USER MOD reduce.3.24.130724 H: found=0, std=0, add=768, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 766 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 61 ASN : amide:sc= -1.3! K(o=-1.3!,f=0.53) USER MOD Set 1.2: A 65 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 67 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 36 THR OG1 : rot -155:sc= 0.263 USER MOD Set 2.2: A 66 CYS SG : rot 26:sc= 0.415 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -55:sc= 0.122 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.18 X(o=-0.18,f=-0.18) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 HIS : no HD1:sc= -2.58! C(o=-2.6!,f=-3!) USER MOD Single : A 15 SER OG : rot 6:sc= 0.163 USER MOD Single : A 17 TYR OH : rot 180:sc= -0.61 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc=-0.00513 K(o=-0.0051,f=-0.69) USER MOD Single : A 25 MET CE :methyl 177:sc= 0 (180deg=-0.00629) USER MOD Single : A 27 ASN : amide:sc= -0.699 K(o=-0.7,f=-0.047) USER MOD Single : A 28 LYS NZ :NH3+ 152:sc= 1.15 (180deg=0.898) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= -0.0427 USER MOD Single : A 52 SER OG : rot 150:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 CYS SG : rot 28:sc= 0.0822 USER MOD Single : A 59 LYS NZ :NH3+ -164:sc= -0.0237 (180deg=-0.195) USER MOD Single : A 62 LYS NZ :NH3+ 166:sc= -0.0257 (180deg=-0.224) USER MOD Single : A 69 SER OG : rot 160:sc= -1.75! USER MOD Single : A 70 TYR OH : rot -169:sc= -3.95! USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 4:sc= 1.33 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 HIS : no HE2:sc= -1.13 K(o=-1.1,f=-0.36) USER MOD Single : A 92 SER OG : rot -104:sc= -0.435 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.956! USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 22:sc= 0.269 USER MOD Single : A 109 SER OG : rot -8:sc= 0.988 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.013 -32.595 10.464 1.00 0.00 N ATOM 2 CA GLY A 1 2.921 -31.652 10.310 1.00 0.00 C ATOM 3 C GLY A 1 3.362 -30.216 10.515 1.00 0.00 C ATOM 4 O GLY A 1 2.845 -29.520 11.389 1.00 0.00 O ATOM 0 H1 GLY A 1 3.660 -33.562 10.314 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.754 -32.385 9.766 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.408 -32.515 11.423 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.491 -31.758 9.314 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.134 -31.893 11.024 1.00 0.00 H new ATOM 8 N SER A 2 4.320 -29.772 9.709 1.00 0.00 N ATOM 9 CA SER A 2 4.835 -28.411 9.810 1.00 0.00 C ATOM 10 C SER A 2 3.697 -27.414 10.006 1.00 0.00 C ATOM 11 O SER A 2 2.958 -27.106 9.071 1.00 0.00 O ATOM 12 CB SER A 2 5.633 -28.051 8.556 1.00 0.00 C ATOM 13 OG SER A 2 6.748 -28.912 8.396 1.00 0.00 O ATOM 0 H SER A 2 4.756 -30.335 8.978 1.00 0.00 H new ATOM 0 HA SER A 2 5.493 -28.361 10.677 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.989 -28.118 7.679 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.974 -27.018 8.622 1.00 0.00 H new ATOM 0 HG SER A 2 7.241 -28.662 7.586 1.00 0.00 H new ATOM 19 N SER A 3 3.563 -26.912 11.230 1.00 0.00 N ATOM 20 CA SER A 3 2.513 -25.953 11.551 1.00 0.00 C ATOM 21 C SER A 3 1.199 -26.339 10.879 1.00 0.00 C ATOM 22 O SER A 3 0.489 -25.488 10.344 1.00 0.00 O ATOM 23 CB SER A 3 2.928 -24.546 11.115 1.00 0.00 C ATOM 24 OG SER A 3 2.108 -23.562 11.721 1.00 0.00 O ATOM 0 H SER A 3 4.168 -27.154 12.015 1.00 0.00 H new ATOM 0 HA SER A 3 2.364 -25.963 12.631 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.970 -24.371 11.383 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.860 -24.463 10.030 1.00 0.00 H new ATOM 0 HG SER A 3 1.168 -23.750 11.519 1.00 0.00 H new ATOM 30 N GLY A 4 0.882 -27.630 10.911 1.00 0.00 N ATOM 31 CA GLY A 4 -0.346 -28.107 10.302 1.00 0.00 C ATOM 32 C GLY A 4 -1.580 -27.677 11.070 1.00 0.00 C ATOM 33 O GLY A 4 -2.248 -26.714 10.695 1.00 0.00 O ATOM 0 H GLY A 4 1.453 -28.354 11.348 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -0.410 -27.734 9.280 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.320 -29.195 10.243 1.00 0.00 H new ATOM 37 N SER A 5 -1.884 -28.394 12.147 1.00 0.00 N ATOM 38 CA SER A 5 -3.050 -28.084 12.967 1.00 0.00 C ATOM 39 C SER A 5 -2.702 -27.056 14.040 1.00 0.00 C ATOM 40 O SER A 5 -1.551 -26.950 14.463 1.00 0.00 O ATOM 41 CB SER A 5 -3.592 -29.356 13.621 1.00 0.00 C ATOM 42 OG SER A 5 -4.246 -30.179 12.670 1.00 0.00 O ATOM 0 H SER A 5 -1.340 -29.193 12.472 1.00 0.00 H new ATOM 0 HA SER A 5 -3.818 -27.661 12.319 1.00 0.00 H new ATOM 0 HB2 SER A 5 -2.774 -29.908 14.083 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.288 -29.091 14.417 1.00 0.00 H new ATOM 0 HG SER A 5 -4.582 -30.986 13.112 1.00 0.00 H new ATOM 48 N SER A 6 -3.706 -26.301 14.474 1.00 0.00 N ATOM 49 CA SER A 6 -3.507 -25.278 15.494 1.00 0.00 C ATOM 50 C SER A 6 -4.811 -24.983 16.229 1.00 0.00 C ATOM 51 O SER A 6 -5.898 -25.132 15.672 1.00 0.00 O ATOM 52 CB SER A 6 -2.963 -23.996 14.862 1.00 0.00 C ATOM 53 OG SER A 6 -3.844 -23.505 13.867 1.00 0.00 O ATOM 0 H SER A 6 -4.665 -26.378 14.135 1.00 0.00 H new ATOM 0 HA SER A 6 -2.781 -25.655 16.215 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.821 -23.238 15.633 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.985 -24.190 14.422 1.00 0.00 H new ATOM 0 HG SER A 6 -3.475 -22.684 13.479 1.00 0.00 H new ATOM 59 N GLY A 7 -4.694 -24.563 17.485 1.00 0.00 N ATOM 60 CA GLY A 7 -5.870 -24.254 18.277 1.00 0.00 C ATOM 61 C GLY A 7 -6.571 -22.995 17.806 1.00 0.00 C ATOM 62 O GLY A 7 -7.799 -22.952 17.729 1.00 0.00 O ATOM 0 H GLY A 7 -3.805 -24.431 17.968 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.565 -25.092 18.232 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.580 -24.136 19.321 1.00 0.00 H new ATOM 66 N ALA A 8 -5.790 -21.967 17.490 1.00 0.00 N ATOM 67 CA ALA A 8 -6.343 -20.702 17.024 1.00 0.00 C ATOM 68 C ALA A 8 -7.581 -20.929 16.161 1.00 0.00 C ATOM 69 O ALA A 8 -7.718 -21.970 15.518 1.00 0.00 O ATOM 70 CB ALA A 8 -5.293 -19.920 16.248 1.00 0.00 C ATOM 0 H ALA A 8 -4.772 -21.986 17.548 1.00 0.00 H new ATOM 0 HA ALA A 8 -6.641 -20.121 17.897 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -5.720 -18.977 15.906 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -4.439 -19.718 16.894 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -4.967 -20.504 15.387 1.00 0.00 H new ATOM 76 N ILE A 9 -8.478 -19.949 16.153 1.00 0.00 N ATOM 77 CA ILE A 9 -9.703 -20.042 15.369 1.00 0.00 C ATOM 78 C ILE A 9 -9.461 -19.636 13.920 1.00 0.00 C ATOM 79 O ILE A 9 -9.611 -20.445 13.005 1.00 0.00 O ATOM 80 CB ILE A 9 -10.818 -19.158 15.959 1.00 0.00 C ATOM 81 CG1 ILE A 9 -11.106 -19.560 17.407 1.00 0.00 C ATOM 82 CG2 ILE A 9 -12.079 -19.261 15.114 1.00 0.00 C ATOM 83 CD1 ILE A 9 -11.574 -20.991 17.555 1.00 0.00 C ATOM 0 H ILE A 9 -8.379 -19.082 16.681 1.00 0.00 H new ATOM 0 HA ILE A 9 -10.021 -21.084 15.403 1.00 0.00 H new ATOM 0 HB ILE A 9 -10.482 -18.121 15.950 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -10.203 -19.418 18.001 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -11.865 -18.894 17.816 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -12.858 -18.631 15.544 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.864 -18.930 14.098 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -12.420 -20.296 15.094 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -11.759 -21.206 18.607 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -12.494 -21.133 16.988 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -10.806 -21.666 17.176 1.00 0.00 H new ATOM 95 N ASN A 10 -9.084 -18.378 13.719 1.00 0.00 N ATOM 96 CA ASN A 10 -8.818 -17.864 12.380 1.00 0.00 C ATOM 97 C ASN A 10 -7.798 -18.736 11.654 1.00 0.00 C ATOM 98 O ASN A 10 -7.005 -19.435 12.284 1.00 0.00 O ATOM 99 CB ASN A 10 -8.312 -16.422 12.455 1.00 0.00 C ATOM 100 CG ASN A 10 -9.185 -15.548 13.334 1.00 0.00 C ATOM 101 OD1 ASN A 10 -8.698 -14.895 14.258 1.00 0.00 O ATOM 102 ND2 ASN A 10 -10.482 -15.531 13.050 1.00 0.00 N ATOM 0 H ASN A 10 -8.956 -17.695 14.466 1.00 0.00 H new ATOM 0 HA ASN A 10 -9.752 -17.885 11.818 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -7.293 -16.417 12.841 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -8.275 -16.000 11.451 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -11.119 -14.961 13.607 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -10.842 -16.088 12.275 1.00 0.00 H new ATOM 109 N SER A 11 -7.826 -18.689 10.326 1.00 0.00 N ATOM 110 CA SER A 11 -6.906 -19.477 9.514 1.00 0.00 C ATOM 111 C SER A 11 -6.228 -18.606 8.461 1.00 0.00 C ATOM 112 O SER A 11 -5.010 -18.425 8.479 1.00 0.00 O ATOM 113 CB SER A 11 -7.649 -20.630 8.837 1.00 0.00 C ATOM 114 OG SER A 11 -7.834 -21.713 9.733 1.00 0.00 O ATOM 0 H SER A 11 -8.475 -18.114 9.790 1.00 0.00 H new ATOM 0 HA SER A 11 -6.139 -19.885 10.172 1.00 0.00 H new ATOM 0 HB2 SER A 11 -8.617 -20.282 8.478 1.00 0.00 H new ATOM 0 HB3 SER A 11 -7.088 -20.967 7.965 1.00 0.00 H new ATOM 0 HG SER A 11 -8.313 -22.437 9.277 1.00 0.00 H new ATOM 120 N ARG A 12 -7.026 -18.068 7.545 1.00 0.00 N ATOM 121 CA ARG A 12 -6.504 -17.216 6.482 1.00 0.00 C ATOM 122 C ARG A 12 -7.272 -15.900 6.414 1.00 0.00 C ATOM 123 O ARG A 12 -8.502 -15.890 6.338 1.00 0.00 O ATOM 124 CB ARG A 12 -6.585 -17.937 5.136 1.00 0.00 C ATOM 125 CG ARG A 12 -6.502 -17.004 3.939 1.00 0.00 C ATOM 126 CD ARG A 12 -6.012 -17.732 2.697 1.00 0.00 C ATOM 127 NE ARG A 12 -7.113 -18.302 1.926 1.00 0.00 N ATOM 128 CZ ARG A 12 -6.954 -19.249 1.008 1.00 0.00 C ATOM 129 NH1 ARG A 12 -5.746 -19.729 0.748 1.00 0.00 N ATOM 130 NH2 ARG A 12 -8.006 -19.718 0.348 1.00 0.00 N ATOM 0 H ARG A 12 -8.036 -18.207 7.517 1.00 0.00 H new ATOM 0 HA ARG A 12 -5.460 -16.996 6.706 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -5.777 -18.666 5.075 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -7.521 -18.494 5.088 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -7.484 -16.572 3.745 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -5.829 -16.177 4.167 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -5.450 -17.040 2.069 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -5.325 -18.526 2.990 1.00 0.00 H new ATOM 0 HE ARG A 12 -8.056 -17.954 2.102 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -4.935 -19.371 1.253 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -5.627 -20.456 0.043 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -8.937 -19.351 0.546 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -7.883 -20.445 -0.357 1.00 0.00 H new ATOM 144 N HIS A 13 -6.540 -14.791 6.441 1.00 0.00 N ATOM 145 CA HIS A 13 -7.153 -13.469 6.382 1.00 0.00 C ATOM 146 C HIS A 13 -6.094 -12.387 6.189 1.00 0.00 C ATOM 147 O HIS A 13 -4.969 -12.513 6.673 1.00 0.00 O ATOM 148 CB HIS A 13 -7.951 -13.196 7.657 1.00 0.00 C ATOM 149 CG HIS A 13 -9.341 -13.753 7.624 1.00 0.00 C ATOM 150 ND1 HIS A 13 -9.769 -14.756 8.468 1.00 0.00 N ATOM 151 CD2 HIS A 13 -10.402 -13.441 6.844 1.00 0.00 C ATOM 152 CE1 HIS A 13 -11.033 -15.038 8.207 1.00 0.00 C ATOM 153 NE2 HIS A 13 -11.441 -14.253 7.226 1.00 0.00 N ATOM 0 H HIS A 13 -5.522 -14.781 6.503 1.00 0.00 H new ATOM 0 HA HIS A 13 -7.829 -13.447 5.528 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -7.418 -13.621 8.507 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -8.003 -12.119 7.820 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -10.427 -12.693 6.066 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -11.631 -15.783 8.710 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -12.376 -14.251 6.819 1.00 0.00 H new ATOM 162 N VAL A 14 -6.461 -11.326 5.478 1.00 0.00 N ATOM 163 CA VAL A 14 -5.543 -10.222 5.222 1.00 0.00 C ATOM 164 C VAL A 14 -6.191 -8.881 5.549 1.00 0.00 C ATOM 165 O VAL A 14 -7.337 -8.627 5.179 1.00 0.00 O ATOM 166 CB VAL A 14 -5.077 -10.210 3.754 1.00 0.00 C ATOM 167 CG1 VAL A 14 -4.150 -9.032 3.498 1.00 0.00 C ATOM 168 CG2 VAL A 14 -4.393 -11.523 3.402 1.00 0.00 C ATOM 0 H VAL A 14 -7.388 -11.207 5.069 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.679 -10.372 5.869 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.952 -10.099 3.114 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.831 -9.040 2.456 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.677 -8.102 3.709 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -3.276 -9.109 4.145 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -4.070 -11.497 2.361 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.526 -11.666 4.047 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -5.092 -12.347 3.545 1.00 0.00 H new ATOM 178 N SER A 15 -5.448 -8.026 6.245 1.00 0.00 N ATOM 179 CA SER A 15 -5.951 -6.711 6.625 1.00 0.00 C ATOM 180 C SER A 15 -4.823 -5.684 6.648 1.00 0.00 C ATOM 181 O SER A 15 -3.856 -5.824 7.397 1.00 0.00 O ATOM 182 CB SER A 15 -6.624 -6.777 7.997 1.00 0.00 C ATOM 183 OG SER A 15 -7.879 -7.430 7.918 1.00 0.00 O ATOM 0 H SER A 15 -4.496 -8.220 6.557 1.00 0.00 H new ATOM 0 HA SER A 15 -6.686 -6.401 5.882 1.00 0.00 H new ATOM 0 HB2 SER A 15 -5.978 -7.307 8.697 1.00 0.00 H new ATOM 0 HB3 SER A 15 -6.759 -5.769 8.388 1.00 0.00 H new ATOM 0 HG SER A 15 -8.003 -7.792 7.016 1.00 0.00 H new ATOM 189 N ALA A 16 -4.954 -4.652 5.822 1.00 0.00 N ATOM 190 CA ALA A 16 -3.948 -3.600 5.748 1.00 0.00 C ATOM 191 C ALA A 16 -4.434 -2.326 6.431 1.00 0.00 C ATOM 192 O ALA A 16 -5.616 -1.987 6.365 1.00 0.00 O ATOM 193 CB ALA A 16 -3.585 -3.318 4.297 1.00 0.00 C ATOM 0 H ALA A 16 -5.747 -4.522 5.194 1.00 0.00 H new ATOM 0 HA ALA A 16 -3.058 -3.945 6.273 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.833 -2.530 4.257 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -3.187 -4.224 3.839 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.475 -2.998 3.755 1.00 0.00 H new ATOM 199 N TYR A 17 -3.516 -1.625 7.087 1.00 0.00 N ATOM 200 CA TYR A 17 -3.853 -0.390 7.785 1.00 0.00 C ATOM 201 C TYR A 17 -2.625 0.503 7.935 1.00 0.00 C ATOM 202 O TYR A 17 -1.508 0.017 8.109 1.00 0.00 O ATOM 203 CB TYR A 17 -4.442 -0.702 9.161 1.00 0.00 C ATOM 204 CG TYR A 17 -3.600 -1.654 9.979 1.00 0.00 C ATOM 205 CD1 TYR A 17 -2.552 -1.188 10.763 1.00 0.00 C ATOM 206 CD2 TYR A 17 -3.851 -3.021 9.967 1.00 0.00 C ATOM 207 CE1 TYR A 17 -1.779 -2.054 11.512 1.00 0.00 C ATOM 208 CE2 TYR A 17 -3.084 -3.894 10.714 1.00 0.00 C ATOM 209 CZ TYR A 17 -2.050 -3.406 11.484 1.00 0.00 C ATOM 210 OH TYR A 17 -1.283 -4.274 12.228 1.00 0.00 O ATOM 0 H TYR A 17 -2.533 -1.891 7.150 1.00 0.00 H new ATOM 0 HA TYR A 17 -4.596 0.142 7.191 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -4.564 0.229 9.714 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -5.437 -1.129 9.033 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -2.338 -0.130 10.787 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -4.659 -3.407 9.364 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.968 -1.675 12.116 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -3.293 -4.953 10.695 1.00 0.00 H new ATOM 0 HH TYR A 17 -1.606 -5.190 12.098 1.00 0.00 H new ATOM 220 N GLY A 18 -2.841 1.813 7.869 1.00 0.00 N ATOM 221 CA GLY A 18 -1.744 2.754 8.000 1.00 0.00 C ATOM 222 C GLY A 18 -2.099 4.134 7.482 1.00 0.00 C ATOM 223 O GLY A 18 -3.161 4.346 6.896 1.00 0.00 O ATOM 0 H GLY A 18 -3.757 2.240 7.727 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -1.454 2.826 9.048 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -0.878 2.376 7.456 1.00 0.00 H new ATOM 227 N PRO A 19 -1.196 5.101 7.699 1.00 0.00 N ATOM 228 CA PRO A 19 -1.397 6.485 7.258 1.00 0.00 C ATOM 229 C PRO A 19 -1.329 6.626 5.741 1.00 0.00 C ATOM 230 O PRO A 19 -2.180 7.269 5.129 1.00 0.00 O ATOM 231 CB PRO A 19 -0.240 7.239 7.917 1.00 0.00 C ATOM 232 CG PRO A 19 0.817 6.209 8.121 1.00 0.00 C ATOM 233 CD PRO A 19 0.092 4.919 8.390 1.00 0.00 C ATOM 0 HA PRO A 19 -2.382 6.862 7.535 1.00 0.00 H new ATOM 0 HB2 PRO A 19 0.116 8.051 7.283 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.546 7.685 8.863 1.00 0.00 H new ATOM 0 HG2 PRO A 19 1.453 6.123 7.240 1.00 0.00 H new ATOM 0 HG3 PRO A 19 1.464 6.474 8.957 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.640 4.061 8.000 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -0.045 4.750 9.458 1.00 0.00 H new ATOM 241 N GLY A 20 -0.310 6.019 5.140 1.00 0.00 N ATOM 242 CA GLY A 20 -0.150 6.089 3.699 1.00 0.00 C ATOM 243 C GLY A 20 -1.335 5.506 2.955 1.00 0.00 C ATOM 244 O GLY A 20 -1.617 5.892 1.820 1.00 0.00 O ATOM 0 H GLY A 20 0.407 5.480 5.625 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -0.014 7.129 3.402 1.00 0.00 H new ATOM 0 HA3 GLY A 20 0.755 5.554 3.411 1.00 0.00 H new ATOM 248 N LEU A 21 -2.031 4.572 3.595 1.00 0.00 N ATOM 249 CA LEU A 21 -3.192 3.931 2.986 1.00 0.00 C ATOM 250 C LEU A 21 -4.410 4.847 3.041 1.00 0.00 C ATOM 251 O LEU A 21 -5.231 4.861 2.124 1.00 0.00 O ATOM 252 CB LEU A 21 -3.500 2.611 3.694 1.00 0.00 C ATOM 253 CG LEU A 21 -2.479 1.489 3.496 1.00 0.00 C ATOM 254 CD1 LEU A 21 -2.849 0.277 4.338 1.00 0.00 C ATOM 255 CD2 LEU A 21 -2.381 1.110 2.026 1.00 0.00 C ATOM 0 H LEU A 21 -1.812 4.242 4.535 1.00 0.00 H new ATOM 0 HA LEU A 21 -2.959 3.729 1.941 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.592 2.807 4.762 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.472 2.256 3.351 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.503 1.849 3.823 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.112 -0.511 4.185 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.867 0.557 5.391 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -3.834 -0.085 4.042 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -1.650 0.311 1.904 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.354 0.769 1.673 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -2.069 1.979 1.446 1.00 0.00 H new ATOM 267 N SER A 22 -4.520 5.613 4.121 1.00 0.00 N ATOM 268 CA SER A 22 -5.639 6.532 4.297 1.00 0.00 C ATOM 269 C SER A 22 -5.426 7.808 3.488 1.00 0.00 C ATOM 270 O SER A 22 -6.356 8.328 2.870 1.00 0.00 O ATOM 271 CB SER A 22 -5.816 6.876 5.777 1.00 0.00 C ATOM 272 OG SER A 22 -7.128 7.343 6.038 1.00 0.00 O ATOM 0 H SER A 22 -3.848 5.616 4.888 1.00 0.00 H new ATOM 0 HA SER A 22 -6.542 6.040 3.936 1.00 0.00 H new ATOM 0 HB2 SER A 22 -5.612 5.995 6.385 1.00 0.00 H new ATOM 0 HB3 SER A 22 -5.091 7.637 6.066 1.00 0.00 H new ATOM 0 HG SER A 22 -7.216 7.555 6.991 1.00 0.00 H new ATOM 278 N HIS A 23 -4.194 8.308 3.497 1.00 0.00 N ATOM 279 CA HIS A 23 -3.857 9.524 2.764 1.00 0.00 C ATOM 280 C HIS A 23 -2.350 9.761 2.768 1.00 0.00 C ATOM 281 O HIS A 23 -1.591 8.982 3.344 1.00 0.00 O ATOM 282 CB HIS A 23 -4.576 10.728 3.374 1.00 0.00 C ATOM 283 CG HIS A 23 -4.191 10.998 4.796 1.00 0.00 C ATOM 284 ND1 HIS A 23 -4.720 10.305 5.864 1.00 0.00 N ATOM 285 CD2 HIS A 23 -3.321 11.892 5.323 1.00 0.00 C ATOM 286 CE1 HIS A 23 -4.194 10.762 6.986 1.00 0.00 C ATOM 287 NE2 HIS A 23 -3.342 11.725 6.686 1.00 0.00 N ATOM 0 H HIS A 23 -3.413 7.890 4.003 1.00 0.00 H new ATOM 0 HA HIS A 23 -4.184 9.399 1.732 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -4.360 11.612 2.774 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -5.652 10.562 3.323 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -2.722 12.604 4.774 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -4.422 10.408 7.980 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -2.789 12.258 7.357 1.00 0.00 H new ATOM 296 N GLY A 24 -1.924 10.841 2.121 1.00 0.00 N ATOM 297 CA GLY A 24 -0.509 11.160 2.061 1.00 0.00 C ATOM 298 C GLY A 24 -0.235 12.442 1.300 1.00 0.00 C ATOM 299 O GLY A 24 -1.163 13.128 0.873 1.00 0.00 O ATOM 0 H GLY A 24 -2.533 11.501 1.637 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -0.117 11.252 3.074 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.026 10.338 1.586 1.00 0.00 H new ATOM 303 N MET A 25 1.042 12.767 1.132 1.00 0.00 N ATOM 304 CA MET A 25 1.435 13.976 0.418 1.00 0.00 C ATOM 305 C MET A 25 2.480 13.663 -0.649 1.00 0.00 C ATOM 306 O MET A 25 3.308 12.768 -0.476 1.00 0.00 O ATOM 307 CB MET A 25 1.984 15.016 1.396 1.00 0.00 C ATOM 308 CG MET A 25 0.984 15.435 2.462 1.00 0.00 C ATOM 309 SD MET A 25 1.778 15.919 4.007 1.00 0.00 S ATOM 310 CE MET A 25 2.647 17.398 3.491 1.00 0.00 C ATOM 0 H MET A 25 1.822 12.210 1.480 1.00 0.00 H new ATOM 0 HA MET A 25 0.550 14.381 -0.073 1.00 0.00 H new ATOM 0 HB2 MET A 25 2.873 14.613 1.882 1.00 0.00 H new ATOM 0 HB3 MET A 25 2.298 15.898 0.838 1.00 0.00 H new ATOM 0 HG2 MET A 25 0.388 16.267 2.088 1.00 0.00 H new ATOM 0 HG3 MET A 25 0.297 14.611 2.654 1.00 0.00 H new ATOM 0 HE1 MET A 25 3.145 17.846 4.351 1.00 0.00 H new ATOM 0 HE2 MET A 25 3.389 17.139 2.736 1.00 0.00 H new ATOM 0 HE3 MET A 25 1.936 18.110 3.072 1.00 0.00 H new ATOM 320 N VAL A 26 2.435 14.404 -1.751 1.00 0.00 N ATOM 321 CA VAL A 26 3.379 14.206 -2.845 1.00 0.00 C ATOM 322 C VAL A 26 4.818 14.279 -2.349 1.00 0.00 C ATOM 323 O VAL A 26 5.127 15.021 -1.417 1.00 0.00 O ATOM 324 CB VAL A 26 3.176 15.251 -3.957 1.00 0.00 C ATOM 325 CG1 VAL A 26 4.390 15.299 -4.873 1.00 0.00 C ATOM 326 CG2 VAL A 26 1.912 14.949 -4.748 1.00 0.00 C ATOM 0 H VAL A 26 1.755 15.147 -1.910 1.00 0.00 H new ATOM 0 HA VAL A 26 3.189 13.213 -3.252 1.00 0.00 H new ATOM 0 HB VAL A 26 3.061 16.231 -3.494 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.228 16.043 -5.653 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.273 15.567 -4.293 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.540 14.321 -5.330 1.00 0.00 H new ATOM 0 HG21 VAL A 26 1.784 15.698 -5.530 1.00 0.00 H new ATOM 0 HG22 VAL A 26 1.994 13.961 -5.202 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.051 14.971 -4.080 1.00 0.00 H new ATOM 336 N ASN A 27 5.696 13.505 -2.979 1.00 0.00 N ATOM 337 CA ASN A 27 7.104 13.482 -2.601 1.00 0.00 C ATOM 338 C ASN A 27 7.278 12.956 -1.180 1.00 0.00 C ATOM 339 O ASN A 27 8.189 13.367 -0.461 1.00 0.00 O ATOM 340 CB ASN A 27 7.707 14.884 -2.715 1.00 0.00 C ATOM 341 CG ASN A 27 8.275 15.158 -4.095 1.00 0.00 C ATOM 342 OD1 ASN A 27 9.236 14.518 -4.521 1.00 0.00 O ATOM 343 ND2 ASN A 27 7.681 16.114 -4.799 1.00 0.00 N ATOM 0 H ASN A 27 5.457 12.886 -3.753 1.00 0.00 H new ATOM 0 HA ASN A 27 7.626 12.812 -3.284 1.00 0.00 H new ATOM 0 HB2 ASN A 27 6.942 15.626 -2.486 1.00 0.00 H new ATOM 0 HB3 ASN A 27 8.495 14.999 -1.971 1.00 0.00 H new ATOM 0 HD21 ASN A 27 8.019 16.344 -5.734 1.00 0.00 H new ATOM 0 HD22 ASN A 27 6.887 16.619 -4.405 1.00 0.00 H new ATOM 350 N LYS A 28 6.399 12.043 -0.781 1.00 0.00 N ATOM 351 CA LYS A 28 6.455 11.458 0.553 1.00 0.00 C ATOM 352 C LYS A 28 6.074 9.981 0.516 1.00 0.00 C ATOM 353 O LYS A 28 4.998 9.604 0.051 1.00 0.00 O ATOM 354 CB LYS A 28 5.521 12.212 1.503 1.00 0.00 C ATOM 355 CG LYS A 28 5.740 13.715 1.504 1.00 0.00 C ATOM 356 CD LYS A 28 6.790 14.125 2.523 1.00 0.00 C ATOM 357 CE LYS A 28 7.475 15.423 2.126 1.00 0.00 C ATOM 358 NZ LYS A 28 8.648 15.183 1.240 1.00 0.00 N ATOM 0 H LYS A 28 5.639 11.692 -1.363 1.00 0.00 H new ATOM 0 HA LYS A 28 7.479 11.543 0.916 1.00 0.00 H new ATOM 0 HB2 LYS A 28 4.488 12.004 1.225 1.00 0.00 H new ATOM 0 HB3 LYS A 28 5.661 11.832 2.515 1.00 0.00 H new ATOM 0 HG2 LYS A 28 6.050 14.039 0.510 1.00 0.00 H new ATOM 0 HG3 LYS A 28 4.800 14.220 1.725 1.00 0.00 H new ATOM 0 HD2 LYS A 28 6.323 14.243 3.501 1.00 0.00 H new ATOM 0 HD3 LYS A 28 7.534 13.334 2.619 1.00 0.00 H new ATOM 0 HE2 LYS A 28 6.761 16.069 1.616 1.00 0.00 H new ATOM 0 HE3 LYS A 28 7.799 15.951 3.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 8.795 16.010 0.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 9.496 15.027 1.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 8.473 14.343 0.652 1.00 0.00 H new ATOM 372 N PRO A 29 6.976 9.124 1.017 1.00 0.00 N ATOM 373 CA PRO A 29 6.756 7.675 1.054 1.00 0.00 C ATOM 374 C PRO A 29 5.676 7.278 2.056 1.00 0.00 C ATOM 375 O PRO A 29 5.888 7.336 3.266 1.00 0.00 O ATOM 376 CB PRO A 29 8.115 7.120 1.486 1.00 0.00 C ATOM 377 CG PRO A 29 8.757 8.235 2.238 1.00 0.00 C ATOM 378 CD PRO A 29 8.280 9.503 1.587 1.00 0.00 C ATOM 0 HA PRO A 29 6.409 7.291 0.095 1.00 0.00 H new ATOM 0 HB2 PRO A 29 8.001 6.235 2.112 1.00 0.00 H new ATOM 0 HB3 PRO A 29 8.715 6.826 0.625 1.00 0.00 H new ATOM 0 HG2 PRO A 29 8.477 8.208 3.291 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.844 8.159 2.195 1.00 0.00 H new ATOM 0 HD2 PRO A 29 8.183 10.314 2.309 1.00 0.00 H new ATOM 0 HD3 PRO A 29 8.972 9.844 0.817 1.00 0.00 H new ATOM 386 N ALA A 30 4.518 6.875 1.542 1.00 0.00 N ATOM 387 CA ALA A 30 3.407 6.466 2.391 1.00 0.00 C ATOM 388 C ALA A 30 3.645 5.079 2.977 1.00 0.00 C ATOM 389 O ALA A 30 3.539 4.071 2.277 1.00 0.00 O ATOM 390 CB ALA A 30 2.104 6.493 1.606 1.00 0.00 C ATOM 0 H ALA A 30 4.326 6.823 0.542 1.00 0.00 H new ATOM 0 HA ALA A 30 3.335 7.173 3.217 1.00 0.00 H new ATOM 0 HB1 ALA A 30 1.283 6.185 2.253 1.00 0.00 H new ATOM 0 HB2 ALA A 30 1.920 7.504 1.242 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.175 5.810 0.760 1.00 0.00 H new ATOM 396 N THR A 31 3.968 5.033 4.266 1.00 0.00 N ATOM 397 CA THR A 31 4.223 3.769 4.945 1.00 0.00 C ATOM 398 C THR A 31 2.956 3.232 5.602 1.00 0.00 C ATOM 399 O THR A 31 2.163 3.992 6.158 1.00 0.00 O ATOM 400 CB THR A 31 5.319 3.918 6.017 1.00 0.00 C ATOM 401 OG1 THR A 31 4.833 4.707 7.109 1.00 0.00 O ATOM 402 CG2 THR A 31 6.564 4.567 5.431 1.00 0.00 C ATOM 0 H THR A 31 4.059 5.857 4.860 1.00 0.00 H new ATOM 0 HA THR A 31 4.562 3.065 4.185 1.00 0.00 H new ATOM 0 HB THR A 31 5.582 2.923 6.377 1.00 0.00 H new ATOM 0 HG1 THR A 31 5.535 4.795 7.787 1.00 0.00 H new ATOM 0 HG21 THR A 31 7.324 4.662 6.206 1.00 0.00 H new ATOM 0 HG22 THR A 31 6.949 3.949 4.619 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.312 5.555 5.047 1.00 0.00 H new ATOM 410 N PHE A 32 2.772 1.917 5.535 1.00 0.00 N ATOM 411 CA PHE A 32 1.601 1.279 6.123 1.00 0.00 C ATOM 412 C PHE A 32 1.918 -0.152 6.550 1.00 0.00 C ATOM 413 O PHE A 32 2.991 -0.677 6.253 1.00 0.00 O ATOM 414 CB PHE A 32 0.439 1.280 5.128 1.00 0.00 C ATOM 415 CG PHE A 32 0.773 0.630 3.816 1.00 0.00 C ATOM 416 CD1 PHE A 32 1.630 1.247 2.920 1.00 0.00 C ATOM 417 CD2 PHE A 32 0.230 -0.600 3.479 1.00 0.00 C ATOM 418 CE1 PHE A 32 1.939 0.651 1.711 1.00 0.00 C ATOM 419 CE2 PHE A 32 0.535 -1.201 2.272 1.00 0.00 C ATOM 420 CZ PHE A 32 1.391 -0.575 1.388 1.00 0.00 C ATOM 0 H PHE A 32 3.419 1.273 5.079 1.00 0.00 H new ATOM 0 HA PHE A 32 1.314 1.849 7.007 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.411 0.764 5.574 1.00 0.00 H new ATOM 0 HB3 PHE A 32 0.128 2.309 4.946 1.00 0.00 H new ATOM 0 HD1 PHE A 32 2.062 2.205 3.168 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -0.439 -1.095 4.167 1.00 0.00 H new ATOM 0 HE1 PHE A 32 2.608 1.143 1.021 1.00 0.00 H new ATOM 0 HE2 PHE A 32 0.104 -2.159 2.021 1.00 0.00 H new ATOM 0 HZ PHE A 32 1.632 -1.043 0.445 1.00 0.00 H new ATOM 430 N THR A 33 0.976 -0.777 7.250 1.00 0.00 N ATOM 431 CA THR A 33 1.154 -2.145 7.720 1.00 0.00 C ATOM 432 C THR A 33 0.305 -3.119 6.911 1.00 0.00 C ATOM 433 O THR A 33 -0.823 -2.804 6.529 1.00 0.00 O ATOM 434 CB THR A 33 0.790 -2.279 9.210 1.00 0.00 C ATOM 435 OG1 THR A 33 1.867 -1.800 10.023 1.00 0.00 O ATOM 436 CG2 THR A 33 0.485 -3.726 9.565 1.00 0.00 C ATOM 0 H THR A 33 0.082 -0.357 7.504 1.00 0.00 H new ATOM 0 HA THR A 33 2.208 -2.390 7.588 1.00 0.00 H new ATOM 0 HB THR A 33 -0.101 -1.680 9.398 1.00 0.00 H new ATOM 0 HG1 THR A 33 1.627 -1.887 10.969 1.00 0.00 H new ATOM 0 HG21 THR A 33 0.231 -3.795 10.623 1.00 0.00 H new ATOM 0 HG22 THR A 33 -0.355 -4.078 8.966 1.00 0.00 H new ATOM 0 HG23 THR A 33 1.360 -4.343 9.361 1.00 0.00 H new ATOM 444 N ILE A 34 0.853 -4.301 6.654 1.00 0.00 N ATOM 445 CA ILE A 34 0.144 -5.322 5.892 1.00 0.00 C ATOM 446 C ILE A 34 0.200 -6.673 6.597 1.00 0.00 C ATOM 447 O ILE A 34 1.240 -7.331 6.620 1.00 0.00 O ATOM 448 CB ILE A 34 0.726 -5.471 4.474 1.00 0.00 C ATOM 449 CG1 ILE A 34 0.658 -4.137 3.728 1.00 0.00 C ATOM 450 CG2 ILE A 34 -0.020 -6.552 3.706 1.00 0.00 C ATOM 451 CD1 ILE A 34 1.430 -4.133 2.426 1.00 0.00 C ATOM 0 H ILE A 34 1.786 -4.576 6.962 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.894 -4.997 5.818 1.00 0.00 H new ATOM 0 HB ILE A 34 1.772 -5.767 4.556 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -0.385 -3.897 3.523 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.046 -3.349 4.373 1.00 0.00 H new ATOM 0 HG21 ILE A 34 0.403 -6.645 2.706 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.076 -7.503 4.231 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -1.074 -6.283 3.631 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.338 -3.156 1.951 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.481 -4.342 2.626 1.00 0.00 H new ATOM 0 HD13 ILE A 34 1.028 -4.898 1.762 1.00 0.00 H new ATOM 463 N VAL A 35 -0.927 -7.081 7.171 1.00 0.00 N ATOM 464 CA VAL A 35 -1.008 -8.356 7.875 1.00 0.00 C ATOM 465 C VAL A 35 -0.903 -9.527 6.905 1.00 0.00 C ATOM 466 O VAL A 35 -1.830 -9.804 6.144 1.00 0.00 O ATOM 467 CB VAL A 35 -2.324 -8.476 8.667 1.00 0.00 C ATOM 468 CG1 VAL A 35 -2.387 -9.809 9.398 1.00 0.00 C ATOM 469 CG2 VAL A 35 -2.467 -7.317 9.642 1.00 0.00 C ATOM 0 H VAL A 35 -1.796 -6.548 7.163 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.169 -8.388 8.570 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.156 -8.434 7.964 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.323 -9.876 9.952 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -2.334 -10.623 8.675 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.549 -9.884 10.091 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -3.402 -7.418 10.193 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.631 -7.325 10.342 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.470 -6.376 9.091 1.00 0.00 H new ATOM 479 N THR A 36 0.235 -10.214 6.937 1.00 0.00 N ATOM 480 CA THR A 36 0.463 -11.356 6.061 1.00 0.00 C ATOM 481 C THR A 36 0.682 -12.632 6.866 1.00 0.00 C ATOM 482 O THR A 36 0.528 -13.739 6.349 1.00 0.00 O ATOM 483 CB THR A 36 1.680 -11.126 5.144 1.00 0.00 C ATOM 484 OG1 THR A 36 2.813 -10.729 5.924 1.00 0.00 O ATOM 485 CG2 THR A 36 1.377 -10.061 4.101 1.00 0.00 C ATOM 0 H THR A 36 1.013 -9.999 7.561 1.00 0.00 H new ATOM 0 HA THR A 36 -0.431 -11.466 5.447 1.00 0.00 H new ATOM 0 HB THR A 36 1.903 -12.061 4.631 1.00 0.00 H new ATOM 0 HG1 THR A 36 3.434 -10.219 5.363 1.00 0.00 H new ATOM 0 HG21 THR A 36 2.250 -9.916 3.465 1.00 0.00 H new ATOM 0 HG22 THR A 36 0.532 -10.380 3.490 1.00 0.00 H new ATOM 0 HG23 THR A 36 1.131 -9.123 4.599 1.00 0.00 H new ATOM 493 N LYS A 37 1.042 -12.471 8.135 1.00 0.00 N ATOM 494 CA LYS A 37 1.280 -13.610 9.013 1.00 0.00 C ATOM 495 C LYS A 37 0.051 -14.510 9.083 1.00 0.00 C ATOM 496 O LYS A 37 0.150 -15.726 8.917 1.00 0.00 O ATOM 497 CB LYS A 37 1.653 -13.128 10.417 1.00 0.00 C ATOM 498 CG LYS A 37 1.683 -14.238 11.453 1.00 0.00 C ATOM 499 CD LYS A 37 3.017 -14.965 11.453 1.00 0.00 C ATOM 500 CE LYS A 37 2.941 -16.270 12.232 1.00 0.00 C ATOM 501 NZ LYS A 37 4.106 -17.154 11.948 1.00 0.00 N ATOM 0 H LYS A 37 1.175 -11.562 8.578 1.00 0.00 H new ATOM 0 HA LYS A 37 2.108 -14.187 8.601 1.00 0.00 H new ATOM 0 HB2 LYS A 37 2.632 -12.650 10.380 1.00 0.00 H new ATOM 0 HB3 LYS A 37 0.939 -12.367 10.732 1.00 0.00 H new ATOM 0 HG2 LYS A 37 1.496 -13.819 12.442 1.00 0.00 H new ATOM 0 HG3 LYS A 37 0.881 -14.948 11.250 1.00 0.00 H new ATOM 0 HD2 LYS A 37 3.321 -15.170 10.426 1.00 0.00 H new ATOM 0 HD3 LYS A 37 3.782 -14.323 11.890 1.00 0.00 H new ATOM 0 HE2 LYS A 37 2.901 -16.054 13.300 1.00 0.00 H new ATOM 0 HE3 LYS A 37 2.019 -16.792 11.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 4.017 -18.033 12.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 4.130 -17.381 10.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 4.985 -16.666 12.215 1.00 0.00 H new ATOM 515 N ASP A 38 -1.106 -13.905 9.327 1.00 0.00 N ATOM 516 CA ASP A 38 -2.356 -14.652 9.415 1.00 0.00 C ATOM 517 C ASP A 38 -2.588 -15.475 8.152 1.00 0.00 C ATOM 518 O ASP A 38 -2.975 -16.641 8.221 1.00 0.00 O ATOM 519 CB ASP A 38 -3.530 -13.699 9.641 1.00 0.00 C ATOM 520 CG ASP A 38 -4.683 -14.363 10.367 1.00 0.00 C ATOM 521 OD1 ASP A 38 -4.466 -15.433 10.973 1.00 0.00 O ATOM 522 OD2 ASP A 38 -5.803 -13.812 10.330 1.00 0.00 O ATOM 0 H ASP A 38 -1.205 -12.900 9.467 1.00 0.00 H new ATOM 0 HA ASP A 38 -2.284 -15.334 10.262 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -3.190 -12.838 10.216 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -3.879 -13.322 8.679 1.00 0.00 H new ATOM 527 N ALA A 39 -2.350 -14.858 6.999 1.00 0.00 N ATOM 528 CA ALA A 39 -2.532 -15.533 5.720 1.00 0.00 C ATOM 529 C ALA A 39 -1.779 -16.858 5.686 1.00 0.00 C ATOM 530 O ALA A 39 -2.360 -17.907 5.411 1.00 0.00 O ATOM 531 CB ALA A 39 -2.076 -14.635 4.579 1.00 0.00 C ATOM 0 H ALA A 39 -2.031 -13.892 6.925 1.00 0.00 H new ATOM 0 HA ALA A 39 -3.594 -15.746 5.598 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -2.218 -15.152 3.630 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -2.662 -13.716 4.583 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -1.021 -14.393 4.706 1.00 0.00 H new ATOM 537 N GLY A 40 -0.480 -16.803 5.967 1.00 0.00 N ATOM 538 CA GLY A 40 0.332 -18.006 5.963 1.00 0.00 C ATOM 539 C GLY A 40 1.283 -18.059 4.784 1.00 0.00 C ATOM 540 O GLY A 40 2.247 -17.297 4.722 1.00 0.00 O ATOM 0 H GLY A 40 0.024 -15.947 6.197 1.00 0.00 H new ATOM 0 HA2 GLY A 40 0.904 -18.058 6.890 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -0.319 -18.880 5.941 1.00 0.00 H new ATOM 544 N GLU A 41 1.012 -18.963 3.847 1.00 0.00 N ATOM 545 CA GLU A 41 1.854 -19.113 2.666 1.00 0.00 C ATOM 546 C GLU A 41 1.048 -18.882 1.391 1.00 0.00 C ATOM 547 O GLU A 41 -0.013 -19.473 1.198 1.00 0.00 O ATOM 548 CB GLU A 41 2.487 -20.506 2.637 1.00 0.00 C ATOM 549 CG GLU A 41 3.516 -20.729 3.732 1.00 0.00 C ATOM 550 CD GLU A 41 2.899 -21.249 5.016 1.00 0.00 C ATOM 551 OE1 GLU A 41 2.167 -22.259 4.955 1.00 0.00 O ATOM 552 OE2 GLU A 41 3.148 -20.646 6.081 1.00 0.00 O ATOM 0 H GLU A 41 0.217 -19.601 3.883 1.00 0.00 H new ATOM 0 HA GLU A 41 2.644 -18.364 2.717 1.00 0.00 H new ATOM 0 HB2 GLU A 41 1.701 -21.255 2.731 1.00 0.00 H new ATOM 0 HB3 GLU A 41 2.961 -20.661 1.668 1.00 0.00 H new ATOM 0 HG2 GLU A 41 4.266 -21.437 3.381 1.00 0.00 H new ATOM 0 HG3 GLU A 41 4.033 -19.791 3.936 1.00 0.00 H new ATOM 559 N GLY A 42 1.562 -18.016 0.522 1.00 0.00 N ATOM 560 CA GLY A 42 0.878 -17.721 -0.724 1.00 0.00 C ATOM 561 C GLY A 42 1.707 -16.852 -1.649 1.00 0.00 C ATOM 562 O GLY A 42 2.915 -17.047 -1.777 1.00 0.00 O ATOM 0 H GLY A 42 2.439 -17.514 0.659 1.00 0.00 H new ATOM 0 HA2 GLY A 42 0.633 -18.655 -1.230 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -0.065 -17.219 -0.507 1.00 0.00 H new ATOM 566 N GLY A 43 1.056 -15.891 -2.297 1.00 0.00 N ATOM 567 CA GLY A 43 1.756 -15.005 -3.209 1.00 0.00 C ATOM 568 C GLY A 43 1.130 -13.627 -3.273 1.00 0.00 C ATOM 569 O GLY A 43 0.585 -13.232 -4.305 1.00 0.00 O ATOM 0 H GLY A 43 0.056 -15.710 -2.207 1.00 0.00 H new ATOM 0 HA2 GLY A 43 2.796 -14.914 -2.896 1.00 0.00 H new ATOM 0 HA3 GLY A 43 1.761 -15.445 -4.206 1.00 0.00 H new ATOM 573 N LEU A 44 1.204 -12.892 -2.169 1.00 0.00 N ATOM 574 CA LEU A 44 0.638 -11.550 -2.103 1.00 0.00 C ATOM 575 C LEU A 44 1.348 -10.611 -3.075 1.00 0.00 C ATOM 576 O LEU A 44 2.577 -10.558 -3.115 1.00 0.00 O ATOM 577 CB LEU A 44 0.741 -11.000 -0.679 1.00 0.00 C ATOM 578 CG LEU A 44 -0.135 -9.788 -0.363 1.00 0.00 C ATOM 579 CD1 LEU A 44 -1.555 -10.225 -0.038 1.00 0.00 C ATOM 580 CD2 LEU A 44 0.456 -8.989 0.790 1.00 0.00 C ATOM 0 H LEU A 44 1.651 -13.203 -1.307 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.413 -11.612 -2.387 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.486 -11.799 0.017 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.780 -10.732 -0.489 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.167 -9.148 -1.244 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -2.164 -9.348 0.184 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.978 -10.753 -0.893 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.543 -10.887 0.828 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.181 -8.130 1.001 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.519 -9.621 1.676 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.454 -8.643 0.519 1.00 0.00 H new ATOM 592 N SER A 45 0.565 -9.872 -3.854 1.00 0.00 N ATOM 593 CA SER A 45 1.118 -8.937 -4.826 1.00 0.00 C ATOM 594 C SER A 45 0.822 -7.496 -4.423 1.00 0.00 C ATOM 595 O SER A 45 -0.087 -7.233 -3.634 1.00 0.00 O ATOM 596 CB SER A 45 0.546 -9.217 -6.217 1.00 0.00 C ATOM 597 OG SER A 45 1.100 -8.339 -7.183 1.00 0.00 O ATOM 0 H SER A 45 -0.454 -9.903 -3.831 1.00 0.00 H new ATOM 0 HA SER A 45 2.199 -9.074 -4.851 1.00 0.00 H new ATOM 0 HB2 SER A 45 0.754 -10.249 -6.498 1.00 0.00 H new ATOM 0 HB3 SER A 45 -0.538 -9.104 -6.197 1.00 0.00 H new ATOM 0 HG SER A 45 0.720 -8.540 -8.064 1.00 0.00 H new ATOM 603 N LEU A 46 1.596 -6.564 -4.970 1.00 0.00 N ATOM 604 CA LEU A 46 1.418 -5.148 -4.668 1.00 0.00 C ATOM 605 C LEU A 46 1.444 -4.312 -5.944 1.00 0.00 C ATOM 606 O LEU A 46 2.326 -4.476 -6.787 1.00 0.00 O ATOM 607 CB LEU A 46 2.509 -4.670 -3.709 1.00 0.00 C ATOM 608 CG LEU A 46 2.452 -5.238 -2.290 1.00 0.00 C ATOM 609 CD1 LEU A 46 3.843 -5.284 -1.677 1.00 0.00 C ATOM 610 CD2 LEU A 46 1.511 -4.414 -1.423 1.00 0.00 C ATOM 0 H LEU A 46 2.352 -6.764 -5.625 1.00 0.00 H new ATOM 0 HA LEU A 46 0.445 -5.022 -4.193 1.00 0.00 H new ATOM 0 HB2 LEU A 46 3.479 -4.920 -4.140 1.00 0.00 H new ATOM 0 HB3 LEU A 46 2.459 -3.583 -3.646 1.00 0.00 H new ATOM 0 HG LEU A 46 2.067 -6.256 -2.342 1.00 0.00 H new ATOM 0 HD11 LEU A 46 3.782 -5.691 -0.668 1.00 0.00 H new ATOM 0 HD12 LEU A 46 4.488 -5.918 -2.286 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.257 -4.276 -1.638 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.483 -4.833 -0.417 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.866 -3.384 -1.378 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.509 -4.434 -1.852 1.00 0.00 H new ATOM 622 N ALA A 47 0.473 -3.415 -6.077 1.00 0.00 N ATOM 623 CA ALA A 47 0.387 -2.550 -7.248 1.00 0.00 C ATOM 624 C ALA A 47 -0.325 -1.244 -6.914 1.00 0.00 C ATOM 625 O ALA A 47 -1.044 -1.154 -5.919 1.00 0.00 O ATOM 626 CB ALA A 47 -0.327 -3.268 -8.383 1.00 0.00 C ATOM 0 H ALA A 47 -0.265 -3.268 -5.389 1.00 0.00 H new ATOM 0 HA ALA A 47 1.401 -2.309 -7.567 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -0.384 -2.611 -9.251 1.00 0.00 H new ATOM 0 HB2 ALA A 47 0.225 -4.170 -8.647 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.334 -3.538 -8.066 1.00 0.00 H new ATOM 632 N VAL A 48 -0.122 -0.233 -7.753 1.00 0.00 N ATOM 633 CA VAL A 48 -0.745 1.069 -7.547 1.00 0.00 C ATOM 634 C VAL A 48 -1.198 1.676 -8.870 1.00 0.00 C ATOM 635 O VAL A 48 -0.454 1.678 -9.850 1.00 0.00 O ATOM 636 CB VAL A 48 0.216 2.048 -6.848 1.00 0.00 C ATOM 637 CG1 VAL A 48 -0.338 3.463 -6.889 1.00 0.00 C ATOM 638 CG2 VAL A 48 0.473 1.609 -5.414 1.00 0.00 C ATOM 0 H VAL A 48 0.469 -0.291 -8.582 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.613 0.907 -6.908 1.00 0.00 H new ATOM 0 HB VAL A 48 1.166 2.041 -7.383 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.355 4.140 -6.390 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.466 3.774 -7.926 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.302 3.491 -6.381 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.154 2.312 -4.935 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.469 1.586 -4.866 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.918 0.614 -5.412 1.00 0.00 H new ATOM 648 N GLU A 49 -2.423 2.192 -8.890 1.00 0.00 N ATOM 649 CA GLU A 49 -2.975 2.802 -10.094 1.00 0.00 C ATOM 650 C GLU A 49 -3.576 4.170 -9.783 1.00 0.00 C ATOM 651 O GLU A 49 -4.640 4.269 -9.174 1.00 0.00 O ATOM 652 CB GLU A 49 -4.040 1.893 -10.711 1.00 0.00 C ATOM 653 CG GLU A 49 -3.464 0.756 -11.538 1.00 0.00 C ATOM 654 CD GLU A 49 -3.210 1.152 -12.979 1.00 0.00 C ATOM 655 OE1 GLU A 49 -2.749 2.290 -13.209 1.00 0.00 O ATOM 656 OE2 GLU A 49 -3.473 0.325 -13.877 1.00 0.00 O ATOM 0 H GLU A 49 -3.052 2.200 -8.087 1.00 0.00 H new ATOM 0 HA GLU A 49 -2.163 2.935 -10.809 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.656 1.476 -9.914 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.697 2.493 -11.341 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.530 0.421 -11.087 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.151 -0.090 -11.513 1.00 0.00 H new ATOM 663 N GLY A 50 -2.885 5.224 -10.208 1.00 0.00 N ATOM 664 CA GLY A 50 -3.365 6.572 -9.966 1.00 0.00 C ATOM 665 C GLY A 50 -2.867 7.560 -11.002 1.00 0.00 C ATOM 666 O GLY A 50 -2.613 7.208 -12.154 1.00 0.00 O ATOM 0 H GLY A 50 -2.002 5.168 -10.715 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.455 6.571 -9.964 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.044 6.896 -8.976 1.00 0.00 H new ATOM 670 N PRO A 51 -2.722 8.829 -10.594 1.00 0.00 N ATOM 671 CA PRO A 51 -2.251 9.897 -11.481 1.00 0.00 C ATOM 672 C PRO A 51 -0.778 9.742 -11.844 1.00 0.00 C ATOM 673 O PRO A 51 -0.251 10.487 -12.670 1.00 0.00 O ATOM 674 CB PRO A 51 -2.467 11.167 -10.654 1.00 0.00 C ATOM 675 CG PRO A 51 -2.426 10.707 -9.237 1.00 0.00 C ATOM 676 CD PRO A 51 -3.005 9.320 -9.235 1.00 0.00 C ATOM 0 HA PRO A 51 -2.780 9.898 -12.434 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -1.691 11.906 -10.853 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -3.422 11.636 -10.891 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.404 10.704 -8.857 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -3.003 11.372 -8.594 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -2.539 8.692 -8.476 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.075 9.332 -9.027 1.00 0.00 H new ATOM 684 N SER A 52 -0.119 8.769 -11.222 1.00 0.00 N ATOM 685 CA SER A 52 1.295 8.519 -11.477 1.00 0.00 C ATOM 686 C SER A 52 1.739 7.209 -10.834 1.00 0.00 C ATOM 687 O SER A 52 1.229 6.814 -9.785 1.00 0.00 O ATOM 688 CB SER A 52 2.143 9.675 -10.945 1.00 0.00 C ATOM 689 OG SER A 52 3.351 9.800 -11.675 1.00 0.00 O ATOM 0 H SER A 52 -0.542 8.141 -10.538 1.00 0.00 H new ATOM 0 HA SER A 52 1.436 8.441 -12.555 1.00 0.00 H new ATOM 0 HB2 SER A 52 1.578 10.605 -11.010 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.367 9.511 -9.891 1.00 0.00 H new ATOM 0 HG SER A 52 3.633 10.738 -11.682 1.00 0.00 H new ATOM 695 N LYS A 53 2.694 6.539 -11.470 1.00 0.00 N ATOM 696 CA LYS A 53 3.210 5.274 -10.962 1.00 0.00 C ATOM 697 C LYS A 53 4.176 5.506 -9.804 1.00 0.00 C ATOM 698 O LYS A 53 5.316 5.922 -10.009 1.00 0.00 O ATOM 699 CB LYS A 53 3.913 4.500 -12.080 1.00 0.00 C ATOM 700 CG LYS A 53 3.902 2.995 -11.878 1.00 0.00 C ATOM 701 CD LYS A 53 4.296 2.259 -13.148 1.00 0.00 C ATOM 702 CE LYS A 53 5.789 2.368 -13.415 1.00 0.00 C ATOM 703 NZ LYS A 53 6.203 1.552 -14.590 1.00 0.00 N ATOM 0 H LYS A 53 3.127 6.852 -12.339 1.00 0.00 H new ATOM 0 HA LYS A 53 2.367 4.687 -10.597 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.433 4.734 -13.030 1.00 0.00 H new ATOM 0 HB3 LYS A 53 4.946 4.841 -12.152 1.00 0.00 H new ATOM 0 HG2 LYS A 53 4.589 2.730 -11.075 1.00 0.00 H new ATOM 0 HG3 LYS A 53 2.908 2.676 -11.565 1.00 0.00 H new ATOM 0 HD2 LYS A 53 4.016 1.209 -13.063 1.00 0.00 H new ATOM 0 HD3 LYS A 53 3.743 2.669 -13.993 1.00 0.00 H new ATOM 0 HE2 LYS A 53 6.052 3.412 -13.587 1.00 0.00 H new ATOM 0 HE3 LYS A 53 6.340 2.041 -12.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 7.227 1.653 -14.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 5.975 0.552 -14.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 5.696 1.880 -15.437 1.00 0.00 H new ATOM 717 N ALA A 54 3.713 5.233 -8.589 1.00 0.00 N ATOM 718 CA ALA A 54 4.537 5.409 -7.400 1.00 0.00 C ATOM 719 C ALA A 54 5.267 4.118 -7.042 1.00 0.00 C ATOM 720 O ALA A 54 4.641 3.082 -6.822 1.00 0.00 O ATOM 721 CB ALA A 54 3.684 5.876 -6.230 1.00 0.00 C ATOM 0 H ALA A 54 2.771 4.889 -8.402 1.00 0.00 H new ATOM 0 HA ALA A 54 5.285 6.171 -7.617 1.00 0.00 H new ATOM 0 HB1 ALA A 54 4.313 6.003 -5.349 1.00 0.00 H new ATOM 0 HB2 ALA A 54 3.213 6.827 -6.480 1.00 0.00 H new ATOM 0 HB3 ALA A 54 2.914 5.133 -6.022 1.00 0.00 H new ATOM 727 N GLU A 55 6.593 4.190 -6.986 1.00 0.00 N ATOM 728 CA GLU A 55 7.407 3.025 -6.656 1.00 0.00 C ATOM 729 C GLU A 55 7.095 2.525 -5.248 1.00 0.00 C ATOM 730 O GLU A 55 7.070 3.302 -4.294 1.00 0.00 O ATOM 731 CB GLU A 55 8.894 3.366 -6.771 1.00 0.00 C ATOM 732 CG GLU A 55 9.433 4.148 -5.584 1.00 0.00 C ATOM 733 CD GLU A 55 10.646 4.985 -5.940 1.00 0.00 C ATOM 734 OE1 GLU A 55 10.471 6.039 -6.586 1.00 0.00 O ATOM 735 OE2 GLU A 55 11.770 4.586 -5.571 1.00 0.00 O ATOM 0 H GLU A 55 7.126 5.041 -7.164 1.00 0.00 H new ATOM 0 HA GLU A 55 7.168 2.233 -7.365 1.00 0.00 H new ATOM 0 HB2 GLU A 55 9.463 2.442 -6.875 1.00 0.00 H new ATOM 0 HB3 GLU A 55 9.056 3.945 -7.680 1.00 0.00 H new ATOM 0 HG2 GLU A 55 8.649 4.798 -5.195 1.00 0.00 H new ATOM 0 HG3 GLU A 55 9.696 3.454 -4.786 1.00 0.00 H new ATOM 742 N ILE A 56 6.859 1.223 -5.129 1.00 0.00 N ATOM 743 CA ILE A 56 6.549 0.619 -3.839 1.00 0.00 C ATOM 744 C ILE A 56 7.708 -0.238 -3.341 1.00 0.00 C ATOM 745 O ILE A 56 8.260 -1.049 -4.086 1.00 0.00 O ATOM 746 CB ILE A 56 5.279 -0.248 -3.913 1.00 0.00 C ATOM 747 CG1 ILE A 56 4.166 0.501 -4.649 1.00 0.00 C ATOM 748 CG2 ILE A 56 4.825 -0.644 -2.516 1.00 0.00 C ATOM 749 CD1 ILE A 56 3.164 -0.412 -5.320 1.00 0.00 C ATOM 0 H ILE A 56 6.876 0.566 -5.909 1.00 0.00 H new ATOM 0 HA ILE A 56 6.379 1.438 -3.140 1.00 0.00 H new ATOM 0 HB ILE A 56 5.509 -1.157 -4.469 1.00 0.00 H new ATOM 0 HG12 ILE A 56 3.642 1.144 -3.941 1.00 0.00 H new ATOM 0 HG13 ILE A 56 4.613 1.152 -5.401 1.00 0.00 H new ATOM 0 HG21 ILE A 56 3.926 -1.257 -2.586 1.00 0.00 H new ATOM 0 HG22 ILE A 56 5.614 -1.213 -2.024 1.00 0.00 H new ATOM 0 HG23 ILE A 56 4.609 0.253 -1.936 1.00 0.00 H new ATOM 0 HD11 ILE A 56 2.404 0.188 -5.822 1.00 0.00 H new ATOM 0 HD12 ILE A 56 3.675 -1.037 -6.052 1.00 0.00 H new ATOM 0 HD13 ILE A 56 2.690 -1.045 -4.570 1.00 0.00 H new ATOM 761 N THR A 57 8.072 -0.055 -2.076 1.00 0.00 N ATOM 762 CA THR A 57 9.165 -0.812 -1.477 1.00 0.00 C ATOM 763 C THR A 57 8.638 -1.866 -0.510 1.00 0.00 C ATOM 764 O THR A 57 7.686 -1.622 0.231 1.00 0.00 O ATOM 765 CB THR A 57 10.144 0.112 -0.729 1.00 0.00 C ATOM 766 OG1 THR A 57 10.530 1.204 -1.572 1.00 0.00 O ATOM 767 CG2 THR A 57 11.381 -0.655 -0.286 1.00 0.00 C ATOM 0 H THR A 57 7.626 0.611 -1.446 1.00 0.00 H new ATOM 0 HA THR A 57 9.694 -1.304 -2.293 1.00 0.00 H new ATOM 0 HB THR A 57 9.639 0.498 0.156 1.00 0.00 H new ATOM 0 HG1 THR A 57 11.151 1.787 -1.088 1.00 0.00 H new ATOM 0 HG21 THR A 57 12.058 0.018 0.240 1.00 0.00 H new ATOM 0 HG22 THR A 57 11.087 -1.467 0.379 1.00 0.00 H new ATOM 0 HG23 THR A 57 11.886 -1.067 -1.160 1.00 0.00 H new ATOM 775 N CYS A 58 9.264 -3.037 -0.522 1.00 0.00 N ATOM 776 CA CYS A 58 8.858 -4.130 0.355 1.00 0.00 C ATOM 777 C CYS A 58 9.966 -4.471 1.347 1.00 0.00 C ATOM 778 O CYS A 58 11.132 -4.597 0.973 1.00 0.00 O ATOM 779 CB CYS A 58 8.497 -5.366 -0.470 1.00 0.00 C ATOM 780 SG CYS A 58 9.845 -5.984 -1.504 1.00 0.00 S ATOM 0 H CYS A 58 10.054 -3.254 -1.129 1.00 0.00 H new ATOM 0 HA CYS A 58 7.980 -3.807 0.915 1.00 0.00 H new ATOM 0 HB2 CYS A 58 8.178 -6.160 0.205 1.00 0.00 H new ATOM 0 HB3 CYS A 58 7.645 -5.128 -1.107 1.00 0.00 H new ATOM 0 HG CYS A 58 10.985 -5.672 -0.963 1.00 0.00 H new ATOM 786 N LYS A 59 9.594 -4.618 2.614 1.00 0.00 N ATOM 787 CA LYS A 59 10.554 -4.944 3.661 1.00 0.00 C ATOM 788 C LYS A 59 10.201 -6.269 4.330 1.00 0.00 C ATOM 789 O LYS A 59 9.029 -6.636 4.421 1.00 0.00 O ATOM 790 CB LYS A 59 10.598 -3.828 4.707 1.00 0.00 C ATOM 791 CG LYS A 59 11.939 -3.704 5.408 1.00 0.00 C ATOM 792 CD LYS A 59 11.835 -2.857 6.665 1.00 0.00 C ATOM 793 CE LYS A 59 11.830 -1.371 6.338 1.00 0.00 C ATOM 794 NZ LYS A 59 13.163 -0.901 5.870 1.00 0.00 N ATOM 0 H LYS A 59 8.633 -4.516 2.941 1.00 0.00 H new ATOM 0 HA LYS A 59 11.537 -5.041 3.200 1.00 0.00 H new ATOM 0 HB2 LYS A 59 10.361 -2.880 4.225 1.00 0.00 H new ATOM 0 HB3 LYS A 59 9.823 -4.009 5.452 1.00 0.00 H new ATOM 0 HG2 LYS A 59 12.309 -4.696 5.666 1.00 0.00 H new ATOM 0 HG3 LYS A 59 12.666 -3.260 4.728 1.00 0.00 H new ATOM 0 HD2 LYS A 59 10.924 -3.115 7.204 1.00 0.00 H new ATOM 0 HD3 LYS A 59 12.671 -3.082 7.327 1.00 0.00 H new ATOM 0 HE2 LYS A 59 11.084 -1.171 5.569 1.00 0.00 H new ATOM 0 HE3 LYS A 59 11.536 -0.806 7.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 13.201 0.137 5.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 13.906 -1.302 6.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 13.315 -1.209 4.888 1.00 0.00 H new ATOM 808 N ASP A 60 11.220 -6.980 4.798 1.00 0.00 N ATOM 809 CA ASP A 60 11.017 -8.263 5.461 1.00 0.00 C ATOM 810 C ASP A 60 11.276 -8.146 6.960 1.00 0.00 C ATOM 811 O ASP A 60 12.422 -8.050 7.396 1.00 0.00 O ATOM 812 CB ASP A 60 11.933 -9.326 4.854 1.00 0.00 C ATOM 813 CG ASP A 60 11.562 -9.662 3.423 1.00 0.00 C ATOM 814 OD1 ASP A 60 10.719 -10.562 3.223 1.00 0.00 O ATOM 815 OD2 ASP A 60 12.113 -9.023 2.502 1.00 0.00 O ATOM 0 H ASP A 60 12.196 -6.690 4.731 1.00 0.00 H new ATOM 0 HA ASP A 60 9.979 -8.561 5.311 1.00 0.00 H new ATOM 0 HB2 ASP A 60 12.964 -8.974 4.886 1.00 0.00 H new ATOM 0 HB3 ASP A 60 11.886 -10.231 5.460 1.00 0.00 H new ATOM 820 N ASN A 61 10.202 -8.155 7.743 1.00 0.00 N ATOM 821 CA ASN A 61 10.313 -8.049 9.194 1.00 0.00 C ATOM 822 C ASN A 61 10.719 -9.386 9.808 1.00 0.00 C ATOM 823 O ASN A 61 11.376 -9.430 10.848 1.00 0.00 O ATOM 824 CB ASN A 61 8.987 -7.581 9.795 1.00 0.00 C ATOM 825 CG ASN A 61 8.476 -6.308 9.147 1.00 0.00 C ATOM 826 OD1 ASN A 61 9.058 -5.237 9.313 1.00 0.00 O ATOM 827 ND2 ASN A 61 7.381 -6.422 8.403 1.00 0.00 N ATOM 0 H ASN A 61 9.246 -8.235 7.398 1.00 0.00 H new ATOM 0 HA ASN A 61 11.086 -7.315 9.421 1.00 0.00 H new ATOM 0 HB2 ASN A 61 8.242 -8.368 9.681 1.00 0.00 H new ATOM 0 HB3 ASN A 61 9.114 -7.415 10.865 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.990 -5.601 7.942 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.931 -7.331 8.293 1.00 0.00 H new ATOM 834 N LYS A 62 10.323 -10.474 9.156 1.00 0.00 N ATOM 835 CA LYS A 62 10.646 -11.813 9.635 1.00 0.00 C ATOM 836 C LYS A 62 10.064 -12.048 11.025 1.00 0.00 C ATOM 837 O LYS A 62 10.644 -12.770 11.837 1.00 0.00 O ATOM 838 CB LYS A 62 12.162 -12.015 9.664 1.00 0.00 C ATOM 839 CG LYS A 62 12.587 -13.462 9.489 1.00 0.00 C ATOM 840 CD LYS A 62 12.330 -13.951 8.073 1.00 0.00 C ATOM 841 CE LYS A 62 12.682 -15.423 7.919 1.00 0.00 C ATOM 842 NZ LYS A 62 11.793 -16.295 8.736 1.00 0.00 N ATOM 0 H LYS A 62 9.778 -10.455 8.294 1.00 0.00 H new ATOM 0 HA LYS A 62 10.203 -12.534 8.948 1.00 0.00 H new ATOM 0 HB2 LYS A 62 12.615 -11.414 8.875 1.00 0.00 H new ATOM 0 HB3 LYS A 62 12.551 -11.643 10.612 1.00 0.00 H new ATOM 0 HG2 LYS A 62 13.647 -13.562 9.723 1.00 0.00 H new ATOM 0 HG3 LYS A 62 12.044 -14.090 10.196 1.00 0.00 H new ATOM 0 HD2 LYS A 62 11.281 -13.798 7.819 1.00 0.00 H new ATOM 0 HD3 LYS A 62 12.918 -13.360 7.371 1.00 0.00 H new ATOM 0 HE2 LYS A 62 12.604 -15.707 6.870 1.00 0.00 H new ATOM 0 HE3 LYS A 62 13.719 -15.581 8.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 11.900 -17.283 8.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 12.053 -16.212 9.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 10.804 -15.999 8.609 1.00 0.00 H new ATOM 856 N ASP A 63 8.916 -11.436 11.293 1.00 0.00 N ATOM 857 CA ASP A 63 8.255 -11.581 12.584 1.00 0.00 C ATOM 858 C ASP A 63 6.795 -11.987 12.405 1.00 0.00 C ATOM 859 O ASP A 63 6.302 -12.886 13.085 1.00 0.00 O ATOM 860 CB ASP A 63 8.340 -10.274 13.375 1.00 0.00 C ATOM 861 CG ASP A 63 8.226 -10.494 14.871 1.00 0.00 C ATOM 862 OD1 ASP A 63 7.331 -11.257 15.291 1.00 0.00 O ATOM 863 OD2 ASP A 63 9.030 -9.902 15.621 1.00 0.00 O ATOM 0 H ASP A 63 8.424 -10.834 10.633 1.00 0.00 H new ATOM 0 HA ASP A 63 8.767 -12.367 13.140 1.00 0.00 H new ATOM 0 HB2 ASP A 63 9.286 -9.780 13.154 1.00 0.00 H new ATOM 0 HB3 ASP A 63 7.546 -9.602 13.048 1.00 0.00 H new ATOM 868 N GLY A 64 6.108 -11.316 11.485 1.00 0.00 N ATOM 869 CA GLY A 64 4.712 -11.620 11.234 1.00 0.00 C ATOM 870 C GLY A 64 3.972 -10.462 10.594 1.00 0.00 C ATOM 871 O GLY A 64 2.785 -10.256 10.848 1.00 0.00 O ATOM 0 H GLY A 64 6.494 -10.567 10.909 1.00 0.00 H new ATOM 0 HA2 GLY A 64 4.645 -12.493 10.585 1.00 0.00 H new ATOM 0 HA3 GLY A 64 4.226 -11.883 12.174 1.00 0.00 H new ATOM 875 N THR A 65 4.675 -9.700 9.762 1.00 0.00 N ATOM 876 CA THR A 65 4.079 -8.554 9.086 1.00 0.00 C ATOM 877 C THR A 65 4.886 -8.163 7.853 1.00 0.00 C ATOM 878 O THR A 65 5.851 -8.837 7.491 1.00 0.00 O ATOM 879 CB THR A 65 3.977 -7.338 10.026 1.00 0.00 C ATOM 880 OG1 THR A 65 5.274 -6.997 10.528 1.00 0.00 O ATOM 881 CG2 THR A 65 3.038 -7.629 11.187 1.00 0.00 C ATOM 0 H THR A 65 5.658 -9.856 9.540 1.00 0.00 H new ATOM 0 HA THR A 65 3.076 -8.853 8.781 1.00 0.00 H new ATOM 0 HB THR A 65 3.576 -6.499 9.457 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.201 -6.222 11.123 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.982 -6.756 11.837 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.044 -7.859 10.802 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.414 -8.480 11.754 1.00 0.00 H new ATOM 889 N CYS A 66 4.485 -7.070 7.212 1.00 0.00 N ATOM 890 CA CYS A 66 5.171 -6.589 6.018 1.00 0.00 C ATOM 891 C CYS A 66 5.096 -5.068 5.924 1.00 0.00 C ATOM 892 O CYS A 66 4.010 -4.492 5.861 1.00 0.00 O ATOM 893 CB CYS A 66 4.562 -7.220 4.765 1.00 0.00 C ATOM 894 SG CYS A 66 5.276 -8.822 4.325 1.00 0.00 S ATOM 0 H CYS A 66 3.689 -6.501 7.499 1.00 0.00 H new ATOM 0 HA CYS A 66 6.219 -6.880 6.089 1.00 0.00 H new ATOM 0 HB2 CYS A 66 3.489 -7.341 4.917 1.00 0.00 H new ATOM 0 HB3 CYS A 66 4.690 -6.535 3.927 1.00 0.00 H new ATOM 0 HG CYS A 66 5.752 -9.393 5.392 1.00 0.00 H new ATOM 900 N THR A 67 6.259 -4.423 5.917 1.00 0.00 N ATOM 901 CA THR A 67 6.326 -2.970 5.834 1.00 0.00 C ATOM 902 C THR A 67 6.500 -2.509 4.392 1.00 0.00 C ATOM 903 O THR A 67 7.519 -2.786 3.760 1.00 0.00 O ATOM 904 CB THR A 67 7.484 -2.411 6.683 1.00 0.00 C ATOM 905 OG1 THR A 67 7.209 -2.605 8.075 1.00 0.00 O ATOM 906 CG2 THR A 67 7.694 -0.931 6.404 1.00 0.00 C ATOM 0 H THR A 67 7.167 -4.885 5.968 1.00 0.00 H new ATOM 0 HA THR A 67 5.382 -2.588 6.223 1.00 0.00 H new ATOM 0 HB THR A 67 8.394 -2.948 6.415 1.00 0.00 H new ATOM 0 HG1 THR A 67 7.950 -2.249 8.608 1.00 0.00 H new ATOM 0 HG21 THR A 67 8.516 -0.559 7.015 1.00 0.00 H new ATOM 0 HG22 THR A 67 7.932 -0.790 5.350 1.00 0.00 H new ATOM 0 HG23 THR A 67 6.784 -0.382 6.647 1.00 0.00 H new ATOM 914 N VAL A 68 5.498 -1.804 3.875 1.00 0.00 N ATOM 915 CA VAL A 68 5.541 -1.303 2.507 1.00 0.00 C ATOM 916 C VAL A 68 5.432 0.217 2.474 1.00 0.00 C ATOM 917 O VAL A 68 4.779 0.821 3.326 1.00 0.00 O ATOM 918 CB VAL A 68 4.411 -1.906 1.652 1.00 0.00 C ATOM 919 CG1 VAL A 68 4.557 -1.484 0.198 1.00 0.00 C ATOM 920 CG2 VAL A 68 4.400 -3.422 1.777 1.00 0.00 C ATOM 0 H VAL A 68 4.646 -1.567 4.384 1.00 0.00 H new ATOM 0 HA VAL A 68 6.502 -1.605 2.091 1.00 0.00 H new ATOM 0 HB VAL A 68 3.458 -1.527 2.021 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.750 -1.920 -0.390 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.511 -0.397 0.128 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.515 -1.832 -0.187 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.595 -3.832 1.166 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.355 -3.822 1.435 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.242 -3.700 2.819 1.00 0.00 H new ATOM 930 N SER A 69 6.074 0.831 1.486 1.00 0.00 N ATOM 931 CA SER A 69 6.052 2.282 1.344 1.00 0.00 C ATOM 932 C SER A 69 6.066 2.684 -0.128 1.00 0.00 C ATOM 933 O SER A 69 6.844 2.152 -0.921 1.00 0.00 O ATOM 934 CB SER A 69 7.249 2.904 2.065 1.00 0.00 C ATOM 935 OG SER A 69 7.428 2.327 3.347 1.00 0.00 O ATOM 0 H SER A 69 6.616 0.346 0.771 1.00 0.00 H new ATOM 0 HA SER A 69 5.132 2.653 1.795 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.151 2.761 1.469 1.00 0.00 H new ATOM 0 HB3 SER A 69 7.099 3.979 2.164 1.00 0.00 H new ATOM 0 HG SER A 69 8.345 2.488 3.653 1.00 0.00 H new ATOM 941 N TYR A 70 5.200 3.625 -0.486 1.00 0.00 N ATOM 942 CA TYR A 70 5.109 4.098 -1.862 1.00 0.00 C ATOM 943 C TYR A 70 5.338 5.604 -1.937 1.00 0.00 C ATOM 944 O TYR A 70 4.762 6.371 -1.163 1.00 0.00 O ATOM 945 CB TYR A 70 3.744 3.748 -2.455 1.00 0.00 C ATOM 946 CG TYR A 70 2.621 4.626 -1.950 1.00 0.00 C ATOM 947 CD1 TYR A 70 2.408 5.891 -2.484 1.00 0.00 C ATOM 948 CD2 TYR A 70 1.774 4.191 -0.938 1.00 0.00 C ATOM 949 CE1 TYR A 70 1.384 6.697 -2.025 1.00 0.00 C ATOM 950 CE2 TYR A 70 0.747 4.990 -0.474 1.00 0.00 C ATOM 951 CZ TYR A 70 0.556 6.242 -1.021 1.00 0.00 C ATOM 952 OH TYR A 70 -0.465 7.041 -0.560 1.00 0.00 O ATOM 0 H TYR A 70 4.550 4.076 0.158 1.00 0.00 H new ATOM 0 HA TYR A 70 5.887 3.601 -2.442 1.00 0.00 H new ATOM 0 HB2 TYR A 70 3.797 3.829 -3.541 1.00 0.00 H new ATOM 0 HB3 TYR A 70 3.513 2.708 -2.224 1.00 0.00 H new ATOM 0 HD1 TYR A 70 3.054 6.250 -3.271 1.00 0.00 H new ATOM 0 HD2 TYR A 70 1.921 3.212 -0.507 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.233 7.678 -2.450 1.00 0.00 H new ATOM 0 HE2 TYR A 70 0.097 4.636 0.313 1.00 0.00 H new ATOM 0 HH TYR A 70 -0.841 6.652 0.257 1.00 0.00 H new ATOM 962 N LEU A 71 6.182 6.022 -2.874 1.00 0.00 N ATOM 963 CA LEU A 71 6.487 7.437 -3.052 1.00 0.00 C ATOM 964 C LEU A 71 5.817 7.985 -4.308 1.00 0.00 C ATOM 965 O LEU A 71 6.305 7.818 -5.425 1.00 0.00 O ATOM 966 CB LEU A 71 8.000 7.646 -3.136 1.00 0.00 C ATOM 967 CG LEU A 71 8.466 9.073 -3.426 1.00 0.00 C ATOM 968 CD1 LEU A 71 8.497 9.895 -2.147 1.00 0.00 C ATOM 969 CD2 LEU A 71 9.836 9.063 -4.090 1.00 0.00 C ATOM 0 H LEU A 71 6.667 5.401 -3.522 1.00 0.00 H new ATOM 0 HA LEU A 71 6.098 7.978 -2.189 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.444 7.325 -2.194 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.394 6.991 -3.913 1.00 0.00 H new ATOM 0 HG LEU A 71 7.756 9.534 -4.112 1.00 0.00 H new ATOM 0 HD11 LEU A 71 8.831 10.908 -2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 71 7.498 9.931 -1.713 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.185 9.436 -1.436 1.00 0.00 H new ATOM 0 HD21 LEU A 71 10.151 10.087 -4.289 1.00 0.00 H new ATOM 0 HD22 LEU A 71 10.557 8.583 -3.429 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.781 8.511 -5.029 1.00 0.00 H new ATOM 981 N PRO A 72 4.671 8.658 -4.121 1.00 0.00 N ATOM 982 CA PRO A 72 3.910 9.247 -5.227 1.00 0.00 C ATOM 983 C PRO A 72 4.625 10.441 -5.851 1.00 0.00 C ATOM 984 O PRO A 72 5.540 11.011 -5.256 1.00 0.00 O ATOM 985 CB PRO A 72 2.606 9.692 -4.562 1.00 0.00 C ATOM 986 CG PRO A 72 2.963 9.906 -3.132 1.00 0.00 C ATOM 987 CD PRO A 72 4.031 8.896 -2.817 1.00 0.00 C ATOM 0 HA PRO A 72 3.768 8.542 -6.046 1.00 0.00 H new ATOM 0 HB2 PRO A 72 2.223 10.606 -5.015 1.00 0.00 H new ATOM 0 HB3 PRO A 72 1.830 8.934 -4.667 1.00 0.00 H new ATOM 0 HG2 PRO A 72 3.325 10.921 -2.968 1.00 0.00 H new ATOM 0 HG3 PRO A 72 2.094 9.769 -2.488 1.00 0.00 H new ATOM 0 HD2 PRO A 72 4.742 9.278 -2.084 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.609 7.980 -2.404 1.00 0.00 H new ATOM 995 N THR A 73 4.201 10.816 -7.054 1.00 0.00 N ATOM 996 CA THR A 73 4.800 11.942 -7.759 1.00 0.00 C ATOM 997 C THR A 73 3.754 12.996 -8.102 1.00 0.00 C ATOM 998 O THR A 73 4.076 14.172 -8.271 1.00 0.00 O ATOM 999 CB THR A 73 5.497 11.486 -9.055 1.00 0.00 C ATOM 1000 OG1 THR A 73 6.240 10.286 -8.816 1.00 0.00 O ATOM 1001 CG2 THR A 73 6.429 12.569 -9.578 1.00 0.00 C ATOM 0 H THR A 73 3.445 10.356 -7.560 1.00 0.00 H new ATOM 0 HA THR A 73 5.542 12.376 -7.089 1.00 0.00 H new ATOM 0 HB THR A 73 4.730 11.295 -9.805 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.678 10.002 -9.645 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.910 12.224 -10.493 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.856 13.472 -9.787 1.00 0.00 H new ATOM 0 HG23 THR A 73 7.190 12.787 -8.829 1.00 0.00 H new ATOM 1009 N ALA A 74 2.500 12.568 -8.203 1.00 0.00 N ATOM 1010 CA ALA A 74 1.406 13.476 -8.524 1.00 0.00 C ATOM 1011 C ALA A 74 0.247 13.304 -7.548 1.00 0.00 C ATOM 1012 O ALA A 74 -0.075 12.197 -7.117 1.00 0.00 O ATOM 1013 CB ALA A 74 0.933 13.250 -9.952 1.00 0.00 C ATOM 0 H ALA A 74 2.216 11.598 -8.067 1.00 0.00 H new ATOM 0 HA ALA A 74 1.776 14.497 -8.433 1.00 0.00 H new ATOM 0 HB1 ALA A 74 0.116 13.935 -10.177 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.758 13.430 -10.641 1.00 0.00 H new ATOM 0 HB3 ALA A 74 0.586 12.223 -10.062 1.00 0.00 H new ATOM 1019 N PRO A 75 -0.396 14.426 -7.188 1.00 0.00 N ATOM 1020 CA PRO A 75 -1.529 14.425 -6.259 1.00 0.00 C ATOM 1021 C PRO A 75 -2.775 13.788 -6.864 1.00 0.00 C ATOM 1022 O PRO A 75 -3.013 13.887 -8.067 1.00 0.00 O ATOM 1023 CB PRO A 75 -1.767 15.913 -5.988 1.00 0.00 C ATOM 1024 CG PRO A 75 -1.230 16.607 -7.192 1.00 0.00 C ATOM 1025 CD PRO A 75 -0.066 15.780 -7.662 1.00 0.00 C ATOM 0 HA PRO A 75 -1.319 13.842 -5.362 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.827 16.126 -5.848 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.255 16.238 -5.082 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.991 16.686 -7.968 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -0.915 17.622 -6.949 1.00 0.00 H new ATOM 0 HD2 PRO A 75 0.038 15.812 -8.747 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.875 16.135 -7.241 1.00 0.00 H new ATOM 1033 N GLY A 76 -3.569 13.133 -6.022 1.00 0.00 N ATOM 1034 CA GLY A 76 -4.782 12.490 -6.493 1.00 0.00 C ATOM 1035 C GLY A 76 -5.145 11.267 -5.675 1.00 0.00 C ATOM 1036 O GLY A 76 -4.555 11.017 -4.624 1.00 0.00 O ATOM 0 H GLY A 76 -3.394 13.036 -5.022 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.605 13.204 -6.458 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -4.655 12.201 -7.536 1.00 0.00 H new ATOM 1040 N ASP A 77 -6.119 10.503 -6.157 1.00 0.00 N ATOM 1041 CA ASP A 77 -6.560 9.299 -5.463 1.00 0.00 C ATOM 1042 C ASP A 77 -5.811 8.072 -5.973 1.00 0.00 C ATOM 1043 O ASP A 77 -6.058 7.597 -7.082 1.00 0.00 O ATOM 1044 CB ASP A 77 -8.066 9.103 -5.644 1.00 0.00 C ATOM 1045 CG ASP A 77 -8.522 9.396 -7.060 1.00 0.00 C ATOM 1046 OD1 ASP A 77 -8.779 10.579 -7.368 1.00 0.00 O ATOM 1047 OD2 ASP A 77 -8.622 8.443 -7.860 1.00 0.00 O ATOM 0 H ASP A 77 -6.618 10.696 -7.025 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.342 9.421 -4.402 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -8.330 8.077 -5.385 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.600 9.754 -4.951 1.00 0.00 H new ATOM 1052 N TYR A 78 -4.894 7.564 -5.157 1.00 0.00 N ATOM 1053 CA TYR A 78 -4.105 6.394 -5.527 1.00 0.00 C ATOM 1054 C TYR A 78 -4.848 5.106 -5.184 1.00 0.00 C ATOM 1055 O TYR A 78 -5.457 4.991 -4.121 1.00 0.00 O ATOM 1056 CB TYR A 78 -2.752 6.420 -4.815 1.00 0.00 C ATOM 1057 CG TYR A 78 -1.749 7.354 -5.454 1.00 0.00 C ATOM 1058 CD1 TYR A 78 -1.793 8.722 -5.215 1.00 0.00 C ATOM 1059 CD2 TYR A 78 -0.758 6.868 -6.298 1.00 0.00 C ATOM 1060 CE1 TYR A 78 -0.879 9.579 -5.797 1.00 0.00 C ATOM 1061 CE2 TYR A 78 0.161 7.718 -6.884 1.00 0.00 C ATOM 1062 CZ TYR A 78 0.096 9.072 -6.631 1.00 0.00 C ATOM 1063 OH TYR A 78 1.008 9.922 -7.212 1.00 0.00 O ATOM 0 H TYR A 78 -4.678 7.944 -4.235 1.00 0.00 H new ATOM 0 HA TYR A 78 -3.942 6.423 -6.604 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -2.903 6.717 -3.777 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.339 5.411 -4.801 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -2.555 9.122 -4.563 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -0.705 5.808 -6.500 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -0.927 10.640 -5.600 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.926 7.324 -7.537 1.00 0.00 H new ATOM 0 HH TYR A 78 0.863 10.833 -6.881 1.00 0.00 H new ATOM 1073 N SER A 79 -4.792 4.139 -6.094 1.00 0.00 N ATOM 1074 CA SER A 79 -5.461 2.859 -5.892 1.00 0.00 C ATOM 1075 C SER A 79 -4.448 1.757 -5.596 1.00 0.00 C ATOM 1076 O SER A 79 -3.830 1.206 -6.507 1.00 0.00 O ATOM 1077 CB SER A 79 -6.286 2.491 -7.126 1.00 0.00 C ATOM 1078 OG SER A 79 -7.205 3.519 -7.451 1.00 0.00 O ATOM 0 H SER A 79 -4.290 4.217 -6.979 1.00 0.00 H new ATOM 0 HA SER A 79 -6.127 2.956 -5.034 1.00 0.00 H new ATOM 0 HB2 SER A 79 -5.621 2.313 -7.971 1.00 0.00 H new ATOM 0 HB3 SER A 79 -6.825 1.562 -6.943 1.00 0.00 H new ATOM 0 HG SER A 79 -7.719 3.260 -8.244 1.00 0.00 H new ATOM 1084 N ILE A 80 -4.284 1.442 -4.315 1.00 0.00 N ATOM 1085 CA ILE A 80 -3.347 0.406 -3.898 1.00 0.00 C ATOM 1086 C ILE A 80 -3.959 -0.982 -4.052 1.00 0.00 C ATOM 1087 O ILE A 80 -4.718 -1.436 -3.195 1.00 0.00 O ATOM 1088 CB ILE A 80 -2.907 0.601 -2.435 1.00 0.00 C ATOM 1089 CG1 ILE A 80 -2.273 1.982 -2.250 1.00 0.00 C ATOM 1090 CG2 ILE A 80 -1.933 -0.494 -2.025 1.00 0.00 C ATOM 1091 CD1 ILE A 80 -2.465 2.553 -0.863 1.00 0.00 C ATOM 0 H ILE A 80 -4.787 1.889 -3.549 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.474 0.490 -4.546 1.00 0.00 H new ATOM 0 HB ILE A 80 -3.787 0.537 -1.794 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -1.206 1.914 -2.462 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -2.700 2.670 -2.980 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -1.631 -0.343 -0.989 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.416 -1.466 -2.124 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -1.054 -0.458 -2.668 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.990 3.532 -0.804 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -3.530 2.653 -0.655 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -2.013 1.886 -0.129 1.00 0.00 H new ATOM 1103 N ILE A 81 -3.623 -1.652 -5.149 1.00 0.00 N ATOM 1104 CA ILE A 81 -4.137 -2.990 -5.414 1.00 0.00 C ATOM 1105 C ILE A 81 -3.320 -4.048 -4.680 1.00 0.00 C ATOM 1106 O ILE A 81 -2.103 -4.133 -4.844 1.00 0.00 O ATOM 1107 CB ILE A 81 -4.130 -3.308 -6.921 1.00 0.00 C ATOM 1108 CG1 ILE A 81 -4.975 -2.285 -7.684 1.00 0.00 C ATOM 1109 CG2 ILE A 81 -4.645 -4.718 -7.168 1.00 0.00 C ATOM 1110 CD1 ILE A 81 -4.557 -2.111 -9.127 1.00 0.00 C ATOM 0 H ILE A 81 -2.997 -1.290 -5.869 1.00 0.00 H new ATOM 0 HA ILE A 81 -5.165 -3.010 -5.051 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.104 -3.248 -7.285 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -6.020 -2.593 -7.652 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.910 -1.322 -7.177 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -4.634 -4.927 -8.238 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -4.006 -5.434 -6.651 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.665 -4.804 -6.792 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -5.199 -1.371 -9.605 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.522 -1.773 -9.168 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -4.648 -3.063 -9.650 1.00 0.00 H new ATOM 1122 N VAL A 82 -3.999 -4.854 -3.869 1.00 0.00 N ATOM 1123 CA VAL A 82 -3.337 -5.909 -3.111 1.00 0.00 C ATOM 1124 C VAL A 82 -4.078 -7.234 -3.252 1.00 0.00 C ATOM 1125 O VAL A 82 -5.103 -7.456 -2.606 1.00 0.00 O ATOM 1126 CB VAL A 82 -3.234 -5.547 -1.618 1.00 0.00 C ATOM 1127 CG1 VAL A 82 -2.567 -6.672 -0.840 1.00 0.00 C ATOM 1128 CG2 VAL A 82 -2.475 -4.241 -1.438 1.00 0.00 C ATOM 0 H VAL A 82 -5.006 -4.796 -3.720 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.333 -6.012 -3.522 1.00 0.00 H new ATOM 0 HB VAL A 82 -4.242 -5.413 -1.224 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -2.503 -6.398 0.213 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -3.155 -7.584 -0.943 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.564 -6.841 -1.232 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -2.412 -4.000 -0.377 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.470 -4.345 -1.847 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -2.999 -3.441 -1.961 1.00 0.00 H new ATOM 1138 N ARG A 83 -3.554 -8.113 -4.100 1.00 0.00 N ATOM 1139 CA ARG A 83 -4.166 -9.416 -4.326 1.00 0.00 C ATOM 1140 C ARG A 83 -3.378 -10.517 -3.621 1.00 0.00 C ATOM 1141 O ARG A 83 -2.181 -10.375 -3.371 1.00 0.00 O ATOM 1142 CB ARG A 83 -4.247 -9.713 -5.824 1.00 0.00 C ATOM 1143 CG ARG A 83 -4.971 -8.638 -6.619 1.00 0.00 C ATOM 1144 CD ARG A 83 -5.129 -9.036 -8.078 1.00 0.00 C ATOM 1145 NE ARG A 83 -5.256 -7.872 -8.952 1.00 0.00 N ATOM 1146 CZ ARG A 83 -5.293 -7.950 -10.278 1.00 0.00 C ATOM 1147 NH1 ARG A 83 -5.214 -9.129 -10.879 1.00 0.00 N ATOM 1148 NH2 ARG A 83 -5.410 -6.846 -11.005 1.00 0.00 N ATOM 0 H ARG A 83 -2.706 -7.946 -4.642 1.00 0.00 H new ATOM 0 HA ARG A 83 -5.174 -9.392 -3.912 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.237 -9.827 -6.218 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -4.756 -10.666 -5.970 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -5.953 -8.459 -6.181 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -4.418 -7.701 -6.554 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.269 -9.629 -8.387 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -6.009 -9.670 -8.188 1.00 0.00 H new ATOM 0 HE ARG A 83 -5.320 -6.950 -8.521 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.125 -9.980 -10.323 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -5.243 -9.185 -11.897 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -5.472 -5.937 -10.546 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -5.438 -6.906 -12.023 1.00 0.00 H new ATOM 1162 N PHE A 84 -4.058 -11.613 -3.302 1.00 0.00 N ATOM 1163 CA PHE A 84 -3.422 -12.737 -2.625 1.00 0.00 C ATOM 1164 C PHE A 84 -3.825 -14.060 -3.270 1.00 0.00 C ATOM 1165 O PHE A 84 -4.934 -14.552 -3.061 1.00 0.00 O ATOM 1166 CB PHE A 84 -3.798 -12.745 -1.142 1.00 0.00 C ATOM 1167 CG PHE A 84 -2.937 -13.652 -0.310 1.00 0.00 C ATOM 1168 CD1 PHE A 84 -1.563 -13.479 -0.270 1.00 0.00 C ATOM 1169 CD2 PHE A 84 -3.501 -14.677 0.432 1.00 0.00 C ATOM 1170 CE1 PHE A 84 -0.767 -14.312 0.495 1.00 0.00 C ATOM 1171 CE2 PHE A 84 -2.711 -15.512 1.199 1.00 0.00 C ATOM 1172 CZ PHE A 84 -1.342 -15.330 1.229 1.00 0.00 C ATOM 0 H PHE A 84 -5.049 -11.747 -3.501 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.342 -12.621 -2.719 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.726 -11.730 -0.752 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.839 -13.052 -1.041 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -1.108 -12.684 -0.843 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -4.571 -14.825 0.411 1.00 0.00 H new ATOM 0 HE1 PHE A 84 0.303 -14.166 0.518 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -3.163 -16.306 1.774 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.723 -15.983 1.826 1.00 0.00 H new ATOM 1182 N ASP A 85 -2.918 -14.629 -4.056 1.00 0.00 N ATOM 1183 CA ASP A 85 -3.178 -15.894 -4.732 1.00 0.00 C ATOM 1184 C ASP A 85 -4.322 -15.752 -5.731 1.00 0.00 C ATOM 1185 O ASP A 85 -5.164 -16.641 -5.856 1.00 0.00 O ATOM 1186 CB ASP A 85 -3.508 -16.984 -3.712 1.00 0.00 C ATOM 1187 CG ASP A 85 -3.508 -18.371 -4.324 1.00 0.00 C ATOM 1188 OD1 ASP A 85 -4.572 -18.803 -4.813 1.00 0.00 O ATOM 1189 OD2 ASP A 85 -2.443 -19.024 -4.315 1.00 0.00 O ATOM 0 H ASP A 85 -1.996 -14.234 -4.241 1.00 0.00 H new ATOM 0 HA ASP A 85 -2.277 -16.178 -5.276 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -2.782 -16.949 -2.900 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -4.486 -16.783 -3.274 1.00 0.00 H new ATOM 1194 N ASP A 86 -4.346 -14.628 -6.439 1.00 0.00 N ATOM 1195 CA ASP A 86 -5.386 -14.369 -7.427 1.00 0.00 C ATOM 1196 C ASP A 86 -6.716 -14.056 -6.747 1.00 0.00 C ATOM 1197 O ASP A 86 -7.780 -14.433 -7.238 1.00 0.00 O ATOM 1198 CB ASP A 86 -5.546 -15.571 -8.359 1.00 0.00 C ATOM 1199 CG ASP A 86 -4.218 -16.217 -8.704 1.00 0.00 C ATOM 1200 OD1 ASP A 86 -3.718 -17.017 -7.887 1.00 0.00 O ATOM 1201 OD2 ASP A 86 -3.679 -15.920 -9.791 1.00 0.00 O ATOM 0 H ASP A 86 -3.657 -13.882 -6.347 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.086 -13.502 -8.015 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -6.194 -16.309 -7.887 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -6.041 -15.252 -9.276 1.00 0.00 H new ATOM 1206 N LYS A 87 -6.647 -13.367 -5.614 1.00 0.00 N ATOM 1207 CA LYS A 87 -7.844 -13.003 -4.865 1.00 0.00 C ATOM 1208 C LYS A 87 -7.672 -11.646 -4.189 1.00 0.00 C ATOM 1209 O LYS A 87 -6.791 -11.468 -3.348 1.00 0.00 O ATOM 1210 CB LYS A 87 -8.158 -14.071 -3.815 1.00 0.00 C ATOM 1211 CG LYS A 87 -8.420 -15.446 -4.406 1.00 0.00 C ATOM 1212 CD LYS A 87 -9.302 -16.284 -3.496 1.00 0.00 C ATOM 1213 CE LYS A 87 -9.680 -17.605 -4.148 1.00 0.00 C ATOM 1214 NZ LYS A 87 -10.472 -18.471 -3.231 1.00 0.00 N ATOM 0 H LYS A 87 -5.774 -13.049 -5.193 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.675 -12.937 -5.567 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -7.324 -14.138 -3.116 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.031 -13.759 -3.241 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -8.897 -15.340 -5.380 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.473 -15.959 -4.570 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -8.781 -16.476 -2.558 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -10.206 -15.727 -3.250 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -10.257 -17.411 -5.053 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -8.775 -18.131 -4.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -10.709 -19.361 -3.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -9.913 -18.677 -2.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.348 -17.980 -2.960 1.00 0.00 H new ATOM 1228 N HIS A 88 -8.519 -10.693 -4.562 1.00 0.00 N ATOM 1229 CA HIS A 88 -8.462 -9.352 -3.990 1.00 0.00 C ATOM 1230 C HIS A 88 -8.755 -9.387 -2.494 1.00 0.00 C ATOM 1231 O HIS A 88 -9.694 -10.049 -2.051 1.00 0.00 O ATOM 1232 CB HIS A 88 -9.457 -8.431 -4.695 1.00 0.00 C ATOM 1233 CG HIS A 88 -8.849 -7.627 -5.803 1.00 0.00 C ATOM 1234 ND1 HIS A 88 -8.661 -6.263 -5.728 1.00 0.00 N ATOM 1235 CD2 HIS A 88 -8.383 -8.003 -7.017 1.00 0.00 C ATOM 1236 CE1 HIS A 88 -8.108 -5.835 -6.849 1.00 0.00 C ATOM 1237 NE2 HIS A 88 -7.928 -6.871 -7.648 1.00 0.00 N ATOM 0 H HIS A 88 -9.253 -10.824 -5.258 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.454 -8.964 -4.136 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -10.272 -9.032 -5.098 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -9.893 -7.752 -3.962 1.00 0.00 H new ATOM 0 HD1 HIS A 88 -8.910 -5.676 -4.932 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -8.371 -9.007 -7.415 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -7.847 -4.811 -7.074 1.00 0.00 H new ATOM 1246 N ILE A 89 -7.945 -8.672 -1.720 1.00 0.00 N ATOM 1247 CA ILE A 89 -8.118 -8.621 -0.274 1.00 0.00 C ATOM 1248 C ILE A 89 -9.296 -7.731 0.108 1.00 0.00 C ATOM 1249 O ILE A 89 -9.660 -6.799 -0.609 1.00 0.00 O ATOM 1250 CB ILE A 89 -6.849 -8.102 0.427 1.00 0.00 C ATOM 1251 CG1 ILE A 89 -6.621 -6.627 0.092 1.00 0.00 C ATOM 1252 CG2 ILE A 89 -5.642 -8.936 0.023 1.00 0.00 C ATOM 1253 CD1 ILE A 89 -5.769 -5.900 1.109 1.00 0.00 C ATOM 0 H ILE A 89 -7.162 -8.120 -2.071 1.00 0.00 H new ATOM 0 HA ILE A 89 -8.314 -9.641 0.056 1.00 0.00 H new ATOM 0 HB ILE A 89 -6.984 -8.193 1.505 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -6.146 -6.554 -0.886 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -7.586 -6.127 0.015 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -4.753 -8.557 0.527 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -5.806 -9.975 0.309 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -5.502 -8.874 -1.056 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -5.650 -4.860 0.807 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -6.253 -5.941 2.085 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.790 -6.375 1.169 1.00 0.00 H new ATOM 1265 N PRO A 90 -9.907 -8.023 1.266 1.00 0.00 N ATOM 1266 CA PRO A 90 -11.052 -7.259 1.771 1.00 0.00 C ATOM 1267 C PRO A 90 -10.660 -5.855 2.219 1.00 0.00 C ATOM 1268 O PRO A 90 -10.461 -5.605 3.406 1.00 0.00 O ATOM 1269 CB PRO A 90 -11.531 -8.087 2.966 1.00 0.00 C ATOM 1270 CG PRO A 90 -10.325 -8.838 3.414 1.00 0.00 C ATOM 1271 CD PRO A 90 -9.527 -9.120 2.171 1.00 0.00 C ATOM 0 HA PRO A 90 -11.813 -7.111 1.005 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.918 -7.449 3.760 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.336 -8.764 2.681 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -9.744 -8.253 4.127 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -10.606 -9.764 3.916 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -8.456 -9.122 2.373 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -9.773 -10.094 1.748 1.00 0.00 H new ATOM 1279 N GLY A 91 -10.552 -4.941 1.259 1.00 0.00 N ATOM 1280 CA GLY A 91 -10.185 -3.573 1.574 1.00 0.00 C ATOM 1281 C GLY A 91 -9.449 -2.893 0.437 1.00 0.00 C ATOM 1282 O GLY A 91 -9.254 -1.678 0.454 1.00 0.00 O ATOM 0 H GLY A 91 -10.712 -5.124 0.268 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -11.084 -3.005 1.812 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -9.558 -3.565 2.465 1.00 0.00 H new ATOM 1286 N SER A 92 -9.037 -3.679 -0.553 1.00 0.00 N ATOM 1287 CA SER A 92 -8.312 -3.146 -1.700 1.00 0.00 C ATOM 1288 C SER A 92 -9.173 -3.201 -2.959 1.00 0.00 C ATOM 1289 O SER A 92 -10.087 -4.016 -3.082 1.00 0.00 O ATOM 1290 CB SER A 92 -7.017 -3.929 -1.921 1.00 0.00 C ATOM 1291 OG SER A 92 -6.700 -4.013 -3.300 1.00 0.00 O ATOM 0 H SER A 92 -9.193 -4.687 -0.584 1.00 0.00 H new ATOM 0 HA SER A 92 -8.067 -2.104 -1.492 1.00 0.00 H new ATOM 0 HB2 SER A 92 -6.200 -3.445 -1.386 1.00 0.00 H new ATOM 0 HB3 SER A 92 -7.120 -4.932 -1.507 1.00 0.00 H new ATOM 0 HG SER A 92 -6.912 -4.911 -3.630 1.00 0.00 H new ATOM 1297 N PRO A 93 -8.875 -2.311 -3.918 1.00 0.00 N ATOM 1298 CA PRO A 93 -7.790 -1.335 -3.782 1.00 0.00 C ATOM 1299 C PRO A 93 -8.102 -0.261 -2.746 1.00 0.00 C ATOM 1300 O PRO A 93 -9.231 0.222 -2.658 1.00 0.00 O ATOM 1301 CB PRO A 93 -7.692 -0.717 -5.179 1.00 0.00 C ATOM 1302 CG PRO A 93 -9.048 -0.898 -5.769 1.00 0.00 C ATOM 1303 CD PRO A 93 -9.576 -2.189 -5.207 1.00 0.00 C ATOM 0 HA PRO A 93 -6.865 -1.799 -3.440 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -7.420 0.337 -5.127 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -6.930 -1.214 -5.779 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -9.700 -0.064 -5.510 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -8.998 -0.938 -6.857 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.658 -2.157 -5.075 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -9.360 -3.032 -5.864 1.00 0.00 H new ATOM 1311 N PHE A 94 -7.095 0.109 -1.962 1.00 0.00 N ATOM 1312 CA PHE A 94 -7.262 1.127 -0.931 1.00 0.00 C ATOM 1313 C PHE A 94 -7.065 2.525 -1.509 1.00 0.00 C ATOM 1314 O PHE A 94 -5.942 2.934 -1.806 1.00 0.00 O ATOM 1315 CB PHE A 94 -6.274 0.891 0.213 1.00 0.00 C ATOM 1316 CG PHE A 94 -6.566 -0.347 1.012 1.00 0.00 C ATOM 1317 CD1 PHE A 94 -7.606 -0.367 1.927 1.00 0.00 C ATOM 1318 CD2 PHE A 94 -5.801 -1.490 0.848 1.00 0.00 C ATOM 1319 CE1 PHE A 94 -7.877 -1.505 2.664 1.00 0.00 C ATOM 1320 CE2 PHE A 94 -6.067 -2.631 1.582 1.00 0.00 C ATOM 1321 CZ PHE A 94 -7.107 -2.638 2.490 1.00 0.00 C ATOM 0 H PHE A 94 -6.154 -0.281 -2.021 1.00 0.00 H new ATOM 0 HA PHE A 94 -8.279 1.054 -0.545 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -5.266 0.820 -0.197 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -6.288 1.755 0.878 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -8.212 0.516 2.066 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -4.987 -1.490 0.138 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -8.690 -1.508 3.375 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -5.462 -3.515 1.445 1.00 0.00 H new ATOM 0 HZ PHE A 94 -7.318 -3.528 3.063 1.00 0.00 H new ATOM 1331 N THR A 95 -8.165 3.255 -1.667 1.00 0.00 N ATOM 1332 CA THR A 95 -8.114 4.606 -2.210 1.00 0.00 C ATOM 1333 C THR A 95 -7.449 5.568 -1.232 1.00 0.00 C ATOM 1334 O THR A 95 -8.047 5.963 -0.232 1.00 0.00 O ATOM 1335 CB THR A 95 -9.523 5.129 -2.549 1.00 0.00 C ATOM 1336 OG1 THR A 95 -10.186 4.215 -3.430 1.00 0.00 O ATOM 1337 CG2 THR A 95 -9.449 6.503 -3.197 1.00 0.00 C ATOM 0 H THR A 95 -9.102 2.932 -1.426 1.00 0.00 H new ATOM 0 HA THR A 95 -7.523 4.556 -3.124 1.00 0.00 H new ATOM 0 HB THR A 95 -10.088 5.213 -1.621 1.00 0.00 H new ATOM 0 HG1 THR A 95 -11.081 4.554 -3.639 1.00 0.00 H new ATOM 0 HG21 THR A 95 -10.456 6.851 -3.427 1.00 0.00 H new ATOM 0 HG22 THR A 95 -8.971 7.203 -2.512 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.867 6.441 -4.117 1.00 0.00 H new ATOM 1345 N ALA A 96 -6.208 5.941 -1.528 1.00 0.00 N ATOM 1346 CA ALA A 96 -5.463 6.859 -0.675 1.00 0.00 C ATOM 1347 C ALA A 96 -5.412 8.255 -1.285 1.00 0.00 C ATOM 1348 O ALA A 96 -5.138 8.416 -2.475 1.00 0.00 O ATOM 1349 CB ALA A 96 -4.055 6.333 -0.438 1.00 0.00 C ATOM 0 H ALA A 96 -5.698 5.622 -2.351 1.00 0.00 H new ATOM 0 HA ALA A 96 -5.980 6.928 0.282 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.510 7.028 0.200 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.108 5.359 0.048 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.538 6.235 -1.392 1.00 0.00 H new ATOM 1355 N LYS A 97 -5.678 9.265 -0.463 1.00 0.00 N ATOM 1356 CA LYS A 97 -5.663 10.649 -0.920 1.00 0.00 C ATOM 1357 C LYS A 97 -4.263 11.243 -0.808 1.00 0.00 C ATOM 1358 O LYS A 97 -3.706 11.342 0.286 1.00 0.00 O ATOM 1359 CB LYS A 97 -6.651 11.488 -0.106 1.00 0.00 C ATOM 1360 CG LYS A 97 -6.576 12.975 -0.405 1.00 0.00 C ATOM 1361 CD LYS A 97 -7.522 13.367 -1.528 1.00 0.00 C ATOM 1362 CE LYS A 97 -6.844 13.269 -2.886 1.00 0.00 C ATOM 1363 NZ LYS A 97 -7.727 13.756 -3.982 1.00 0.00 N ATOM 0 H LYS A 97 -5.907 9.150 0.524 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.962 10.662 -1.968 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.663 11.136 -0.305 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -6.461 11.329 0.956 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -6.823 13.541 0.494 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -5.555 13.241 -0.679 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -8.398 12.719 -1.510 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -7.875 14.386 -1.369 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -5.923 13.852 -2.875 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -6.564 12.233 -3.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -7.229 13.673 -4.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -8.595 13.184 -4.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -7.974 14.752 -3.812 1.00 0.00 H new ATOM 1377 N ILE A 98 -3.700 11.639 -1.945 1.00 0.00 N ATOM 1378 CA ILE A 98 -2.366 12.226 -1.974 1.00 0.00 C ATOM 1379 C ILE A 98 -2.412 13.673 -2.450 1.00 0.00 C ATOM 1380 O ILE A 98 -2.812 13.955 -3.580 1.00 0.00 O ATOM 1381 CB ILE A 98 -1.419 11.426 -2.887 1.00 0.00 C ATOM 1382 CG1 ILE A 98 -1.305 9.980 -2.401 1.00 0.00 C ATOM 1383 CG2 ILE A 98 -0.048 12.084 -2.934 1.00 0.00 C ATOM 1384 CD1 ILE A 98 -0.651 9.849 -1.044 1.00 0.00 C ATOM 0 H ILE A 98 -4.147 11.564 -2.859 1.00 0.00 H new ATOM 0 HA ILE A 98 -1.985 12.195 -0.953 1.00 0.00 H new ATOM 0 HB ILE A 98 -1.832 11.418 -3.896 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -2.301 9.540 -2.359 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -0.732 9.405 -3.128 1.00 0.00 H new ATOM 0 HG21 ILE A 98 0.610 11.507 -3.583 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -0.144 13.098 -3.323 1.00 0.00 H new ATOM 0 HG23 ILE A 98 0.373 12.119 -1.929 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -0.604 8.797 -0.763 1.00 0.00 H new ATOM 0 HD12 ILE A 98 0.358 10.259 -1.085 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -1.235 10.396 -0.304 1.00 0.00 H new ATOM 1396 N THR A 99 -1.999 14.590 -1.580 1.00 0.00 N ATOM 1397 CA THR A 99 -1.993 16.010 -1.911 1.00 0.00 C ATOM 1398 C THR A 99 -0.687 16.410 -2.587 1.00 0.00 C ATOM 1399 O THR A 99 0.233 15.603 -2.712 1.00 0.00 O ATOM 1400 CB THR A 99 -2.197 16.880 -0.657 1.00 0.00 C ATOM 1401 OG1 THR A 99 -1.469 18.106 -0.788 1.00 0.00 O ATOM 1402 CG2 THR A 99 -1.739 16.144 0.593 1.00 0.00 C ATOM 0 H THR A 99 -1.664 14.375 -0.641 1.00 0.00 H new ATOM 0 HA THR A 99 -2.822 16.178 -2.599 1.00 0.00 H new ATOM 0 HB THR A 99 -3.261 17.098 -0.562 1.00 0.00 H new ATOM 0 HG1 THR A 99 -1.605 18.654 0.013 1.00 0.00 H new ATOM 0 HG21 THR A 99 -1.893 16.779 1.466 1.00 0.00 H new ATOM 0 HG22 THR A 99 -2.315 15.226 0.706 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.680 15.900 0.504 1.00 0.00 H new ATOM 1410 N GLY A 100 -0.611 17.665 -3.022 1.00 0.00 N ATOM 1411 CA GLY A 100 0.588 18.151 -3.680 1.00 0.00 C ATOM 1412 C GLY A 100 0.603 19.660 -3.815 1.00 0.00 C ATOM 1413 O GLY A 100 -0.398 20.267 -4.197 1.00 0.00 O ATOM 0 H GLY A 100 -1.358 18.353 -2.930 1.00 0.00 H new ATOM 0 HA2 GLY A 100 1.464 17.831 -3.115 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.664 17.700 -4.669 1.00 0.00 H new ATOM 1417 N ASP A 101 1.741 20.269 -3.500 1.00 0.00 N ATOM 1418 CA ASP A 101 1.883 21.718 -3.588 1.00 0.00 C ATOM 1419 C ASP A 101 2.088 22.158 -5.034 1.00 0.00 C ATOM 1420 O ASP A 101 1.246 22.849 -5.608 1.00 0.00 O ATOM 1421 CB ASP A 101 3.056 22.190 -2.727 1.00 0.00 C ATOM 1422 CG ASP A 101 2.668 22.379 -1.274 1.00 0.00 C ATOM 1423 OD1 ASP A 101 2.391 21.366 -0.598 1.00 0.00 O ATOM 1424 OD2 ASP A 101 2.642 23.539 -0.812 1.00 0.00 O ATOM 0 H ASP A 101 2.579 19.782 -3.181 1.00 0.00 H new ATOM 0 HA ASP A 101 0.964 22.171 -3.217 1.00 0.00 H new ATOM 0 HB2 ASP A 101 3.866 21.464 -2.792 1.00 0.00 H new ATOM 0 HB3 ASP A 101 3.438 23.131 -3.123 1.00 0.00 H new ATOM 1429 N ASP A 102 3.211 21.753 -5.616 1.00 0.00 N ATOM 1430 CA ASP A 102 3.527 22.105 -6.996 1.00 0.00 C ATOM 1431 C ASP A 102 4.490 21.093 -7.608 1.00 0.00 C ATOM 1432 O ASP A 102 5.024 20.229 -6.912 1.00 0.00 O ATOM 1433 CB ASP A 102 4.132 23.508 -7.061 1.00 0.00 C ATOM 1434 CG ASP A 102 3.074 24.591 -7.146 1.00 0.00 C ATOM 1435 OD1 ASP A 102 2.386 24.669 -8.185 1.00 0.00 O ATOM 1436 OD2 ASP A 102 2.934 25.360 -6.173 1.00 0.00 O ATOM 0 H ASP A 102 3.918 21.181 -5.154 1.00 0.00 H new ATOM 0 HA ASP A 102 2.601 22.091 -7.570 1.00 0.00 H new ATOM 0 HB2 ASP A 102 4.749 23.676 -6.178 1.00 0.00 H new ATOM 0 HB3 ASP A 102 4.789 23.577 -7.928 1.00 0.00 H new ATOM 1441 N SER A 103 4.708 21.205 -8.914 1.00 0.00 N ATOM 1442 CA SER A 103 5.604 20.297 -9.621 1.00 0.00 C ATOM 1443 C SER A 103 6.961 20.951 -9.862 1.00 0.00 C ATOM 1444 O SER A 103 7.557 20.795 -10.928 1.00 0.00 O ATOM 1445 CB SER A 103 4.985 19.873 -10.955 1.00 0.00 C ATOM 1446 OG SER A 103 3.957 18.917 -10.759 1.00 0.00 O ATOM 0 H SER A 103 4.276 21.916 -9.505 1.00 0.00 H new ATOM 0 HA SER A 103 5.751 19.414 -8.999 1.00 0.00 H new ATOM 0 HB2 SER A 103 4.581 20.747 -11.466 1.00 0.00 H new ATOM 0 HB3 SER A 103 5.757 19.455 -11.601 1.00 0.00 H new ATOM 0 HG SER A 103 3.576 18.664 -11.626 1.00 0.00 H new ATOM 1452 N MET A 104 7.443 21.684 -8.864 1.00 0.00 N ATOM 1453 CA MET A 104 8.731 22.361 -8.966 1.00 0.00 C ATOM 1454 C MET A 104 8.746 23.325 -10.148 1.00 0.00 C ATOM 1455 O MET A 104 9.764 23.478 -10.823 1.00 0.00 O ATOM 1456 CB MET A 104 9.859 21.338 -9.113 1.00 0.00 C ATOM 1457 CG MET A 104 10.200 20.620 -7.817 1.00 0.00 C ATOM 1458 SD MET A 104 11.467 21.475 -6.862 1.00 0.00 S ATOM 1459 CE MET A 104 11.564 20.427 -5.413 1.00 0.00 C ATOM 0 H MET A 104 6.962 21.825 -7.976 1.00 0.00 H new ATOM 0 HA MET A 104 8.886 22.933 -8.051 1.00 0.00 H new ATOM 0 HB2 MET A 104 9.574 20.601 -9.863 1.00 0.00 H new ATOM 0 HB3 MET A 104 10.751 21.843 -9.485 1.00 0.00 H new ATOM 0 HG2 MET A 104 9.298 20.523 -7.212 1.00 0.00 H new ATOM 0 HG3 MET A 104 10.542 19.610 -8.045 1.00 0.00 H new ATOM 0 HE1 MET A 104 12.309 20.826 -4.724 1.00 0.00 H new ATOM 0 HE2 MET A 104 10.592 20.397 -4.920 1.00 0.00 H new ATOM 0 HE3 MET A 104 11.850 19.419 -5.712 1.00 0.00 H new ATOM 1469 N ARG A 105 7.611 23.972 -10.393 1.00 0.00 N ATOM 1470 CA ARG A 105 7.494 24.919 -11.495 1.00 0.00 C ATOM 1471 C ARG A 105 8.336 24.473 -12.687 1.00 0.00 C ATOM 1472 O ARG A 105 8.991 25.288 -13.337 1.00 0.00 O ATOM 1473 CB ARG A 105 7.928 26.315 -11.044 1.00 0.00 C ATOM 1474 CG ARG A 105 9.397 26.402 -10.663 1.00 0.00 C ATOM 1475 CD ARG A 105 9.703 27.692 -9.918 1.00 0.00 C ATOM 1476 NE ARG A 105 9.265 27.637 -8.526 1.00 0.00 N ATOM 1477 CZ ARG A 105 9.859 26.896 -7.597 1.00 0.00 C ATOM 1478 NH1 ARG A 105 10.910 26.152 -7.911 1.00 0.00 N ATOM 1479 NH2 ARG A 105 9.402 26.899 -6.351 1.00 0.00 N ATOM 0 H ARG A 105 6.760 23.857 -9.843 1.00 0.00 H new ATOM 0 HA ARG A 105 6.449 24.953 -11.803 1.00 0.00 H new ATOM 0 HB2 ARG A 105 7.726 27.026 -11.846 1.00 0.00 H new ATOM 0 HB3 ARG A 105 7.321 26.617 -10.190 1.00 0.00 H new ATOM 0 HG2 ARG A 105 9.664 25.548 -10.040 1.00 0.00 H new ATOM 0 HG3 ARG A 105 10.011 26.345 -11.562 1.00 0.00 H new ATOM 0 HD2 ARG A 105 10.775 27.885 -9.953 1.00 0.00 H new ATOM 0 HD3 ARG A 105 9.212 28.526 -10.420 1.00 0.00 H new ATOM 0 HE ARG A 105 8.459 28.198 -8.252 1.00 0.00 H new ATOM 0 HH11 ARG A 105 11.264 26.148 -8.867 1.00 0.00 H new ATOM 0 HH12 ARG A 105 11.365 25.584 -7.196 1.00 0.00 H new ATOM 0 HH21 ARG A 105 8.594 27.471 -6.106 1.00 0.00 H new ATOM 0 HH22 ARG A 105 9.859 26.330 -5.639 1.00 0.00 H new ATOM 1493 N SER A 106 8.314 23.174 -12.968 1.00 0.00 N ATOM 1494 CA SER A 106 9.078 22.619 -14.079 1.00 0.00 C ATOM 1495 C SER A 106 9.118 23.594 -15.252 1.00 0.00 C ATOM 1496 O SER A 106 8.079 24.038 -15.740 1.00 0.00 O ATOM 1497 CB SER A 106 8.473 21.288 -14.527 1.00 0.00 C ATOM 1498 OG SER A 106 7.153 21.465 -15.012 1.00 0.00 O ATOM 0 H SER A 106 7.775 22.486 -12.441 1.00 0.00 H new ATOM 0 HA SER A 106 10.099 22.449 -13.737 1.00 0.00 H new ATOM 0 HB2 SER A 106 9.094 20.847 -15.307 1.00 0.00 H new ATOM 0 HB3 SER A 106 8.466 20.589 -13.691 1.00 0.00 H new ATOM 0 HG SER A 106 7.029 22.396 -15.292 1.00 0.00 H new ATOM 1504 N GLY A 107 10.326 23.923 -15.700 1.00 0.00 N ATOM 1505 CA GLY A 107 10.479 24.843 -16.811 1.00 0.00 C ATOM 1506 C GLY A 107 11.929 25.201 -17.072 1.00 0.00 C ATOM 1507 O GLY A 107 12.429 26.229 -16.616 1.00 0.00 O ATOM 0 H GLY A 107 11.201 23.569 -15.313 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.051 24.398 -17.709 1.00 0.00 H new ATOM 0 HA3 GLY A 107 9.915 25.753 -16.606 1.00 0.00 H new ATOM 1511 N PRO A 108 12.631 24.337 -17.821 1.00 0.00 N ATOM 1512 CA PRO A 108 14.042 24.545 -18.157 1.00 0.00 C ATOM 1513 C PRO A 108 14.242 25.702 -19.130 1.00 0.00 C ATOM 1514 O PRO A 108 13.355 26.019 -19.922 1.00 0.00 O ATOM 1515 CB PRO A 108 14.450 23.221 -18.809 1.00 0.00 C ATOM 1516 CG PRO A 108 13.181 22.657 -19.348 1.00 0.00 C ATOM 1517 CD PRO A 108 12.099 23.090 -18.398 1.00 0.00 C ATOM 0 HA PRO A 108 14.636 24.805 -17.281 1.00 0.00 H new ATOM 0 HB2 PRO A 108 15.181 23.379 -19.602 1.00 0.00 H new ATOM 0 HB3 PRO A 108 14.906 22.547 -18.084 1.00 0.00 H new ATOM 0 HG2 PRO A 108 12.987 23.026 -20.355 1.00 0.00 H new ATOM 0 HG3 PRO A 108 13.233 21.570 -19.411 1.00 0.00 H new ATOM 0 HD2 PRO A 108 11.154 23.257 -18.915 1.00 0.00 H new ATOM 0 HD3 PRO A 108 11.914 22.339 -17.630 1.00 0.00 H new ATOM 1525 N SER A 109 15.412 26.328 -19.065 1.00 0.00 N ATOM 1526 CA SER A 109 15.727 27.453 -19.939 1.00 0.00 C ATOM 1527 C SER A 109 17.236 27.651 -20.047 1.00 0.00 C ATOM 1528 O SER A 109 18.005 27.083 -19.272 1.00 0.00 O ATOM 1529 CB SER A 109 15.069 28.732 -19.416 1.00 0.00 C ATOM 1530 OG SER A 109 13.656 28.638 -19.472 1.00 0.00 O ATOM 0 H SER A 109 16.158 26.076 -18.417 1.00 0.00 H new ATOM 0 HA SER A 109 15.335 27.231 -20.932 1.00 0.00 H new ATOM 0 HB2 SER A 109 15.384 28.913 -18.388 1.00 0.00 H new ATOM 0 HB3 SER A 109 15.404 29.585 -20.007 1.00 0.00 H new ATOM 0 HG SER A 109 13.401 27.824 -19.954 1.00 0.00 H new ATOM 1536 N SER A 110 17.652 28.462 -21.014 1.00 0.00 N ATOM 1537 CA SER A 110 19.069 28.733 -21.228 1.00 0.00 C ATOM 1538 C SER A 110 19.497 29.998 -20.490 1.00 0.00 C ATOM 1539 O SER A 110 18.844 31.036 -20.584 1.00 0.00 O ATOM 1540 CB SER A 110 19.363 28.877 -22.722 1.00 0.00 C ATOM 1541 OG SER A 110 18.857 30.101 -23.226 1.00 0.00 O ATOM 0 H SER A 110 17.028 28.943 -21.662 1.00 0.00 H new ATOM 0 HA SER A 110 19.638 27.892 -20.833 1.00 0.00 H new ATOM 0 HB2 SER A 110 20.439 28.828 -22.890 1.00 0.00 H new ATOM 0 HB3 SER A 110 18.917 28.044 -23.266 1.00 0.00 H new ATOM 0 HG SER A 110 19.059 30.170 -24.182 1.00 0.00 H new ATOM 1547 N GLY A 111 20.601 29.902 -19.755 1.00 0.00 N ATOM 1548 CA GLY A 111 21.098 31.044 -19.011 1.00 0.00 C ATOM 1549 C GLY A 111 22.291 31.697 -19.680 1.00 0.00 C ATOM 1550 O GLY A 111 23.334 31.067 -19.858 1.00 0.00 O ATOM 0 H GLY A 111 21.160 29.054 -19.662 1.00 0.00 H new ATOM 0 HA2 GLY A 111 20.300 31.778 -18.902 1.00 0.00 H new ATOM 0 HA3 GLY A 111 21.378 30.726 -18.007 1.00 0.00 H new TER 1554 GLY A 111