0.00 H new ATOM 1617 N GLU A 102 -5.600 8.646 -7.585 1.00 0.00 N ATOM 1618 CA GLU A 102 -6.805 8.654 -6.707 1.00 0.00 C ATOM 1619 C GLU A 102 -8.085 8.787 -7.537 1.00 0.00 C ATOM 1620 O GLU A 102 -8.251 9.719 -8.299 1.00 0.00 O ATOM 1621 CB GLU A 102 -6.616 9.878 -5.809 1.00 0.00 C ATOM 1622 CG GLU A 102 -7.909 10.162 -5.045 1.00 0.00 C ATOM 1623 CD GLU A 102 -7.605 11.086 -3.866 1.00 0.00 C ATOM 1624 OE1 GLU A 102 -7.129 12.183 -4.108 1.00 0.00 O ATOM 1625 OE2 GLU A 102 -7.848 10.681 -2.742 1.00 0.00 O ATOM 0 H GLU A 102 -5.233 9.567 -7.825 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.905 7.730 -6.137 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -5.799 9.704 -5.108 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.341 10.744 -6.411 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -8.641 10.625 -5.706 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.347 9.230 -4.688 1.00 0.00 H new ATOM 1632 N GLU A 103 -8.995 7.863 -7.387 1.00 0.00 N ATOM 1633 CA GLU A 103 -10.269 7.937 -8.158 1.00 0.00 C ATOM 1634 C GLU A 103 -11.393 8.448 -7.253 1.00 0.00 C ATOM 1635 O GLU A 103 -11.270 8.461 -6.045 1.00 0.00 O ATOM 1636 CB GLU A 103 -10.550 6.503 -8.608 1.00 0.00 C ATOM 1637 CG GLU A 103 -10.441 6.418 -10.131 1.00 0.00 C ATOM 1638 CD GLU A 103 -11.779 5.962 -10.717 1.00 0.00 C ATOM 1639 OE1 GLU A 103 -12.792 6.525 -10.337 1.00 0.00 O ATOM 1640 OE2 GLU A 103 -11.767 5.058 -11.536 1.00 0.00 O ATOM 0 H GLU A 103 -8.911 7.060 -6.764 1.00 0.00 H new ATOM 0 HA GLU A 103 -10.203 8.618 -9.006 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -9.841 5.819 -8.143 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -11.546 6.198 -8.286 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -10.165 7.390 -10.541 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -9.653 5.719 -10.411 1.00 0.00 H new ATOM 1647 N VAL A 104 -12.486 8.873 -7.824 1.00 0.00 N ATOM 1648 CA VAL A 104 -13.607 9.386 -6.989 1.00 0.00 C ATOM 1649 C VAL A 104 -14.517 8.237 -6.547 1.00 0.00 C ATOM 1650 O VAL A 104 -14.707 7.271 -7.258 1.00 0.00 O ATOM 1651 CB VAL A 104 -14.365 10.352 -7.898 1.00 0.00 C ATOM 1652 CG1 VAL A 104 -15.154 9.559 -8.942 1.00 0.00 C ATOM 1653 CG2 VAL A 104 -15.332 11.186 -7.057 1.00 0.00 C ATOM 0 H VAL A 104 -12.651 8.887 -8.830 1.00 0.00 H new ATOM 0 HA VAL A 104 -13.253 9.871 -6.080 1.00 0.00 H new ATOM 0 HB VAL A 104 -13.656 11.010 -8.401 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -15.695 10.248 -9.590 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -14.467 8.961 -9.541 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -15.863 8.901 -8.440 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -15.874 11.876 -7.703 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -16.040 10.526 -6.556 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -14.772 11.751 -6.312 1.00 0.00 H new ATOM 1663 N LEU A 105 -15.083 8.340 -5.375 1.00 0.00 N ATOM 1664 CA LEU A 105 -15.984 7.260 -4.882 1.00 0.00 C ATOM 1665 C LEU A 105 -17.447 7.700 -4.997 1.00 0.00 C ATOM 1666 O LEU A 105 -18.329 6.899 -5.237 1.00 0.00 O ATOM 1667 CB LEU A 105 -15.599 7.062 -3.416 1.00 0.00 C ATOM 1668 CG LEU A 105 -14.343 6.195 -3.330 1.00 0.00 C ATOM 1669 CD1 LEU A 105 -13.222 6.834 -4.152 1.00 0.00 C ATOM 1670 CD2 LEU A 105 -13.902 6.084 -1.868 1.00 0.00 C ATOM 0 H LEU A 105 -14.960 9.126 -4.737 1.00 0.00 H new ATOM 0 HA LEU A 105 -15.881 6.341 -5.458 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -15.420 8.027 -2.943 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -16.418 6.588 -2.875 1.00 0.00 H new ATOM 0 HG LEU A 105 -14.560 5.202 -3.723 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -12.327 6.215 -4.090 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -13.535 6.916 -5.193 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -13.004 7.827 -3.760 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -13.006 5.466 -1.804 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -13.686 7.078 -1.477 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -14.700 5.629 -1.281 1.00 0.00 H new ATOM 1682 N ASP A 106 -17.711 8.966 -4.824 1.00 0.00 N ATOM 1683 CA ASP A 106 -19.118 9.454 -4.922 1.00 0.00 C ATOM 1684 C ASP A 106 -19.159 10.984 -4.849 1.00 0.00 C ATOM 1685 O ASP A 106 -18.149 11.648 -4.973 1.00 0.00 O ATOM 1686 CB ASP A 106 -19.833 8.837 -3.720 1.00 0.00 C ATOM 1687 CG ASP A 106 -20.974 7.943 -4.209 1.00 0.00 C ATOM 1688 OD1 ASP A 106 -21.801 8.431 -4.961 1.00 0.00 O ATOM 1689 OD2 ASP A 106 -21.000 6.785 -3.825 1.00 0.00 O ATOM 0 H ASP A 106 -17.015 9.683 -4.619 1.00 0.00 H new ATOM 0 HA ASP A 106 -19.588 9.173 -5.865 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -19.130 8.254 -3.125 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -20.224 9.623 -3.073 1.00 0.00 H new ATOM 1694 N LEU A 107 -20.321 11.548 -4.651 1.00 0.00 N ATOM 1695 CA LEU A 107 -20.431 13.035 -4.573 1.00 0.00 C ATOM 1696 C LEU A 107 -21.030 13.447 -3.224 1.00 0.00 C ATOM 1697 O LEU A 107 -21.758 12.695 -2.607 1.00 0.00 O ATOM 1698 CB LEU A 107 -21.371 13.418 -5.717 1.00 0.00 C ATOM 1699 CG LEU A 107 -20.654 13.226 -7.055 1.00 0.00 C ATOM 1700 CD1 LEU A 107 -19.291 13.917 -7.008 1.00 0.00 C ATOM 1701 CD2 LEU A 107 -20.459 11.731 -7.320 1.00 0.00 C ATOM 0 H LEU A 107 -21.200 11.043 -4.540 1.00 0.00 H new ATOM 0 HA LEU A 107 -19.463 13.530 -4.656 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -22.271 12.804 -5.683 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -21.689 14.455 -5.609 1.00 0.00 H new ATOM 0 HG LEU A 107 -21.254 13.662 -7.854 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -18.781 13.780 -7.961 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -19.429 14.982 -6.820 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -18.690 13.483 -6.209 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -19.948 11.594 -8.273 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -19.859 11.295 -6.521 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -21.430 11.238 -7.355 1.00 0.00 H new ATOM 1713 N VAL A 108 -20.729 14.630 -2.756 1.00 0.00 N ATOM 1714 CA VAL A 108 -21.288 15.066 -1.442 1.00 0.00 C ATOM 1715 C VAL A 108 -21.724 16.535 -1.491 1.00 0.00 C ATOM 1716 O VAL A 108 -20.909 17.435 -1.512 1.00 0.00 O ATOM 1717 CB VAL A 108 -20.141 14.880 -0.450 1.00 0.00 C ATOM 1718 CG1 VAL A 108 -18.880 15.554 -0.995 1.00 0.00 C ATOM 1719 CG2 VAL A 108 -20.520 15.515 0.889 1.00 0.00 C ATOM 0 H VAL A 108 -20.126 15.308 -3.222 1.00 0.00 H new ATOM 0 HA VAL A 108 -22.173 14.493 -1.165 1.00 0.00 H new ATOM 0 HB VAL A 108 -19.951 13.816 -0.308 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -18.062 15.421 -0.287 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -18.610 15.103 -1.950 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -19.068 16.618 -1.136 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -19.703 15.383 1.598 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -20.709 16.579 0.747 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -21.419 15.036 1.278 1.00 0.00 H new ATOM 1729 N ASP A 109 -23.006 16.781 -1.498 1.00 0.00 N ATOM 1730 CA ASP A 109 -23.496 18.190 -1.535 1.00 0.00 C ATOM 1731 C ASP A 109 -23.210 18.885 -0.201 1.00 0.00 C ATOM 1732 O ASP A 109 -23.697 18.481 0.836 1.00 0.00 O ATOM 1733 CB ASP A 109 -25.003 18.078 -1.766 1.00 0.00 C ATOM 1734 CG ASP A 109 -25.564 19.449 -2.149 1.00 0.00 C ATOM 1735 OD1 ASP A 109 -25.392 19.839 -3.293 1.00 0.00 O ATOM 1736 OD2 ASP A 109 -26.156 20.085 -1.293 1.00 0.00 O ATOM 0 H ASP A 109 -23.735 16.068 -1.480 1.00 0.00 H new ATOM 0 HA ASP A 109 -23.006 18.777 -2.311 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -25.208 17.356 -2.556 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -25.494 17.711 -0.864 1.00 0.00 H new ATOM 1741 N ALA A 110 -22.421 19.925 -0.218 1.00 0.00 N ATOM 1742 CA ALA A 110 -22.104 20.640 1.052 1.00 0.00 C ATOM 1743 C ALA A 110 -23.293 21.501 1.492 1.00 0.00 C ATOM 1744 O ALA A 110 -24.214 21.738 0.736 1.00 0.00 O ATOM 1745 CB ALA A 110 -20.900 21.520 0.720 1.00 0.00 C ATOM 0 H ALA A 110 -21.983 20.310 -1.055 1.00 0.00 H new ATOM 0 HA ALA A 110 -21.894 19.951 1.870 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -20.604 22.081 1.606 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -20.070 20.893 0.393 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -21.166 22.214 -0.077 1.00 0.00 H new ATOM 1751 N VAL A 111 -23.277 21.969 2.710 1.00 0.00 N ATOM 1752 CA VAL A 111 -24.403 22.813 3.203 1.00 0.00 C ATOM 1753 C VAL A 111 -24.160 24.283 2.848 1.00 0.00 C ATOM 1754 O VAL A 111 -23.095 24.819 3.081 1.00 0.00 O ATOM 1755 CB VAL A 111 -24.398 22.619 4.720 1.00 0.00 C ATOM 1756 CG1 VAL A 111 -23.071 23.119 5.294 1.00 0.00 C ATOM 1757 CG2 VAL A 111 -25.551 23.412 5.338 1.00 0.00 C ATOM 0 H VAL A 111 -22.532 21.803 3.386 1.00 0.00 H new ATOM 0 HA VAL A 111 -25.358 22.535 2.756 1.00 0.00 H new ATOM 0 HB VAL A 111 -24.518 21.561 4.952 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -23.067 22.981 6.375 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -22.249 22.556 4.853 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -22.950 24.177 5.063 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -25.549 23.275 6.419 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -25.430 24.470 5.106 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -26.497 23.057 4.929 1.00 0.00 H new ATOM 1767 N ILE A 112 -25.139 24.939 2.286 1.00 0.00 N ATOM 1768 CA ILE A 112 -24.960 26.374 1.920 1.00 0.00 C ATOM 1769 C ILE A 112 -25.546 27.275 3.010 1.00 0.00 C ATOM 1770 O ILE A 112 -25.096 28.384 3.219 1.00 0.00 O ATOM 1771 CB ILE A 112 -25.721 26.550 0.605 1.00 0.00 C ATOM 1772 CG1 ILE A 112 -25.136 25.609 -0.450 1.00 0.00 C ATOM 1773 CG2 ILE A 112 -25.585 27.996 0.124 1.00 0.00 C ATOM 1774 CD1 ILE A 112 -26.114 24.462 -0.710 1.00 0.00 C ATOM 0 H ILE A 112 -26.053 24.545 2.065 1.00 0.00 H new ATOM 0 HA ILE A 112 -23.909 26.645 1.817 1.00 0.00 H new ATOM 0 HB ILE A 112 -26.774 26.316 0.762 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -24.946 26.155 -1.374 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -24.179 25.214 -0.110 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -26.128 28.120 -0.813 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -25.998 28.670 0.875 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -24.532 28.230 -0.033 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -25.697 23.792 -1.462 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -26.282 23.910 0.215 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -27.061 24.865 -1.069 1.00 0.00 H new ATOM 1786 N LEU A 113 -26.545 26.808 3.709 1.00 0.00 N ATOM 1787 CA LEU A 113 -27.153 27.641 4.787 1.00 0.00 C ATOM 1788 C LEU A 113 -27.144 26.875 6.114 1.00 0.00 C ATOM 1789 O LEU A 113 -26.593 25.787 6.143 1.00 0.00 O ATOM 1790 CB LEU A 113 -28.588 27.903 4.329 1.00 0.00 C ATOM 1791 CG LEU A 113 -29.281 26.573 4.032 1.00 0.00 C ATOM 1792 CD1 LEU A 113 -30.619 26.519 4.772 1.00 0.00 C ATOM 1793 CD2 LEU A 113 -29.527 26.454 2.527 1.00 0.00 C ATOM 1794 OXT LEU A 113 -27.688 27.391 7.077 1.00 0.00 O ATOM 0 H LEU A 113 -26.966 25.888 3.581 1.00 0.00 H new ATOM 0 HA LEU A 113 -26.604 28.568 4.950 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -29.134 28.445 5.101 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -28.587 28.531 3.438 1.00 0.00 H new ATOM 0 HG LEU A 113 -28.648 25.750 4.365 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -31.114 25.571 4.561 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -30.445 26.607 5.845 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -31.253 27.341 4.439 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -30.021 25.506 2.313 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -30.161 27.277 2.196 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -28.575 26.494 1.998 1.00 0.00 H new TER 1806 LEU A 113