USER MOD reduce.3.24.130724 H: found=0, std=0, add=636, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 628 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 33 LYS NZ :NH3+ 176:sc= 0.126 (180deg=-0.0953) USER MOD Set 1.2: A 62 TYR OH : rot 180:sc= -0.78 USER MOD Set 2.1: A 17 TYR OH : rot 180:sc= 0.798 USER MOD Set 2.2: A 74 TYR OH : rot -177:sc= 1.32 USER MOD Single : A 1 MET CE :methyl 166:sc= -0.0136 (180deg=-0.246) USER MOD Single : A 1 MET N :NH3+ -120:sc= 0.149 (180deg=-0.0559) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 4 HIS : no HD1:sc= 0.287 K(o=0.29,f=-1.8!) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 7 HIS : no HD1:sc=-0.00588 X(o=-0.0059,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot -73:sc= 0.442 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.167 USER MOD Single : A 18 TYR OH : rot 100:sc= 1.1 USER MOD Single : A 24 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0754) USER MOD Single : A 26 ASN : amide:sc= -0.188 K(o=-0.19,f=-0.98) USER MOD Single : A 28 THR OG1 : rot -170:sc= 0.861 USER MOD Single : A 29 GLN : amide:sc= -1.01 K(o=-1,f=-5.3!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot -51:sc= 0.00514 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 HIS : no HD1:sc= -1.85! X(o=-1.9!,f=-1.8) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 ASN : amide:sc=-0.00794 K(o=-0.0079,f=-0.86) USER MOD Single : A 54 LYS NZ :NH3+ 152:sc= 1.28 (180deg=0.999) USER MOD Single : A 56 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0601) USER MOD Single : A 57 GLN : amide:sc= -0.366 X(o=-0.37,f=-0.38) USER MOD Single : A 59 SER OG : rot 71:sc= 0.0751 USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=-0.067) USER MOD Single : A 66 SER OG : rot -78:sc= 0.735 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -158:sc= 0.498 (180deg=-0.054) USER MOD Single : A 76 LYS NZ :NH3+ 167:sc= -0.0105 (180deg=-0.183) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.986 24.720 -4.291 1.00 0.00 N ATOM 2 CA MET A 1 2.227 23.923 -4.215 1.00 0.00 C ATOM 3 C MET A 1 1.892 22.476 -3.923 1.00 0.00 C ATOM 4 O MET A 1 0.723 22.133 -3.748 1.00 0.00 O ATOM 5 CB MET A 1 3.167 24.474 -3.134 1.00 0.00 C ATOM 6 CG MET A 1 3.728 25.855 -3.440 1.00 0.00 C ATOM 7 SD MET A 1 4.822 26.478 -2.137 1.00 0.00 S ATOM 8 CE MET A 1 6.225 25.367 -2.295 1.00 0.00 C ATOM 0 H1 MET A 1 0.909 25.153 -5.233 1.00 0.00 H new ATOM 0 H2 MET A 1 0.166 24.102 -4.126 1.00 0.00 H new ATOM 0 H3 MET A 1 1.008 25.467 -3.567 1.00 0.00 H new ATOM 0 HA MET A 1 2.737 23.988 -5.176 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.629 24.514 -2.187 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.996 23.779 -3.000 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.277 25.818 -4.381 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.903 26.554 -3.579 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.073 25.770 -1.741 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.961 24.389 -1.893 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.493 25.267 -3.347 1.00 0.00 H new ATOM 20 N GLY A 2 2.904 21.628 -3.882 1.00 0.00 N ATOM 21 CA GLY A 2 2.674 20.235 -3.598 1.00 0.00 C ATOM 22 C GLY A 2 3.897 19.391 -3.838 1.00 0.00 C ATOM 23 O GLY A 2 4.808 19.798 -4.558 1.00 0.00 O ATOM 0 H GLY A 2 3.879 21.881 -4.040 1.00 0.00 H new ATOM 0 HA2 GLY A 2 2.358 20.126 -2.560 1.00 0.00 H new ATOM 0 HA3 GLY A 2 1.856 19.870 -4.220 1.00 0.00 H new ATOM 27 N HIS A 3 3.926 18.226 -3.221 1.00 0.00 N ATOM 28 CA HIS A 3 5.028 17.285 -3.396 1.00 0.00 C ATOM 29 C HIS A 3 4.658 16.229 -4.417 1.00 0.00 C ATOM 30 O HIS A 3 5.517 15.512 -4.934 1.00 0.00 O ATOM 31 CB HIS A 3 5.395 16.620 -2.067 1.00 0.00 C ATOM 32 CG HIS A 3 6.137 17.516 -1.125 1.00 0.00 C ATOM 33 ND1 HIS A 3 7.479 17.375 -0.859 1.00 0.00 N ATOM 34 CD2 HIS A 3 5.718 18.563 -0.376 1.00 0.00 C ATOM 35 CE1 HIS A 3 7.854 18.290 0.012 1.00 0.00 C ATOM 36 NE2 HIS A 3 6.808 19.025 0.325 1.00 0.00 N ATOM 0 H HIS A 3 3.195 17.902 -2.588 1.00 0.00 H new ATOM 0 HA HIS A 3 5.895 17.841 -3.754 1.00 0.00 H new ATOM 0 HB2 HIS A 3 4.483 16.274 -1.581 1.00 0.00 H new ATOM 0 HB3 HIS A 3 6.003 15.738 -2.269 1.00 0.00 H new ATOM 0 HD2 HIS A 3 4.715 18.961 -0.336 1.00 0.00 H new ATOM 0 HE1 HIS A 3 8.853 18.416 0.404 1.00 0.00 H new ATOM 0 HE2 HIS A 3 6.806 19.808 0.979 1.00 0.00 H new ATOM 44 N HIS A 4 3.377 16.146 -4.711 1.00 0.00 N ATOM 45 CA HIS A 4 2.870 15.196 -5.677 1.00 0.00 C ATOM 46 C HIS A 4 2.690 15.877 -7.025 1.00 0.00 C ATOM 47 O HIS A 4 2.387 17.071 -7.086 1.00 0.00 O ATOM 48 CB HIS A 4 1.532 14.598 -5.196 1.00 0.00 C ATOM 49 CG HIS A 4 0.405 15.594 -5.111 1.00 0.00 C ATOM 50 ND1 HIS A 4 0.410 16.663 -4.243 1.00 0.00 N ATOM 51 CD2 HIS A 4 -0.759 15.676 -5.794 1.00 0.00 C ATOM 52 CE1 HIS A 4 -0.704 17.360 -4.397 1.00 0.00 C ATOM 53 NE2 HIS A 4 -1.431 16.782 -5.332 1.00 0.00 N ATOM 0 H HIS A 4 2.660 16.735 -4.287 1.00 0.00 H new ATOM 0 HA HIS A 4 3.590 14.384 -5.783 1.00 0.00 H new ATOM 0 HB2 HIS A 4 1.242 13.795 -5.873 1.00 0.00 H new ATOM 0 HB3 HIS A 4 1.680 14.149 -4.214 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -1.098 14.997 -6.562 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -0.972 18.251 -3.849 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -2.342 17.103 -5.659 1.00 0.00 H new ATOM 61 N HIS A 5 2.876 15.129 -8.093 1.00 0.00 N ATOM 62 CA HIS A 5 2.714 15.679 -9.426 1.00 0.00 C ATOM 63 C HIS A 5 1.258 15.967 -9.720 1.00 0.00 C ATOM 64 O HIS A 5 0.445 15.048 -9.837 1.00 0.00 O ATOM 65 CB HIS A 5 3.286 14.739 -10.492 1.00 0.00 C ATOM 66 CG HIS A 5 4.764 14.851 -10.667 1.00 0.00 C ATOM 67 ND1 HIS A 5 5.357 15.893 -11.344 1.00 0.00 N ATOM 68 CD2 HIS A 5 5.778 14.053 -10.257 1.00 0.00 C ATOM 69 CE1 HIS A 5 6.666 15.734 -11.345 1.00 0.00 C ATOM 70 NE2 HIS A 5 6.950 14.626 -10.692 1.00 0.00 N ATOM 0 H HIS A 5 3.138 14.144 -8.066 1.00 0.00 H new ATOM 0 HA HIS A 5 3.271 16.615 -9.459 1.00 0.00 H new ATOM 0 HB2 HIS A 5 3.038 13.711 -10.227 1.00 0.00 H new ATOM 0 HB3 HIS A 5 2.800 14.948 -11.445 1.00 0.00 H new ATOM 0 HD2 HIS A 5 5.684 13.137 -9.693 1.00 0.00 H new ATOM 0 HE1 HIS A 5 7.383 16.399 -11.803 1.00 0.00 H new ATOM 0 HE2 HIS A 5 7.886 14.254 -10.535 1.00 0.00 H new ATOM 78 N HIS A 6 0.926 17.253 -9.823 1.00 0.00 N ATOM 79 CA HIS A 6 -0.431 17.669 -10.159 1.00 0.00 C ATOM 80 C HIS A 6 -0.771 17.146 -11.542 1.00 0.00 C ATOM 81 O HIS A 6 -1.875 16.661 -11.793 1.00 0.00 O ATOM 82 CB HIS A 6 -0.556 19.201 -10.135 1.00 0.00 C ATOM 83 CG HIS A 6 -0.312 19.820 -8.789 1.00 0.00 C ATOM 84 ND1 HIS A 6 0.941 20.194 -8.354 1.00 0.00 N ATOM 85 CD2 HIS A 6 -1.165 20.136 -7.787 1.00 0.00 C ATOM 86 CE1 HIS A 6 0.847 20.714 -7.144 1.00 0.00 C ATOM 87 NE2 HIS A 6 -0.419 20.694 -6.775 1.00 0.00 N ATOM 0 H HIS A 6 1.579 18.023 -9.678 1.00 0.00 H new ATOM 0 HA HIS A 6 -1.123 17.263 -9.422 1.00 0.00 H new ATOM 0 HB2 HIS A 6 0.151 19.623 -10.849 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -1.554 19.478 -10.474 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -2.234 19.979 -7.783 1.00 0.00 H new ATOM 0 HE1 HIS A 6 1.669 21.092 -6.555 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -0.784 21.036 -5.886 1.00 0.00 H new ATOM 95 N HIS A 7 0.210 17.232 -12.424 1.00 0.00 N ATOM 96 CA HIS A 7 0.102 16.738 -13.777 1.00 0.00 C ATOM 97 C HIS A 7 1.474 16.289 -14.251 1.00 0.00 C ATOM 98 O HIS A 7 2.487 16.875 -13.869 1.00 0.00 O ATOM 99 CB HIS A 7 -0.474 17.816 -14.734 1.00 0.00 C ATOM 100 CG HIS A 7 0.310 19.107 -14.781 1.00 0.00 C ATOM 101 ND1 HIS A 7 -0.077 20.250 -14.115 1.00 0.00 N ATOM 102 CD2 HIS A 7 1.455 19.432 -15.435 1.00 0.00 C ATOM 103 CE1 HIS A 7 0.788 21.218 -14.353 1.00 0.00 C ATOM 104 NE2 HIS A 7 1.724 20.749 -15.150 1.00 0.00 N ATOM 0 H HIS A 7 1.115 17.654 -12.213 1.00 0.00 H new ATOM 0 HA HIS A 7 -0.589 15.895 -13.786 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -0.522 17.400 -15.740 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -1.497 18.040 -14.432 1.00 0.00 H new ATOM 0 HD2 HIS A 7 2.044 18.778 -16.061 1.00 0.00 H new ATOM 0 HE1 HIS A 7 0.736 22.223 -13.961 1.00 0.00 H new ATOM 0 HE2 HIS A 7 2.522 21.279 -15.500 1.00 0.00 H new ATOM 112 N HIS A 8 1.507 15.252 -15.055 1.00 0.00 N ATOM 113 CA HIS A 8 2.756 14.742 -15.601 1.00 0.00 C ATOM 114 C HIS A 8 2.513 14.109 -16.953 1.00 0.00 C ATOM 115 O HIS A 8 1.486 13.470 -17.171 1.00 0.00 O ATOM 116 CB HIS A 8 3.433 13.747 -14.632 1.00 0.00 C ATOM 117 CG HIS A 8 2.541 12.646 -14.123 1.00 0.00 C ATOM 118 ND1 HIS A 8 1.996 12.651 -12.858 1.00 0.00 N ATOM 119 CD2 HIS A 8 2.113 11.500 -14.704 1.00 0.00 C ATOM 120 CE1 HIS A 8 1.278 11.558 -12.685 1.00 0.00 C ATOM 121 NE2 HIS A 8 1.332 10.845 -13.785 1.00 0.00 N ATOM 0 H HIS A 8 0.678 14.737 -15.351 1.00 0.00 H new ATOM 0 HA HIS A 8 3.440 15.581 -15.729 1.00 0.00 H new ATOM 0 HB2 HIS A 8 4.288 13.297 -15.136 1.00 0.00 H new ATOM 0 HB3 HIS A 8 3.822 14.302 -13.779 1.00 0.00 H new ATOM 0 HD2 HIS A 8 2.343 11.164 -15.704 1.00 0.00 H new ATOM 0 HE1 HIS A 8 0.737 11.294 -11.788 1.00 0.00 H new ATOM 0 HE2 HIS A 8 0.868 9.949 -13.933 1.00 0.00 H new ATOM 129 N SER A 9 3.452 14.278 -17.852 1.00 0.00 N ATOM 130 CA SER A 9 3.301 13.776 -19.195 1.00 0.00 C ATOM 131 C SER A 9 4.213 12.586 -19.440 1.00 0.00 C ATOM 132 O SER A 9 5.433 12.687 -19.316 1.00 0.00 O ATOM 133 CB SER A 9 3.604 14.886 -20.197 1.00 0.00 C ATOM 134 OG SER A 9 2.856 16.056 -19.894 1.00 0.00 O ATOM 0 H SER A 9 4.333 14.762 -17.676 1.00 0.00 H new ATOM 0 HA SER A 9 2.271 13.443 -19.324 1.00 0.00 H new ATOM 0 HB2 SER A 9 4.669 15.116 -20.181 1.00 0.00 H new ATOM 0 HB3 SER A 9 3.366 14.547 -21.205 1.00 0.00 H new ATOM 0 HG SER A 9 3.066 16.756 -20.547 1.00 0.00 H new ATOM 140 N HIS A 10 3.617 11.450 -19.760 1.00 0.00 N ATOM 141 CA HIS A 10 4.387 10.256 -20.069 1.00 0.00 C ATOM 142 C HIS A 10 4.908 10.326 -21.491 1.00 0.00 C ATOM 143 O HIS A 10 5.988 9.833 -21.796 1.00 0.00 O ATOM 144 CB HIS A 10 3.555 8.992 -19.854 1.00 0.00 C ATOM 145 CG HIS A 10 3.567 8.515 -18.434 1.00 0.00 C ATOM 146 ND1 HIS A 10 4.417 7.529 -17.978 1.00 0.00 N ATOM 147 CD2 HIS A 10 2.835 8.900 -17.362 1.00 0.00 C ATOM 148 CE1 HIS A 10 4.205 7.332 -16.688 1.00 0.00 C ATOM 149 NE2 HIS A 10 3.252 8.146 -16.292 1.00 0.00 N ATOM 0 H HIS A 10 2.606 11.329 -19.813 1.00 0.00 H new ATOM 0 HA HIS A 10 5.237 10.209 -19.388 1.00 0.00 H new ATOM 0 HB2 HIS A 10 2.526 9.186 -20.157 1.00 0.00 H new ATOM 0 HB3 HIS A 10 3.934 8.200 -20.500 1.00 0.00 H new ATOM 0 HD2 HIS A 10 2.066 9.659 -17.350 1.00 0.00 H new ATOM 0 HE1 HIS A 10 4.727 6.622 -16.064 1.00 0.00 H new ATOM 0 HE2 HIS A 10 2.882 8.208 -15.344 1.00 0.00 H new ATOM 157 N MET A 11 4.122 10.939 -22.357 1.00 0.00 N ATOM 158 CA MET A 11 4.518 11.144 -23.740 1.00 0.00 C ATOM 159 C MET A 11 5.366 12.407 -23.825 1.00 0.00 C ATOM 160 O MET A 11 5.211 13.313 -23.002 1.00 0.00 O ATOM 161 CB MET A 11 3.283 11.277 -24.639 1.00 0.00 C ATOM 162 CG MET A 11 2.433 10.015 -24.729 1.00 0.00 C ATOM 163 SD MET A 11 1.017 10.215 -25.831 1.00 0.00 S ATOM 164 CE MET A 11 0.133 8.680 -25.542 1.00 0.00 C ATOM 0 H MET A 11 3.199 11.306 -22.126 1.00 0.00 H new ATOM 0 HA MET A 11 5.096 10.286 -24.083 1.00 0.00 H new ATOM 0 HB2 MET A 11 2.663 12.092 -24.266 1.00 0.00 H new ATOM 0 HB3 MET A 11 3.607 11.555 -25.642 1.00 0.00 H new ATOM 0 HG2 MET A 11 3.050 9.189 -25.082 1.00 0.00 H new ATOM 0 HG3 MET A 11 2.080 9.746 -23.733 1.00 0.00 H new ATOM 0 HE1 MET A 11 -0.768 8.658 -26.155 1.00 0.00 H new ATOM 0 HE2 MET A 11 0.772 7.837 -25.805 1.00 0.00 H new ATOM 0 HE3 MET A 11 -0.143 8.611 -24.490 1.00 0.00 H new ATOM 174 N VAL A 12 6.249 12.483 -24.806 1.00 0.00 N ATOM 175 CA VAL A 12 7.126 13.641 -24.922 1.00 0.00 C ATOM 176 C VAL A 12 6.404 14.763 -25.634 1.00 0.00 C ATOM 177 O VAL A 12 6.198 14.712 -26.853 1.00 0.00 O ATOM 178 CB VAL A 12 8.437 13.306 -25.680 1.00 0.00 C ATOM 179 CG1 VAL A 12 9.445 14.446 -25.557 1.00 0.00 C ATOM 180 CG2 VAL A 12 9.034 12.003 -25.168 1.00 0.00 C ATOM 0 H VAL A 12 6.379 11.770 -25.524 1.00 0.00 H new ATOM 0 HA VAL A 12 7.395 13.950 -23.912 1.00 0.00 H new ATOM 0 HB VAL A 12 8.195 13.182 -26.736 1.00 0.00 H new ATOM 0 HG11 VAL A 12 10.356 14.186 -26.097 1.00 0.00 H new ATOM 0 HG12 VAL A 12 9.019 15.356 -25.980 1.00 0.00 H new ATOM 0 HG13 VAL A 12 9.681 14.611 -24.506 1.00 0.00 H new ATOM 0 HG21 VAL A 12 9.953 11.785 -25.712 1.00 0.00 H new ATOM 0 HG22 VAL A 12 9.255 12.097 -24.105 1.00 0.00 H new ATOM 0 HG23 VAL A 12 8.322 11.192 -25.320 1.00 0.00 H new ATOM 190 N LYS A 13 6.002 15.771 -24.867 1.00 0.00 N ATOM 191 CA LYS A 13 5.260 16.887 -25.400 1.00 0.00 C ATOM 192 C LYS A 13 5.762 18.181 -24.782 1.00 0.00 C ATOM 193 O LYS A 13 5.427 18.497 -23.639 1.00 0.00 O ATOM 194 CB LYS A 13 3.768 16.724 -25.089 1.00 0.00 C ATOM 195 CG LYS A 13 3.137 15.467 -25.674 1.00 0.00 C ATOM 196 CD LYS A 13 1.655 15.389 -25.337 1.00 0.00 C ATOM 197 CE LYS A 13 1.015 14.134 -25.909 1.00 0.00 C ATOM 198 NZ LYS A 13 -0.432 14.051 -25.585 1.00 0.00 N ATOM 0 H LYS A 13 6.184 15.829 -23.865 1.00 0.00 H new ATOM 0 HA LYS A 13 5.402 16.918 -26.480 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.634 16.714 -24.007 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.233 17.595 -25.468 1.00 0.00 H new ATOM 0 HG2 LYS A 13 3.268 15.461 -26.756 1.00 0.00 H new ATOM 0 HG3 LYS A 13 3.648 14.586 -25.286 1.00 0.00 H new ATOM 0 HD2 LYS A 13 1.526 15.402 -24.255 1.00 0.00 H new ATOM 0 HD3 LYS A 13 1.145 16.269 -25.730 1.00 0.00 H new ATOM 0 HE2 LYS A 13 1.146 14.121 -26.991 1.00 0.00 H new ATOM 0 HE3 LYS A 13 1.526 13.255 -25.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -0.830 13.181 -25.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -0.556 14.037 -24.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -0.925 14.876 -25.982 1.00 0.00 H new ATOM 212 N GLU A 14 6.584 18.903 -25.534 1.00 0.00 N ATOM 213 CA GLU A 14 7.134 20.183 -25.101 1.00 0.00 C ATOM 214 C GLU A 14 8.025 20.007 -23.873 1.00 0.00 C ATOM 215 O GLU A 14 7.958 20.774 -22.909 1.00 0.00 O ATOM 216 CB GLU A 14 6.013 21.191 -24.821 1.00 0.00 C ATOM 217 CG GLU A 14 6.514 22.598 -24.566 1.00 0.00 C ATOM 218 CD GLU A 14 7.109 23.224 -25.810 1.00 0.00 C ATOM 219 OE1 GLU A 14 6.339 23.752 -26.639 1.00 0.00 O ATOM 220 OE2 GLU A 14 8.343 23.173 -25.983 1.00 0.00 O ATOM 0 H GLU A 14 6.889 18.617 -26.464 1.00 0.00 H new ATOM 0 HA GLU A 14 7.749 20.576 -25.910 1.00 0.00 H new ATOM 0 HB2 GLU A 14 5.329 21.206 -25.669 1.00 0.00 H new ATOM 0 HB3 GLU A 14 5.441 20.855 -23.956 1.00 0.00 H new ATOM 0 HG2 GLU A 14 5.691 23.216 -24.208 1.00 0.00 H new ATOM 0 HG3 GLU A 14 7.265 22.578 -23.776 1.00 0.00 H new ATOM 227 N THR A 15 8.860 19.012 -23.906 1.00 0.00 N ATOM 228 CA THR A 15 9.732 18.782 -22.819 1.00 0.00 C ATOM 229 C THR A 15 10.946 19.672 -22.914 1.00 0.00 C ATOM 230 O THR A 15 11.838 19.471 -23.746 1.00 0.00 O ATOM 231 CB THR A 15 10.154 17.340 -22.760 1.00 0.00 C ATOM 232 OG1 THR A 15 9.002 16.506 -22.594 1.00 0.00 O ATOM 233 CG2 THR A 15 11.132 17.107 -21.630 1.00 0.00 C ATOM 0 H THR A 15 8.948 18.352 -24.679 1.00 0.00 H new ATOM 0 HA THR A 15 9.191 19.020 -21.903 1.00 0.00 H new ATOM 0 HB THR A 15 10.652 17.087 -23.696 1.00 0.00 H new ATOM 0 HG1 THR A 15 8.665 16.592 -21.678 1.00 0.00 H new ATOM 0 HG21 THR A 15 11.421 16.056 -21.610 1.00 0.00 H new ATOM 0 HG22 THR A 15 12.018 17.724 -21.782 1.00 0.00 H new ATOM 0 HG23 THR A 15 10.663 17.373 -20.682 1.00 0.00 H new ATOM 241 N THR A 16 10.954 20.656 -22.077 1.00 0.00 N ATOM 242 CA THR A 16 12.023 21.600 -22.025 1.00 0.00 C ATOM 243 C THR A 16 13.011 21.232 -20.934 1.00 0.00 C ATOM 244 O THR A 16 12.819 20.255 -20.225 1.00 0.00 O ATOM 245 CB THR A 16 11.503 23.056 -21.858 1.00 0.00 C ATOM 246 OG1 THR A 16 12.588 23.992 -21.922 1.00 0.00 O ATOM 247 CG2 THR A 16 10.746 23.232 -20.547 1.00 0.00 C ATOM 0 H THR A 16 10.210 20.830 -21.401 1.00 0.00 H new ATOM 0 HA THR A 16 12.546 21.561 -22.981 1.00 0.00 H new ATOM 0 HB THR A 16 10.814 23.251 -22.680 1.00 0.00 H new ATOM 0 HG1 THR A 16 12.241 24.903 -21.817 1.00 0.00 H new ATOM 0 HG21 THR A 16 10.397 24.261 -20.464 1.00 0.00 H new ATOM 0 HG22 THR A 16 9.891 22.556 -20.527 1.00 0.00 H new ATOM 0 HG23 THR A 16 11.408 23.004 -19.711 1.00 0.00 H new ATOM 255 N TYR A 17 14.037 22.038 -20.786 1.00 0.00 N ATOM 256 CA TYR A 17 15.108 21.787 -19.820 1.00 0.00 C ATOM 257 C TYR A 17 14.534 21.706 -18.420 1.00 0.00 C ATOM 258 O TYR A 17 14.977 20.915 -17.597 1.00 0.00 O ATOM 259 CB TYR A 17 16.154 22.913 -19.901 1.00 0.00 C ATOM 260 CG TYR A 17 16.729 23.102 -21.290 1.00 0.00 C ATOM 261 CD1 TYR A 17 17.761 22.302 -21.753 1.00 0.00 C ATOM 262 CD2 TYR A 17 16.222 24.078 -22.144 1.00 0.00 C ATOM 263 CE1 TYR A 17 18.275 22.466 -23.026 1.00 0.00 C ATOM 264 CE2 TYR A 17 16.726 24.248 -23.417 1.00 0.00 C ATOM 265 CZ TYR A 17 17.751 23.439 -23.852 1.00 0.00 C ATOM 266 OH TYR A 17 18.255 23.605 -25.124 1.00 0.00 O ATOM 0 H TYR A 17 14.163 22.892 -21.329 1.00 0.00 H new ATOM 0 HA TYR A 17 15.589 20.838 -20.056 1.00 0.00 H new ATOM 0 HB2 TYR A 17 15.697 23.847 -19.575 1.00 0.00 H new ATOM 0 HB3 TYR A 17 16.965 22.696 -19.206 1.00 0.00 H new ATOM 0 HD1 TYR A 17 18.171 21.538 -21.109 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.419 24.714 -21.803 1.00 0.00 H new ATOM 0 HE1 TYR A 17 19.082 21.836 -23.372 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.320 25.009 -24.067 1.00 0.00 H new ATOM 0 HH TYR A 17 17.775 24.331 -25.574 1.00 0.00 H new ATOM 276 N TYR A 18 13.523 22.505 -18.179 1.00 0.00 N ATOM 277 CA TYR A 18 12.874 22.551 -16.913 1.00 0.00 C ATOM 278 C TYR A 18 12.048 21.289 -16.707 1.00 0.00 C ATOM 279 O TYR A 18 11.977 20.754 -15.608 1.00 0.00 O ATOM 280 CB TYR A 18 12.010 23.792 -16.849 1.00 0.00 C ATOM 281 CG TYR A 18 12.794 25.100 -16.876 1.00 0.00 C ATOM 282 CD1 TYR A 18 13.656 25.414 -17.933 1.00 0.00 C ATOM 283 CD2 TYR A 18 12.675 26.015 -15.845 1.00 0.00 C ATOM 284 CE1 TYR A 18 14.358 26.598 -17.954 1.00 0.00 C ATOM 285 CE2 TYR A 18 13.373 27.203 -15.860 1.00 0.00 C ATOM 286 CZ TYR A 18 14.214 27.490 -16.917 1.00 0.00 C ATOM 287 OH TYR A 18 14.909 28.677 -16.937 1.00 0.00 O ATOM 0 H TYR A 18 13.132 23.144 -18.871 1.00 0.00 H new ATOM 0 HA TYR A 18 13.613 22.598 -16.113 1.00 0.00 H new ATOM 0 HB2 TYR A 18 11.314 23.781 -17.688 1.00 0.00 H new ATOM 0 HB3 TYR A 18 11.412 23.758 -15.938 1.00 0.00 H new ATOM 0 HD1 TYR A 18 13.773 24.714 -18.747 1.00 0.00 H new ATOM 0 HD2 TYR A 18 12.023 25.794 -15.013 1.00 0.00 H new ATOM 0 HE1 TYR A 18 15.017 26.825 -18.779 1.00 0.00 H new ATOM 0 HE2 TYR A 18 13.263 27.907 -15.048 1.00 0.00 H new ATOM 0 HH TYR A 18 14.318 29.397 -17.240 1.00 0.00 H new ATOM 297 N ASP A 19 11.423 20.819 -17.790 1.00 0.00 N ATOM 298 CA ASP A 19 10.629 19.584 -17.767 1.00 0.00 C ATOM 299 C ASP A 19 11.533 18.369 -17.536 1.00 0.00 C ATOM 300 O ASP A 19 11.177 17.440 -16.812 1.00 0.00 O ATOM 301 CB ASP A 19 9.841 19.418 -19.080 1.00 0.00 C ATOM 302 CG ASP A 19 8.785 18.320 -18.979 1.00 0.00 C ATOM 303 OD1 ASP A 19 7.938 18.394 -18.063 1.00 0.00 O ATOM 304 OD2 ASP A 19 8.781 17.396 -19.814 1.00 0.00 O ATOM 0 H ASP A 19 11.451 21.278 -18.701 1.00 0.00 H new ATOM 0 HA ASP A 19 9.918 19.653 -16.944 1.00 0.00 H new ATOM 0 HB2 ASP A 19 9.359 20.362 -19.335 1.00 0.00 H new ATOM 0 HB3 ASP A 19 10.532 19.183 -19.890 1.00 0.00 H new ATOM 309 N VAL A 20 12.717 18.408 -18.151 1.00 0.00 N ATOM 310 CA VAL A 20 13.725 17.354 -18.012 1.00 0.00 C ATOM 311 C VAL A 20 14.138 17.214 -16.552 1.00 0.00 C ATOM 312 O VAL A 20 14.254 16.110 -16.026 1.00 0.00 O ATOM 313 CB VAL A 20 14.982 17.673 -18.863 1.00 0.00 C ATOM 314 CG1 VAL A 20 16.024 16.592 -18.729 1.00 0.00 C ATOM 315 CG2 VAL A 20 14.605 17.859 -20.310 1.00 0.00 C ATOM 0 H VAL A 20 13.005 19.173 -18.761 1.00 0.00 H new ATOM 0 HA VAL A 20 13.285 16.421 -18.364 1.00 0.00 H new ATOM 0 HB VAL A 20 15.411 18.602 -18.488 1.00 0.00 H new ATOM 0 HG11 VAL A 20 16.892 16.846 -19.338 1.00 0.00 H new ATOM 0 HG12 VAL A 20 16.326 16.505 -17.685 1.00 0.00 H new ATOM 0 HG13 VAL A 20 15.609 15.643 -19.067 1.00 0.00 H new ATOM 0 HG21 VAL A 20 15.499 18.082 -20.893 1.00 0.00 H new ATOM 0 HG22 VAL A 20 14.145 16.945 -20.686 1.00 0.00 H new ATOM 0 HG23 VAL A 20 13.898 18.684 -20.399 1.00 0.00 H new ATOM 325 N LEU A 21 14.332 18.350 -15.905 1.00 0.00 N ATOM 326 CA LEU A 21 14.721 18.370 -14.495 1.00 0.00 C ATOM 327 C LEU A 21 13.499 18.231 -13.599 1.00 0.00 C ATOM 328 O LEU A 21 13.624 18.011 -12.401 1.00 0.00 O ATOM 329 CB LEU A 21 15.476 19.670 -14.136 1.00 0.00 C ATOM 330 CG LEU A 21 16.997 19.729 -14.429 1.00 0.00 C ATOM 331 CD1 LEU A 21 17.764 18.732 -13.589 1.00 0.00 C ATOM 332 CD2 LEU A 21 17.300 19.514 -15.889 1.00 0.00 C ATOM 0 H LEU A 21 14.228 19.272 -16.328 1.00 0.00 H new ATOM 0 HA LEU A 21 15.388 17.524 -14.331 1.00 0.00 H new ATOM 0 HB2 LEU A 21 15.000 20.492 -14.671 1.00 0.00 H new ATOM 0 HB3 LEU A 21 15.333 19.857 -13.072 1.00 0.00 H new ATOM 0 HG LEU A 21 17.324 20.734 -14.160 1.00 0.00 H new ATOM 0 HD11 LEU A 21 18.827 18.802 -13.821 1.00 0.00 H new ATOM 0 HD12 LEU A 21 17.608 18.950 -12.533 1.00 0.00 H new ATOM 0 HD13 LEU A 21 17.410 17.724 -13.807 1.00 0.00 H new ATOM 0 HD21 LEU A 21 18.377 19.564 -16.048 1.00 0.00 H new ATOM 0 HD22 LEU A 21 16.932 18.535 -16.197 1.00 0.00 H new ATOM 0 HD23 LEU A 21 16.810 20.288 -16.480 1.00 0.00 H new ATOM 344 N GLY A 22 12.318 18.329 -14.199 1.00 0.00 N ATOM 345 CA GLY A 22 11.092 18.218 -13.439 1.00 0.00 C ATOM 346 C GLY A 22 10.985 19.300 -12.382 1.00 0.00 C ATOM 347 O GLY A 22 10.504 19.061 -11.271 1.00 0.00 O ATOM 0 H GLY A 22 12.190 18.483 -15.199 1.00 0.00 H new ATOM 0 HA2 GLY A 22 10.239 18.284 -14.114 1.00 0.00 H new ATOM 0 HA3 GLY A 22 11.047 17.239 -12.963 1.00 0.00 H new ATOM 351 N VAL A 23 11.430 20.490 -12.735 1.00 0.00 N ATOM 352 CA VAL A 23 11.481 21.588 -11.801 1.00 0.00 C ATOM 353 C VAL A 23 10.470 22.677 -12.178 1.00 0.00 C ATOM 354 O VAL A 23 9.823 22.605 -13.226 1.00 0.00 O ATOM 355 CB VAL A 23 12.917 22.181 -11.732 1.00 0.00 C ATOM 356 CG1 VAL A 23 13.130 23.279 -12.765 1.00 0.00 C ATOM 357 CG2 VAL A 23 13.252 22.647 -10.324 1.00 0.00 C ATOM 0 H VAL A 23 11.763 20.718 -13.672 1.00 0.00 H new ATOM 0 HA VAL A 23 11.216 21.205 -10.816 1.00 0.00 H new ATOM 0 HB VAL A 23 13.614 21.381 -11.983 1.00 0.00 H new ATOM 0 HG11 VAL A 23 14.146 23.665 -12.681 1.00 0.00 H new ATOM 0 HG12 VAL A 23 12.977 22.873 -13.765 1.00 0.00 H new ATOM 0 HG13 VAL A 23 12.419 24.087 -12.589 1.00 0.00 H new ATOM 0 HG21 VAL A 23 14.262 23.057 -10.307 1.00 0.00 H new ATOM 0 HG22 VAL A 23 12.543 23.416 -10.017 1.00 0.00 H new ATOM 0 HG23 VAL A 23 13.191 21.803 -9.637 1.00 0.00 H new ATOM 367 N LYS A 24 10.350 23.683 -11.327 1.00 0.00 N ATOM 368 CA LYS A 24 9.412 24.758 -11.542 1.00 0.00 C ATOM 369 C LYS A 24 10.032 25.821 -12.448 1.00 0.00 C ATOM 370 O LYS A 24 11.248 25.982 -12.482 1.00 0.00 O ATOM 371 CB LYS A 24 9.013 25.394 -10.202 1.00 0.00 C ATOM 372 CG LYS A 24 8.436 24.422 -9.167 1.00 0.00 C ATOM 373 CD LYS A 24 8.098 25.147 -7.871 1.00 0.00 C ATOM 374 CE LYS A 24 7.600 24.187 -6.795 1.00 0.00 C ATOM 375 NZ LYS A 24 8.663 23.252 -6.329 1.00 0.00 N ATOM 0 H LYS A 24 10.900 23.772 -10.473 1.00 0.00 H new ATOM 0 HA LYS A 24 8.522 24.350 -12.021 1.00 0.00 H new ATOM 0 HB2 LYS A 24 9.890 25.879 -9.773 1.00 0.00 H new ATOM 0 HB3 LYS A 24 8.278 26.175 -10.393 1.00 0.00 H new ATOM 0 HG2 LYS A 24 7.540 23.948 -9.567 1.00 0.00 H new ATOM 0 HG3 LYS A 24 9.155 23.628 -8.967 1.00 0.00 H new ATOM 0 HD2 LYS A 24 8.981 25.672 -7.508 1.00 0.00 H new ATOM 0 HD3 LYS A 24 7.336 25.901 -8.065 1.00 0.00 H new ATOM 0 HE2 LYS A 24 7.227 24.760 -5.946 1.00 0.00 H new ATOM 0 HE3 LYS A 24 6.760 23.612 -7.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 8.323 22.727 -5.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 8.895 22.583 -7.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 9.513 23.793 -6.073 1.00 0.00 H new ATOM 389 N PRO A 25 9.201 26.563 -13.176 1.00 0.00 N ATOM 390 CA PRO A 25 9.659 27.628 -14.075 1.00 0.00 C ATOM 391 C PRO A 25 10.243 28.820 -13.308 1.00 0.00 C ATOM 392 O PRO A 25 10.889 29.693 -13.890 1.00 0.00 O ATOM 393 CB PRO A 25 8.391 28.041 -14.842 1.00 0.00 C ATOM 394 CG PRO A 25 7.362 27.006 -14.510 1.00 0.00 C ATOM 395 CD PRO A 25 7.747 26.436 -13.183 1.00 0.00 C ATOM 0 HA PRO A 25 10.462 27.288 -14.728 1.00 0.00 H new ATOM 0 HB2 PRO A 25 8.058 29.035 -14.542 1.00 0.00 H new ATOM 0 HB3 PRO A 25 8.577 28.078 -15.915 1.00 0.00 H new ATOM 0 HG2 PRO A 25 6.366 27.448 -14.468 1.00 0.00 H new ATOM 0 HG3 PRO A 25 7.334 26.228 -15.273 1.00 0.00 H new ATOM 0 HD2 PRO A 25 7.291 26.986 -12.360 1.00 0.00 H new ATOM 0 HD3 PRO A 25 7.433 25.397 -13.084 1.00 0.00 H new ATOM 403 N ASN A 26 10.007 28.839 -12.000 1.00 0.00 N ATOM 404 CA ASN A 26 10.474 29.914 -11.128 1.00 0.00 C ATOM 405 C ASN A 26 11.377 29.327 -10.045 1.00 0.00 C ATOM 406 O ASN A 26 11.562 29.903 -8.973 1.00 0.00 O ATOM 407 CB ASN A 26 9.267 30.628 -10.501 1.00 0.00 C ATOM 408 CG ASN A 26 9.621 31.945 -9.810 1.00 0.00 C ATOM 409 OD1 ASN A 26 10.547 32.650 -10.215 1.00 0.00 O ATOM 410 ND2 ASN A 26 8.871 32.290 -8.776 1.00 0.00 N ATOM 0 H ASN A 26 9.486 28.109 -11.513 1.00 0.00 H new ATOM 0 HA ASN A 26 11.045 30.641 -11.705 1.00 0.00 H new ATOM 0 HB2 ASN A 26 8.528 30.823 -11.278 1.00 0.00 H new ATOM 0 HB3 ASN A 26 8.799 29.962 -9.776 1.00 0.00 H new ATOM 0 HD21 ASN A 26 9.051 33.166 -8.285 1.00 0.00 H new ATOM 0 HD22 ASN A 26 8.113 31.680 -8.470 1.00 0.00 H new ATOM 417 N ALA A 27 11.932 28.159 -10.344 1.00 0.00 N ATOM 418 CA ALA A 27 12.789 27.447 -9.424 1.00 0.00 C ATOM 419 C ALA A 27 14.121 28.154 -9.205 1.00 0.00 C ATOM 420 O ALA A 27 14.641 28.835 -10.093 1.00 0.00 O ATOM 421 CB ALA A 27 13.013 26.048 -9.938 1.00 0.00 C ATOM 0 H ALA A 27 11.796 27.683 -11.236 1.00 0.00 H new ATOM 0 HA ALA A 27 12.290 27.414 -8.455 1.00 0.00 H new ATOM 0 HB1 ALA A 27 13.659 25.506 -9.248 1.00 0.00 H new ATOM 0 HB2 ALA A 27 12.056 25.533 -10.020 1.00 0.00 H new ATOM 0 HB3 ALA A 27 13.486 26.092 -10.919 1.00 0.00 H new ATOM 427 N THR A 28 14.648 27.989 -8.011 1.00 0.00 N ATOM 428 CA THR A 28 15.907 28.572 -7.617 1.00 0.00 C ATOM 429 C THR A 28 17.048 27.716 -8.035 1.00 0.00 C ATOM 430 O THR A 28 16.863 26.573 -8.441 1.00 0.00 O ATOM 431 CB THR A 28 15.965 28.731 -6.094 1.00 0.00 C ATOM 432 OG1 THR A 28 15.927 27.445 -5.466 1.00 0.00 O ATOM 433 CG2 THR A 28 14.795 29.517 -5.639 1.00 0.00 C ATOM 0 H THR A 28 14.205 27.437 -7.277 1.00 0.00 H new ATOM 0 HA THR A 28 15.982 29.544 -8.104 1.00 0.00 H new ATOM 0 HB THR A 28 16.890 29.241 -5.825 1.00 0.00 H new ATOM 0 HG1 THR A 28 15.805 27.556 -4.500 1.00 0.00 H new ATOM 0 HG21 THR A 28 14.833 29.632 -4.556 1.00 0.00 H new ATOM 0 HG22 THR A 28 14.812 30.500 -6.109 1.00 0.00 H new ATOM 0 HG23 THR A 28 13.878 28.998 -5.917 1.00 0.00 H new ATOM 441 N GLN A 29 18.229 28.266 -7.942 1.00 0.00 N ATOM 442 CA GLN A 29 19.429 27.508 -8.190 1.00 0.00 C ATOM 443 C GLN A 29 19.465 26.283 -7.275 1.00 0.00 C ATOM 444 O GLN A 29 19.909 25.203 -7.669 1.00 0.00 O ATOM 445 CB GLN A 29 20.662 28.379 -7.995 1.00 0.00 C ATOM 446 CG GLN A 29 21.973 27.663 -8.312 1.00 0.00 C ATOM 447 CD GLN A 29 23.183 28.575 -8.252 1.00 0.00 C ATOM 448 OE1 GLN A 29 23.088 29.777 -8.507 1.00 0.00 O ATOM 449 NE2 GLN A 29 24.330 28.009 -7.937 1.00 0.00 N ATOM 0 H GLN A 29 18.388 29.243 -7.695 1.00 0.00 H new ATOM 0 HA GLN A 29 19.428 27.166 -9.225 1.00 0.00 H new ATOM 0 HB2 GLN A 29 20.577 29.261 -8.629 1.00 0.00 H new ATOM 0 HB3 GLN A 29 20.689 28.729 -6.963 1.00 0.00 H new ATOM 0 HG2 GLN A 29 22.110 26.842 -7.608 1.00 0.00 H new ATOM 0 HG3 GLN A 29 21.907 27.223 -9.307 1.00 0.00 H new ATOM 0 HE21 GLN A 29 24.367 27.010 -7.733 1.00 0.00 H new ATOM 0 HE22 GLN A 29 25.181 28.569 -7.897 1.00 0.00 H new ATOM 458 N GLU A 30 18.971 26.461 -6.057 1.00 0.00 N ATOM 459 CA GLU A 30 18.905 25.381 -5.090 1.00 0.00 C ATOM 460 C GLU A 30 17.865 24.359 -5.531 1.00 0.00 C ATOM 461 O GLU A 30 18.083 23.154 -5.448 1.00 0.00 O ATOM 462 CB GLU A 30 18.522 25.928 -3.724 1.00 0.00 C ATOM 463 CG GLU A 30 18.549 24.887 -2.617 1.00 0.00 C ATOM 464 CD GLU A 30 18.089 25.433 -1.291 1.00 0.00 C ATOM 465 OE1 GLU A 30 17.493 26.527 -1.272 1.00 0.00 O ATOM 466 OE2 GLU A 30 18.314 24.768 -0.257 1.00 0.00 O ATOM 0 H GLU A 30 18.608 27.351 -5.716 1.00 0.00 H new ATOM 0 HA GLU A 30 19.883 24.904 -5.027 1.00 0.00 H new ATOM 0 HB2 GLU A 30 19.202 26.739 -3.464 1.00 0.00 H new ATOM 0 HB3 GLU A 30 17.522 26.357 -3.782 1.00 0.00 H new ATOM 0 HG2 GLU A 30 17.914 24.047 -2.899 1.00 0.00 H new ATOM 0 HG3 GLU A 30 19.563 24.500 -2.513 1.00 0.00 H new ATOM 473 N GLU A 31 16.742 24.866 -6.018 1.00 0.00 N ATOM 474 CA GLU A 31 15.652 24.059 -6.473 1.00 0.00 C ATOM 475 C GLU A 31 16.079 23.239 -7.698 1.00 0.00 C ATOM 476 O GLU A 31 15.710 22.068 -7.836 1.00 0.00 O ATOM 477 CB GLU A 31 14.484 24.980 -6.802 1.00 0.00 C ATOM 478 CG GLU A 31 13.207 24.270 -7.138 1.00 0.00 C ATOM 479 CD GLU A 31 12.583 23.599 -5.933 1.00 0.00 C ATOM 480 OE1 GLU A 31 12.265 24.307 -4.956 1.00 0.00 O ATOM 481 OE2 GLU A 31 12.398 22.369 -5.958 1.00 0.00 O ATOM 0 H GLU A 31 16.573 25.868 -6.104 1.00 0.00 H new ATOM 0 HA GLU A 31 15.348 23.354 -5.699 1.00 0.00 H new ATOM 0 HB2 GLU A 31 14.306 25.638 -5.951 1.00 0.00 H new ATOM 0 HB3 GLU A 31 14.764 25.615 -7.643 1.00 0.00 H new ATOM 0 HG2 GLU A 31 12.499 24.983 -7.560 1.00 0.00 H new ATOM 0 HG3 GLU A 31 13.402 23.522 -7.906 1.00 0.00 H new ATOM 488 N LEU A 32 16.871 23.862 -8.569 1.00 0.00 N ATOM 489 CA LEU A 32 17.414 23.193 -9.748 1.00 0.00 C ATOM 490 C LEU A 32 18.291 22.010 -9.329 1.00 0.00 C ATOM 491 O LEU A 32 18.201 20.914 -9.889 1.00 0.00 O ATOM 492 CB LEU A 32 18.247 24.180 -10.575 1.00 0.00 C ATOM 493 CG LEU A 32 17.488 25.086 -11.555 1.00 0.00 C ATOM 494 CD1 LEU A 32 16.029 25.239 -11.162 1.00 0.00 C ATOM 495 CD2 LEU A 32 18.139 26.451 -11.638 1.00 0.00 C ATOM 0 H LEU A 32 17.152 24.838 -8.478 1.00 0.00 H new ATOM 0 HA LEU A 32 16.584 22.826 -10.352 1.00 0.00 H new ATOM 0 HB2 LEU A 32 18.800 24.817 -9.885 1.00 0.00 H new ATOM 0 HB3 LEU A 32 18.983 23.610 -11.142 1.00 0.00 H new ATOM 0 HG LEU A 32 17.530 24.608 -12.533 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.525 25.887 -11.879 1.00 0.00 H new ATOM 0 HD12 LEU A 32 15.549 24.260 -11.157 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.964 25.680 -10.167 1.00 0.00 H new ATOM 0 HD21 LEU A 32 17.585 27.076 -12.338 1.00 0.00 H new ATOM 0 HD22 LEU A 32 18.134 26.917 -10.653 1.00 0.00 H new ATOM 0 HD23 LEU A 32 19.167 26.343 -11.983 1.00 0.00 H new ATOM 507 N LYS A 33 19.130 22.249 -8.328 1.00 0.00 N ATOM 508 CA LYS A 33 20.002 21.226 -7.764 1.00 0.00 C ATOM 509 C LYS A 33 19.208 20.123 -7.100 1.00 0.00 C ATOM 510 O LYS A 33 19.534 18.941 -7.235 1.00 0.00 O ATOM 511 CB LYS A 33 20.976 21.854 -6.783 1.00 0.00 C ATOM 512 CG LYS A 33 22.033 22.696 -7.457 1.00 0.00 C ATOM 513 CD LYS A 33 22.889 23.426 -6.451 1.00 0.00 C ATOM 514 CE LYS A 33 24.033 24.151 -7.136 1.00 0.00 C ATOM 515 NZ LYS A 33 25.056 23.200 -7.643 1.00 0.00 N ATOM 0 H LYS A 33 19.225 23.162 -7.883 1.00 0.00 H new ATOM 0 HA LYS A 33 20.565 20.774 -8.581 1.00 0.00 H new ATOM 0 HB2 LYS A 33 20.423 22.473 -6.076 1.00 0.00 H new ATOM 0 HB3 LYS A 33 21.460 21.066 -6.206 1.00 0.00 H new ATOM 0 HG2 LYS A 33 22.664 22.060 -8.078 1.00 0.00 H new ATOM 0 HG3 LYS A 33 21.556 23.417 -8.120 1.00 0.00 H new ATOM 0 HD2 LYS A 33 22.279 24.141 -5.899 1.00 0.00 H new ATOM 0 HD3 LYS A 33 23.286 22.718 -5.724 1.00 0.00 H new ATOM 0 HE2 LYS A 33 23.645 24.745 -7.964 1.00 0.00 H new ATOM 0 HE3 LYS A 33 24.496 24.846 -6.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 25.788 23.723 -8.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.492 22.699 -6.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 24.605 22.511 -8.278 1.00 0.00 H new ATOM 529 N LYS A 34 18.173 20.516 -6.381 1.00 0.00 N ATOM 530 CA LYS A 34 17.314 19.579 -5.688 1.00 0.00 C ATOM 531 C LYS A 34 16.647 18.627 -6.677 1.00 0.00 C ATOM 532 O LYS A 34 16.571 17.414 -6.436 1.00 0.00 O ATOM 533 CB LYS A 34 16.273 20.335 -4.854 1.00 0.00 C ATOM 534 CG LYS A 34 15.350 19.431 -4.054 1.00 0.00 C ATOM 535 CD LYS A 34 14.389 20.237 -3.202 1.00 0.00 C ATOM 536 CE LYS A 34 13.464 19.327 -2.412 1.00 0.00 C ATOM 537 NZ LYS A 34 12.535 20.093 -1.549 1.00 0.00 N ATOM 0 H LYS A 34 17.906 21.493 -6.262 1.00 0.00 H new ATOM 0 HA LYS A 34 17.921 18.979 -5.011 1.00 0.00 H new ATOM 0 HB2 LYS A 34 16.789 21.008 -4.169 1.00 0.00 H new ATOM 0 HB3 LYS A 34 15.671 20.956 -5.518 1.00 0.00 H new ATOM 0 HG2 LYS A 34 14.787 18.790 -4.733 1.00 0.00 H new ATOM 0 HG3 LYS A 34 15.943 18.776 -3.416 1.00 0.00 H new ATOM 0 HD2 LYS A 34 14.950 20.873 -2.518 1.00 0.00 H new ATOM 0 HD3 LYS A 34 13.799 20.897 -3.838 1.00 0.00 H new ATOM 0 HE2 LYS A 34 12.891 18.707 -3.101 1.00 0.00 H new ATOM 0 HE3 LYS A 34 14.059 18.653 -1.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 11.922 19.434 -1.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 13.081 20.666 -0.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 11.949 20.718 -2.139 1.00 0.00 H new ATOM 551 N ALA A 35 16.180 19.177 -7.793 1.00 0.00 N ATOM 552 CA ALA A 35 15.562 18.378 -8.840 1.00 0.00 C ATOM 553 C ALA A 35 16.559 17.368 -9.384 1.00 0.00 C ATOM 554 O ALA A 35 16.255 16.181 -9.505 1.00 0.00 O ATOM 555 CB ALA A 35 15.063 19.277 -9.965 1.00 0.00 C ATOM 0 H ALA A 35 16.219 20.176 -7.994 1.00 0.00 H new ATOM 0 HA ALA A 35 14.713 17.843 -8.416 1.00 0.00 H new ATOM 0 HB1 ALA A 35 14.603 18.666 -10.742 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.327 19.978 -9.571 1.00 0.00 H new ATOM 0 HB3 ALA A 35 15.902 19.830 -10.388 1.00 0.00 H new ATOM 561 N TYR A 36 17.764 17.847 -9.674 1.00 0.00 N ATOM 562 CA TYR A 36 18.816 17.007 -10.218 1.00 0.00 C ATOM 563 C TYR A 36 19.149 15.846 -9.278 1.00 0.00 C ATOM 564 O TYR A 36 19.326 14.719 -9.724 1.00 0.00 O ATOM 565 CB TYR A 36 20.071 17.829 -10.513 1.00 0.00 C ATOM 566 CG TYR A 36 21.236 16.997 -11.001 1.00 0.00 C ATOM 567 CD1 TYR A 36 21.252 16.501 -12.289 1.00 0.00 C ATOM 568 CD2 TYR A 36 22.315 16.711 -10.175 1.00 0.00 C ATOM 569 CE1 TYR A 36 22.305 15.742 -12.754 1.00 0.00 C ATOM 570 CE2 TYR A 36 23.376 15.950 -10.632 1.00 0.00 C ATOM 571 CZ TYR A 36 23.364 15.468 -11.924 1.00 0.00 C ATOM 572 OH TYR A 36 24.415 14.717 -12.386 1.00 0.00 O ATOM 0 H TYR A 36 18.034 18.821 -9.539 1.00 0.00 H new ATOM 0 HA TYR A 36 18.447 16.587 -11.154 1.00 0.00 H new ATOM 0 HB2 TYR A 36 19.834 18.583 -11.263 1.00 0.00 H new ATOM 0 HB3 TYR A 36 20.368 18.361 -9.609 1.00 0.00 H new ATOM 0 HD1 TYR A 36 20.422 16.712 -12.947 1.00 0.00 H new ATOM 0 HD2 TYR A 36 22.326 17.088 -9.163 1.00 0.00 H new ATOM 0 HE1 TYR A 36 22.297 15.365 -13.766 1.00 0.00 H new ATOM 0 HE2 TYR A 36 24.210 15.734 -9.980 1.00 0.00 H new ATOM 0 HH TYR A 36 24.074 13.893 -12.793 1.00 0.00 H new ATOM 582 N ARG A 37 19.220 16.126 -7.979 1.00 0.00 N ATOM 583 CA ARG A 37 19.528 15.115 -6.995 1.00 0.00 C ATOM 584 C ARG A 37 18.489 13.994 -7.011 1.00 0.00 C ATOM 585 O ARG A 37 18.837 12.802 -6.964 1.00 0.00 O ATOM 586 CB ARG A 37 19.604 15.761 -5.615 1.00 0.00 C ATOM 587 CG ARG A 37 20.833 16.636 -5.414 1.00 0.00 C ATOM 588 CD ARG A 37 20.796 17.367 -4.079 1.00 0.00 C ATOM 589 NE ARG A 37 22.036 18.114 -3.846 1.00 0.00 N ATOM 590 CZ ARG A 37 22.161 19.154 -3.012 1.00 0.00 C ATOM 591 NH1 ARG A 37 21.103 19.627 -2.357 1.00 0.00 N ATOM 592 NH2 ARG A 37 23.348 19.723 -2.848 1.00 0.00 N ATOM 0 H ARG A 37 19.065 17.056 -7.590 1.00 0.00 H new ATOM 0 HA ARG A 37 20.492 14.669 -7.238 1.00 0.00 H new ATOM 0 HB2 ARG A 37 18.710 16.364 -5.457 1.00 0.00 H new ATOM 0 HB3 ARG A 37 19.599 14.978 -4.857 1.00 0.00 H new ATOM 0 HG2 ARG A 37 21.730 16.019 -5.466 1.00 0.00 H new ATOM 0 HG3 ARG A 37 20.898 17.362 -6.224 1.00 0.00 H new ATOM 0 HD2 ARG A 37 19.948 18.051 -4.060 1.00 0.00 H new ATOM 0 HD3 ARG A 37 20.644 16.649 -3.273 1.00 0.00 H new ATOM 0 HE ARG A 37 22.867 17.819 -4.358 1.00 0.00 H new ATOM 0 HH11 ARG A 37 20.188 19.197 -2.488 1.00 0.00 H new ATOM 0 HH12 ARG A 37 21.208 20.420 -1.724 1.00 0.00 H new ATOM 0 HH21 ARG A 37 24.158 19.368 -3.356 1.00 0.00 H new ATOM 0 HH22 ARG A 37 23.450 20.516 -2.214 1.00 0.00 H new ATOM 606 N LYS A 38 17.223 14.372 -7.106 1.00 0.00 N ATOM 607 CA LYS A 38 16.141 13.399 -7.156 1.00 0.00 C ATOM 608 C LYS A 38 16.259 12.519 -8.405 1.00 0.00 C ATOM 609 O LYS A 38 16.172 11.284 -8.333 1.00 0.00 O ATOM 610 CB LYS A 38 14.791 14.118 -7.173 1.00 0.00 C ATOM 611 CG LYS A 38 13.609 13.169 -7.234 1.00 0.00 C ATOM 612 CD LYS A 38 12.300 13.914 -7.367 1.00 0.00 C ATOM 613 CE LYS A 38 11.133 12.947 -7.414 1.00 0.00 C ATOM 614 NZ LYS A 38 9.857 13.640 -7.686 1.00 0.00 N ATOM 0 H LYS A 38 16.919 15.345 -7.150 1.00 0.00 H new ATOM 0 HA LYS A 38 16.211 12.768 -6.270 1.00 0.00 H new ATOM 0 HB2 LYS A 38 14.705 14.738 -6.280 1.00 0.00 H new ATOM 0 HB3 LYS A 38 14.755 14.789 -8.031 1.00 0.00 H new ATOM 0 HG2 LYS A 38 13.730 12.491 -8.079 1.00 0.00 H new ATOM 0 HG3 LYS A 38 13.588 12.555 -6.334 1.00 0.00 H new ATOM 0 HD2 LYS A 38 12.178 14.597 -6.527 1.00 0.00 H new ATOM 0 HD3 LYS A 38 12.312 14.521 -8.272 1.00 0.00 H new ATOM 0 HE2 LYS A 38 11.312 12.199 -8.186 1.00 0.00 H new ATOM 0 HE3 LYS A 38 11.063 12.415 -6.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 9.083 12.946 -7.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 9.674 14.337 -6.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 9.915 14.126 -8.603 1.00 0.00 H new ATOM 628 N LEU A 39 16.461 13.164 -9.539 1.00 0.00 N ATOM 629 CA LEU A 39 16.550 12.478 -10.820 1.00 0.00 C ATOM 630 C LEU A 39 17.757 11.582 -10.876 1.00 0.00 C ATOM 631 O LEU A 39 17.692 10.489 -11.403 1.00 0.00 O ATOM 632 CB LEU A 39 16.622 13.473 -11.937 1.00 0.00 C ATOM 633 CG LEU A 39 15.567 14.547 -11.910 1.00 0.00 C ATOM 634 CD1 LEU A 39 15.736 15.486 -13.075 1.00 0.00 C ATOM 635 CD2 LEU A 39 14.163 13.960 -11.889 1.00 0.00 C ATOM 0 H LEU A 39 16.568 14.176 -9.601 1.00 0.00 H new ATOM 0 HA LEU A 39 15.655 11.866 -10.930 1.00 0.00 H new ATOM 0 HB2 LEU A 39 17.602 13.949 -11.915 1.00 0.00 H new ATOM 0 HB3 LEU A 39 16.548 12.938 -12.884 1.00 0.00 H new ATOM 0 HG LEU A 39 15.697 15.111 -10.987 1.00 0.00 H new ATOM 0 HD11 LEU A 39 14.964 16.255 -13.038 1.00 0.00 H new ATOM 0 HD12 LEU A 39 16.718 15.955 -13.024 1.00 0.00 H new ATOM 0 HD13 LEU A 39 15.648 14.928 -14.007 1.00 0.00 H new ATOM 0 HD21 LEU A 39 13.431 14.768 -11.870 1.00 0.00 H new ATOM 0 HD22 LEU A 39 14.009 13.352 -12.781 1.00 0.00 H new ATOM 0 HD23 LEU A 39 14.041 13.339 -11.001 1.00 0.00 H new ATOM 647 N ALA A 40 18.854 12.063 -10.328 1.00 0.00 N ATOM 648 CA ALA A 40 20.114 11.312 -10.320 1.00 0.00 C ATOM 649 C ALA A 40 19.945 9.950 -9.688 1.00 0.00 C ATOM 650 O ALA A 40 20.502 8.957 -10.164 1.00 0.00 O ATOM 651 CB ALA A 40 21.199 12.098 -9.593 1.00 0.00 C ATOM 0 H ALA A 40 18.908 12.976 -9.877 1.00 0.00 H new ATOM 0 HA ALA A 40 20.416 11.165 -11.357 1.00 0.00 H new ATOM 0 HB1 ALA A 40 22.127 11.526 -9.597 1.00 0.00 H new ATOM 0 HB2 ALA A 40 21.358 13.051 -10.098 1.00 0.00 H new ATOM 0 HB3 ALA A 40 20.889 12.280 -8.564 1.00 0.00 H new ATOM 657 N LEU A 41 19.194 9.912 -8.620 1.00 0.00 N ATOM 658 CA LEU A 41 18.909 8.684 -7.930 1.00 0.00 C ATOM 659 C LEU A 41 18.053 7.736 -8.797 1.00 0.00 C ATOM 660 O LEU A 41 18.319 6.534 -8.871 1.00 0.00 O ATOM 661 CB LEU A 41 18.174 9.010 -6.641 1.00 0.00 C ATOM 662 CG LEU A 41 18.948 9.865 -5.636 1.00 0.00 C ATOM 663 CD1 LEU A 41 18.087 10.170 -4.431 1.00 0.00 C ATOM 664 CD2 LEU A 41 20.240 9.176 -5.216 1.00 0.00 C ATOM 0 H LEU A 41 18.761 10.736 -8.203 1.00 0.00 H new ATOM 0 HA LEU A 41 19.848 8.175 -7.714 1.00 0.00 H new ATOM 0 HB2 LEU A 41 17.248 9.527 -6.893 1.00 0.00 H new ATOM 0 HB3 LEU A 41 17.895 8.074 -6.156 1.00 0.00 H new ATOM 0 HG LEU A 41 19.212 10.806 -6.119 1.00 0.00 H new ATOM 0 HD11 LEU A 41 18.652 10.779 -3.725 1.00 0.00 H new ATOM 0 HD12 LEU A 41 17.197 10.713 -4.748 1.00 0.00 H new ATOM 0 HD13 LEU A 41 17.791 9.238 -3.950 1.00 0.00 H new ATOM 0 HD21 LEU A 41 20.772 9.804 -4.501 1.00 0.00 H new ATOM 0 HD22 LEU A 41 20.007 8.217 -4.753 1.00 0.00 H new ATOM 0 HD23 LEU A 41 20.867 9.013 -6.093 1.00 0.00 H new ATOM 676 N LYS A 42 17.034 8.297 -9.453 1.00 0.00 N ATOM 677 CA LYS A 42 16.098 7.533 -10.269 1.00 0.00 C ATOM 678 C LYS A 42 16.659 7.097 -11.637 1.00 0.00 C ATOM 679 O LYS A 42 16.538 5.934 -12.028 1.00 0.00 O ATOM 680 CB LYS A 42 14.852 8.356 -10.481 1.00 0.00 C ATOM 681 CG LYS A 42 14.013 8.528 -9.236 1.00 0.00 C ATOM 682 CD LYS A 42 13.389 7.215 -8.792 1.00 0.00 C ATOM 683 CE LYS A 42 12.539 7.400 -7.550 1.00 0.00 C ATOM 684 NZ LYS A 42 11.889 6.137 -7.129 1.00 0.00 N ATOM 0 H LYS A 42 16.838 9.298 -9.430 1.00 0.00 H new ATOM 0 HA LYS A 42 15.888 6.614 -9.722 1.00 0.00 H new ATOM 0 HB2 LYS A 42 15.137 9.340 -10.854 1.00 0.00 H new ATOM 0 HB3 LYS A 42 14.245 7.886 -11.254 1.00 0.00 H new ATOM 0 HG2 LYS A 42 14.632 8.927 -8.432 1.00 0.00 H new ATOM 0 HG3 LYS A 42 13.227 9.259 -9.425 1.00 0.00 H new ATOM 0 HD2 LYS A 42 12.776 6.811 -9.598 1.00 0.00 H new ATOM 0 HD3 LYS A 42 14.174 6.486 -8.592 1.00 0.00 H new ATOM 0 HE2 LYS A 42 13.161 7.776 -6.738 1.00 0.00 H new ATOM 0 HE3 LYS A 42 11.776 8.154 -7.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 11.318 6.308 -6.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 11.275 5.791 -7.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 12.617 5.424 -6.920 1.00 0.00 H new ATOM 698 N TYR A 43 17.271 8.032 -12.344 1.00 0.00 N ATOM 699 CA TYR A 43 17.733 7.804 -13.728 1.00 0.00 C ATOM 700 C TYR A 43 19.216 7.474 -13.778 1.00 0.00 C ATOM 701 O TYR A 43 19.862 7.681 -14.804 1.00 0.00 O ATOM 702 CB TYR A 43 17.452 9.047 -14.611 1.00 0.00 C ATOM 703 CG TYR A 43 15.985 9.437 -14.708 1.00 0.00 C ATOM 704 CD1 TYR A 43 15.394 10.229 -13.731 1.00 0.00 C ATOM 705 CD2 TYR A 43 15.199 9.024 -15.781 1.00 0.00 C ATOM 706 CE1 TYR A 43 14.066 10.594 -13.813 1.00 0.00 C ATOM 707 CE2 TYR A 43 13.868 9.388 -15.870 1.00 0.00 C ATOM 708 CZ TYR A 43 13.308 10.173 -14.883 1.00 0.00 C ATOM 709 OH TYR A 43 11.979 10.538 -14.969 1.00 0.00 O ATOM 0 H TYR A 43 17.467 8.968 -11.990 1.00 0.00 H new ATOM 0 HA TYR A 43 17.177 6.950 -14.115 1.00 0.00 H new ATOM 0 HB2 TYR A 43 18.014 9.893 -14.214 1.00 0.00 H new ATOM 0 HB3 TYR A 43 17.831 8.856 -15.615 1.00 0.00 H new ATOM 0 HD1 TYR A 43 15.985 10.565 -12.892 1.00 0.00 H new ATOM 0 HD2 TYR A 43 15.636 8.410 -16.555 1.00 0.00 H new ATOM 0 HE1 TYR A 43 13.623 11.207 -13.042 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.270 9.060 -16.707 1.00 0.00 H new ATOM 0 HH TYR A 43 11.588 10.160 -15.784 1.00 0.00 H new ATOM 719 N HIS A 44 19.754 6.982 -12.665 1.00 0.00 N ATOM 720 CA HIS A 44 21.173 6.616 -12.580 1.00 0.00 C ATOM 721 C HIS A 44 21.543 5.664 -13.735 1.00 0.00 C ATOM 722 O HIS A 44 21.035 4.544 -13.806 1.00 0.00 O ATOM 723 CB HIS A 44 21.463 5.950 -11.228 1.00 0.00 C ATOM 724 CG HIS A 44 22.906 5.986 -10.825 1.00 0.00 C ATOM 725 ND1 HIS A 44 23.743 4.898 -10.917 1.00 0.00 N ATOM 726 CD2 HIS A 44 23.655 6.988 -10.303 1.00 0.00 C ATOM 727 CE1 HIS A 44 24.944 5.229 -10.464 1.00 0.00 C ATOM 728 NE2 HIS A 44 24.913 6.487 -10.092 1.00 0.00 N ATOM 0 H HIS A 44 19.230 6.826 -11.804 1.00 0.00 H new ATOM 0 HA HIS A 44 21.778 7.519 -12.663 1.00 0.00 H new ATOM 0 HB2 HIS A 44 20.869 6.443 -10.458 1.00 0.00 H new ATOM 0 HB3 HIS A 44 21.134 4.912 -11.269 1.00 0.00 H new ATOM 0 HD2 HIS A 44 23.322 7.994 -10.093 1.00 0.00 H new ATOM 0 HE1 HIS A 44 25.802 4.575 -10.410 1.00 0.00 H new ATOM 0 HE2 HIS A 44 25.700 7.009 -9.707 1.00 0.00 H new ATOM 736 N PRO A 45 22.441 6.097 -14.647 1.00 0.00 N ATOM 737 CA PRO A 45 22.812 5.315 -15.841 1.00 0.00 C ATOM 738 C PRO A 45 23.495 3.992 -15.512 1.00 0.00 C ATOM 739 O PRO A 45 23.465 3.054 -16.308 1.00 0.00 O ATOM 740 CB PRO A 45 23.764 6.238 -16.601 1.00 0.00 C ATOM 741 CG PRO A 45 24.274 7.178 -15.575 1.00 0.00 C ATOM 742 CD PRO A 45 23.159 7.380 -14.593 1.00 0.00 C ATOM 0 HA PRO A 45 21.928 5.027 -16.411 1.00 0.00 H new ATOM 0 HB2 PRO A 45 24.576 5.676 -17.062 1.00 0.00 H new ATOM 0 HB3 PRO A 45 23.248 6.767 -17.402 1.00 0.00 H new ATOM 0 HG2 PRO A 45 25.157 6.772 -15.082 1.00 0.00 H new ATOM 0 HG3 PRO A 45 24.569 8.125 -16.028 1.00 0.00 H new ATOM 0 HD2 PRO A 45 23.535 7.591 -13.592 1.00 0.00 H new ATOM 0 HD3 PRO A 45 22.518 8.215 -14.875 1.00 0.00 H new ATOM 750 N ASP A 46 24.103 3.919 -14.346 1.00 0.00 N ATOM 751 CA ASP A 46 24.795 2.706 -13.915 1.00 0.00 C ATOM 752 C ASP A 46 23.811 1.727 -13.306 1.00 0.00 C ATOM 753 O ASP A 46 24.146 0.569 -13.038 1.00 0.00 O ATOM 754 CB ASP A 46 25.884 3.046 -12.902 1.00 0.00 C ATOM 755 CG ASP A 46 26.827 4.113 -13.404 1.00 0.00 C ATOM 756 OD1 ASP A 46 26.445 5.293 -13.383 1.00 0.00 O ATOM 757 OD2 ASP A 46 27.952 3.779 -13.828 1.00 0.00 O ATOM 0 H ASP A 46 24.136 4.684 -13.673 1.00 0.00 H new ATOM 0 HA ASP A 46 25.258 2.245 -14.788 1.00 0.00 H new ATOM 0 HB2 ASP A 46 25.421 3.382 -11.974 1.00 0.00 H new ATOM 0 HB3 ASP A 46 26.451 2.145 -12.667 1.00 0.00 H new ATOM 762 N LYS A 47 22.601 2.201 -13.077 1.00 0.00 N ATOM 763 CA LYS A 47 21.557 1.383 -12.486 1.00 0.00 C ATOM 764 C LYS A 47 20.524 1.025 -13.550 1.00 0.00 C ATOM 765 O LYS A 47 20.007 -0.088 -13.588 1.00 0.00 O ATOM 766 CB LYS A 47 20.898 2.145 -11.345 1.00 0.00 C ATOM 767 CG LYS A 47 20.060 1.286 -10.430 1.00 0.00 C ATOM 768 CD LYS A 47 19.544 2.099 -9.267 1.00 0.00 C ATOM 769 CE LYS A 47 18.772 1.243 -8.289 1.00 0.00 C ATOM 770 NZ LYS A 47 18.314 2.033 -7.127 1.00 0.00 N ATOM 0 H LYS A 47 22.315 3.156 -13.293 1.00 0.00 H new ATOM 0 HA LYS A 47 21.991 0.464 -12.093 1.00 0.00 H new ATOM 0 HB2 LYS A 47 21.673 2.636 -10.756 1.00 0.00 H new ATOM 0 HB3 LYS A 47 20.270 2.931 -11.763 1.00 0.00 H new ATOM 0 HG2 LYS A 47 19.223 0.862 -10.985 1.00 0.00 H new ATOM 0 HG3 LYS A 47 20.654 0.450 -10.062 1.00 0.00 H new ATOM 0 HD2 LYS A 47 20.381 2.574 -8.754 1.00 0.00 H new ATOM 0 HD3 LYS A 47 18.902 2.898 -9.637 1.00 0.00 H new ATOM 0 HE2 LYS A 47 17.912 0.799 -8.791 1.00 0.00 H new ATOM 0 HE3 LYS A 47 19.401 0.421 -7.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 17.788 1.418 -6.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 19.137 2.436 -6.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 17.695 2.802 -7.453 1.00 0.00 H new ATOM 784 N ASN A 48 20.242 1.986 -14.416 1.00 0.00 N ATOM 785 CA ASN A 48 19.343 1.784 -15.534 1.00 0.00 C ATOM 786 C ASN A 48 19.974 2.341 -16.787 1.00 0.00 C ATOM 787 O ASN A 48 19.844 3.530 -17.091 1.00 0.00 O ATOM 788 CB ASN A 48 17.983 2.444 -15.313 1.00 0.00 C ATOM 789 CG ASN A 48 17.182 1.814 -14.183 1.00 0.00 C ATOM 790 OD1 ASN A 48 16.448 0.846 -14.396 1.00 0.00 O ATOM 791 ND2 ASN A 48 17.288 2.371 -12.991 1.00 0.00 N ATOM 0 H ASN A 48 20.632 2.927 -14.361 1.00 0.00 H new ATOM 0 HA ASN A 48 19.174 0.712 -15.632 1.00 0.00 H new ATOM 0 HB2 ASN A 48 18.132 3.502 -15.097 1.00 0.00 H new ATOM 0 HB3 ASN A 48 17.405 2.385 -16.235 1.00 0.00 H new ATOM 0 HD21 ASN A 48 16.752 2.002 -12.206 1.00 0.00 H new ATOM 0 HD22 ASN A 48 17.906 3.171 -12.855 1.00 0.00 H new ATOM 798 N PRO A 49 20.683 1.495 -17.517 1.00 0.00 N ATOM 799 CA PRO A 49 21.384 1.875 -18.725 1.00 0.00 C ATOM 800 C PRO A 49 20.447 2.425 -19.799 1.00 0.00 C ATOM 801 O PRO A 49 20.829 3.281 -20.596 1.00 0.00 O ATOM 802 CB PRO A 49 22.020 0.567 -19.184 1.00 0.00 C ATOM 803 CG PRO A 49 21.246 -0.476 -18.518 1.00 0.00 C ATOM 804 CD PRO A 49 20.856 0.093 -17.224 1.00 0.00 C ATOM 0 HA PRO A 49 22.101 2.676 -18.546 1.00 0.00 H new ATOM 0 HB2 PRO A 49 21.973 0.463 -20.268 1.00 0.00 H new ATOM 0 HB3 PRO A 49 23.072 0.519 -18.904 1.00 0.00 H new ATOM 0 HG2 PRO A 49 20.370 -0.751 -19.106 1.00 0.00 H new ATOM 0 HG3 PRO A 49 21.839 -1.381 -18.386 1.00 0.00 H new ATOM 0 HD2 PRO A 49 19.937 -0.356 -16.848 1.00 0.00 H new ATOM 0 HD3 PRO A 49 21.623 -0.068 -16.466 1.00 0.00 H new ATOM 812 N ASN A 50 19.214 1.956 -19.789 1.00 0.00 N ATOM 813 CA ASN A 50 18.228 2.388 -20.773 1.00 0.00 C ATOM 814 C ASN A 50 17.672 3.755 -20.426 1.00 0.00 C ATOM 815 O ASN A 50 17.053 4.411 -21.264 1.00 0.00 O ATOM 816 CB ASN A 50 17.085 1.365 -20.901 1.00 0.00 C ATOM 817 CG ASN A 50 17.556 0.046 -21.484 1.00 0.00 C ATOM 818 OD1 ASN A 50 18.460 0.013 -22.321 1.00 0.00 O ATOM 819 ND2 ASN A 50 16.960 -1.045 -21.044 1.00 0.00 N ATOM 0 H ASN A 50 18.867 1.276 -19.113 1.00 0.00 H new ATOM 0 HA ASN A 50 18.736 2.457 -21.735 1.00 0.00 H new ATOM 0 HB2 ASN A 50 16.646 1.190 -19.919 1.00 0.00 H new ATOM 0 HB3 ASN A 50 16.299 1.779 -21.533 1.00 0.00 H new ATOM 0 HD21 ASN A 50 17.244 -1.959 -21.397 1.00 0.00 H new ATOM 0 HD22 ASN A 50 16.215 -0.975 -20.350 1.00 0.00 H new ATOM 826 N GLU A 51 17.894 4.192 -19.196 1.00 0.00 N ATOM 827 CA GLU A 51 17.416 5.495 -18.769 1.00 0.00 C ATOM 828 C GLU A 51 18.520 6.555 -18.867 1.00 0.00 C ATOM 829 O GLU A 51 18.279 7.737 -18.628 1.00 0.00 O ATOM 830 CB GLU A 51 16.862 5.437 -17.344 1.00 0.00 C ATOM 831 CG GLU A 51 15.686 4.482 -17.184 1.00 0.00 C ATOM 832 CD GLU A 51 14.583 4.744 -18.187 1.00 0.00 C ATOM 833 OE1 GLU A 51 14.056 5.875 -18.221 1.00 0.00 O ATOM 834 OE2 GLU A 51 14.247 3.819 -18.953 1.00 0.00 O ATOM 0 H GLU A 51 18.398 3.667 -18.482 1.00 0.00 H new ATOM 0 HA GLU A 51 16.609 5.782 -19.443 1.00 0.00 H new ATOM 0 HB2 GLU A 51 17.660 5.135 -16.665 1.00 0.00 H new ATOM 0 HB3 GLU A 51 16.550 6.437 -17.044 1.00 0.00 H new ATOM 0 HG2 GLU A 51 16.038 3.456 -17.296 1.00 0.00 H new ATOM 0 HG3 GLU A 51 15.284 4.573 -16.175 1.00 0.00 H new ATOM 841 N GLY A 52 19.726 6.129 -19.255 1.00 0.00 N ATOM 842 CA GLY A 52 20.856 7.043 -19.336 1.00 0.00 C ATOM 843 C GLY A 52 20.699 8.095 -20.420 1.00 0.00 C ATOM 844 O GLY A 52 21.279 9.176 -20.331 1.00 0.00 O ATOM 0 H GLY A 52 19.938 5.166 -19.514 1.00 0.00 H new ATOM 0 HA2 GLY A 52 20.984 7.539 -18.374 1.00 0.00 H new ATOM 0 HA3 GLY A 52 21.765 6.471 -19.523 1.00 0.00 H new ATOM 848 N GLU A 53 19.929 7.778 -21.453 1.00 0.00 N ATOM 849 CA GLU A 53 19.662 8.735 -22.519 1.00 0.00 C ATOM 850 C GLU A 53 18.876 9.917 -21.974 1.00 0.00 C ATOM 851 O GLU A 53 19.091 11.061 -22.368 1.00 0.00 O ATOM 852 CB GLU A 53 18.923 8.066 -23.682 1.00 0.00 C ATOM 853 CG GLU A 53 19.810 7.145 -24.509 1.00 0.00 C ATOM 854 CD GLU A 53 20.905 7.901 -25.237 1.00 0.00 C ATOM 855 OE1 GLU A 53 20.649 8.406 -26.349 1.00 0.00 O ATOM 856 OE2 GLU A 53 22.025 8.006 -24.698 1.00 0.00 O ATOM 0 H GLU A 53 19.480 6.870 -21.575 1.00 0.00 H new ATOM 0 HA GLU A 53 20.613 9.103 -22.904 1.00 0.00 H new ATOM 0 HB2 GLU A 53 18.083 7.493 -23.288 1.00 0.00 H new ATOM 0 HB3 GLU A 53 18.507 8.837 -24.331 1.00 0.00 H new ATOM 0 HG2 GLU A 53 20.260 6.396 -23.857 1.00 0.00 H new ATOM 0 HG3 GLU A 53 19.197 6.609 -25.234 1.00 0.00 H new ATOM 863 N LYS A 54 17.968 9.625 -21.057 1.00 0.00 N ATOM 864 CA LYS A 54 17.200 10.641 -20.394 1.00 0.00 C ATOM 865 C LYS A 54 18.117 11.452 -19.480 1.00 0.00 C ATOM 866 O LYS A 54 17.972 12.661 -19.327 1.00 0.00 O ATOM 867 CB LYS A 54 16.061 10.026 -19.592 1.00 0.00 C ATOM 868 CG LYS A 54 15.009 9.307 -20.431 1.00 0.00 C ATOM 869 CD LYS A 54 13.804 8.982 -19.598 1.00 0.00 C ATOM 870 CE LYS A 54 12.793 8.150 -20.374 1.00 0.00 C ATOM 871 NZ LYS A 54 13.301 6.777 -20.637 1.00 0.00 N ATOM 0 H LYS A 54 17.750 8.674 -20.758 1.00 0.00 H new ATOM 0 HA LYS A 54 16.762 11.298 -21.145 1.00 0.00 H new ATOM 0 HB2 LYS A 54 16.479 9.320 -18.875 1.00 0.00 H new ATOM 0 HB3 LYS A 54 15.573 10.813 -19.017 1.00 0.00 H new ATOM 0 HG2 LYS A 54 14.717 9.933 -21.274 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.430 8.391 -20.845 1.00 0.00 H new ATOM 0 HD2 LYS A 54 14.114 8.439 -18.705 1.00 0.00 H new ATOM 0 HD3 LYS A 54 13.334 9.906 -19.262 1.00 0.00 H new ATOM 0 HE2 LYS A 54 11.861 8.092 -19.812 1.00 0.00 H new ATOM 0 HE3 LYS A 54 12.565 8.642 -21.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 12.499 6.119 -20.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 13.843 6.771 -21.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.917 6.479 -19.854 1.00 0.00 H new ATOM 885 N PHE A 55 19.069 10.749 -18.876 1.00 0.00 N ATOM 886 CA PHE A 55 20.027 11.339 -17.951 1.00 0.00 C ATOM 887 C PHE A 55 20.940 12.335 -18.659 1.00 0.00 C ATOM 888 O PHE A 55 21.333 13.344 -18.075 1.00 0.00 O ATOM 889 CB PHE A 55 20.857 10.245 -17.271 1.00 0.00 C ATOM 890 CG PHE A 55 21.671 10.727 -16.101 1.00 0.00 C ATOM 891 CD1 PHE A 55 21.052 11.163 -14.938 1.00 0.00 C ATOM 892 CD2 PHE A 55 23.054 10.731 -16.159 1.00 0.00 C ATOM 893 CE1 PHE A 55 21.800 11.598 -13.858 1.00 0.00 C ATOM 894 CE2 PHE A 55 23.806 11.167 -15.081 1.00 0.00 C ATOM 895 CZ PHE A 55 23.180 11.599 -13.932 1.00 0.00 C ATOM 0 H PHE A 55 19.198 9.747 -19.016 1.00 0.00 H new ATOM 0 HA PHE A 55 19.466 11.881 -17.189 1.00 0.00 H new ATOM 0 HB2 PHE A 55 20.188 9.454 -16.933 1.00 0.00 H new ATOM 0 HB3 PHE A 55 21.527 9.802 -18.008 1.00 0.00 H new ATOM 0 HD1 PHE A 55 19.974 11.163 -14.875 1.00 0.00 H new ATOM 0 HD2 PHE A 55 23.552 10.390 -17.055 1.00 0.00 H new ATOM 0 HE1 PHE A 55 21.306 11.936 -12.959 1.00 0.00 H new ATOM 0 HE2 PHE A 55 24.884 11.168 -15.141 1.00 0.00 H new ATOM 0 HZ PHE A 55 23.767 11.938 -13.091 1.00 0.00 H new ATOM 905 N LYS A 56 21.275 12.047 -19.915 1.00 0.00 N ATOM 906 CA LYS A 56 22.122 12.939 -20.706 1.00 0.00 C ATOM 907 C LYS A 56 21.463 14.316 -20.778 1.00 0.00 C ATOM 908 O LYS A 56 22.124 15.347 -20.628 1.00 0.00 O ATOM 909 CB LYS A 56 22.303 12.381 -22.119 1.00 0.00 C ATOM 910 CG LYS A 56 23.273 13.177 -22.977 1.00 0.00 C ATOM 911 CD LYS A 56 23.372 12.603 -24.379 1.00 0.00 C ATOM 912 CE LYS A 56 24.356 13.388 -25.238 1.00 0.00 C ATOM 913 NZ LYS A 56 25.758 13.217 -24.781 1.00 0.00 N ATOM 0 H LYS A 56 20.974 11.205 -20.406 1.00 0.00 H new ATOM 0 HA LYS A 56 23.101 13.020 -20.234 1.00 0.00 H new ATOM 0 HB2 LYS A 56 22.655 11.352 -22.050 1.00 0.00 H new ATOM 0 HB3 LYS A 56 21.333 12.354 -22.615 1.00 0.00 H new ATOM 0 HG2 LYS A 56 22.947 14.216 -23.030 1.00 0.00 H new ATOM 0 HG3 LYS A 56 24.258 13.176 -22.511 1.00 0.00 H new ATOM 0 HD2 LYS A 56 23.686 11.561 -24.325 1.00 0.00 H new ATOM 0 HD3 LYS A 56 22.388 12.615 -24.848 1.00 0.00 H new ATOM 0 HE2 LYS A 56 24.271 13.062 -26.275 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.094 14.446 -25.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 26.403 13.655 -25.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 25.879 13.673 -23.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 25.975 12.203 -24.699 1.00 0.00 H new ATOM 927 N GLN A 57 20.146 14.307 -20.978 1.00 0.00 N ATOM 928 CA GLN A 57 19.341 15.501 -21.008 1.00 0.00 C ATOM 929 C GLN A 57 19.500 16.258 -19.703 1.00 0.00 C ATOM 930 O GLN A 57 19.733 17.476 -19.685 1.00 0.00 O ATOM 931 CB GLN A 57 17.888 15.082 -21.124 1.00 0.00 C ATOM 932 CG GLN A 57 17.532 14.370 -22.403 1.00 0.00 C ATOM 933 CD GLN A 57 16.107 13.847 -22.404 1.00 0.00 C ATOM 934 OE1 GLN A 57 15.207 14.451 -21.816 1.00 0.00 O ATOM 935 NE2 GLN A 57 15.895 12.711 -23.047 1.00 0.00 N ATOM 0 H GLN A 57 19.611 13.451 -21.125 1.00 0.00 H new ATOM 0 HA GLN A 57 19.647 16.131 -21.844 1.00 0.00 H new ATOM 0 HB2 GLN A 57 17.645 14.432 -20.284 1.00 0.00 H new ATOM 0 HB3 GLN A 57 17.261 15.969 -21.033 1.00 0.00 H new ATOM 0 HG2 GLN A 57 17.665 15.052 -23.243 1.00 0.00 H new ATOM 0 HG3 GLN A 57 18.220 13.539 -22.555 1.00 0.00 H new ATOM 0 HE21 GLN A 57 16.667 12.242 -23.521 1.00 0.00 H new ATOM 0 HE22 GLN A 57 14.960 12.304 -23.069 1.00 0.00 H new ATOM 944 N ILE A 58 19.389 15.513 -18.613 1.00 0.00 N ATOM 945 CA ILE A 58 19.457 16.068 -17.283 1.00 0.00 C ATOM 946 C ILE A 58 20.814 16.695 -17.018 1.00 0.00 C ATOM 947 O ILE A 58 20.894 17.810 -16.533 1.00 0.00 O ATOM 948 CB ILE A 58 19.200 14.972 -16.226 1.00 0.00 C ATOM 949 CG1 ILE A 58 17.785 14.438 -16.343 1.00 0.00 C ATOM 950 CG2 ILE A 58 19.418 15.519 -14.844 1.00 0.00 C ATOM 951 CD1 ILE A 58 17.515 13.219 -15.483 1.00 0.00 C ATOM 0 H ILE A 58 19.249 14.503 -18.634 1.00 0.00 H new ATOM 0 HA ILE A 58 18.689 16.838 -17.212 1.00 0.00 H new ATOM 0 HB ILE A 58 19.901 14.157 -16.405 1.00 0.00 H new ATOM 0 HG12 ILE A 58 17.085 15.227 -16.067 1.00 0.00 H new ATOM 0 HG13 ILE A 58 17.587 14.186 -17.385 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.233 14.735 -14.109 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.446 15.870 -14.750 1.00 0.00 H new ATOM 0 HG23 ILE A 58 18.734 16.349 -14.669 1.00 0.00 H new ATOM 0 HD11 ILE A 58 16.483 12.897 -15.622 1.00 0.00 H new ATOM 0 HD12 ILE A 58 18.189 12.413 -15.773 1.00 0.00 H new ATOM 0 HD13 ILE A 58 17.679 13.470 -14.435 1.00 0.00 H new ATOM 963 N SER A 59 21.872 15.979 -17.363 1.00 0.00 N ATOM 964 CA SER A 59 23.227 16.453 -17.126 1.00 0.00 C ATOM 965 C SER A 59 23.525 17.771 -17.861 1.00 0.00 C ATOM 966 O SER A 59 24.158 18.662 -17.302 1.00 0.00 O ATOM 967 CB SER A 59 24.245 15.376 -17.503 1.00 0.00 C ATOM 968 OG SER A 59 24.074 14.211 -16.700 1.00 0.00 O ATOM 0 H SER A 59 21.818 15.064 -17.810 1.00 0.00 H new ATOM 0 HA SER A 59 23.313 16.661 -16.060 1.00 0.00 H new ATOM 0 HB2 SER A 59 24.133 15.117 -18.556 1.00 0.00 H new ATOM 0 HB3 SER A 59 25.255 15.765 -17.376 1.00 0.00 H new ATOM 0 HG SER A 59 23.246 13.755 -16.958 1.00 0.00 H new ATOM 974 N GLN A 60 23.072 17.888 -19.107 1.00 0.00 N ATOM 975 CA GLN A 60 23.305 19.083 -19.896 1.00 0.00 C ATOM 976 C GLN A 60 22.519 20.267 -19.355 1.00 0.00 C ATOM 977 O GLN A 60 23.084 21.354 -19.102 1.00 0.00 O ATOM 978 CB GLN A 60 22.933 18.809 -21.328 1.00 0.00 C ATOM 979 CG GLN A 60 23.772 17.723 -21.975 1.00 0.00 C ATOM 980 CD GLN A 60 23.423 17.493 -23.433 1.00 0.00 C ATOM 981 OE1 GLN A 60 22.528 16.717 -23.757 1.00 0.00 O ATOM 982 NE2 GLN A 60 24.131 18.167 -24.322 1.00 0.00 N ATOM 0 H GLN A 60 22.540 17.163 -19.589 1.00 0.00 H new ATOM 0 HA GLN A 60 24.362 19.343 -19.836 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.883 18.521 -21.373 1.00 0.00 H new ATOM 0 HB3 GLN A 60 23.036 19.729 -21.904 1.00 0.00 H new ATOM 0 HG2 GLN A 60 24.826 17.991 -21.897 1.00 0.00 H new ATOM 0 HG3 GLN A 60 23.639 16.792 -21.424 1.00 0.00 H new ATOM 0 HE21 GLN A 60 24.866 18.802 -24.013 1.00 0.00 H new ATOM 0 HE22 GLN A 60 23.942 18.052 -25.318 1.00 0.00 H new ATOM 991 N ALA A 61 21.230 20.066 -19.151 1.00 0.00 N ATOM 992 CA ALA A 61 20.389 21.121 -18.619 1.00 0.00 C ATOM 993 C ALA A 61 20.881 21.516 -17.244 1.00 0.00 C ATOM 994 O ALA A 61 21.024 22.692 -16.959 1.00 0.00 O ATOM 995 CB ALA A 61 18.926 20.693 -18.594 1.00 0.00 C ATOM 0 H ALA A 61 20.746 19.189 -19.344 1.00 0.00 H new ATOM 0 HA ALA A 61 20.453 21.993 -19.270 1.00 0.00 H new ATOM 0 HB1 ALA A 61 18.317 21.502 -18.191 1.00 0.00 H new ATOM 0 HB2 ALA A 61 18.597 20.462 -19.607 1.00 0.00 H new ATOM 0 HB3 ALA A 61 18.816 19.809 -17.966 1.00 0.00 H new ATOM 1001 N TYR A 62 21.184 20.522 -16.405 1.00 0.00 N ATOM 1002 CA TYR A 62 21.738 20.791 -15.096 1.00 0.00 C ATOM 1003 C TYR A 62 23.094 21.498 -15.192 1.00 0.00 C ATOM 1004 O TYR A 62 23.474 22.209 -14.291 1.00 0.00 O ATOM 1005 CB TYR A 62 21.887 19.521 -14.253 1.00 0.00 C ATOM 1006 CG TYR A 62 22.462 19.811 -12.880 1.00 0.00 C ATOM 1007 CD1 TYR A 62 21.726 20.521 -11.937 1.00 0.00 C ATOM 1008 CD2 TYR A 62 23.747 19.398 -12.533 1.00 0.00 C ATOM 1009 CE1 TYR A 62 22.250 20.814 -10.694 1.00 0.00 C ATOM 1010 CE2 TYR A 62 24.275 19.683 -11.287 1.00 0.00 C ATOM 1011 CZ TYR A 62 23.524 20.391 -10.372 1.00 0.00 C ATOM 1012 OH TYR A 62 24.052 20.692 -9.133 1.00 0.00 O ATOM 0 H TYR A 62 21.052 19.533 -16.616 1.00 0.00 H new ATOM 0 HA TYR A 62 21.025 21.450 -14.600 1.00 0.00 H new ATOM 0 HB2 TYR A 62 20.914 19.043 -14.144 1.00 0.00 H new ATOM 0 HB3 TYR A 62 22.533 18.814 -14.774 1.00 0.00 H new ATOM 0 HD1 TYR A 62 20.727 20.849 -12.182 1.00 0.00 H new ATOM 0 HD2 TYR A 62 24.340 18.847 -13.248 1.00 0.00 H new ATOM 0 HE1 TYR A 62 21.666 21.372 -9.977 1.00 0.00 H new ATOM 0 HE2 TYR A 62 25.271 19.353 -11.032 1.00 0.00 H new ATOM 0 HH TYR A 62 24.957 20.322 -9.064 1.00 0.00 H new ATOM 1022 N GLU A 63 23.824 21.294 -16.288 1.00 0.00 N ATOM 1023 CA GLU A 63 25.129 21.920 -16.441 1.00 0.00 C ATOM 1024 C GLU A 63 25.007 23.422 -16.323 1.00 0.00 C ATOM 1025 O GLU A 63 25.759 24.066 -15.602 1.00 0.00 O ATOM 1026 CB GLU A 63 25.775 21.526 -17.766 1.00 0.00 C ATOM 1027 CG GLU A 63 27.165 22.087 -17.961 1.00 0.00 C ATOM 1028 CD GLU A 63 28.131 21.626 -16.897 1.00 0.00 C ATOM 1029 OE1 GLU A 63 28.349 20.407 -16.783 1.00 0.00 O ATOM 1030 OE2 GLU A 63 28.684 22.487 -16.184 1.00 0.00 O ATOM 0 H GLU A 63 23.536 20.708 -17.071 1.00 0.00 H new ATOM 0 HA GLU A 63 25.777 21.563 -15.640 1.00 0.00 H new ATOM 0 HB2 GLU A 63 25.821 20.439 -17.827 1.00 0.00 H new ATOM 0 HB3 GLU A 63 25.139 21.865 -18.584 1.00 0.00 H new ATOM 0 HG2 GLU A 63 27.539 21.789 -18.940 1.00 0.00 H new ATOM 0 HG3 GLU A 63 27.117 23.176 -17.956 1.00 0.00 H new ATOM 1037 N VAL A 64 24.066 23.965 -17.030 1.00 0.00 N ATOM 1038 CA VAL A 64 23.759 25.384 -16.944 1.00 0.00 C ATOM 1039 C VAL A 64 22.828 25.697 -15.743 1.00 0.00 C ATOM 1040 O VAL A 64 23.017 26.689 -15.054 1.00 0.00 O ATOM 1041 CB VAL A 64 23.183 25.883 -18.288 1.00 0.00 C ATOM 1042 CG1 VAL A 64 22.862 24.716 -19.191 1.00 0.00 C ATOM 1043 CG2 VAL A 64 21.975 26.731 -18.082 1.00 0.00 C ATOM 0 H VAL A 64 23.481 23.449 -17.687 1.00 0.00 H new ATOM 0 HA VAL A 64 24.683 25.931 -16.756 1.00 0.00 H new ATOM 0 HB VAL A 64 23.944 26.499 -18.768 1.00 0.00 H new ATOM 0 HG11 VAL A 64 22.457 25.086 -20.133 1.00 0.00 H new ATOM 0 HG12 VAL A 64 23.770 24.146 -19.385 1.00 0.00 H new ATOM 0 HG13 VAL A 64 22.126 24.073 -18.707 1.00 0.00 H new ATOM 0 HG21 VAL A 64 21.596 27.065 -19.048 1.00 0.00 H new ATOM 0 HG22 VAL A 64 21.206 26.151 -17.571 1.00 0.00 H new ATOM 0 HG23 VAL A 64 22.238 27.598 -17.476 1.00 0.00 H new ATOM 1053 N LEU A 65 21.854 24.821 -15.491 1.00 0.00 N ATOM 1054 CA LEU A 65 20.883 24.990 -14.386 1.00 0.00 C ATOM 1055 C LEU A 65 21.542 24.846 -13.008 1.00 0.00 C ATOM 1056 O LEU A 65 20.939 25.159 -11.994 1.00 0.00 O ATOM 1057 CB LEU A 65 19.696 24.011 -14.536 1.00 0.00 C ATOM 1058 CG LEU A 65 18.466 24.518 -15.342 1.00 0.00 C ATOM 1059 CD1 LEU A 65 18.853 25.053 -16.715 1.00 0.00 C ATOM 1060 CD2 LEU A 65 17.431 23.406 -15.493 1.00 0.00 C ATOM 0 H LEU A 65 21.708 23.974 -16.040 1.00 0.00 H new ATOM 0 HA LEU A 65 20.499 26.008 -14.452 1.00 0.00 H new ATOM 0 HB2 LEU A 65 20.063 23.102 -15.013 1.00 0.00 H new ATOM 0 HB3 LEU A 65 19.357 23.733 -13.538 1.00 0.00 H new ATOM 0 HG LEU A 65 18.035 25.344 -14.776 1.00 0.00 H new ATOM 0 HD11 LEU A 65 17.959 25.394 -17.238 1.00 0.00 H new ATOM 0 HD12 LEU A 65 19.546 25.886 -16.599 1.00 0.00 H new ATOM 0 HD13 LEU A 65 19.331 24.262 -17.292 1.00 0.00 H new ATOM 0 HD21 LEU A 65 16.577 23.778 -16.059 1.00 0.00 H new ATOM 0 HD22 LEU A 65 17.877 22.563 -16.021 1.00 0.00 H new ATOM 0 HD23 LEU A 65 17.099 23.082 -14.507 1.00 0.00 H new ATOM 1072 N SER A 66 22.775 24.368 -12.977 1.00 0.00 N ATOM 1073 CA SER A 66 23.487 24.198 -11.724 1.00 0.00 C ATOM 1074 C SER A 66 23.884 25.539 -11.136 1.00 0.00 C ATOM 1075 O SER A 66 24.163 25.645 -9.943 1.00 0.00 O ATOM 1076 CB SER A 66 24.724 23.317 -11.921 1.00 0.00 C ATOM 1077 OG SER A 66 25.591 23.852 -12.910 1.00 0.00 O ATOM 0 H SER A 66 23.302 24.091 -13.805 1.00 0.00 H new ATOM 0 HA SER A 66 22.815 23.704 -11.022 1.00 0.00 H new ATOM 0 HB2 SER A 66 25.260 23.225 -10.977 1.00 0.00 H new ATOM 0 HB3 SER A 66 24.415 22.313 -12.211 1.00 0.00 H new ATOM 0 HG SER A 66 25.235 23.651 -13.801 1.00 0.00 H new ATOM 1083 N ASP A 67 23.899 26.560 -11.975 1.00 0.00 N ATOM 1084 CA ASP A 67 24.256 27.889 -11.537 1.00 0.00 C ATOM 1085 C ASP A 67 23.361 28.908 -12.216 1.00 0.00 C ATOM 1086 O ASP A 67 23.213 28.897 -13.440 1.00 0.00 O ATOM 1087 CB ASP A 67 25.726 28.185 -11.839 1.00 0.00 C ATOM 1088 CG ASP A 67 26.213 29.432 -11.134 1.00 0.00 C ATOM 1089 OD1 ASP A 67 25.965 30.543 -11.643 1.00 0.00 O ATOM 1090 OD2 ASP A 67 26.844 29.309 -10.066 1.00 0.00 O ATOM 0 H ASP A 67 23.667 26.489 -12.966 1.00 0.00 H new ATOM 0 HA ASP A 67 24.115 27.951 -10.458 1.00 0.00 H new ATOM 0 HB2 ASP A 67 26.336 27.335 -11.534 1.00 0.00 H new ATOM 0 HB3 ASP A 67 25.858 28.302 -12.915 1.00 0.00 H new ATOM 1095 N ALA A 68 22.771 29.785 -11.421 1.00 0.00 N ATOM 1096 CA ALA A 68 21.841 30.798 -11.916 1.00 0.00 C ATOM 1097 C ALA A 68 22.441 31.631 -13.047 1.00 0.00 C ATOM 1098 O ALA A 68 21.726 32.086 -13.940 1.00 0.00 O ATOM 1099 CB ALA A 68 21.400 31.703 -10.780 1.00 0.00 C ATOM 0 H ALA A 68 22.920 29.818 -10.413 1.00 0.00 H new ATOM 0 HA ALA A 68 20.976 30.273 -12.322 1.00 0.00 H new ATOM 0 HB1 ALA A 68 20.707 32.454 -11.161 1.00 0.00 H new ATOM 0 HB2 ALA A 68 20.905 31.108 -10.012 1.00 0.00 H new ATOM 0 HB3 ALA A 68 22.271 32.198 -10.350 1.00 0.00 H new ATOM 1105 N LYS A 69 23.752 31.816 -13.014 1.00 0.00 N ATOM 1106 CA LYS A 69 24.417 32.637 -13.999 1.00 0.00 C ATOM 1107 C LYS A 69 24.402 31.976 -15.366 1.00 0.00 C ATOM 1108 O LYS A 69 24.091 32.616 -16.366 1.00 0.00 O ATOM 1109 CB LYS A 69 25.841 32.971 -13.559 1.00 0.00 C ATOM 1110 CG LYS A 69 26.569 33.915 -14.497 1.00 0.00 C ATOM 1111 CD LYS A 69 27.925 34.313 -13.948 1.00 0.00 C ATOM 1112 CE LYS A 69 28.635 35.268 -14.889 1.00 0.00 C ATOM 1113 NZ LYS A 69 29.940 35.713 -14.348 1.00 0.00 N ATOM 0 H LYS A 69 24.371 31.407 -12.314 1.00 0.00 H new ATOM 0 HA LYS A 69 23.866 33.574 -14.082 1.00 0.00 H new ATOM 0 HB2 LYS A 69 25.808 33.416 -12.565 1.00 0.00 H new ATOM 0 HB3 LYS A 69 26.411 32.046 -13.476 1.00 0.00 H new ATOM 0 HG2 LYS A 69 26.695 33.437 -15.469 1.00 0.00 H new ATOM 0 HG3 LYS A 69 25.964 34.808 -14.657 1.00 0.00 H new ATOM 0 HD2 LYS A 69 27.802 34.783 -12.972 1.00 0.00 H new ATOM 0 HD3 LYS A 69 28.536 33.423 -13.799 1.00 0.00 H new ATOM 0 HE2 LYS A 69 28.789 34.781 -15.852 1.00 0.00 H new ATOM 0 HE3 LYS A 69 28.002 36.137 -15.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 30.391 36.364 -15.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 29.792 36.201 -13.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 30.554 34.887 -14.200 1.00 0.00 H new ATOM 1127 N LYS A 70 24.717 30.682 -15.406 1.00 0.00 N ATOM 1128 CA LYS A 70 24.739 29.955 -16.643 1.00 0.00 C ATOM 1129 C LYS A 70 23.332 29.873 -17.200 1.00 0.00 C ATOM 1130 O LYS A 70 23.117 29.984 -18.409 1.00 0.00 O ATOM 1131 CB LYS A 70 25.320 28.578 -16.406 1.00 0.00 C ATOM 1132 CG LYS A 70 26.735 28.633 -15.845 1.00 0.00 C ATOM 1133 CD LYS A 70 27.282 27.256 -15.547 1.00 0.00 C ATOM 1134 CE LYS A 70 27.481 26.456 -16.814 1.00 0.00 C ATOM 1135 NZ LYS A 70 28.189 25.185 -16.547 1.00 0.00 N ATOM 0 H LYS A 70 24.959 30.127 -14.585 1.00 0.00 H new ATOM 0 HA LYS A 70 25.366 30.468 -17.372 1.00 0.00 H new ATOM 0 HB2 LYS A 70 24.679 28.030 -15.715 1.00 0.00 H new ATOM 0 HB3 LYS A 70 25.325 28.023 -17.344 1.00 0.00 H new ATOM 0 HG2 LYS A 70 27.388 29.136 -16.558 1.00 0.00 H new ATOM 0 HG3 LYS A 70 26.740 29.230 -14.933 1.00 0.00 H new ATOM 0 HD2 LYS A 70 28.231 27.346 -15.019 1.00 0.00 H new ATOM 0 HD3 LYS A 70 26.598 26.726 -14.884 1.00 0.00 H new ATOM 0 HE2 LYS A 70 26.513 26.246 -17.269 1.00 0.00 H new ATOM 0 HE3 LYS A 70 28.049 27.046 -17.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 28.634 24.845 -17.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 28.921 25.340 -15.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 27.510 24.475 -16.206 1.00 0.00 H new ATOM 1149 N ARG A 71 22.373 29.691 -16.293 1.00 0.00 N ATOM 1150 CA ARG A 71 20.957 29.658 -16.643 1.00 0.00 C ATOM 1151 C ARG A 71 20.545 30.955 -17.324 1.00 0.00 C ATOM 1152 O ARG A 71 19.833 30.945 -18.332 1.00 0.00 O ATOM 1153 CB ARG A 71 20.093 29.461 -15.386 1.00 0.00 C ATOM 1154 CG ARG A 71 18.599 29.426 -15.683 1.00 0.00 C ATOM 1155 CD ARG A 71 17.762 29.345 -14.418 1.00 0.00 C ATOM 1156 NE ARG A 71 16.329 29.423 -14.719 1.00 0.00 N ATOM 1157 CZ ARG A 71 15.414 30.019 -13.946 1.00 0.00 C ATOM 1158 NH1 ARG A 71 15.766 30.582 -12.789 1.00 0.00 N ATOM 1159 NH2 ARG A 71 14.148 30.062 -14.341 1.00 0.00 N ATOM 0 H ARG A 71 22.557 29.563 -15.298 1.00 0.00 H new ATOM 0 HA ARG A 71 20.803 28.822 -17.325 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.381 28.530 -14.897 1.00 0.00 H new ATOM 0 HB3 ARG A 71 20.298 30.268 -14.682 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.321 30.319 -16.243 1.00 0.00 H new ATOM 0 HG3 ARG A 71 18.377 28.569 -16.319 1.00 0.00 H new ATOM 0 HD2 ARG A 71 17.976 28.411 -13.898 1.00 0.00 H new ATOM 0 HD3 ARG A 71 18.039 30.156 -13.744 1.00 0.00 H new ATOM 0 HE ARG A 71 16.005 28.990 -15.584 1.00 0.00 H new ATOM 0 HH11 ARG A 71 16.740 30.560 -12.487 1.00 0.00 H new ATOM 0 HH12 ARG A 71 15.061 31.034 -12.207 1.00 0.00 H new ATOM 0 HH21 ARG A 71 13.877 29.642 -15.230 1.00 0.00 H new ATOM 0 HH22 ARG A 71 13.446 30.515 -13.756 1.00 0.00 H new ATOM 1173 N GLU A 72 21.025 32.062 -16.782 1.00 0.00 N ATOM 1174 CA GLU A 72 20.651 33.358 -17.242 1.00 0.00 C ATOM 1175 C GLU A 72 21.205 33.606 -18.632 1.00 0.00 C ATOM 1176 O GLU A 72 20.503 34.097 -19.513 1.00 0.00 O ATOM 1177 CB GLU A 72 21.179 34.398 -16.261 1.00 0.00 C ATOM 1178 CG GLU A 72 20.769 35.808 -16.572 1.00 0.00 C ATOM 1179 CD GLU A 72 19.283 36.046 -16.380 1.00 0.00 C ATOM 1180 OE1 GLU A 72 18.802 35.931 -15.236 1.00 0.00 O ATOM 1181 OE2 GLU A 72 18.595 36.370 -17.367 1.00 0.00 O ATOM 0 H GLU A 72 21.688 32.070 -16.007 1.00 0.00 H new ATOM 0 HA GLU A 72 19.565 33.429 -17.298 1.00 0.00 H new ATOM 0 HB2 GLU A 72 20.832 34.144 -15.259 1.00 0.00 H new ATOM 0 HB3 GLU A 72 22.268 34.344 -16.244 1.00 0.00 H new ATOM 0 HG2 GLU A 72 21.327 36.493 -15.933 1.00 0.00 H new ATOM 0 HG3 GLU A 72 21.039 36.041 -17.602 1.00 0.00 H new ATOM 1188 N LEU A 73 22.462 33.242 -18.833 1.00 0.00 N ATOM 1189 CA LEU A 73 23.108 33.445 -20.102 1.00 0.00 C ATOM 1190 C LEU A 73 22.452 32.581 -21.173 1.00 0.00 C ATOM 1191 O LEU A 73 22.241 33.021 -22.306 1.00 0.00 O ATOM 1192 CB LEU A 73 24.585 33.083 -19.996 1.00 0.00 C ATOM 1193 CG LEU A 73 25.359 33.707 -18.830 1.00 0.00 C ATOM 1194 CD1 LEU A 73 26.843 33.447 -18.973 1.00 0.00 C ATOM 1195 CD2 LEU A 73 25.065 35.193 -18.693 1.00 0.00 C ATOM 0 H LEU A 73 23.050 32.803 -18.124 1.00 0.00 H new ATOM 0 HA LEU A 73 23.009 34.495 -20.379 1.00 0.00 H new ATOM 0 HB2 LEU A 73 24.666 31.999 -19.918 1.00 0.00 H new ATOM 0 HB3 LEU A 73 25.075 33.373 -20.925 1.00 0.00 H new ATOM 0 HG LEU A 73 25.020 33.229 -17.911 1.00 0.00 H new ATOM 0 HD11 LEU A 73 27.374 33.898 -18.135 1.00 0.00 H new ATOM 0 HD12 LEU A 73 27.025 32.372 -18.981 1.00 0.00 H new ATOM 0 HD13 LEU A 73 27.200 33.883 -19.906 1.00 0.00 H new ATOM 0 HD21 LEU A 73 25.632 35.600 -17.856 1.00 0.00 H new ATOM 0 HD22 LEU A 73 25.353 35.707 -19.610 1.00 0.00 H new ATOM 0 HD23 LEU A 73 24.000 35.338 -18.515 1.00 0.00 H new ATOM 1207 N TYR A 74 22.145 31.347 -20.799 1.00 0.00 N ATOM 1208 CA TYR A 74 21.538 30.387 -21.701 1.00 0.00 C ATOM 1209 C TYR A 74 20.163 30.861 -22.153 1.00 0.00 C ATOM 1210 O TYR A 74 19.848 30.857 -23.343 1.00 0.00 O ATOM 1211 CB TYR A 74 21.432 29.026 -21.011 1.00 0.00 C ATOM 1212 CG TYR A 74 21.232 27.859 -21.951 1.00 0.00 C ATOM 1213 CD1 TYR A 74 22.308 27.336 -22.652 1.00 0.00 C ATOM 1214 CD2 TYR A 74 19.986 27.272 -22.125 1.00 0.00 C ATOM 1215 CE1 TYR A 74 22.157 26.264 -23.500 1.00 0.00 C ATOM 1216 CE2 TYR A 74 19.823 26.196 -22.980 1.00 0.00 C ATOM 1217 CZ TYR A 74 20.913 25.697 -23.664 1.00 0.00 C ATOM 1218 OH TYR A 74 20.762 24.620 -24.506 1.00 0.00 O ATOM 0 H TYR A 74 22.311 30.986 -19.860 1.00 0.00 H new ATOM 0 HA TYR A 74 22.169 30.292 -22.585 1.00 0.00 H new ATOM 0 HB2 TYR A 74 22.338 28.856 -20.430 1.00 0.00 H new ATOM 0 HB3 TYR A 74 20.601 29.054 -20.306 1.00 0.00 H new ATOM 0 HD1 TYR A 74 23.285 27.780 -22.529 1.00 0.00 H new ATOM 0 HD2 TYR A 74 19.134 27.660 -21.587 1.00 0.00 H new ATOM 0 HE1 TYR A 74 23.009 25.869 -24.034 1.00 0.00 H new ATOM 0 HE2 TYR A 74 18.848 25.749 -23.111 1.00 0.00 H new ATOM 0 HH TYR A 74 19.816 24.370 -24.550 1.00 0.00 H new ATOM 1228 N ASP A 75 19.356 31.277 -21.190 1.00 0.00 N ATOM 1229 CA ASP A 75 18.002 31.765 -21.455 1.00 0.00 C ATOM 1230 C ASP A 75 18.033 33.047 -22.286 1.00 0.00 C ATOM 1231 O ASP A 75 17.153 33.291 -23.114 1.00 0.00 O ATOM 1232 CB ASP A 75 17.249 31.993 -20.136 1.00 0.00 C ATOM 1233 CG ASP A 75 15.843 32.516 -20.343 1.00 0.00 C ATOM 1234 OD1 ASP A 75 14.952 31.719 -20.712 1.00 0.00 O ATOM 1235 OD2 ASP A 75 15.616 33.718 -20.130 1.00 0.00 O ATOM 0 H ASP A 75 19.615 31.288 -20.204 1.00 0.00 H new ATOM 0 HA ASP A 75 17.473 31.006 -22.031 1.00 0.00 H new ATOM 0 HB2 ASP A 75 17.205 31.055 -19.582 1.00 0.00 H new ATOM 0 HB3 ASP A 75 17.807 32.700 -19.522 1.00 0.00 H new ATOM 1240 N LYS A 76 19.068 33.856 -22.065 1.00 0.00 N ATOM 1241 CA LYS A 76 19.229 35.130 -22.769 1.00 0.00 C ATOM 1242 C LYS A 76 19.791 34.906 -24.181 1.00 0.00 C ATOM 1243 O LYS A 76 19.890 35.841 -24.979 1.00 0.00 O ATOM 1244 CB LYS A 76 20.162 36.065 -21.970 1.00 0.00 C ATOM 1245 CG LYS A 76 20.315 37.464 -22.563 1.00 0.00 C ATOM 1246 CD LYS A 76 21.277 38.322 -21.754 1.00 0.00 C ATOM 1247 CE LYS A 76 21.414 39.723 -22.347 1.00 0.00 C ATOM 1248 NZ LYS A 76 20.124 40.462 -22.344 1.00 0.00 N ATOM 0 H LYS A 76 19.813 33.651 -21.399 1.00 0.00 H new ATOM 0 HA LYS A 76 18.248 35.597 -22.859 1.00 0.00 H new ATOM 0 HB2 LYS A 76 19.781 36.155 -20.953 1.00 0.00 H new ATOM 0 HB3 LYS A 76 21.147 35.603 -21.902 1.00 0.00 H new ATOM 0 HG2 LYS A 76 20.674 37.386 -23.589 1.00 0.00 H new ATOM 0 HG3 LYS A 76 19.340 37.950 -22.602 1.00 0.00 H new ATOM 0 HD2 LYS A 76 20.924 38.394 -20.725 1.00 0.00 H new ATOM 0 HD3 LYS A 76 22.255 37.842 -21.722 1.00 0.00 H new ATOM 0 HE2 LYS A 76 22.155 40.286 -21.779 1.00 0.00 H new ATOM 0 HE3 LYS A 76 21.786 39.649 -23.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 20.299 41.467 -22.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 19.496 40.068 -23.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 19.673 40.368 -21.412 1.00 0.00 H new ATOM 1262 N GLY A 77 20.163 33.668 -24.476 1.00 0.00 N ATOM 1263 CA GLY A 77 20.737 33.342 -25.767 1.00 0.00 C ATOM 1264 C GLY A 77 19.734 33.448 -26.898 1.00 0.00 C ATOM 1265 O GLY A 77 19.016 32.457 -27.155 1.00 0.00 O ATOM 1266 OXT GLY A 77 19.672 34.516 -27.549 1.00 0.00 O ATOM 0 H GLY A 77 20.076 32.877 -23.838 1.00 0.00 H new ATOM 0 HA2 GLY A 77 21.575 34.010 -25.966 1.00 0.00 H new ATOM 0 HA3 GLY A 77 21.138 32.329 -25.736 1.00 0.00 H new TER 1270 GLY A 77