USER MOD reduce.3.24.130724 H: found=0, std=0, add=998, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 998 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 82 CYS SG : rot 30:sc= -2.54! USER MOD Set 1.2: A 102 GLN :FLIP amide:sc= -4.64! C(o=-8.6!,f=-7.2!) USER MOD Set 2.1: A 49 GLN : amide:sc= -2.4! C(o=-7.3!,f=-7.7!) USER MOD Set 2.2: A 97 GLN :FLIP amide:sc= -4.91! C(o=-7.7!,f=-7.3!) USER MOD Set 3.1: A 50 GLN : amide:sc= -0.759 K(o=-0.64,f=-1.5!) USER MOD Set 3.2: A 56 THR OG1 : rot -24:sc= 0.119! USER MOD Set 4.1: A 45 HIS : no HD1:sc= -1.93 K(o=-3.8,f=-5.2) USER MOD Set 4.2: A 124 HIS : no HE2:sc= -1.9 K(o=-3.8,f=-6.1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= -0.413 X(o=-0.41,f=-0.21) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.008) USER MOD Single : A 7 HIS : no HD1:sc= -0.397 X(o=-0.4,f=-0.22) USER MOD Single : A 8 HIS : no HD1:sc= -0.545 X(o=-0.54,f=-0.44) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.425 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.21 X(o=-0.21,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.338 K(o=-0.34,f=-2.9!) USER MOD Single : A 21 HIS : no HD1:sc= -0.126 X(o=-0.13,f=-0.4) USER MOD Single : A 22 SER OG : rot 28:sc= 0.269 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 180:sc=0.000417 USER MOD Single : A 43 TYR OH : rot 6:sc= -3.79! USER MOD Single : A 52 ASN : amide:sc= -0.0672 K(o=-0.067,f=-1.9!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot -60:sc= -0.673 USER MOD Single : A 59 THR OG1 : rot 43:sc= 0.953 USER MOD Single : A 61 GLN : amide:sc= -3.85! C(o=-3.8!,f=-5.1!) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 154:sc= -0.113 (180deg=-0.73) USER MOD Single : A 71 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.101) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0666) USER MOD Single : A 78 LYS NZ :NH3+ -164:sc=-0.00454 (180deg=-0.0897) USER MOD Single : A 79 LYS NZ :NH3+ -146:sc= 1.22 (180deg=-0.866) USER MOD Single : A 83 ASN : amide:sc= -0.315 X(o=-0.31,f=-0.092) USER MOD Single : A 85 THR OG1 : rot -41:sc= 0.0135 USER MOD Single : A 89 HIS : no HD1:sc= -2.7 K(o=-2.7,f=-4.2!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= -0.288 K(o=-0.29,f=-2.7!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.33 X(o=-0.33,f=-0.46) USER MOD Single : A 107 CYS SG : rot -16:sc= -0.977 USER MOD Single : A 108 GLN :FLIP amide:sc= 0 F(o=-0.65,f=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 GLN : amide:sc= -3.49 X(o=-3.5,f=-4!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -31.811 -15.945 -29.105 1.00 0.00 N ATOM 2 CA MET A 1 -32.788 -15.936 -30.226 1.00 0.00 C ATOM 3 C MET A 1 -33.886 -14.905 -29.993 1.00 0.00 C ATOM 4 O MET A 1 -34.050 -13.969 -30.775 1.00 0.00 O ATOM 5 CB MET A 1 -33.393 -17.335 -30.356 1.00 0.00 C ATOM 6 CG MET A 1 -34.006 -17.608 -31.722 1.00 0.00 C ATOM 7 SD MET A 1 -35.746 -18.072 -31.626 1.00 0.00 S ATOM 8 CE MET A 1 -36.133 -18.294 -33.361 1.00 0.00 C ATOM 0 H1 MET A 1 -31.075 -16.656 -29.291 1.00 0.00 H new ATOM 0 H2 MET A 1 -31.371 -15.006 -29.020 1.00 0.00 H new ATOM 0 H3 MET A 1 -32.302 -16.179 -28.218 1.00 0.00 H new ATOM 0 HA MET A 1 -32.274 -15.662 -31.147 1.00 0.00 H new ATOM 0 HB2 MET A 1 -32.619 -18.077 -30.160 1.00 0.00 H new ATOM 0 HB3 MET A 1 -34.159 -17.463 -29.591 1.00 0.00 H new ATOM 0 HG2 MET A 1 -33.905 -16.719 -32.345 1.00 0.00 H new ATOM 0 HG3 MET A 1 -33.448 -18.406 -32.213 1.00 0.00 H new ATOM 0 HE1 MET A 1 -37.178 -18.584 -33.466 1.00 0.00 H new ATOM 0 HE2 MET A 1 -35.960 -17.360 -33.895 1.00 0.00 H new ATOM 0 HE3 MET A 1 -35.496 -19.074 -33.779 1.00 0.00 H new ATOM 20 N ARG A 2 -34.638 -15.085 -28.911 1.00 0.00 N ATOM 21 CA ARG A 2 -35.722 -14.171 -28.572 1.00 0.00 C ATOM 22 C ARG A 2 -35.491 -13.538 -27.204 1.00 0.00 C ATOM 23 O ARG A 2 -36.054 -13.978 -26.201 1.00 0.00 O ATOM 24 CB ARG A 2 -37.063 -14.909 -28.585 1.00 0.00 C ATOM 25 CG ARG A 2 -38.222 -14.055 -29.070 1.00 0.00 C ATOM 26 CD ARG A 2 -39.339 -14.909 -29.648 1.00 0.00 C ATOM 27 NE ARG A 2 -40.295 -15.328 -28.625 1.00 0.00 N ATOM 28 CZ ARG A 2 -41.182 -14.512 -28.062 1.00 0.00 C ATOM 29 NH1 ARG A 2 -41.240 -13.235 -28.417 1.00 0.00 N ATOM 30 NH2 ARG A 2 -42.017 -14.975 -27.141 1.00 0.00 N ATOM 0 H ARG A 2 -34.516 -15.856 -28.254 1.00 0.00 H new ATOM 0 HA ARG A 2 -35.744 -13.379 -29.321 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -36.978 -15.788 -29.224 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -37.282 -15.266 -27.579 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -38.608 -13.460 -28.242 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -37.868 -13.356 -29.827 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -39.861 -14.347 -30.423 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -38.911 -15.790 -30.126 1.00 0.00 H new ATOM 0 HE ARG A 2 -40.281 -16.303 -28.325 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -40.602 -12.873 -29.126 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -41.923 -12.615 -27.981 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -41.979 -15.956 -26.865 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -42.697 -14.350 -26.709 1.00 0.00 H new ATOM 44 N GLY A 3 -34.659 -12.503 -27.169 1.00 0.00 N ATOM 45 CA GLY A 3 -34.366 -11.827 -25.919 1.00 0.00 C ATOM 46 C GLY A 3 -33.217 -10.847 -26.044 1.00 0.00 C ATOM 47 O GLY A 3 -32.482 -10.864 -27.031 1.00 0.00 O ATOM 0 H GLY A 3 -34.182 -12.120 -27.985 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -35.256 -11.297 -25.579 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -34.126 -12.568 -25.157 1.00 0.00 H new ATOM 51 N SER A 4 -33.060 -9.990 -25.039 1.00 0.00 N ATOM 52 CA SER A 4 -31.992 -8.999 -25.041 1.00 0.00 C ATOM 53 C SER A 4 -30.808 -9.473 -24.203 1.00 0.00 C ATOM 54 O SER A 4 -30.934 -9.687 -22.998 1.00 0.00 O ATOM 55 CB SER A 4 -32.508 -7.662 -24.506 1.00 0.00 C ATOM 56 OG SER A 4 -33.696 -7.271 -25.170 1.00 0.00 O ATOM 0 H SER A 4 -33.659 -9.963 -24.214 1.00 0.00 H new ATOM 0 HA SER A 4 -31.656 -8.866 -26.069 1.00 0.00 H new ATOM 0 HB2 SER A 4 -32.696 -7.744 -23.435 1.00 0.00 H new ATOM 0 HB3 SER A 4 -31.745 -6.895 -24.638 1.00 0.00 H new ATOM 0 HG SER A 4 -34.006 -6.415 -24.809 1.00 0.00 H new ATOM 62 N HIS A 5 -29.658 -9.631 -24.850 1.00 0.00 N ATOM 63 CA HIS A 5 -28.451 -10.079 -24.164 1.00 0.00 C ATOM 64 C HIS A 5 -27.226 -9.326 -24.674 1.00 0.00 C ATOM 65 O HIS A 5 -27.348 -8.345 -25.408 1.00 0.00 O ATOM 66 CB HIS A 5 -28.259 -11.585 -24.357 1.00 0.00 C ATOM 67 CG HIS A 5 -27.946 -12.316 -23.088 1.00 0.00 C ATOM 68 ND1 HIS A 5 -27.772 -13.683 -23.030 1.00 0.00 N ATOM 69 CD2 HIS A 5 -27.775 -11.862 -21.823 1.00 0.00 C ATOM 70 CE1 HIS A 5 -27.508 -14.038 -21.784 1.00 0.00 C ATOM 71 NE2 HIS A 5 -27.504 -12.952 -21.034 1.00 0.00 N ATOM 0 H HIS A 5 -29.536 -9.456 -25.847 1.00 0.00 H new ATOM 0 HA HIS A 5 -28.566 -9.869 -23.101 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -29.164 -12.005 -24.795 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -27.453 -11.752 -25.071 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -27.840 -10.835 -21.496 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -27.327 -15.045 -21.439 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -27.328 -12.927 -20.030 1.00 0.00 H new ATOM 80 N HIS A 6 -26.046 -9.791 -24.279 1.00 0.00 N ATOM 81 CA HIS A 6 -24.798 -9.162 -24.694 1.00 0.00 C ATOM 82 C HIS A 6 -24.097 -9.996 -25.764 1.00 0.00 C ATOM 83 O HIS A 6 -22.880 -10.175 -25.730 1.00 0.00 O ATOM 84 CB HIS A 6 -23.876 -8.970 -23.485 1.00 0.00 C ATOM 85 CG HIS A 6 -23.417 -7.556 -23.303 1.00 0.00 C ATOM 86 ND1 HIS A 6 -23.616 -6.846 -22.138 1.00 0.00 N ATOM 87 CD2 HIS A 6 -22.764 -6.721 -24.145 1.00 0.00 C ATOM 88 CE1 HIS A 6 -23.107 -5.633 -22.272 1.00 0.00 C ATOM 89 NE2 HIS A 6 -22.584 -5.533 -23.480 1.00 0.00 N ATOM 0 H HIS A 6 -25.928 -10.602 -23.672 1.00 0.00 H new ATOM 0 HA HIS A 6 -25.032 -8.187 -25.121 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -24.399 -9.293 -22.585 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -23.005 -9.615 -23.596 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -22.444 -6.947 -25.152 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -23.117 -4.857 -21.521 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -22.121 -4.707 -23.858 1.00 0.00 H new ATOM 98 N HIS A 7 -24.876 -10.505 -26.713 1.00 0.00 N ATOM 99 CA HIS A 7 -24.331 -11.321 -27.793 1.00 0.00 C ATOM 100 C HIS A 7 -23.580 -10.461 -28.805 1.00 0.00 C ATOM 101 O HIS A 7 -22.391 -10.667 -29.047 1.00 0.00 O ATOM 102 CB HIS A 7 -25.454 -12.092 -28.491 1.00 0.00 C ATOM 103 CG HIS A 7 -25.120 -13.527 -28.755 1.00 0.00 C ATOM 104 ND1 HIS A 7 -25.811 -14.308 -29.658 1.00 0.00 N ATOM 105 CD2 HIS A 7 -24.159 -14.325 -28.229 1.00 0.00 C ATOM 106 CE1 HIS A 7 -25.291 -15.523 -29.676 1.00 0.00 C ATOM 107 NE2 HIS A 7 -24.288 -15.559 -28.818 1.00 0.00 N ATOM 0 H HIS A 7 -25.886 -10.367 -26.756 1.00 0.00 H new ATOM 0 HA HIS A 7 -23.627 -12.030 -27.359 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -26.353 -12.044 -27.877 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -25.687 -11.602 -29.436 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -23.428 -14.043 -27.485 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -25.629 -16.346 -30.288 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -23.703 -16.372 -28.624 1.00 0.00 H new ATOM 116 N HIS A 8 -24.283 -9.498 -29.394 1.00 0.00 N ATOM 117 CA HIS A 8 -23.681 -8.608 -30.381 1.00 0.00 C ATOM 118 C HIS A 8 -23.210 -9.390 -31.603 1.00 0.00 C ATOM 119 O HIS A 8 -23.499 -10.579 -31.739 1.00 0.00 O ATOM 120 CB HIS A 8 -22.506 -7.845 -29.765 1.00 0.00 C ATOM 121 CG HIS A 8 -22.405 -6.424 -30.228 1.00 0.00 C ATOM 122 ND1 HIS A 8 -21.371 -5.587 -29.867 1.00 0.00 N ATOM 123 CD2 HIS A 8 -23.216 -5.694 -31.030 1.00 0.00 C ATOM 124 CE1 HIS A 8 -21.552 -4.402 -30.425 1.00 0.00 C ATOM 125 NE2 HIS A 8 -22.663 -4.442 -31.136 1.00 0.00 N ATOM 0 H HIS A 8 -25.268 -9.314 -29.205 1.00 0.00 H new ATOM 0 HA HIS A 8 -24.441 -7.894 -30.699 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -22.604 -7.859 -28.679 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -21.579 -8.364 -30.008 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -24.128 -6.033 -31.499 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -20.901 -3.547 -30.317 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -23.049 -3.668 -31.677 1.00 0.00 H new ATOM 134 N HIS A 9 -22.485 -8.716 -32.490 1.00 0.00 N ATOM 135 CA HIS A 9 -21.976 -9.350 -33.701 1.00 0.00 C ATOM 136 C HIS A 9 -20.689 -8.677 -34.171 1.00 0.00 C ATOM 137 O HIS A 9 -19.594 -9.203 -33.973 1.00 0.00 O ATOM 138 CB HIS A 9 -23.029 -9.299 -34.810 1.00 0.00 C ATOM 139 CG HIS A 9 -23.860 -10.541 -34.907 1.00 0.00 C ATOM 140 ND1 HIS A 9 -23.413 -11.699 -35.507 1.00 0.00 N ATOM 141 CD2 HIS A 9 -25.116 -10.803 -34.476 1.00 0.00 C ATOM 142 CE1 HIS A 9 -24.360 -12.620 -35.443 1.00 0.00 C ATOM 143 NE2 HIS A 9 -25.402 -12.101 -34.821 1.00 0.00 N ATOM 0 H HIS A 9 -22.237 -7.731 -32.393 1.00 0.00 H new ATOM 0 HA HIS A 9 -21.754 -10.392 -33.469 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -23.685 -8.446 -34.637 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -22.531 -9.130 -35.765 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -25.771 -10.119 -33.957 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -24.292 -13.625 -35.833 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -26.278 -12.586 -34.628 1.00 0.00 H new ATOM 152 N HIS A 10 -20.831 -7.512 -34.795 1.00 0.00 N ATOM 153 CA HIS A 10 -19.680 -6.768 -35.294 1.00 0.00 C ATOM 154 C HIS A 10 -18.892 -6.147 -34.145 1.00 0.00 C ATOM 155 O HIS A 10 -19.205 -5.048 -33.689 1.00 0.00 O ATOM 156 CB HIS A 10 -20.134 -5.677 -36.265 1.00 0.00 C ATOM 157 CG HIS A 10 -19.120 -5.348 -37.315 1.00 0.00 C ATOM 158 ND1 HIS A 10 -18.536 -4.104 -37.433 1.00 0.00 N ATOM 159 CD2 HIS A 10 -18.584 -6.108 -38.300 1.00 0.00 C ATOM 160 CE1 HIS A 10 -17.686 -4.114 -38.446 1.00 0.00 C ATOM 161 NE2 HIS A 10 -17.697 -5.317 -38.987 1.00 0.00 N ATOM 0 H HIS A 10 -21.731 -7.063 -34.967 1.00 0.00 H new ATOM 0 HA HIS A 10 -19.029 -7.466 -35.821 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -21.057 -5.995 -36.750 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -20.366 -4.774 -35.701 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -18.812 -7.143 -38.506 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -17.085 -3.279 -38.775 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -17.137 -5.612 -39.787 1.00 0.00 H new ATOM 170 N THR A 11 -17.869 -6.859 -33.683 1.00 0.00 N ATOM 171 CA THR A 11 -17.036 -6.377 -32.587 1.00 0.00 C ATOM 172 C THR A 11 -15.574 -6.280 -33.014 1.00 0.00 C ATOM 173 O THR A 11 -15.077 -5.196 -33.319 1.00 0.00 O ATOM 174 CB THR A 11 -17.168 -7.300 -31.375 1.00 0.00 C ATOM 175 OG1 THR A 11 -16.949 -8.649 -31.747 1.00 0.00 O ATOM 176 CG2 THR A 11 -18.524 -7.221 -30.707 1.00 0.00 C ATOM 0 H THR A 11 -17.597 -7.771 -34.050 1.00 0.00 H new ATOM 0 HA THR A 11 -17.380 -5.380 -32.314 1.00 0.00 H new ATOM 0 HB THR A 11 -16.413 -6.958 -30.667 1.00 0.00 H new ATOM 0 HG1 THR A 11 -17.036 -9.224 -30.958 1.00 0.00 H new ATOM 0 HG21 THR A 11 -18.550 -7.900 -29.855 1.00 0.00 H new ATOM 0 HG22 THR A 11 -18.702 -6.202 -30.364 1.00 0.00 H new ATOM 0 HG23 THR A 11 -19.298 -7.504 -31.420 1.00 0.00 H new ATOM 184 N ASP A 12 -14.890 -7.421 -33.036 1.00 0.00 N ATOM 185 CA ASP A 12 -13.485 -7.463 -33.427 1.00 0.00 C ATOM 186 C ASP A 12 -12.645 -6.536 -32.547 1.00 0.00 C ATOM 187 O ASP A 12 -12.000 -5.612 -33.041 1.00 0.00 O ATOM 188 CB ASP A 12 -13.333 -7.069 -34.898 1.00 0.00 C ATOM 189 CG ASP A 12 -13.385 -8.267 -35.825 1.00 0.00 C ATOM 190 OD1 ASP A 12 -12.909 -9.350 -35.423 1.00 0.00 O ATOM 191 OD2 ASP A 12 -13.898 -8.123 -36.954 1.00 0.00 O ATOM 0 H ASP A 12 -15.286 -8.328 -32.788 1.00 0.00 H new ATOM 0 HA ASP A 12 -13.125 -8.483 -33.292 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -14.124 -6.370 -35.168 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -12.386 -6.547 -35.036 1.00 0.00 H new ATOM 196 N PRO A 13 -12.643 -6.775 -31.223 1.00 0.00 N ATOM 197 CA PRO A 13 -11.879 -5.959 -30.275 1.00 0.00 C ATOM 198 C PRO A 13 -10.377 -6.182 -30.398 1.00 0.00 C ATOM 199 O PRO A 13 -9.580 -5.285 -30.118 1.00 0.00 O ATOM 200 CB PRO A 13 -12.382 -6.434 -28.911 1.00 0.00 C ATOM 201 CG PRO A 13 -12.850 -7.829 -29.145 1.00 0.00 C ATOM 202 CD PRO A 13 -13.386 -7.858 -30.549 1.00 0.00 C ATOM 0 HA PRO A 13 -12.022 -4.892 -30.448 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -11.589 -6.402 -28.164 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -13.191 -5.801 -28.545 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -12.032 -8.540 -29.025 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -13.622 -8.107 -28.427 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -13.211 -8.822 -31.026 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -14.461 -7.682 -30.572 1.00 0.00 H new ATOM 210 N MET A 14 -9.993 -7.383 -30.821 1.00 0.00 N ATOM 211 CA MET A 14 -8.583 -7.721 -30.983 1.00 0.00 C ATOM 212 C MET A 14 -8.149 -7.561 -32.436 1.00 0.00 C ATOM 213 O MET A 14 -7.354 -8.349 -32.948 1.00 0.00 O ATOM 214 CB MET A 14 -8.322 -9.155 -30.515 1.00 0.00 C ATOM 215 CG MET A 14 -8.994 -9.496 -29.194 1.00 0.00 C ATOM 216 SD MET A 14 -7.970 -10.546 -28.146 1.00 0.00 S ATOM 217 CE MET A 14 -8.980 -10.638 -26.669 1.00 0.00 C ATOM 0 H MET A 14 -10.638 -8.137 -31.057 1.00 0.00 H new ATOM 0 HA MET A 14 -7.998 -7.035 -30.370 1.00 0.00 H new ATOM 0 HB2 MET A 14 -8.672 -9.848 -31.281 1.00 0.00 H new ATOM 0 HB3 MET A 14 -7.247 -9.306 -30.416 1.00 0.00 H new ATOM 0 HG2 MET A 14 -9.228 -8.574 -28.661 1.00 0.00 H new ATOM 0 HG3 MET A 14 -9.941 -9.999 -29.391 1.00 0.00 H new ATOM 0 HE1 MET A 14 -8.479 -11.256 -25.924 1.00 0.00 H new ATOM 0 HE2 MET A 14 -9.130 -9.636 -26.268 1.00 0.00 H new ATOM 0 HE3 MET A 14 -9.946 -11.078 -26.916 1.00 0.00 H new ATOM 227 N SER A 15 -8.677 -6.536 -33.096 1.00 0.00 N ATOM 228 CA SER A 15 -8.345 -6.270 -34.490 1.00 0.00 C ATOM 229 C SER A 15 -7.472 -5.026 -34.617 1.00 0.00 C ATOM 230 O SER A 15 -6.710 -4.885 -35.573 1.00 0.00 O ATOM 231 CB SER A 15 -9.621 -6.099 -35.316 1.00 0.00 C ATOM 232 OG SER A 15 -9.426 -6.527 -36.653 1.00 0.00 O ATOM 0 H SER A 15 -9.338 -5.875 -32.687 1.00 0.00 H new ATOM 0 HA SER A 15 -7.784 -7.123 -34.872 1.00 0.00 H new ATOM 0 HB2 SER A 15 -10.431 -6.671 -34.862 1.00 0.00 H new ATOM 0 HB3 SER A 15 -9.926 -5.053 -35.307 1.00 0.00 H new ATOM 0 HG SER A 15 -10.257 -6.409 -37.159 1.00 0.00 H new ATOM 238 N ALA A 16 -7.587 -4.123 -33.645 1.00 0.00 N ATOM 239 CA ALA A 16 -6.806 -2.892 -33.651 1.00 0.00 C ATOM 240 C ALA A 16 -5.525 -3.049 -32.837 1.00 0.00 C ATOM 241 O ALA A 16 -5.126 -2.143 -32.106 1.00 0.00 O ATOM 242 CB ALA A 16 -7.639 -1.740 -33.109 1.00 0.00 C ATOM 0 H ALA A 16 -8.213 -4.222 -32.846 1.00 0.00 H new ATOM 0 HA ALA A 16 -6.525 -2.673 -34.681 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -7.045 -0.826 -33.118 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -8.523 -1.605 -33.733 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -7.947 -1.963 -32.087 1.00 0.00 H new ATOM 248 N ILE A 17 -4.884 -4.207 -32.970 1.00 0.00 N ATOM 249 CA ILE A 17 -3.648 -4.484 -32.251 1.00 0.00 C ATOM 250 C ILE A 17 -2.655 -5.228 -33.139 1.00 0.00 C ATOM 251 O ILE A 17 -2.707 -6.452 -33.253 1.00 0.00 O ATOM 252 CB ILE A 17 -3.909 -5.321 -30.983 1.00 0.00 C ATOM 253 CG1 ILE A 17 -5.078 -4.736 -30.188 1.00 0.00 C ATOM 254 CG2 ILE A 17 -2.656 -5.386 -30.123 1.00 0.00 C ATOM 255 CD1 ILE A 17 -5.588 -5.655 -29.099 1.00 0.00 C ATOM 0 H ILE A 17 -5.202 -4.968 -33.570 1.00 0.00 H new ATOM 0 HA ILE A 17 -3.227 -3.521 -31.961 1.00 0.00 H new ATOM 0 HB ILE A 17 -4.172 -6.335 -31.285 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -4.766 -3.793 -29.740 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -5.895 -4.509 -30.873 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.857 -5.980 -29.232 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.848 -5.846 -30.692 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.364 -4.378 -29.829 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -6.416 -5.176 -28.577 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -5.931 -6.590 -29.543 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -4.785 -5.862 -28.392 1.00 0.00 H new ATOM 267 N GLN A 18 -1.755 -4.479 -33.769 1.00 0.00 N ATOM 268 CA GLN A 18 -0.753 -5.068 -34.651 1.00 0.00 C ATOM 269 C GLN A 18 -1.415 -5.733 -35.854 1.00 0.00 C ATOM 270 O GLN A 18 -2.307 -6.567 -35.701 1.00 0.00 O ATOM 271 CB GLN A 18 0.092 -6.091 -33.887 1.00 0.00 C ATOM 272 CG GLN A 18 1.579 -5.996 -34.187 1.00 0.00 C ATOM 273 CD GLN A 18 2.389 -7.045 -33.450 1.00 0.00 C ATOM 274 OE1 GLN A 18 3.208 -7.745 -34.045 1.00 0.00 O ATOM 275 NE2 GLN A 18 2.163 -7.161 -32.146 1.00 0.00 N ATOM 0 H GLN A 18 -1.699 -3.464 -33.685 1.00 0.00 H new ATOM 0 HA GLN A 18 -0.104 -4.269 -35.010 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -0.064 -5.953 -32.817 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -0.257 -7.094 -34.133 1.00 0.00 H new ATOM 0 HG2 GLN A 18 1.738 -6.107 -35.260 1.00 0.00 H new ATOM 0 HG3 GLN A 18 1.939 -5.005 -33.912 1.00 0.00 H new ATOM 0 HE21 GLN A 18 1.475 -6.560 -31.692 1.00 0.00 H new ATOM 0 HE22 GLN A 18 2.678 -7.851 -31.599 1.00 0.00 H new ATOM 284 N ASN A 19 -0.974 -5.358 -37.049 1.00 0.00 N ATOM 285 CA ASN A 19 -1.528 -5.919 -38.276 1.00 0.00 C ATOM 286 C ASN A 19 -0.421 -6.281 -39.261 1.00 0.00 C ATOM 287 O ASN A 19 0.212 -5.405 -39.851 1.00 0.00 O ATOM 288 CB ASN A 19 -2.499 -4.929 -38.922 1.00 0.00 C ATOM 289 CG ASN A 19 -3.744 -5.608 -39.458 1.00 0.00 C ATOM 290 OD1 ASN A 19 -4.002 -6.776 -39.166 1.00 0.00 O ATOM 291 ND2 ASN A 19 -4.523 -4.880 -40.249 1.00 0.00 N ATOM 0 H ASN A 19 -0.236 -4.669 -37.195 1.00 0.00 H new ATOM 0 HA ASN A 19 -2.068 -6.830 -38.016 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -2.786 -4.175 -38.189 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -1.994 -4.407 -39.735 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -5.373 -5.285 -40.641 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -4.271 -3.915 -40.465 1.00 0.00 H new ATOM 298 N LEU A 20 -0.193 -7.578 -39.432 1.00 0.00 N ATOM 299 CA LEU A 20 0.836 -8.063 -40.344 1.00 0.00 C ATOM 300 C LEU A 20 0.226 -8.954 -41.424 1.00 0.00 C ATOM 301 O LEU A 20 -0.293 -10.032 -41.132 1.00 0.00 O ATOM 302 CB LEU A 20 1.910 -8.834 -39.572 1.00 0.00 C ATOM 303 CG LEU A 20 3.350 -8.424 -39.883 1.00 0.00 C ATOM 304 CD1 LEU A 20 3.657 -8.632 -41.358 1.00 0.00 C ATOM 305 CD2 LEU A 20 3.589 -6.975 -39.485 1.00 0.00 C ATOM 0 H LEU A 20 -0.708 -8.314 -38.950 1.00 0.00 H new ATOM 0 HA LEU A 20 1.297 -7.201 -40.827 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.733 -8.703 -38.504 1.00 0.00 H new ATOM 0 HB3 LEU A 20 1.797 -9.897 -39.785 1.00 0.00 H new ATOM 0 HG LEU A 20 4.022 -9.055 -39.301 1.00 0.00 H new ATOM 0 HD11 LEU A 20 4.686 -8.335 -41.561 1.00 0.00 H new ATOM 0 HD12 LEU A 20 3.526 -9.684 -41.612 1.00 0.00 H new ATOM 0 HD13 LEU A 20 2.979 -8.026 -41.960 1.00 0.00 H new ATOM 0 HD21 LEU A 20 4.619 -6.700 -39.713 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.909 -6.328 -40.040 1.00 0.00 H new ATOM 0 HD23 LEU A 20 3.410 -6.857 -38.416 1.00 0.00 H new ATOM 317 N HIS A 21 0.291 -8.496 -42.669 1.00 0.00 N ATOM 318 CA HIS A 21 -0.256 -9.251 -43.789 1.00 0.00 C ATOM 319 C HIS A 21 0.607 -10.468 -44.102 1.00 0.00 C ATOM 320 O HIS A 21 1.481 -10.417 -44.969 1.00 0.00 O ATOM 321 CB HIS A 21 -0.369 -8.359 -45.027 1.00 0.00 C ATOM 322 CG HIS A 21 -1.314 -7.211 -44.852 1.00 0.00 C ATOM 323 ND1 HIS A 21 -2.036 -7.001 -43.695 1.00 0.00 N ATOM 324 CD2 HIS A 21 -1.655 -6.207 -45.694 1.00 0.00 C ATOM 325 CE1 HIS A 21 -2.781 -5.919 -43.835 1.00 0.00 C ATOM 326 NE2 HIS A 21 -2.567 -5.419 -45.037 1.00 0.00 N ATOM 0 H HIS A 21 0.717 -7.606 -42.928 1.00 0.00 H new ATOM 0 HA HIS A 21 -1.250 -9.598 -43.507 1.00 0.00 H new ATOM 0 HB2 HIS A 21 0.619 -7.971 -45.277 1.00 0.00 H new ATOM 0 HB3 HIS A 21 -0.697 -8.964 -45.872 1.00 0.00 H new ATOM 0 HD2 HIS A 21 -1.280 -6.055 -46.695 1.00 0.00 H new ATOM 0 HE1 HIS A 21 -3.451 -5.513 -43.092 1.00 0.00 H new ATOM 0 HE2 HIS A 21 -3.008 -4.582 -45.417 1.00 0.00 H new ATOM 335 N SER A 22 0.355 -11.564 -43.393 1.00 0.00 N ATOM 336 CA SER A 22 1.107 -12.796 -43.595 1.00 0.00 C ATOM 337 C SER A 22 0.261 -14.014 -43.239 1.00 0.00 C ATOM 338 O SER A 22 0.134 -14.374 -42.068 1.00 0.00 O ATOM 339 CB SER A 22 2.384 -12.783 -42.751 1.00 0.00 C ATOM 340 OG SER A 22 3.442 -12.136 -43.436 1.00 0.00 O ATOM 0 H SER A 22 -0.365 -11.623 -42.673 1.00 0.00 H new ATOM 0 HA SER A 22 1.377 -12.859 -44.649 1.00 0.00 H new ATOM 0 HB2 SER A 22 2.194 -12.274 -41.806 1.00 0.00 H new ATOM 0 HB3 SER A 22 2.674 -13.805 -42.510 1.00 0.00 H new ATOM 0 HG SER A 22 3.073 -11.471 -44.055 1.00 0.00 H new ATOM 346 N PHE A 23 -0.320 -14.642 -44.256 1.00 0.00 N ATOM 347 CA PHE A 23 -1.158 -15.819 -44.051 1.00 0.00 C ATOM 348 C PHE A 23 -0.316 -17.090 -44.041 1.00 0.00 C ATOM 349 O PHE A 23 0.543 -17.286 -44.901 1.00 0.00 O ATOM 350 CB PHE A 23 -2.225 -15.907 -45.143 1.00 0.00 C ATOM 351 CG PHE A 23 -3.519 -15.240 -44.775 1.00 0.00 C ATOM 352 CD1 PHE A 23 -4.231 -15.646 -43.657 1.00 0.00 C ATOM 353 CD2 PHE A 23 -4.024 -14.206 -45.547 1.00 0.00 C ATOM 354 CE1 PHE A 23 -5.422 -15.033 -43.316 1.00 0.00 C ATOM 355 CE2 PHE A 23 -5.214 -13.589 -45.211 1.00 0.00 C ATOM 356 CZ PHE A 23 -5.914 -14.003 -44.095 1.00 0.00 C ATOM 0 H PHE A 23 -0.226 -14.356 -45.231 1.00 0.00 H new ATOM 0 HA PHE A 23 -1.648 -15.722 -43.082 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -1.838 -15.452 -46.055 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -2.418 -16.956 -45.367 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -3.851 -16.451 -43.045 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -3.481 -13.879 -46.421 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -5.967 -15.358 -42.442 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -5.596 -12.784 -45.821 1.00 0.00 H new ATOM 0 HZ PHE A 23 -6.845 -13.523 -43.831 1.00 0.00 H new ATOM 366 N ASP A 24 -0.570 -17.954 -43.063 1.00 0.00 N ATOM 367 CA ASP A 24 0.164 -19.209 -42.941 1.00 0.00 C ATOM 368 C ASP A 24 1.661 -18.952 -42.779 1.00 0.00 C ATOM 369 O ASP A 24 2.459 -19.294 -43.653 1.00 0.00 O ATOM 370 CB ASP A 24 -0.087 -20.091 -44.166 1.00 0.00 C ATOM 371 CG ASP A 24 -1.505 -20.628 -44.212 1.00 0.00 C ATOM 372 OD1 ASP A 24 -2.407 -19.886 -44.654 1.00 0.00 O ATOM 373 OD2 ASP A 24 -1.713 -21.790 -43.805 1.00 0.00 O ATOM 0 H ASP A 24 -1.278 -17.808 -42.344 1.00 0.00 H new ATOM 0 HA ASP A 24 -0.194 -19.726 -42.051 1.00 0.00 H new ATOM 0 HB2 ASP A 24 0.110 -19.516 -45.071 1.00 0.00 H new ATOM 0 HB3 ASP A 24 0.614 -20.925 -44.159 1.00 0.00 H new ATOM 378 N PRO A 25 2.065 -18.343 -41.650 1.00 0.00 N ATOM 379 CA PRO A 25 3.474 -18.039 -41.376 1.00 0.00 C ATOM 380 C PRO A 25 4.345 -19.291 -41.378 1.00 0.00 C ATOM 381 O PRO A 25 5.439 -19.298 -41.944 1.00 0.00 O ATOM 382 CB PRO A 25 3.448 -17.415 -39.976 1.00 0.00 C ATOM 383 CG PRO A 25 2.046 -16.950 -39.781 1.00 0.00 C ATOM 384 CD PRO A 25 1.182 -17.902 -40.557 1.00 0.00 C ATOM 0 HA PRO A 25 3.901 -17.387 -42.138 1.00 0.00 H new ATOM 0 HB2 PRO A 25 3.731 -18.143 -39.215 1.00 0.00 H new ATOM 0 HB3 PRO A 25 4.152 -16.586 -39.901 1.00 0.00 H new ATOM 0 HG2 PRO A 25 1.778 -16.952 -38.725 1.00 0.00 H new ATOM 0 HG3 PRO A 25 1.920 -15.928 -40.140 1.00 0.00 H new ATOM 0 HD2 PRO A 25 0.853 -18.740 -39.942 1.00 0.00 H new ATOM 0 HD3 PRO A 25 0.285 -17.413 -40.937 1.00 0.00 H new ATOM 392 N PHE A 26 3.853 -20.348 -40.740 1.00 0.00 N ATOM 393 CA PHE A 26 4.585 -21.607 -40.665 1.00 0.00 C ATOM 394 C PHE A 26 3.872 -22.703 -41.452 1.00 0.00 C ATOM 395 O PHE A 26 4.508 -23.627 -41.960 1.00 0.00 O ATOM 396 CB PHE A 26 4.752 -22.036 -39.205 1.00 0.00 C ATOM 397 CG PHE A 26 3.472 -22.004 -38.419 1.00 0.00 C ATOM 398 CD1 PHE A 26 2.993 -20.811 -37.897 1.00 0.00 C ATOM 399 CD2 PHE A 26 2.748 -23.164 -38.201 1.00 0.00 C ATOM 400 CE1 PHE A 26 1.817 -20.779 -37.174 1.00 0.00 C ATOM 401 CE2 PHE A 26 1.570 -23.137 -37.478 1.00 0.00 C ATOM 402 CZ PHE A 26 1.104 -21.943 -36.964 1.00 0.00 C ATOM 0 H PHE A 26 2.949 -20.358 -40.267 1.00 0.00 H new ATOM 0 HA PHE A 26 5.569 -21.452 -41.107 1.00 0.00 H new ATOM 0 HB2 PHE A 26 5.161 -23.046 -39.176 1.00 0.00 H new ATOM 0 HB3 PHE A 26 5.480 -21.383 -38.724 1.00 0.00 H new ATOM 0 HD1 PHE A 26 3.546 -19.897 -38.058 1.00 0.00 H new ATOM 0 HD2 PHE A 26 3.108 -24.101 -38.600 1.00 0.00 H new ATOM 0 HE1 PHE A 26 1.455 -19.844 -36.773 1.00 0.00 H new ATOM 0 HE2 PHE A 26 1.015 -24.049 -37.315 1.00 0.00 H new ATOM 0 HZ PHE A 26 0.184 -21.919 -36.399 1.00 0.00 H new ATOM 412 N ALA A 27 2.550 -22.594 -41.550 1.00 0.00 N ATOM 413 CA ALA A 27 1.754 -23.576 -42.277 1.00 0.00 C ATOM 414 C ALA A 27 1.853 -24.952 -41.628 1.00 0.00 C ATOM 415 O ALA A 27 2.685 -25.774 -42.014 1.00 0.00 O ATOM 416 CB ALA A 27 2.193 -23.640 -43.732 1.00 0.00 C ATOM 0 H ALA A 27 2.008 -21.836 -41.135 1.00 0.00 H new ATOM 0 HA ALA A 27 0.711 -23.262 -42.240 1.00 0.00 H new ATOM 0 HB1 ALA A 27 1.590 -24.377 -44.262 1.00 0.00 H new ATOM 0 HB2 ALA A 27 2.061 -22.662 -44.195 1.00 0.00 H new ATOM 0 HB3 ALA A 27 3.243 -23.926 -43.783 1.00 0.00 H new ATOM 422 N ASP A 28 0.996 -25.199 -40.642 1.00 0.00 N ATOM 423 CA ASP A 28 0.984 -26.477 -39.939 1.00 0.00 C ATOM 424 C ASP A 28 -0.226 -26.574 -39.014 1.00 0.00 C ATOM 425 O ASP A 28 -1.171 -25.792 -39.129 1.00 0.00 O ATOM 426 CB ASP A 28 2.277 -26.652 -39.135 1.00 0.00 C ATOM 427 CG ASP A 28 2.830 -28.060 -39.231 1.00 0.00 C ATOM 428 OD1 ASP A 28 2.050 -28.985 -39.540 1.00 0.00 O ATOM 429 OD2 ASP A 28 4.043 -28.239 -38.995 1.00 0.00 O ATOM 0 H ASP A 28 0.300 -24.530 -40.312 1.00 0.00 H new ATOM 0 HA ASP A 28 0.917 -27.274 -40.679 1.00 0.00 H new ATOM 0 HB2 ASP A 28 3.025 -25.945 -39.496 1.00 0.00 H new ATOM 0 HB3 ASP A 28 2.087 -26.409 -38.089 1.00 0.00 H new ATOM 434 N ALA A 29 -0.194 -27.539 -38.099 1.00 0.00 N ATOM 435 CA ALA A 29 -1.290 -27.739 -37.156 1.00 0.00 C ATOM 436 C ALA A 29 -1.613 -26.453 -36.402 1.00 0.00 C ATOM 437 O ALA A 29 -1.041 -25.398 -36.676 1.00 0.00 O ATOM 438 CB ALA A 29 -0.945 -28.853 -36.180 1.00 0.00 C ATOM 0 H ALA A 29 0.580 -28.195 -37.991 1.00 0.00 H new ATOM 0 HA ALA A 29 -2.176 -28.025 -37.723 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -1.770 -28.993 -35.481 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -0.774 -29.778 -36.730 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -0.043 -28.587 -35.628 1.00 0.00 H new ATOM 444 N SER A 30 -2.536 -26.547 -35.450 1.00 0.00 N ATOM 445 CA SER A 30 -2.938 -25.392 -34.655 1.00 0.00 C ATOM 446 C SER A 30 -3.591 -24.328 -35.533 1.00 0.00 C ATOM 447 O SER A 30 -3.249 -24.183 -36.706 1.00 0.00 O ATOM 448 CB SER A 30 -1.731 -24.798 -33.927 1.00 0.00 C ATOM 449 OG SER A 30 -0.979 -25.809 -33.276 1.00 0.00 O ATOM 0 H SER A 30 -3.020 -27.412 -35.210 1.00 0.00 H new ATOM 0 HA SER A 30 -3.667 -25.728 -33.918 1.00 0.00 H new ATOM 0 HB2 SER A 30 -1.097 -24.270 -34.639 1.00 0.00 H new ATOM 0 HB3 SER A 30 -2.069 -24.064 -33.196 1.00 0.00 H new ATOM 0 HG SER A 30 -0.212 -25.404 -32.820 1.00 0.00 H new ATOM 455 N LYS A 31 -4.534 -23.589 -34.957 1.00 0.00 N ATOM 456 CA LYS A 31 -5.236 -22.540 -35.687 1.00 0.00 C ATOM 457 C LYS A 31 -4.695 -21.162 -35.315 1.00 0.00 C ATOM 458 O LYS A 31 -4.529 -20.298 -36.175 1.00 0.00 O ATOM 459 CB LYS A 31 -6.738 -22.606 -35.400 1.00 0.00 C ATOM 460 CG LYS A 31 -7.090 -22.383 -33.938 1.00 0.00 C ATOM 461 CD LYS A 31 -8.530 -22.774 -33.646 1.00 0.00 C ATOM 462 CE LYS A 31 -9.512 -21.793 -34.266 1.00 0.00 C ATOM 463 NZ LYS A 31 -10.831 -21.816 -33.576 1.00 0.00 N ATOM 0 H LYS A 31 -4.829 -23.697 -33.987 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.070 -22.700 -36.752 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -7.248 -21.857 -36.006 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -7.116 -23.580 -35.711 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -6.419 -22.966 -33.308 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -6.937 -21.335 -33.682 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -8.722 -23.775 -34.033 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -8.686 -22.813 -32.568 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -9.096 -20.786 -34.221 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -9.650 -22.034 -35.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -11.472 -21.133 -34.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -11.240 -22.770 -33.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -10.704 -21.561 -32.576 1.00 0.00 H new ATOM 477 N GLY A 32 -4.425 -20.965 -34.029 1.00 0.00 N ATOM 478 CA GLY A 32 -3.906 -19.691 -33.568 1.00 0.00 C ATOM 479 C GLY A 32 -2.395 -19.612 -33.655 1.00 0.00 C ATOM 480 O GLY A 32 -1.721 -20.632 -33.801 1.00 0.00 O ATOM 0 H GLY A 32 -4.556 -21.664 -33.298 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -4.343 -18.888 -34.162 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -4.216 -19.529 -32.536 1.00 0.00 H new ATOM 484 N ASP A 33 -1.860 -18.398 -33.566 1.00 0.00 N ATOM 485 CA ASP A 33 -0.419 -18.190 -33.636 1.00 0.00 C ATOM 486 C ASP A 33 0.125 -17.699 -32.297 1.00 0.00 C ATOM 487 O ASP A 33 1.099 -16.948 -32.250 1.00 0.00 O ATOM 488 CB ASP A 33 -0.080 -17.183 -34.736 1.00 0.00 C ATOM 489 CG ASP A 33 -0.625 -17.597 -36.088 1.00 0.00 C ATOM 490 OD1 ASP A 33 -0.696 -18.816 -36.350 1.00 0.00 O ATOM 491 OD2 ASP A 33 -0.979 -16.704 -36.885 1.00 0.00 O ATOM 0 H ASP A 33 -2.404 -17.544 -33.445 1.00 0.00 H new ATOM 0 HA ASP A 33 0.050 -19.146 -33.871 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -0.484 -16.207 -34.468 1.00 0.00 H new ATOM 0 HB3 ASP A 33 1.002 -17.072 -34.802 1.00 0.00 H new ATOM 496 N ASP A 34 -0.509 -18.130 -31.213 1.00 0.00 N ATOM 497 CA ASP A 34 -0.089 -17.735 -29.874 1.00 0.00 C ATOM 498 C ASP A 34 1.100 -18.568 -29.408 1.00 0.00 C ATOM 499 O ASP A 34 0.938 -19.535 -28.663 1.00 0.00 O ATOM 500 CB ASP A 34 -1.249 -17.884 -28.888 1.00 0.00 C ATOM 501 CG ASP A 34 -1.805 -19.294 -28.859 1.00 0.00 C ATOM 502 OD1 ASP A 34 -1.901 -19.916 -29.938 1.00 0.00 O ATOM 503 OD2 ASP A 34 -2.142 -19.776 -27.758 1.00 0.00 O ATOM 0 H ASP A 34 -1.316 -18.753 -31.235 1.00 0.00 H new ATOM 0 HA ASP A 34 0.216 -16.689 -29.910 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -0.911 -17.609 -27.889 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -2.044 -17.188 -29.158 1.00 0.00 H new ATOM 508 N LEU A 35 2.293 -18.187 -29.849 1.00 0.00 N ATOM 509 CA LEU A 35 3.509 -18.899 -29.476 1.00 0.00 C ATOM 510 C LEU A 35 3.840 -18.676 -28.003 1.00 0.00 C ATOM 511 O LEU A 35 3.473 -17.654 -27.422 1.00 0.00 O ATOM 512 CB LEU A 35 4.681 -18.446 -30.353 1.00 0.00 C ATOM 513 CG LEU A 35 5.364 -19.562 -31.144 1.00 0.00 C ATOM 514 CD1 LEU A 35 5.884 -20.639 -30.206 1.00 0.00 C ATOM 515 CD2 LEU A 35 4.402 -20.158 -32.161 1.00 0.00 C ATOM 0 H LEU A 35 2.444 -17.389 -30.466 1.00 0.00 H new ATOM 0 HA LEU A 35 3.340 -19.964 -29.633 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.321 -17.692 -31.053 1.00 0.00 H new ATOM 0 HB3 LEU A 35 5.424 -17.963 -29.719 1.00 0.00 H new ATOM 0 HG LEU A 35 6.212 -19.136 -31.680 1.00 0.00 H new ATOM 0 HD11 LEU A 35 6.367 -21.425 -30.787 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.606 -20.203 -29.515 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.053 -21.063 -29.642 1.00 0.00 H new ATOM 0 HD21 LEU A 35 4.904 -20.951 -32.716 1.00 0.00 H new ATOM 0 HD22 LEU A 35 3.535 -20.569 -31.644 1.00 0.00 H new ATOM 0 HD23 LEU A 35 4.077 -19.381 -32.853 1.00 0.00 H new ATOM 527 N LEU A 36 4.532 -19.640 -27.404 1.00 0.00 N ATOM 528 CA LEU A 36 4.912 -19.550 -25.999 1.00 0.00 C ATOM 529 C LEU A 36 3.676 -19.499 -25.103 1.00 0.00 C ATOM 530 O LEU A 36 2.627 -18.999 -25.507 1.00 0.00 O ATOM 531 CB LEU A 36 5.782 -18.313 -25.761 1.00 0.00 C ATOM 532 CG LEU A 36 6.912 -18.112 -26.772 1.00 0.00 C ATOM 533 CD1 LEU A 36 7.565 -16.752 -26.580 1.00 0.00 C ATOM 534 CD2 LEU A 36 7.943 -19.223 -26.645 1.00 0.00 C ATOM 0 H LEU A 36 4.841 -20.493 -27.870 1.00 0.00 H new ATOM 0 HA LEU A 36 5.486 -20.442 -25.746 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.143 -17.430 -25.773 1.00 0.00 H new ATOM 0 HB3 LEU A 36 6.215 -18.379 -24.763 1.00 0.00 H new ATOM 0 HG LEU A 36 6.488 -18.149 -27.775 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.366 -16.627 -27.308 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.821 -15.968 -26.721 1.00 0.00 H new ATOM 0 HD13 LEU A 36 7.976 -16.685 -25.573 1.00 0.00 H new ATOM 0 HD21 LEU A 36 8.740 -19.065 -27.372 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.363 -19.217 -25.639 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.466 -20.185 -26.833 1.00 0.00 H new ATOM 546 N PRO A 37 3.787 -20.017 -23.867 1.00 0.00 N ATOM 547 CA PRO A 37 2.673 -20.027 -22.913 1.00 0.00 C ATOM 548 C PRO A 37 2.343 -18.632 -22.395 1.00 0.00 C ATOM 549 O PRO A 37 3.010 -18.119 -21.496 1.00 0.00 O ATOM 550 CB PRO A 37 3.187 -20.913 -21.776 1.00 0.00 C ATOM 551 CG PRO A 37 4.670 -20.797 -21.847 1.00 0.00 C ATOM 552 CD PRO A 37 5.003 -20.633 -23.305 1.00 0.00 C ATOM 0 HA PRO A 37 1.750 -20.387 -23.367 1.00 0.00 H new ATOM 0 HB2 PRO A 37 2.809 -20.577 -20.810 1.00 0.00 H new ATOM 0 HB3 PRO A 37 2.864 -21.946 -21.902 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.023 -19.944 -21.268 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.151 -21.684 -21.434 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.878 -19.999 -23.448 1.00 0.00 H new ATOM 0 HD3 PRO A 37 5.223 -21.591 -23.777 1.00 0.00 H new ATOM 560 N ALA A 38 1.310 -18.022 -22.968 1.00 0.00 N ATOM 561 CA ALA A 38 0.891 -16.686 -22.563 1.00 0.00 C ATOM 562 C ALA A 38 0.349 -16.686 -21.138 1.00 0.00 C ATOM 563 O ALA A 38 -0.824 -16.982 -20.910 1.00 0.00 O ATOM 564 CB ALA A 38 -0.153 -16.147 -23.530 1.00 0.00 C ATOM 0 H ALA A 38 0.748 -18.432 -23.714 1.00 0.00 H new ATOM 0 HA ALA A 38 1.765 -16.035 -22.588 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -0.458 -15.149 -23.217 1.00 0.00 H new ATOM 0 HB2 ALA A 38 0.271 -16.099 -24.533 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -1.021 -16.807 -23.534 1.00 0.00 H new ATOM 570 N GLY A 39 1.210 -16.351 -20.183 1.00 0.00 N ATOM 571 CA GLY A 39 0.799 -16.317 -18.791 1.00 0.00 C ATOM 572 C GLY A 39 0.801 -14.912 -18.222 1.00 0.00 C ATOM 573 O GLY A 39 1.795 -14.470 -17.645 1.00 0.00 O ATOM 0 H GLY A 39 2.185 -16.102 -20.348 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -0.201 -16.742 -18.700 1.00 0.00 H new ATOM 0 HA3 GLY A 39 1.467 -16.945 -18.202 1.00 0.00 H new ATOM 577 N THR A 40 -0.312 -14.206 -18.388 1.00 0.00 N ATOM 578 CA THR A 40 -0.435 -12.842 -17.888 1.00 0.00 C ATOM 579 C THR A 40 -1.488 -12.753 -16.788 1.00 0.00 C ATOM 580 O THR A 40 -2.563 -12.188 -16.987 1.00 0.00 O ATOM 581 CB THR A 40 -0.792 -11.890 -19.031 1.00 0.00 C ATOM 582 OG1 THR A 40 -1.695 -12.505 -19.932 1.00 0.00 O ATOM 583 CG2 THR A 40 0.411 -11.433 -19.828 1.00 0.00 C ATOM 0 H THR A 40 -1.143 -14.556 -18.865 1.00 0.00 H new ATOM 0 HA THR A 40 0.526 -12.550 -17.465 1.00 0.00 H new ATOM 0 HB THR A 40 -1.242 -11.020 -18.552 1.00 0.00 H new ATOM 0 HG1 THR A 40 -1.913 -11.880 -20.655 1.00 0.00 H new ATOM 0 HG21 THR A 40 0.087 -10.761 -20.622 1.00 0.00 H new ATOM 0 HG22 THR A 40 1.106 -10.910 -19.171 1.00 0.00 H new ATOM 0 HG23 THR A 40 0.908 -12.299 -20.266 1.00 0.00 H new ATOM 591 N GLU A 41 -1.175 -13.320 -15.628 1.00 0.00 N ATOM 592 CA GLU A 41 -2.100 -13.306 -14.499 1.00 0.00 C ATOM 593 C GLU A 41 -1.397 -12.933 -13.191 1.00 0.00 C ATOM 594 O GLU A 41 -2.045 -12.793 -12.153 1.00 0.00 O ATOM 595 CB GLU A 41 -2.774 -14.669 -14.354 1.00 0.00 C ATOM 596 CG GLU A 41 -3.782 -14.969 -15.450 1.00 0.00 C ATOM 597 CD GLU A 41 -3.218 -15.874 -16.529 1.00 0.00 C ATOM 598 OE1 GLU A 41 -2.377 -16.736 -16.200 1.00 0.00 O ATOM 599 OE2 GLU A 41 -3.617 -15.719 -17.702 1.00 0.00 O ATOM 0 H GLU A 41 -0.291 -13.794 -15.444 1.00 0.00 H new ATOM 0 HA GLU A 41 -2.853 -12.545 -14.702 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.009 -15.445 -14.354 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.276 -14.716 -13.388 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.662 -15.438 -15.011 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -4.112 -14.033 -15.901 1.00 0.00 H new ATOM 606 N ASP A 42 -0.076 -12.773 -13.239 1.00 0.00 N ATOM 607 CA ASP A 42 0.692 -12.417 -12.051 1.00 0.00 C ATOM 608 C ASP A 42 1.064 -10.939 -12.074 1.00 0.00 C ATOM 609 O ASP A 42 2.177 -10.575 -12.452 1.00 0.00 O ATOM 610 CB ASP A 42 1.955 -13.275 -11.960 1.00 0.00 C ATOM 611 CG ASP A 42 1.825 -14.388 -10.938 1.00 0.00 C ATOM 612 OD1 ASP A 42 1.202 -14.152 -9.881 1.00 0.00 O ATOM 613 OD2 ASP A 42 2.344 -15.494 -11.195 1.00 0.00 O ATOM 0 H ASP A 42 0.482 -12.884 -14.086 1.00 0.00 H new ATOM 0 HA ASP A 42 0.073 -12.605 -11.174 1.00 0.00 H new ATOM 0 HB2 ASP A 42 2.169 -13.706 -12.938 1.00 0.00 H new ATOM 0 HB3 ASP A 42 2.803 -12.642 -11.698 1.00 0.00 H new ATOM 618 N TYR A 43 0.122 -10.091 -11.676 1.00 0.00 N ATOM 619 CA TYR A 43 0.348 -8.651 -11.659 1.00 0.00 C ATOM 620 C TYR A 43 0.145 -8.070 -10.265 1.00 0.00 C ATOM 621 O TYR A 43 -0.443 -8.707 -9.392 1.00 0.00 O ATOM 622 CB TYR A 43 -0.600 -7.964 -12.638 1.00 0.00 C ATOM 623 CG TYR A 43 -0.355 -8.348 -14.075 1.00 0.00 C ATOM 624 CD1 TYR A 43 0.762 -7.883 -14.752 1.00 0.00 C ATOM 625 CD2 TYR A 43 -1.238 -9.176 -14.753 1.00 0.00 C ATOM 626 CE1 TYR A 43 0.994 -8.232 -16.068 1.00 0.00 C ATOM 627 CE2 TYR A 43 -1.015 -9.533 -16.068 1.00 0.00 C ATOM 628 CZ TYR A 43 0.104 -9.058 -16.722 1.00 0.00 C ATOM 629 OH TYR A 43 0.331 -9.407 -18.032 1.00 0.00 O ATOM 0 H TYR A 43 -0.805 -10.376 -11.361 1.00 0.00 H new ATOM 0 HA TYR A 43 1.381 -8.473 -11.956 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -1.628 -8.213 -12.373 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.497 -6.884 -12.535 1.00 0.00 H new ATOM 0 HD1 TYR A 43 1.462 -7.238 -14.242 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -2.115 -9.548 -14.243 1.00 0.00 H new ATOM 0 HE1 TYR A 43 1.868 -7.860 -16.582 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -1.711 -10.179 -16.581 1.00 0.00 H new ATOM 0 HH TYR A 43 1.205 -9.066 -18.315 1.00 0.00 H new ATOM 639 N ILE A 44 0.623 -6.846 -10.074 1.00 0.00 N ATOM 640 CA ILE A 44 0.483 -6.154 -8.799 1.00 0.00 C ATOM 641 C ILE A 44 -0.121 -4.774 -9.034 1.00 0.00 C ATOM 642 O ILE A 44 0.582 -3.764 -9.049 1.00 0.00 O ATOM 643 CB ILE A 44 1.839 -6.029 -8.071 1.00 0.00 C ATOM 644 CG1 ILE A 44 2.372 -7.420 -7.714 1.00 0.00 C ATOM 645 CG2 ILE A 44 1.703 -5.172 -6.820 1.00 0.00 C ATOM 646 CD1 ILE A 44 1.540 -8.142 -6.676 1.00 0.00 C ATOM 0 H ILE A 44 1.113 -6.310 -10.790 1.00 0.00 H new ATOM 0 HA ILE A 44 -0.179 -6.739 -8.161 1.00 0.00 H new ATOM 0 HB ILE A 44 2.549 -5.541 -8.739 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.415 -8.026 -8.619 1.00 0.00 H new ATOM 0 HG13 ILE A 44 3.394 -7.325 -7.346 1.00 0.00 H new ATOM 0 HG21 ILE A 44 2.670 -5.098 -6.323 1.00 0.00 H new ATOM 0 HG22 ILE A 44 1.360 -4.175 -7.097 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.981 -5.629 -6.143 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.978 -9.119 -6.474 1.00 0.00 H new ATOM 0 HD12 ILE A 44 1.518 -7.557 -5.756 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.524 -8.270 -7.049 1.00 0.00 H new ATOM 658 N HIS A 45 -1.433 -4.755 -9.247 1.00 0.00 N ATOM 659 CA HIS A 45 -2.162 -3.525 -9.520 1.00 0.00 C ATOM 660 C HIS A 45 -2.052 -2.514 -8.386 1.00 0.00 C ATOM 661 O HIS A 45 -1.850 -2.871 -7.226 1.00 0.00 O ATOM 662 CB HIS A 45 -3.634 -3.845 -9.775 1.00 0.00 C ATOM 663 CG HIS A 45 -4.054 -3.672 -11.199 1.00 0.00 C ATOM 664 ND1 HIS A 45 -3.557 -4.438 -12.232 1.00 0.00 N ATOM 665 CD2 HIS A 45 -4.942 -2.818 -11.756 1.00 0.00 C ATOM 666 CE1 HIS A 45 -4.121 -4.061 -13.365 1.00 0.00 C ATOM 667 NE2 HIS A 45 -4.966 -3.080 -13.104 1.00 0.00 N ATOM 0 H HIS A 45 -2.018 -5.591 -9.235 1.00 0.00 H new ATOM 0 HA HIS A 45 -1.711 -3.074 -10.404 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -3.830 -4.873 -9.471 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -4.250 -3.203 -9.144 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -5.524 -2.070 -11.238 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -3.925 -4.483 -14.340 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -5.543 -2.596 -13.792 1.00 0.00 H new ATOM 676 N ILE A 46 -2.221 -1.250 -8.751 1.00 0.00 N ATOM 677 CA ILE A 46 -2.184 -0.145 -7.806 1.00 0.00 C ATOM 678 C ILE A 46 -3.127 0.951 -8.293 1.00 0.00 C ATOM 679 O ILE A 46 -2.802 1.699 -9.213 1.00 0.00 O ATOM 680 CB ILE A 46 -0.760 0.424 -7.634 1.00 0.00 C ATOM 681 CG1 ILE A 46 0.003 -0.391 -6.592 1.00 0.00 C ATOM 682 CG2 ILE A 46 -0.815 1.885 -7.216 1.00 0.00 C ATOM 683 CD1 ILE A 46 0.718 -1.589 -7.164 1.00 0.00 C ATOM 0 H ILE A 46 -2.388 -0.963 -9.715 1.00 0.00 H new ATOM 0 HA ILE A 46 -2.501 -0.517 -6.832 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.241 0.358 -8.590 1.00 0.00 H new ATOM 0 HG12 ILE A 46 0.731 0.255 -6.100 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -0.694 -0.727 -5.825 1.00 0.00 H new ATOM 0 HG21 ILE A 46 0.199 2.269 -7.100 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -1.336 2.463 -7.980 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -1.347 1.973 -6.269 1.00 0.00 H new ATOM 0 HD11 ILE A 46 1.237 -2.118 -6.365 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.006 -2.256 -7.631 1.00 0.00 H new ATOM 0 HD13 ILE A 46 1.441 -1.259 -7.910 1.00 0.00 H new ATOM 695 N ARG A 47 -4.304 1.022 -7.688 1.00 0.00 N ATOM 696 CA ARG A 47 -5.303 2.007 -8.087 1.00 0.00 C ATOM 697 C ARG A 47 -5.697 2.920 -6.934 1.00 0.00 C ATOM 698 O ARG A 47 -5.887 2.472 -5.803 1.00 0.00 O ATOM 699 CB ARG A 47 -6.545 1.302 -8.636 1.00 0.00 C ATOM 700 CG ARG A 47 -6.559 1.191 -10.151 1.00 0.00 C ATOM 701 CD ARG A 47 -7.959 0.929 -10.681 1.00 0.00 C ATOM 702 NE ARG A 47 -7.986 -0.181 -11.630 1.00 0.00 N ATOM 703 CZ ARG A 47 -9.031 -0.473 -12.400 1.00 0.00 C ATOM 704 NH1 ARG A 47 -10.136 0.260 -12.338 1.00 0.00 N ATOM 705 NH2 ARG A 47 -8.972 -1.501 -13.236 1.00 0.00 N ATOM 0 H ARG A 47 -4.591 0.413 -6.922 1.00 0.00 H new ATOM 0 HA ARG A 47 -4.857 2.627 -8.864 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -6.605 0.302 -8.206 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -7.434 1.843 -8.311 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -6.171 2.111 -10.587 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -5.895 0.385 -10.463 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -8.627 0.710 -9.848 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -8.338 1.829 -11.165 1.00 0.00 H new ATOM 0 HE ARG A 47 -7.155 -0.767 -11.707 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -10.187 1.052 -11.697 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -10.934 0.031 -12.931 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -8.126 -2.068 -13.289 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -9.773 -1.725 -13.826 1.00 0.00 H new ATOM 719 N ILE A 48 -5.830 4.204 -7.242 1.00 0.00 N ATOM 720 CA ILE A 48 -6.216 5.199 -6.250 1.00 0.00 C ATOM 721 C ILE A 48 -7.738 5.304 -6.153 1.00 0.00 C ATOM 722 O ILE A 48 -8.456 4.955 -7.089 1.00 0.00 O ATOM 723 CB ILE A 48 -5.635 6.589 -6.599 1.00 0.00 C ATOM 724 CG1 ILE A 48 -4.116 6.593 -6.442 1.00 0.00 C ATOM 725 CG2 ILE A 48 -6.252 7.677 -5.730 1.00 0.00 C ATOM 726 CD1 ILE A 48 -3.470 7.850 -6.983 1.00 0.00 C ATOM 0 H ILE A 48 -5.675 4.582 -8.177 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.812 4.875 -5.291 1.00 0.00 H new ATOM 0 HB ILE A 48 -5.883 6.799 -7.639 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -3.865 6.487 -5.387 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.701 5.727 -6.957 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -5.824 8.643 -5.998 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -7.330 7.701 -5.888 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -6.044 7.467 -4.681 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -2.391 7.794 -6.843 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.693 7.945 -8.046 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -3.860 8.718 -6.451 1.00 0.00 H new ATOM 738 N GLN A 49 -8.215 5.802 -5.019 1.00 0.00 N ATOM 739 CA GLN A 49 -9.645 5.975 -4.798 1.00 0.00 C ATOM 740 C GLN A 49 -9.907 7.304 -4.097 1.00 0.00 C ATOM 741 O GLN A 49 -10.037 7.362 -2.874 1.00 0.00 O ATOM 742 CB GLN A 49 -10.213 4.815 -3.975 1.00 0.00 C ATOM 743 CG GLN A 49 -9.628 4.710 -2.576 1.00 0.00 C ATOM 744 CD GLN A 49 -10.681 4.823 -1.492 1.00 0.00 C ATOM 745 OE1 GLN A 49 -10.979 5.917 -1.011 1.00 0.00 O ATOM 746 NE2 GLN A 49 -11.251 3.689 -1.100 1.00 0.00 N ATOM 0 H GLN A 49 -7.630 6.094 -4.236 1.00 0.00 H new ATOM 0 HA GLN A 49 -10.147 5.980 -5.765 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -11.294 4.931 -3.899 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -10.030 3.881 -4.506 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -9.109 3.757 -2.474 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -8.884 5.495 -2.438 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -10.973 2.805 -1.526 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -11.966 3.702 -0.373 1.00 0.00 H new ATOM 755 N GLN A 50 -9.961 8.375 -4.881 1.00 0.00 N ATOM 756 CA GLN A 50 -10.187 9.709 -4.339 1.00 0.00 C ATOM 757 C GLN A 50 -11.675 10.020 -4.224 1.00 0.00 C ATOM 758 O GLN A 50 -12.317 10.405 -5.201 1.00 0.00 O ATOM 759 CB GLN A 50 -9.496 10.761 -5.210 1.00 0.00 C ATOM 760 CG GLN A 50 -8.730 11.799 -4.409 1.00 0.00 C ATOM 761 CD GLN A 50 -7.910 12.729 -5.283 1.00 0.00 C ATOM 762 OE1 GLN A 50 -8.289 13.034 -6.413 1.00 0.00 O ATOM 763 NE2 GLN A 50 -6.778 13.184 -4.759 1.00 0.00 N ATOM 0 H GLN A 50 -9.851 8.345 -5.895 1.00 0.00 H new ATOM 0 HA GLN A 50 -9.759 9.737 -3.337 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -8.810 10.262 -5.894 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -10.245 11.265 -5.821 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -9.433 12.388 -3.820 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -8.069 11.293 -3.705 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.503 12.904 -3.817 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.183 13.813 -5.298 1.00 0.00 H new ATOM 772 N ARG A 51 -12.214 9.866 -3.018 1.00 0.00 N ATOM 773 CA ARG A 51 -13.622 10.146 -2.771 1.00 0.00 C ATOM 774 C ARG A 51 -13.852 11.650 -2.684 1.00 0.00 C ATOM 775 O ARG A 51 -13.273 12.328 -1.834 1.00 0.00 O ATOM 776 CB ARG A 51 -14.083 9.466 -1.481 1.00 0.00 C ATOM 777 CG ARG A 51 -14.000 7.948 -1.529 1.00 0.00 C ATOM 778 CD ARG A 51 -14.042 7.341 -0.136 1.00 0.00 C ATOM 779 NE ARG A 51 -15.346 6.757 0.169 1.00 0.00 N ATOM 780 CZ ARG A 51 -15.678 6.263 1.359 1.00 0.00 C ATOM 781 NH1 ARG A 51 -14.804 6.280 2.358 1.00 0.00 N ATOM 782 NH2 ARG A 51 -16.886 5.751 1.552 1.00 0.00 N ATOM 0 H ARG A 51 -11.696 9.549 -2.198 1.00 0.00 H new ATOM 0 HA ARG A 51 -14.206 9.748 -3.601 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -13.475 9.829 -0.652 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -15.112 9.759 -1.274 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -14.826 7.556 -2.122 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -13.079 7.649 -2.029 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -13.273 6.573 -0.052 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -13.808 8.109 0.601 1.00 0.00 H new ATOM 0 HE ARG A 51 -16.043 6.726 -0.575 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -13.874 6.673 2.215 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -15.063 5.900 3.269 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -17.561 5.736 0.788 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -17.140 5.372 2.465 1.00 0.00 H new ATOM 796 N ASN A 52 -14.686 12.171 -3.577 1.00 0.00 N ATOM 797 CA ASN A 52 -14.979 13.602 -3.610 1.00 0.00 C ATOM 798 C ASN A 52 -13.773 14.387 -4.121 1.00 0.00 C ATOM 799 O ASN A 52 -13.648 15.585 -3.872 1.00 0.00 O ATOM 800 CB ASN A 52 -15.380 14.106 -2.221 1.00 0.00 C ATOM 801 CG ASN A 52 -16.280 15.324 -2.286 1.00 0.00 C ATOM 802 OD1 ASN A 52 -16.634 15.791 -3.368 1.00 0.00 O ATOM 803 ND2 ASN A 52 -16.654 15.846 -1.123 1.00 0.00 N ATOM 0 H ASN A 52 -15.172 11.625 -4.288 1.00 0.00 H new ATOM 0 HA ASN A 52 -15.814 13.758 -4.293 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -15.891 13.308 -1.682 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -14.482 14.351 -1.653 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -17.259 16.667 -1.103 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -16.336 15.426 -0.250 1.00 0.00 H new ATOM 810 N GLY A 53 -12.889 13.700 -4.840 1.00 0.00 N ATOM 811 CA GLY A 53 -11.706 14.343 -5.381 1.00 0.00 C ATOM 812 C GLY A 53 -10.756 14.833 -4.304 1.00 0.00 C ATOM 813 O GLY A 53 -10.013 15.790 -4.518 1.00 0.00 O ATOM 0 H GLY A 53 -12.972 12.707 -5.057 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -11.181 13.641 -6.029 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -12.009 15.186 -6.002 1.00 0.00 H new ATOM 817 N ARG A 54 -10.776 14.178 -3.146 1.00 0.00 N ATOM 818 CA ARG A 54 -9.903 14.565 -2.042 1.00 0.00 C ATOM 819 C ARG A 54 -9.393 13.344 -1.282 1.00 0.00 C ATOM 820 O ARG A 54 -8.191 13.085 -1.249 1.00 0.00 O ATOM 821 CB ARG A 54 -10.641 15.501 -1.082 1.00 0.00 C ATOM 822 CG ARG A 54 -11.254 16.716 -1.762 1.00 0.00 C ATOM 823 CD ARG A 54 -10.971 17.994 -0.987 1.00 0.00 C ATOM 824 NE ARG A 54 -11.882 19.073 -1.358 1.00 0.00 N ATOM 825 CZ ARG A 54 -11.678 20.353 -1.054 1.00 0.00 C ATOM 826 NH1 ARG A 54 -10.591 20.717 -0.383 1.00 0.00 N ATOM 827 NH2 ARG A 54 -12.560 21.271 -1.423 1.00 0.00 N ATOM 0 H ARG A 54 -11.383 13.382 -2.949 1.00 0.00 H new ATOM 0 HA ARG A 54 -9.045 15.087 -2.466 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.429 14.942 -0.578 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -9.947 15.838 -0.312 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.856 16.807 -2.773 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -12.331 16.577 -1.855 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -11.059 17.797 0.081 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -9.943 18.308 -1.170 1.00 0.00 H new ATOM 0 HE ARG A 54 -12.724 18.832 -1.881 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -9.908 20.015 -0.098 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -10.439 21.699 -0.152 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -13.395 20.997 -1.940 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -12.403 22.252 -1.190 1.00 0.00 H new ATOM 841 N LYS A 55 -10.311 12.602 -0.669 1.00 0.00 N ATOM 842 CA LYS A 55 -9.950 11.411 0.095 1.00 0.00 C ATOM 843 C LYS A 55 -9.291 10.368 -0.803 1.00 0.00 C ATOM 844 O LYS A 55 -9.922 9.390 -1.201 1.00 0.00 O ATOM 845 CB LYS A 55 -11.188 10.815 0.768 1.00 0.00 C ATOM 846 CG LYS A 55 -10.885 10.091 2.071 1.00 0.00 C ATOM 847 CD LYS A 55 -10.364 11.045 3.135 1.00 0.00 C ATOM 848 CE LYS A 55 -11.351 12.171 3.410 1.00 0.00 C ATOM 849 NZ LYS A 55 -11.137 12.788 4.749 1.00 0.00 N ATOM 0 H LYS A 55 -11.311 12.804 -0.686 1.00 0.00 H new ATOM 0 HA LYS A 55 -9.235 11.706 0.864 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -11.904 11.613 0.964 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -11.666 10.119 0.079 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -11.788 9.600 2.433 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -10.147 9.309 1.890 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -10.173 10.494 4.056 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -9.412 11.466 2.812 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -11.253 12.935 2.639 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -12.368 11.784 3.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -11.830 13.550 4.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -11.256 12.065 5.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -10.175 13.180 4.801 1.00 0.00 H new ATOM 863 N THR A 56 -8.020 10.590 -1.118 1.00 0.00 N ATOM 864 CA THR A 56 -7.268 9.680 -1.970 1.00 0.00 C ATOM 865 C THR A 56 -6.786 8.464 -1.188 1.00 0.00 C ATOM 866 O THR A 56 -6.189 8.598 -0.121 1.00 0.00 O ATOM 867 CB THR A 56 -6.073 10.413 -2.586 1.00 0.00 C ATOM 868 OG1 THR A 56 -6.183 11.811 -2.386 1.00 0.00 O ATOM 869 CG2 THR A 56 -5.924 10.176 -4.071 1.00 0.00 C ATOM 0 H THR A 56 -7.488 11.397 -0.793 1.00 0.00 H new ATOM 0 HA THR A 56 -7.929 9.331 -2.763 1.00 0.00 H new ATOM 0 HB THR A 56 -5.197 10.008 -2.079 1.00 0.00 H new ATOM 0 HG1 THR A 56 -7.125 12.051 -2.262 1.00 0.00 H new ATOM 0 HG21 THR A 56 -5.058 10.725 -4.442 1.00 0.00 H new ATOM 0 HG22 THR A 56 -5.786 9.111 -4.257 1.00 0.00 H new ATOM 0 HG23 THR A 56 -6.820 10.521 -4.586 1.00 0.00 H new ATOM 877 N LEU A 57 -7.046 7.278 -1.726 1.00 0.00 N ATOM 878 CA LEU A 57 -6.633 6.039 -1.078 1.00 0.00 C ATOM 879 C LEU A 57 -6.136 5.029 -2.113 1.00 0.00 C ATOM 880 O LEU A 57 -6.926 4.464 -2.868 1.00 0.00 O ATOM 881 CB LEU A 57 -7.794 5.446 -0.278 1.00 0.00 C ATOM 882 CG LEU A 57 -7.648 5.531 1.241 1.00 0.00 C ATOM 883 CD1 LEU A 57 -9.010 5.424 1.912 1.00 0.00 C ATOM 884 CD2 LEU A 57 -6.709 4.446 1.750 1.00 0.00 C ATOM 0 H LEU A 57 -7.541 7.148 -2.609 1.00 0.00 H new ATOM 0 HA LEU A 57 -5.814 6.265 -0.395 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -8.712 5.957 -0.568 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.910 4.399 -0.558 1.00 0.00 H new ATOM 0 HG LEU A 57 -7.216 6.500 1.494 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -8.889 5.486 2.993 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -9.649 6.239 1.571 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -9.469 4.470 1.653 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -6.618 4.523 2.833 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -7.109 3.466 1.488 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.727 4.571 1.293 1.00 0.00 H new ATOM 896 N THR A 58 -4.825 4.813 -2.146 1.00 0.00 N ATOM 897 CA THR A 58 -4.228 3.877 -3.093 1.00 0.00 C ATOM 898 C THR A 58 -4.449 2.431 -2.657 1.00 0.00 C ATOM 899 O THR A 58 -4.230 2.083 -1.499 1.00 0.00 O ATOM 900 CB THR A 58 -2.730 4.152 -3.237 1.00 0.00 C ATOM 901 OG1 THR A 58 -2.425 5.482 -2.853 1.00 0.00 O ATOM 902 CG2 THR A 58 -2.219 3.954 -4.647 1.00 0.00 C ATOM 0 H THR A 58 -4.156 5.273 -1.529 1.00 0.00 H new ATOM 0 HA THR A 58 -4.716 4.022 -4.057 1.00 0.00 H new ATOM 0 HB THR A 58 -2.239 3.430 -2.584 1.00 0.00 H new ATOM 0 HG1 THR A 58 -2.917 6.108 -3.424 1.00 0.00 H new ATOM 0 HG21 THR A 58 -1.150 4.165 -4.680 1.00 0.00 H new ATOM 0 HG22 THR A 58 -2.395 2.924 -4.956 1.00 0.00 H new ATOM 0 HG23 THR A 58 -2.743 4.630 -5.322 1.00 0.00 H new ATOM 910 N THR A 59 -4.878 1.589 -3.594 1.00 0.00 N ATOM 911 CA THR A 59 -5.120 0.180 -3.298 1.00 0.00 C ATOM 912 C THR A 59 -4.272 -0.721 -4.192 1.00 0.00 C ATOM 913 O THR A 59 -4.242 -0.553 -5.412 1.00 0.00 O ATOM 914 CB THR A 59 -6.602 -0.163 -3.467 1.00 0.00 C ATOM 915 OG1 THR A 59 -7.272 0.845 -4.204 1.00 0.00 O ATOM 916 CG2 THR A 59 -7.328 -0.331 -2.151 1.00 0.00 C ATOM 0 H THR A 59 -5.064 1.857 -4.560 1.00 0.00 H new ATOM 0 HA THR A 59 -4.835 0.006 -2.260 1.00 0.00 H new ATOM 0 HB THR A 59 -6.620 -1.114 -3.999 1.00 0.00 H new ATOM 0 HG1 THR A 59 -6.716 1.120 -4.962 1.00 0.00 H new ATOM 0 HG21 THR A 59 -8.374 -0.573 -2.341 1.00 0.00 H new ATOM 0 HG22 THR A 59 -6.866 -1.137 -1.581 1.00 0.00 H new ATOM 0 HG23 THR A 59 -7.268 0.596 -1.581 1.00 0.00 H new ATOM 924 N VAL A 60 -3.590 -1.681 -3.576 1.00 0.00 N ATOM 925 CA VAL A 60 -2.746 -2.616 -4.310 1.00 0.00 C ATOM 926 C VAL A 60 -3.486 -3.924 -4.576 1.00 0.00 C ATOM 927 O VAL A 60 -4.040 -4.531 -3.657 1.00 0.00 O ATOM 928 CB VAL A 60 -1.444 -2.916 -3.545 1.00 0.00 C ATOM 929 CG1 VAL A 60 -0.552 -3.852 -4.346 1.00 0.00 C ATOM 930 CG2 VAL A 60 -0.714 -1.624 -3.214 1.00 0.00 C ATOM 0 H VAL A 60 -3.606 -1.832 -2.567 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.495 -2.144 -5.260 1.00 0.00 H new ATOM 0 HB VAL A 60 -1.700 -3.414 -2.610 1.00 0.00 H new ATOM 0 HG11 VAL A 60 0.362 -4.050 -3.787 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.078 -4.790 -4.527 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -0.300 -3.388 -5.299 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.204 -1.853 -2.673 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.470 -1.097 -4.137 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.352 -0.994 -2.594 1.00 0.00 H new ATOM 940 N GLN A 61 -3.495 -4.346 -5.840 1.00 0.00 N ATOM 941 CA GLN A 61 -4.171 -5.578 -6.239 1.00 0.00 C ATOM 942 C GLN A 61 -3.173 -6.630 -6.709 1.00 0.00 C ATOM 943 O GLN A 61 -2.961 -6.806 -7.909 1.00 0.00 O ATOM 944 CB GLN A 61 -5.173 -5.291 -7.358 1.00 0.00 C ATOM 945 CG GLN A 61 -6.616 -5.255 -6.893 1.00 0.00 C ATOM 946 CD GLN A 61 -7.194 -3.854 -6.905 1.00 0.00 C ATOM 947 OE1 GLN A 61 -8.359 -3.652 -7.244 1.00 0.00 O ATOM 948 NE2 GLN A 61 -6.374 -2.875 -6.541 1.00 0.00 N ATOM 0 H GLN A 61 -3.040 -3.850 -6.607 1.00 0.00 H new ATOM 0 HA GLN A 61 -4.697 -5.966 -5.367 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -4.925 -4.334 -7.818 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -5.069 -6.053 -8.131 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -7.218 -5.898 -7.535 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -6.680 -5.662 -5.884 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -5.415 -3.088 -6.267 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -6.703 -1.910 -6.535 1.00 0.00 H new ATOM 957 N GLY A 62 -2.567 -7.333 -5.761 1.00 0.00 N ATOM 958 CA GLY A 62 -1.607 -8.364 -6.110 1.00 0.00 C ATOM 959 C GLY A 62 -0.810 -8.851 -4.916 1.00 0.00 C ATOM 960 O GLY A 62 -0.448 -10.025 -4.839 1.00 0.00 O ATOM 0 H GLY A 62 -2.722 -7.209 -4.760 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -2.133 -9.207 -6.559 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -0.923 -7.977 -6.865 1.00 0.00 H new ATOM 964 N ILE A 63 -0.533 -7.945 -3.987 1.00 0.00 N ATOM 965 CA ILE A 63 0.229 -8.281 -2.792 1.00 0.00 C ATOM 966 C ILE A 63 -0.394 -9.460 -2.050 1.00 0.00 C ATOM 967 O ILE A 63 -1.616 -9.577 -1.955 1.00 0.00 O ATOM 968 CB ILE A 63 0.335 -7.065 -1.850 1.00 0.00 C ATOM 969 CG1 ILE A 63 1.110 -5.943 -2.545 1.00 0.00 C ATOM 970 CG2 ILE A 63 0.997 -7.442 -0.530 1.00 0.00 C ATOM 971 CD1 ILE A 63 2.563 -6.275 -2.787 1.00 0.00 C ATOM 0 H ILE A 63 -0.826 -6.969 -4.039 1.00 0.00 H new ATOM 0 HA ILE A 63 1.230 -8.567 -3.113 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.672 -6.715 -1.620 1.00 0.00 H new ATOM 0 HG12 ILE A 63 0.633 -5.720 -3.499 1.00 0.00 H new ATOM 0 HG13 ILE A 63 1.048 -5.040 -1.938 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.057 -6.563 0.111 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.407 -8.213 -0.035 1.00 0.00 H new ATOM 0 HG23 ILE A 63 2.001 -7.820 -0.722 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.050 -5.435 -3.283 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.055 -6.470 -1.834 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.634 -7.160 -3.419 1.00 0.00 H new ATOM 983 N ALA A 64 0.462 -10.335 -1.534 1.00 0.00 N ATOM 984 CA ALA A 64 0.015 -11.513 -0.806 1.00 0.00 C ATOM 985 C ALA A 64 -0.211 -11.203 0.669 1.00 0.00 C ATOM 986 O ALA A 64 0.571 -10.482 1.290 1.00 0.00 O ATOM 987 CB ALA A 64 1.026 -12.639 -0.958 1.00 0.00 C ATOM 0 H ALA A 64 1.476 -10.248 -1.608 1.00 0.00 H new ATOM 0 HA ALA A 64 -0.938 -11.828 -1.231 1.00 0.00 H new ATOM 0 HB1 ALA A 64 0.680 -13.515 -0.409 1.00 0.00 H new ATOM 0 HB2 ALA A 64 1.134 -12.891 -2.013 1.00 0.00 H new ATOM 0 HB3 ALA A 64 1.989 -12.319 -0.561 1.00 0.00 H new ATOM 993 N ASP A 65 -1.281 -11.758 1.225 1.00 0.00 N ATOM 994 CA ASP A 65 -1.608 -11.549 2.631 1.00 0.00 C ATOM 995 C ASP A 65 -0.493 -12.071 3.533 1.00 0.00 C ATOM 996 O ASP A 65 -0.376 -11.664 4.689 1.00 0.00 O ATOM 997 CB ASP A 65 -2.925 -12.245 2.978 1.00 0.00 C ATOM 998 CG ASP A 65 -2.979 -13.670 2.461 1.00 0.00 C ATOM 999 OD1 ASP A 65 -1.904 -14.250 2.207 1.00 0.00 O ATOM 1000 OD2 ASP A 65 -4.098 -14.204 2.309 1.00 0.00 O ATOM 0 H ASP A 65 -1.938 -12.357 0.724 1.00 0.00 H new ATOM 0 HA ASP A 65 -1.715 -10.477 2.798 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.057 -12.249 4.060 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -3.755 -11.677 2.558 1.00 0.00 H new ATOM 1005 N ASP A 66 0.326 -12.972 2.997 1.00 0.00 N ATOM 1006 CA ASP A 66 1.431 -13.546 3.753 1.00 0.00 C ATOM 1007 C ASP A 66 2.450 -12.475 4.120 1.00 0.00 C ATOM 1008 O ASP A 66 3.134 -12.576 5.139 1.00 0.00 O ATOM 1009 CB ASP A 66 2.108 -14.656 2.947 1.00 0.00 C ATOM 1010 CG ASP A 66 3.106 -15.444 3.773 1.00 0.00 C ATOM 1011 OD1 ASP A 66 2.856 -15.637 4.982 1.00 0.00 O ATOM 1012 OD2 ASP A 66 4.138 -15.869 3.211 1.00 0.00 O ATOM 0 H ASP A 66 0.244 -13.319 2.041 1.00 0.00 H new ATOM 0 HA ASP A 66 1.028 -13.970 4.672 1.00 0.00 H new ATOM 0 HB2 ASP A 66 1.348 -15.333 2.557 1.00 0.00 H new ATOM 0 HB3 ASP A 66 2.617 -14.219 2.088 1.00 0.00 H new ATOM 1017 N TYR A 67 2.548 -11.447 3.281 1.00 0.00 N ATOM 1018 CA TYR A 67 3.484 -10.354 3.514 1.00 0.00 C ATOM 1019 C TYR A 67 3.325 -9.794 4.924 1.00 0.00 C ATOM 1020 O TYR A 67 2.211 -9.684 5.435 1.00 0.00 O ATOM 1021 CB TYR A 67 3.253 -9.234 2.497 1.00 0.00 C ATOM 1022 CG TYR A 67 3.553 -9.607 1.058 1.00 0.00 C ATOM 1023 CD1 TYR A 67 3.725 -10.931 0.663 1.00 0.00 C ATOM 1024 CD2 TYR A 67 3.657 -8.620 0.089 1.00 0.00 C ATOM 1025 CE1 TYR A 67 3.993 -11.253 -0.655 1.00 0.00 C ATOM 1026 CE2 TYR A 67 3.922 -8.933 -1.229 1.00 0.00 C ATOM 1027 CZ TYR A 67 4.091 -10.251 -1.597 1.00 0.00 C ATOM 1028 OH TYR A 67 4.356 -10.567 -2.909 1.00 0.00 O ATOM 0 H TYR A 67 1.989 -11.349 2.433 1.00 0.00 H new ATOM 0 HA TYR A 67 4.494 -10.747 3.401 1.00 0.00 H new ATOM 0 HB2 TYR A 67 2.214 -8.910 2.564 1.00 0.00 H new ATOM 0 HB3 TYR A 67 3.872 -8.380 2.772 1.00 0.00 H new ATOM 0 HD1 TYR A 67 3.648 -11.719 1.397 1.00 0.00 H new ATOM 0 HD2 TYR A 67 3.528 -7.586 0.371 1.00 0.00 H new ATOM 0 HE1 TYR A 67 4.125 -12.285 -0.945 1.00 0.00 H new ATOM 0 HE2 TYR A 67 3.997 -8.149 -1.968 1.00 0.00 H new ATOM 0 HH TYR A 67 4.391 -9.746 -3.443 1.00 0.00 H new ATOM 1038 N ASP A 68 4.442 -9.433 5.544 1.00 0.00 N ATOM 1039 CA ASP A 68 4.415 -8.876 6.891 1.00 0.00 C ATOM 1040 C ASP A 68 3.594 -7.590 6.916 1.00 0.00 C ATOM 1041 O ASP A 68 4.070 -6.533 6.507 1.00 0.00 O ATOM 1042 CB ASP A 68 5.837 -8.600 7.381 1.00 0.00 C ATOM 1043 CG ASP A 68 6.560 -9.867 7.795 1.00 0.00 C ATOM 1044 OD1 ASP A 68 6.053 -10.575 8.691 1.00 0.00 O ATOM 1045 OD2 ASP A 68 7.632 -10.154 7.221 1.00 0.00 O ATOM 0 H ASP A 68 5.374 -9.515 5.138 1.00 0.00 H new ATOM 0 HA ASP A 68 3.950 -9.603 7.557 1.00 0.00 H new ATOM 0 HB2 ASP A 68 6.401 -8.104 6.591 1.00 0.00 H new ATOM 0 HB3 ASP A 68 5.801 -7.913 8.226 1.00 0.00 H new ATOM 1050 N LYS A 69 2.354 -7.694 7.393 1.00 0.00 N ATOM 1051 CA LYS A 69 1.452 -6.545 7.467 1.00 0.00 C ATOM 1052 C LYS A 69 2.177 -5.295 7.956 1.00 0.00 C ATOM 1053 O LYS A 69 1.991 -4.205 7.416 1.00 0.00 O ATOM 1054 CB LYS A 69 0.274 -6.856 8.392 1.00 0.00 C ATOM 1055 CG LYS A 69 -0.557 -8.045 7.939 1.00 0.00 C ATOM 1056 CD LYS A 69 -0.860 -8.989 9.092 1.00 0.00 C ATOM 1057 CE LYS A 69 -2.294 -9.492 9.039 1.00 0.00 C ATOM 1058 NZ LYS A 69 -2.387 -10.842 8.416 1.00 0.00 N ATOM 0 H LYS A 69 1.950 -8.566 7.735 1.00 0.00 H new ATOM 0 HA LYS A 69 1.082 -6.350 6.461 1.00 0.00 H new ATOM 0 HB2 LYS A 69 0.652 -7.049 9.396 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -0.368 -5.978 8.457 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.491 -7.691 7.503 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -0.024 -8.585 7.157 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -0.175 -9.836 9.060 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -0.688 -8.476 10.038 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.703 -9.529 10.049 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.905 -8.788 8.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.381 -11.149 8.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -2.020 -10.802 7.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -1.825 -11.519 8.970 1.00 0.00 H new ATOM 1072 N LYS A 70 3.007 -5.460 8.980 1.00 0.00 N ATOM 1073 CA LYS A 70 3.760 -4.344 9.536 1.00 0.00 C ATOM 1074 C LYS A 70 4.835 -3.877 8.559 1.00 0.00 C ATOM 1075 O LYS A 70 5.056 -2.679 8.387 1.00 0.00 O ATOM 1076 CB LYS A 70 4.402 -4.746 10.866 1.00 0.00 C ATOM 1077 CG LYS A 70 5.378 -5.905 10.745 1.00 0.00 C ATOM 1078 CD LYS A 70 5.686 -6.516 12.103 1.00 0.00 C ATOM 1079 CE LYS A 70 4.440 -7.106 12.744 1.00 0.00 C ATOM 1080 NZ LYS A 70 3.659 -7.933 11.784 1.00 0.00 N ATOM 0 H LYS A 70 3.175 -6.354 9.441 1.00 0.00 H new ATOM 0 HA LYS A 70 3.068 -3.520 9.710 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.924 -3.885 11.283 1.00 0.00 H new ATOM 0 HB3 LYS A 70 3.617 -5.016 11.572 1.00 0.00 H new ATOM 0 HG2 LYS A 70 4.960 -6.667 10.088 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.302 -5.558 10.283 1.00 0.00 H new ATOM 0 HD2 LYS A 70 6.441 -7.294 11.990 1.00 0.00 H new ATOM 0 HD3 LYS A 70 6.108 -5.754 12.759 1.00 0.00 H new ATOM 0 HE2 LYS A 70 4.727 -7.717 13.600 1.00 0.00 H new ATOM 0 HE3 LYS A 70 3.811 -6.301 13.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 3.109 -8.645 12.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 3.012 -7.322 11.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 4.310 -8.411 11.128 1.00 0.00 H new ATOM 1094 N LYS A 71 5.499 -4.831 7.917 1.00 0.00 N ATOM 1095 CA LYS A 71 6.552 -4.517 6.956 1.00 0.00 C ATOM 1096 C LYS A 71 5.991 -3.874 5.686 1.00 0.00 C ATOM 1097 O LYS A 71 6.750 -3.481 4.800 1.00 0.00 O ATOM 1098 CB LYS A 71 7.330 -5.783 6.596 1.00 0.00 C ATOM 1099 CG LYS A 71 8.733 -5.508 6.081 1.00 0.00 C ATOM 1100 CD LYS A 71 9.736 -6.514 6.625 1.00 0.00 C ATOM 1101 CE LYS A 71 10.561 -5.922 7.757 1.00 0.00 C ATOM 1102 NZ LYS A 71 9.703 -5.393 8.854 1.00 0.00 N ATOM 0 H LYS A 71 5.328 -5.828 8.044 1.00 0.00 H new ATOM 0 HA LYS A 71 7.221 -3.797 7.427 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.394 -6.423 7.476 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.776 -6.337 5.838 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.735 -5.544 4.992 1.00 0.00 H new ATOM 0 HG3 LYS A 71 9.035 -4.501 6.367 1.00 0.00 H new ATOM 0 HD2 LYS A 71 9.209 -7.399 6.982 1.00 0.00 H new ATOM 0 HD3 LYS A 71 10.398 -6.840 5.823 1.00 0.00 H new ATOM 0 HE2 LYS A 71 11.230 -6.685 8.155 1.00 0.00 H new ATOM 0 HE3 LYS A 71 11.188 -5.120 7.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 10.296 -5.155 9.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 9.207 -4.540 8.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 9.006 -6.115 9.128 1.00 0.00 H new ATOM 1116 N LEU A 72 4.666 -3.773 5.592 1.00 0.00 N ATOM 1117 CA LEU A 72 4.035 -3.181 4.418 1.00 0.00 C ATOM 1118 C LEU A 72 3.521 -1.777 4.711 1.00 0.00 C ATOM 1119 O LEU A 72 4.079 -0.798 4.222 1.00 0.00 O ATOM 1120 CB LEU A 72 2.888 -4.071 3.929 1.00 0.00 C ATOM 1121 CG LEU A 72 3.316 -5.344 3.185 1.00 0.00 C ATOM 1122 CD1 LEU A 72 4.768 -5.692 3.493 1.00 0.00 C ATOM 1123 CD2 LEU A 72 2.400 -6.503 3.547 1.00 0.00 C ATOM 0 H LEU A 72 4.015 -4.091 6.310 1.00 0.00 H new ATOM 0 HA LEU A 72 4.790 -3.106 3.635 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.282 -4.359 4.788 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.249 -3.483 3.270 1.00 0.00 H new ATOM 0 HG LEU A 72 3.233 -5.157 2.114 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.047 -6.597 2.954 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.413 -4.871 3.181 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.883 -5.857 4.564 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.717 -7.398 3.011 1.00 0.00 H new ATOM 0 HD22 LEU A 72 2.451 -6.685 4.620 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.375 -6.257 3.269 1.00 0.00 H new ATOM 1135 N VAL A 73 2.458 -1.681 5.501 1.00 0.00 N ATOM 1136 CA VAL A 73 1.881 -0.385 5.837 1.00 0.00 C ATOM 1137 C VAL A 73 2.700 0.328 6.906 1.00 0.00 C ATOM 1138 O VAL A 73 2.937 1.532 6.812 1.00 0.00 O ATOM 1139 CB VAL A 73 0.420 -0.513 6.314 1.00 0.00 C ATOM 1140 CG1 VAL A 73 -0.469 -1.013 5.185 1.00 0.00 C ATOM 1141 CG2 VAL A 73 0.325 -1.432 7.523 1.00 0.00 C ATOM 0 H VAL A 73 1.981 -2.480 5.919 1.00 0.00 H new ATOM 0 HA VAL A 73 1.898 0.206 4.921 1.00 0.00 H new ATOM 0 HB VAL A 73 0.070 0.475 6.613 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -1.496 -1.097 5.541 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -0.429 -0.311 4.352 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -0.119 -1.990 4.852 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -0.715 -1.507 7.842 1.00 0.00 H new ATOM 0 HG22 VAL A 73 0.696 -2.422 7.257 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.926 -1.026 8.337 1.00 0.00 H new ATOM 1151 N LYS A 74 3.145 -0.413 7.918 1.00 0.00 N ATOM 1152 CA LYS A 74 3.950 0.178 8.981 1.00 0.00 C ATOM 1153 C LYS A 74 5.263 0.690 8.406 1.00 0.00 C ATOM 1154 O LYS A 74 5.671 1.820 8.667 1.00 0.00 O ATOM 1155 CB LYS A 74 4.215 -0.834 10.096 1.00 0.00 C ATOM 1156 CG LYS A 74 4.039 -0.259 11.493 1.00 0.00 C ATOM 1157 CD LYS A 74 5.361 0.219 12.068 1.00 0.00 C ATOM 1158 CE LYS A 74 6.232 -0.947 12.506 1.00 0.00 C ATOM 1159 NZ LYS A 74 7.682 -0.609 12.452 1.00 0.00 N ATOM 0 H LYS A 74 2.964 -1.411 8.023 1.00 0.00 H new ATOM 0 HA LYS A 74 3.397 1.013 9.412 1.00 0.00 H new ATOM 0 HB2 LYS A 74 3.541 -1.682 9.973 1.00 0.00 H new ATOM 0 HB3 LYS A 74 5.231 -1.216 9.995 1.00 0.00 H new ATOM 0 HG2 LYS A 74 3.334 0.572 11.460 1.00 0.00 H new ATOM 0 HG3 LYS A 74 3.609 -1.017 12.148 1.00 0.00 H new ATOM 0 HD2 LYS A 74 5.891 0.810 11.321 1.00 0.00 H new ATOM 0 HD3 LYS A 74 5.173 0.874 12.919 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.965 -1.238 13.522 1.00 0.00 H new ATOM 0 HE3 LYS A 74 6.036 -1.807 11.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 8.242 -1.430 12.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 7.943 -0.356 11.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 7.875 0.195 13.082 1.00 0.00 H new ATOM 1173 N ALA A 75 5.909 -0.147 7.597 1.00 0.00 N ATOM 1174 CA ALA A 75 7.161 0.229 6.959 1.00 0.00 C ATOM 1175 C ALA A 75 6.937 1.428 6.049 1.00 0.00 C ATOM 1176 O ALA A 75 7.707 2.389 6.066 1.00 0.00 O ATOM 1177 CB ALA A 75 7.732 -0.940 6.171 1.00 0.00 C ATOM 0 H ALA A 75 5.584 -1.087 7.370 1.00 0.00 H new ATOM 0 HA ALA A 75 7.881 0.501 7.730 1.00 0.00 H new ATOM 0 HB1 ALA A 75 8.668 -0.639 5.701 1.00 0.00 H new ATOM 0 HB2 ALA A 75 7.916 -1.777 6.844 1.00 0.00 H new ATOM 0 HB3 ALA A 75 7.021 -1.242 5.402 1.00 0.00 H new ATOM 1183 N PHE A 76 5.860 1.370 5.263 1.00 0.00 N ATOM 1184 CA PHE A 76 5.508 2.459 4.352 1.00 0.00 C ATOM 1185 C PHE A 76 5.625 3.812 5.052 1.00 0.00 C ATOM 1186 O PHE A 76 6.344 4.700 4.597 1.00 0.00 O ATOM 1187 CB PHE A 76 4.079 2.272 3.835 1.00 0.00 C ATOM 1188 CG PHE A 76 3.848 2.869 2.479 1.00 0.00 C ATOM 1189 CD1 PHE A 76 4.501 2.365 1.367 1.00 0.00 C ATOM 1190 CD2 PHE A 76 2.984 3.938 2.317 1.00 0.00 C ATOM 1191 CE1 PHE A 76 4.296 2.915 0.118 1.00 0.00 C ATOM 1192 CE2 PHE A 76 2.776 4.495 1.070 1.00 0.00 C ATOM 1193 CZ PHE A 76 3.434 3.983 -0.031 1.00 0.00 C ATOM 0 H PHE A 76 5.216 0.579 5.240 1.00 0.00 H new ATOM 0 HA PHE A 76 6.203 2.438 3.513 1.00 0.00 H new ATOM 0 HB2 PHE A 76 3.852 1.207 3.797 1.00 0.00 H new ATOM 0 HB3 PHE A 76 3.383 2.721 4.544 1.00 0.00 H new ATOM 0 HD1 PHE A 76 5.179 1.532 1.478 1.00 0.00 H new ATOM 0 HD2 PHE A 76 2.467 4.341 3.175 1.00 0.00 H new ATOM 0 HE1 PHE A 76 4.809 2.510 -0.742 1.00 0.00 H new ATOM 0 HE2 PHE A 76 2.100 5.329 0.956 1.00 0.00 H new ATOM 0 HZ PHE A 76 3.274 4.417 -1.007 1.00 0.00 H new ATOM 1203 N LYS A 77 4.912 3.956 6.167 1.00 0.00 N ATOM 1204 CA LYS A 77 4.933 5.195 6.940 1.00 0.00 C ATOM 1205 C LYS A 77 6.358 5.575 7.335 1.00 0.00 C ATOM 1206 O LYS A 77 6.650 6.739 7.606 1.00 0.00 O ATOM 1207 CB LYS A 77 4.068 5.053 8.193 1.00 0.00 C ATOM 1208 CG LYS A 77 2.613 4.728 7.895 1.00 0.00 C ATOM 1209 CD LYS A 77 1.970 3.954 9.036 1.00 0.00 C ATOM 1210 CE LYS A 77 1.111 4.856 9.907 1.00 0.00 C ATOM 1211 NZ LYS A 77 1.890 5.995 10.467 1.00 0.00 N ATOM 0 H LYS A 77 4.312 3.229 6.556 1.00 0.00 H new ATOM 0 HA LYS A 77 4.528 5.988 6.311 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.485 4.269 8.825 1.00 0.00 H new ATOM 0 HB3 LYS A 77 4.115 5.981 8.764 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.060 5.652 7.724 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.550 4.144 6.977 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.358 3.148 8.631 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.746 3.490 9.645 1.00 0.00 H new ATOM 0 HE2 LYS A 77 0.277 5.241 9.320 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.684 4.273 10.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.313 6.497 11.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.754 5.635 10.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.147 6.650 9.701 1.00 0.00 H new ATOM 1225 N LYS A 78 7.245 4.588 7.364 1.00 0.00 N ATOM 1226 CA LYS A 78 8.635 4.825 7.722 1.00 0.00 C ATOM 1227 C LYS A 78 9.404 5.413 6.544 1.00 0.00 C ATOM 1228 O LYS A 78 10.480 5.984 6.716 1.00 0.00 O ATOM 1229 CB LYS A 78 9.294 3.520 8.168 1.00 0.00 C ATOM 1230 CG LYS A 78 10.513 3.724 9.053 1.00 0.00 C ATOM 1231 CD LYS A 78 10.648 2.609 10.079 1.00 0.00 C ATOM 1232 CE LYS A 78 9.998 2.986 11.400 1.00 0.00 C ATOM 1233 NZ LYS A 78 10.797 3.997 12.145 1.00 0.00 N ATOM 0 H LYS A 78 7.025 3.617 7.144 1.00 0.00 H new ATOM 0 HA LYS A 78 8.658 5.539 8.545 1.00 0.00 H new ATOM 0 HB2 LYS A 78 8.561 2.919 8.706 1.00 0.00 H new ATOM 0 HB3 LYS A 78 9.587 2.951 7.286 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.410 3.763 8.435 1.00 0.00 H new ATOM 0 HG3 LYS A 78 10.437 4.684 9.564 1.00 0.00 H new ATOM 0 HD2 LYS A 78 10.188 1.700 9.692 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.703 2.388 10.241 1.00 0.00 H new ATOM 0 HE2 LYS A 78 8.999 3.379 11.213 1.00 0.00 H new ATOM 0 HE3 LYS A 78 9.880 2.093 12.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 10.481 4.028 13.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 11.804 3.738 12.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 10.666 4.932 11.710 1.00 0.00 H new ATOM 1247 N LYS A 79 8.846 5.264 5.345 1.00 0.00 N ATOM 1248 CA LYS A 79 9.487 5.775 4.141 1.00 0.00 C ATOM 1249 C LYS A 79 8.744 6.987 3.583 1.00 0.00 C ATOM 1250 O LYS A 79 9.364 7.964 3.164 1.00 0.00 O ATOM 1251 CB LYS A 79 9.565 4.679 3.077 1.00 0.00 C ATOM 1252 CG LYS A 79 10.206 5.139 1.776 1.00 0.00 C ATOM 1253 CD LYS A 79 10.511 3.969 0.856 1.00 0.00 C ATOM 1254 CE LYS A 79 11.152 4.432 -0.441 1.00 0.00 C ATOM 1255 NZ LYS A 79 12.628 4.580 -0.311 1.00 0.00 N ATOM 0 H LYS A 79 7.955 4.795 5.184 1.00 0.00 H new ATOM 0 HA LYS A 79 10.495 6.090 4.411 1.00 0.00 H new ATOM 0 HB2 LYS A 79 10.133 3.838 3.475 1.00 0.00 H new ATOM 0 HB3 LYS A 79 8.559 4.315 2.868 1.00 0.00 H new ATOM 0 HG2 LYS A 79 9.540 5.837 1.269 1.00 0.00 H new ATOM 0 HG3 LYS A 79 11.127 5.679 1.995 1.00 0.00 H new ATOM 0 HD2 LYS A 79 11.177 3.270 1.363 1.00 0.00 H new ATOM 0 HD3 LYS A 79 9.590 3.429 0.635 1.00 0.00 H new ATOM 0 HE2 LYS A 79 10.928 3.717 -1.232 1.00 0.00 H new ATOM 0 HE3 LYS A 79 10.717 5.385 -0.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 12.951 5.371 -0.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 12.872 4.769 0.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 13.093 3.703 -0.621 1.00 0.00 H new ATOM 1269 N PHE A 80 7.417 6.914 3.565 1.00 0.00 N ATOM 1270 CA PHE A 80 6.601 8.006 3.038 1.00 0.00 C ATOM 1271 C PHE A 80 5.735 8.641 4.124 1.00 0.00 C ATOM 1272 O PHE A 80 5.225 9.748 3.947 1.00 0.00 O ATOM 1273 CB PHE A 80 5.713 7.502 1.897 1.00 0.00 C ATOM 1274 CG PHE A 80 6.352 6.426 1.065 1.00 0.00 C ATOM 1275 CD1 PHE A 80 6.381 5.114 1.512 1.00 0.00 C ATOM 1276 CD2 PHE A 80 6.924 6.726 -0.159 1.00 0.00 C ATOM 1277 CE1 PHE A 80 6.970 4.122 0.754 1.00 0.00 C ATOM 1278 CE2 PHE A 80 7.516 5.739 -0.923 1.00 0.00 C ATOM 1279 CZ PHE A 80 7.539 4.435 -0.466 1.00 0.00 C ATOM 0 H PHE A 80 6.884 6.114 3.907 1.00 0.00 H new ATOM 0 HA PHE A 80 7.281 8.769 2.661 1.00 0.00 H new ATOM 0 HB2 PHE A 80 4.781 7.121 2.315 1.00 0.00 H new ATOM 0 HB3 PHE A 80 5.453 8.342 1.252 1.00 0.00 H new ATOM 0 HD1 PHE A 80 5.937 4.865 2.465 1.00 0.00 H new ATOM 0 HD2 PHE A 80 6.907 7.743 -0.521 1.00 0.00 H new ATOM 0 HE1 PHE A 80 6.986 3.104 1.113 1.00 0.00 H new ATOM 0 HE2 PHE A 80 7.960 5.986 -1.876 1.00 0.00 H new ATOM 0 HZ PHE A 80 8.001 3.661 -1.061 1.00 0.00 H new ATOM 1289 N ALA A 81 5.566 7.943 5.242 1.00 0.00 N ATOM 1290 CA ALA A 81 4.753 8.454 6.341 1.00 0.00 C ATOM 1291 C ALA A 81 3.290 8.558 5.931 1.00 0.00 C ATOM 1292 O ALA A 81 2.572 9.454 6.375 1.00 0.00 O ATOM 1293 CB ALA A 81 5.273 9.808 6.800 1.00 0.00 C ATOM 0 H ALA A 81 5.979 7.026 5.411 1.00 0.00 H new ATOM 0 HA ALA A 81 4.824 7.752 7.172 1.00 0.00 H new ATOM 0 HB1 ALA A 81 4.656 10.176 7.620 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.304 9.706 7.139 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.232 10.514 5.970 1.00 0.00 H new ATOM 1299 N CYS A 82 2.855 7.636 5.080 1.00 0.00 N ATOM 1300 CA CYS A 82 1.476 7.621 4.608 1.00 0.00 C ATOM 1301 C CYS A 82 0.657 6.579 5.363 1.00 0.00 C ATOM 1302 O CYS A 82 1.162 5.513 5.712 1.00 0.00 O ATOM 1303 CB CYS A 82 1.432 7.333 3.107 1.00 0.00 C ATOM 1304 SG CYS A 82 2.372 8.507 2.104 1.00 0.00 S ATOM 0 H CYS A 82 3.438 6.889 4.703 1.00 0.00 H new ATOM 0 HA CYS A 82 1.042 8.603 4.794 1.00 0.00 H new ATOM 0 HB2 CYS A 82 1.817 6.329 2.929 1.00 0.00 H new ATOM 0 HB3 CYS A 82 0.393 7.339 2.777 1.00 0.00 H new ATOM 0 HG CYS A 82 3.379 8.957 2.792 1.00 0.00 H new ATOM 1310 N ASN A 83 -0.609 6.896 5.613 1.00 0.00 N ATOM 1311 CA ASN A 83 -1.496 5.989 6.329 1.00 0.00 C ATOM 1312 C ASN A 83 -1.786 4.746 5.496 1.00 0.00 C ATOM 1313 O ASN A 83 -2.645 4.763 4.613 1.00 0.00 O ATOM 1314 CB ASN A 83 -2.803 6.697 6.689 1.00 0.00 C ATOM 1315 CG ASN A 83 -2.797 7.228 8.108 1.00 0.00 C ATOM 1316 OD1 ASN A 83 -3.112 8.394 8.348 1.00 0.00 O ATOM 1317 ND2 ASN A 83 -2.437 6.374 9.057 1.00 0.00 N ATOM 0 H ASN A 83 -1.043 7.775 5.330 1.00 0.00 H new ATOM 0 HA ASN A 83 -0.997 5.680 7.248 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -2.970 7.521 5.996 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -3.635 6.004 6.566 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -2.413 6.675 10.031 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -2.184 5.417 8.812 1.00 0.00 H new ATOM 1324 N GLY A 84 -1.062 3.671 5.781 1.00 0.00 N ATOM 1325 CA GLY A 84 -1.253 2.433 5.049 1.00 0.00 C ATOM 1326 C GLY A 84 -2.090 1.428 5.815 1.00 0.00 C ATOM 1327 O GLY A 84 -1.938 1.277 7.027 1.00 0.00 O ATOM 0 H GLY A 84 -0.346 3.634 6.506 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -1.734 2.649 4.095 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -0.281 1.994 4.824 1.00 0.00 H new ATOM 1331 N THR A 85 -2.977 0.741 5.104 1.00 0.00 N ATOM 1332 CA THR A 85 -3.842 -0.257 5.723 1.00 0.00 C ATOM 1333 C THR A 85 -3.987 -1.485 4.829 1.00 0.00 C ATOM 1334 O THR A 85 -3.952 -1.380 3.605 1.00 0.00 O ATOM 1335 CB THR A 85 -5.219 0.341 6.015 1.00 0.00 C ATOM 1336 OG1 THR A 85 -5.838 0.780 4.818 1.00 0.00 O ATOM 1337 CG2 THR A 85 -5.171 1.518 6.964 1.00 0.00 C ATOM 0 H THR A 85 -3.116 0.856 4.100 1.00 0.00 H new ATOM 0 HA THR A 85 -3.381 -0.567 6.661 1.00 0.00 H new ATOM 0 HB THR A 85 -5.789 -0.461 6.485 1.00 0.00 H new ATOM 0 HG1 THR A 85 -5.172 1.215 4.246 1.00 0.00 H new ATOM 0 HG21 THR A 85 -6.181 1.894 7.128 1.00 0.00 H new ATOM 0 HG22 THR A 85 -4.743 1.201 7.915 1.00 0.00 H new ATOM 0 HG23 THR A 85 -4.555 2.308 6.534 1.00 0.00 H new ATOM 1345 N VAL A 86 -4.154 -2.648 5.449 1.00 0.00 N ATOM 1346 CA VAL A 86 -4.311 -3.897 4.710 1.00 0.00 C ATOM 1347 C VAL A 86 -5.742 -4.418 4.826 1.00 0.00 C ATOM 1348 O VAL A 86 -6.089 -5.097 5.791 1.00 0.00 O ATOM 1349 CB VAL A 86 -3.331 -4.977 5.216 1.00 0.00 C ATOM 1350 CG1 VAL A 86 -3.546 -5.250 6.698 1.00 0.00 C ATOM 1351 CG2 VAL A 86 -3.475 -6.255 4.404 1.00 0.00 C ATOM 0 H VAL A 86 -4.184 -2.753 6.463 1.00 0.00 H new ATOM 0 HA VAL A 86 -4.088 -3.684 3.665 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.315 -4.604 5.085 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.845 -6.014 7.033 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.381 -4.333 7.264 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.566 -5.598 6.860 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.776 -7.003 4.776 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -4.493 -6.632 4.497 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -3.259 -6.047 3.356 1.00 0.00 H new ATOM 1361 N ILE A 87 -6.573 -4.089 3.841 1.00 0.00 N ATOM 1362 CA ILE A 87 -7.966 -4.521 3.844 1.00 0.00 C ATOM 1363 C ILE A 87 -8.227 -5.587 2.786 1.00 0.00 C ATOM 1364 O ILE A 87 -7.573 -5.617 1.743 1.00 0.00 O ATOM 1365 CB ILE A 87 -8.927 -3.339 3.595 1.00 0.00 C ATOM 1366 CG1 ILE A 87 -8.659 -2.707 2.227 1.00 0.00 C ATOM 1367 CG2 ILE A 87 -8.793 -2.300 4.696 1.00 0.00 C ATOM 1368 CD1 ILE A 87 -9.919 -2.393 1.452 1.00 0.00 C ATOM 0 H ILE A 87 -6.306 -3.526 3.033 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.152 -4.939 4.833 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.948 -3.720 3.604 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.088 -1.789 2.365 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -8.038 -3.383 1.638 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.478 -1.475 4.503 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -9.034 -2.755 5.657 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -7.770 -1.924 4.719 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -9.655 -1.948 0.493 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -10.481 -3.312 1.283 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -10.531 -1.693 2.021 1.00 0.00 H new ATOM 1380 N GLU A 88 -9.201 -6.451 3.057 1.00 0.00 N ATOM 1381 CA GLU A 88 -9.568 -7.507 2.124 1.00 0.00 C ATOM 1382 C GLU A 88 -10.791 -7.086 1.318 1.00 0.00 C ATOM 1383 O GLU A 88 -11.904 -7.552 1.564 1.00 0.00 O ATOM 1384 CB GLU A 88 -9.856 -8.808 2.875 1.00 0.00 C ATOM 1385 CG GLU A 88 -9.603 -10.055 2.045 1.00 0.00 C ATOM 1386 CD GLU A 88 -9.877 -11.333 2.813 1.00 0.00 C ATOM 1387 OE1 GLU A 88 -11.061 -11.610 3.100 1.00 0.00 O ATOM 1388 OE2 GLU A 88 -8.909 -12.057 3.127 1.00 0.00 O ATOM 0 H GLU A 88 -9.750 -6.439 3.917 1.00 0.00 H new ATOM 0 HA GLU A 88 -8.734 -7.677 1.443 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -9.237 -8.846 3.771 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -10.895 -8.805 3.205 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -10.232 -10.028 1.155 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -8.568 -10.056 1.704 1.00 0.00 H new ATOM 1395 N HIS A 89 -10.575 -6.189 0.362 1.00 0.00 N ATOM 1396 CA HIS A 89 -11.652 -5.682 -0.475 1.00 0.00 C ATOM 1397 C HIS A 89 -12.456 -6.819 -1.105 1.00 0.00 C ATOM 1398 O HIS A 89 -11.891 -7.818 -1.549 1.00 0.00 O ATOM 1399 CB HIS A 89 -11.081 -4.777 -1.566 1.00 0.00 C ATOM 1400 CG HIS A 89 -11.997 -3.661 -1.950 1.00 0.00 C ATOM 1401 ND1 HIS A 89 -12.667 -3.624 -3.152 1.00 0.00 N ATOM 1402 CD2 HIS A 89 -12.363 -2.542 -1.280 1.00 0.00 C ATOM 1403 CE1 HIS A 89 -13.407 -2.531 -3.209 1.00 0.00 C ATOM 1404 NE2 HIS A 89 -13.241 -1.857 -2.084 1.00 0.00 N ATOM 0 H HIS A 89 -9.658 -5.797 0.148 1.00 0.00 H new ATOM 0 HA HIS A 89 -12.328 -5.107 0.158 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -10.135 -4.359 -1.223 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -10.862 -5.378 -2.449 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -12.027 -2.244 -0.298 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -14.040 -2.238 -4.034 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -13.692 -0.972 -1.851 1.00 0.00 H new ATOM 1413 N PRO A 90 -13.794 -6.679 -1.153 1.00 0.00 N ATOM 1414 CA PRO A 90 -14.673 -7.695 -1.731 1.00 0.00 C ATOM 1415 C PRO A 90 -14.722 -7.621 -3.253 1.00 0.00 C ATOM 1416 O PRO A 90 -15.012 -8.613 -3.923 1.00 0.00 O ATOM 1417 CB PRO A 90 -16.034 -7.345 -1.136 1.00 0.00 C ATOM 1418 CG PRO A 90 -15.991 -5.867 -0.948 1.00 0.00 C ATOM 1419 CD PRO A 90 -14.555 -5.518 -0.645 1.00 0.00 C ATOM 0 HA PRO A 90 -14.337 -8.708 -1.509 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -16.845 -7.637 -1.803 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -16.198 -7.861 -0.190 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -16.335 -5.351 -1.844 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.646 -5.560 -0.132 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -14.255 -4.595 -1.141 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -14.396 -5.372 0.423 1.00 0.00 H new ATOM 1427 N GLU A 91 -14.437 -6.441 -3.794 1.00 0.00 N ATOM 1428 CA GLU A 91 -14.449 -6.244 -5.238 1.00 0.00 C ATOM 1429 C GLU A 91 -13.125 -6.679 -5.859 1.00 0.00 C ATOM 1430 O GLU A 91 -13.076 -7.062 -7.028 1.00 0.00 O ATOM 1431 CB GLU A 91 -14.734 -4.780 -5.577 1.00 0.00 C ATOM 1432 CG GLU A 91 -16.183 -4.376 -5.352 1.00 0.00 C ATOM 1433 CD GLU A 91 -16.568 -3.132 -6.131 1.00 0.00 C ATOM 1434 OE1 GLU A 91 -16.228 -2.019 -5.677 1.00 0.00 O ATOM 1435 OE2 GLU A 91 -17.210 -3.271 -7.193 1.00 0.00 O ATOM 0 H GLU A 91 -14.196 -5.609 -3.255 1.00 0.00 H new ATOM 0 HA GLU A 91 -15.244 -6.863 -5.655 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -14.089 -4.143 -4.971 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -14.472 -4.599 -6.620 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -16.836 -5.199 -5.643 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -16.347 -4.200 -4.289 1.00 0.00 H new ATOM 1442 N TYR A 92 -12.053 -6.621 -5.072 1.00 0.00 N ATOM 1443 CA TYR A 92 -10.733 -7.013 -5.556 1.00 0.00 C ATOM 1444 C TYR A 92 -10.257 -8.283 -4.861 1.00 0.00 C ATOM 1445 O TYR A 92 -9.863 -9.250 -5.512 1.00 0.00 O ATOM 1446 CB TYR A 92 -9.718 -5.888 -5.330 1.00 0.00 C ATOM 1447 CG TYR A 92 -10.279 -4.497 -5.535 1.00 0.00 C ATOM 1448 CD1 TYR A 92 -11.303 -4.263 -6.446 1.00 0.00 C ATOM 1449 CD2 TYR A 92 -9.782 -3.417 -4.817 1.00 0.00 C ATOM 1450 CE1 TYR A 92 -11.816 -2.993 -6.632 1.00 0.00 C ATOM 1451 CE2 TYR A 92 -10.288 -2.145 -4.998 1.00 0.00 C ATOM 1452 CZ TYR A 92 -11.305 -1.938 -5.906 1.00 0.00 C ATOM 1453 OH TYR A 92 -11.812 -0.672 -6.090 1.00 0.00 O ATOM 0 H TYR A 92 -12.073 -6.308 -4.101 1.00 0.00 H new ATOM 0 HA TYR A 92 -10.814 -7.207 -6.626 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -9.327 -5.964 -4.315 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -8.876 -6.032 -6.007 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -11.704 -5.087 -7.018 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -8.986 -3.575 -4.105 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -12.613 -2.828 -7.342 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -9.889 -1.317 -4.431 1.00 0.00 H new ATOM 0 HH TYR A 92 -11.344 -0.043 -5.502 1.00 0.00 H new ATOM 1463 N GLY A 93 -10.298 -8.273 -3.532 1.00 0.00 N ATOM 1464 CA GLY A 93 -9.870 -9.430 -2.769 1.00 0.00 C ATOM 1465 C GLY A 93 -8.436 -9.310 -2.290 1.00 0.00 C ATOM 1466 O GLY A 93 -7.500 -9.610 -3.031 1.00 0.00 O ATOM 0 H GLY A 93 -10.620 -7.484 -2.971 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -10.528 -9.558 -1.909 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -9.971 -10.325 -3.384 1.00 0.00 H new ATOM 1470 N GLU A 94 -8.263 -8.876 -1.046 1.00 0.00 N ATOM 1471 CA GLU A 94 -6.934 -8.719 -0.464 1.00 0.00 C ATOM 1472 C GLU A 94 -6.145 -7.626 -1.180 1.00 0.00 C ATOM 1473 O GLU A 94 -5.469 -7.885 -2.175 1.00 0.00 O ATOM 1474 CB GLU A 94 -6.168 -10.043 -0.524 1.00 0.00 C ATOM 1475 CG GLU A 94 -5.562 -10.455 0.808 1.00 0.00 C ATOM 1476 CD GLU A 94 -5.760 -11.928 1.108 1.00 0.00 C ATOM 1477 OE1 GLU A 94 -5.296 -12.764 0.304 1.00 0.00 O ATOM 1478 OE2 GLU A 94 -6.378 -12.244 2.145 1.00 0.00 O ATOM 0 H GLU A 94 -9.028 -8.626 -0.420 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.056 -8.424 0.578 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -6.842 -10.828 -0.866 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -5.373 -9.960 -1.265 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -4.496 -10.229 0.803 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -6.010 -9.862 1.606 1.00 0.00 H new ATOM 1485 N VAL A 95 -6.234 -6.404 -0.664 1.00 0.00 N ATOM 1486 CA VAL A 95 -5.527 -5.271 -1.249 1.00 0.00 C ATOM 1487 C VAL A 95 -5.016 -4.329 -0.166 1.00 0.00 C ATOM 1488 O VAL A 95 -5.630 -4.197 0.893 1.00 0.00 O ATOM 1489 CB VAL A 95 -6.432 -4.483 -2.214 1.00 0.00 C ATOM 1490 CG1 VAL A 95 -6.800 -5.335 -3.418 1.00 0.00 C ATOM 1491 CG2 VAL A 95 -7.681 -3.995 -1.494 1.00 0.00 C ATOM 0 H VAL A 95 -6.790 -6.173 0.160 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.682 -5.676 -1.806 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.882 -3.612 -2.571 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.440 -4.761 -4.088 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.893 -5.630 -3.946 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -7.331 -6.226 -3.084 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.309 -3.440 -2.191 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -8.236 -4.850 -1.107 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -7.394 -3.345 -0.668 1.00 0.00 H new ATOM 1501 N ILE A 96 -3.894 -3.671 -0.437 1.00 0.00 N ATOM 1502 CA ILE A 96 -3.312 -2.737 0.522 1.00 0.00 C ATOM 1503 C ILE A 96 -3.818 -1.323 0.258 1.00 0.00 C ATOM 1504 O ILE A 96 -3.589 -0.764 -0.812 1.00 0.00 O ATOM 1505 CB ILE A 96 -1.764 -2.782 0.487 1.00 0.00 C ATOM 1506 CG1 ILE A 96 -1.253 -3.727 1.579 1.00 0.00 C ATOM 1507 CG2 ILE A 96 -1.154 -1.389 0.648 1.00 0.00 C ATOM 1508 CD1 ILE A 96 -1.197 -3.101 2.956 1.00 0.00 C ATOM 0 H ILE A 96 -3.371 -3.766 -1.308 1.00 0.00 H new ATOM 0 HA ILE A 96 -3.627 -3.040 1.521 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.454 -3.157 -0.489 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -1.897 -4.605 1.616 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -0.256 -4.074 1.308 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -0.067 -1.462 0.618 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -1.497 -0.746 -0.163 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -1.463 -0.965 1.603 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -0.825 -3.833 3.673 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -0.529 -2.240 2.937 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.196 -2.779 3.250 1.00 0.00 H new ATOM 1520 N GLN A 97 -4.519 -0.762 1.236 1.00 0.00 N ATOM 1521 CA GLN A 97 -5.077 0.578 1.105 1.00 0.00 C ATOM 1522 C GLN A 97 -4.178 1.630 1.745 1.00 0.00 C ATOM 1523 O GLN A 97 -4.050 1.697 2.967 1.00 0.00 O ATOM 1524 CB GLN A 97 -6.471 0.631 1.737 1.00 0.00 C ATOM 1525 CG GLN A 97 -7.508 1.324 0.870 1.00 0.00 C ATOM 1526 CD GLN A 97 -8.705 1.807 1.666 1.00 0.00 C ATOM 1527 OE1 GLN A 97 -9.651 2.442 0.984 1.00 0.00 O flip ATOM 1528 NE2 GLN A 97 -8.780 1.609 2.878 1.00 0.00 N flip ATOM 0 H GLN A 97 -4.715 -1.215 2.129 1.00 0.00 H new ATOM 0 HA GLN A 97 -5.149 0.803 0.041 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -6.805 -0.386 1.945 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -6.407 1.148 2.695 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -7.046 2.172 0.365 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -7.846 0.637 0.094 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -8.029 1.116 3.362 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -9.593 1.938 3.399 1.00 0.00 H new ATOM 1537 N LEU A 98 -3.574 2.463 0.905 1.00 0.00 N ATOM 1538 CA LEU A 98 -2.704 3.532 1.374 1.00 0.00 C ATOM 1539 C LEU A 98 -3.419 4.871 1.259 1.00 0.00 C ATOM 1540 O LEU A 98 -4.354 5.015 0.475 1.00 0.00 O ATOM 1541 CB LEU A 98 -1.408 3.559 0.567 1.00 0.00 C ATOM 1542 CG LEU A 98 -0.571 2.283 0.657 1.00 0.00 C ATOM 1543 CD1 LEU A 98 0.218 2.071 -0.625 1.00 0.00 C ATOM 1544 CD2 LEU A 98 0.358 2.338 1.863 1.00 0.00 C ATOM 0 H LEU A 98 -3.673 2.417 -0.109 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.457 3.348 2.420 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.652 3.744 -0.479 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.802 4.399 0.907 1.00 0.00 H new ATOM 0 HG LEU A 98 -1.245 1.436 0.785 1.00 0.00 H new ATOM 0 HD11 LEU A 98 0.808 1.158 -0.542 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -0.470 1.984 -1.466 1.00 0.00 H new ATOM 0 HD13 LEU A 98 0.883 2.919 -0.787 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.946 1.422 1.911 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.027 3.194 1.769 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -0.233 2.438 2.773 1.00 0.00 H new ATOM 1556 N GLN A 99 -2.988 5.843 2.048 1.00 0.00 N ATOM 1557 CA GLN A 99 -3.609 7.164 2.031 1.00 0.00 C ATOM 1558 C GLN A 99 -2.913 8.101 1.047 1.00 0.00 C ATOM 1559 O GLN A 99 -1.690 8.079 0.910 1.00 0.00 O ATOM 1560 CB GLN A 99 -3.597 7.773 3.433 1.00 0.00 C ATOM 1561 CG GLN A 99 -4.982 7.919 4.043 1.00 0.00 C ATOM 1562 CD GLN A 99 -5.542 9.319 3.889 1.00 0.00 C ATOM 1563 OE1 GLN A 99 -4.829 10.247 3.509 1.00 0.00 O ATOM 1564 NE2 GLN A 99 -6.827 9.478 4.187 1.00 0.00 N ATOM 0 H GLN A 99 -2.215 5.746 2.706 1.00 0.00 H new ATOM 0 HA GLN A 99 -4.640 7.040 1.701 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -2.985 7.150 4.086 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -3.122 8.753 3.391 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -5.659 7.207 3.572 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -4.937 7.664 5.102 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -7.381 8.680 4.498 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -7.260 10.398 4.104 1.00 0.00 H new ATOM 1573 N GLY A 100 -3.707 8.925 0.370 1.00 0.00 N ATOM 1574 CA GLY A 100 -3.164 9.867 -0.592 1.00 0.00 C ATOM 1575 C GLY A 100 -2.843 9.220 -1.924 1.00 0.00 C ATOM 1576 O GLY A 100 -2.990 8.007 -2.083 1.00 0.00 O ATOM 0 H GLY A 100 -4.721 8.957 0.471 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -3.879 10.675 -0.748 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -2.259 10.317 -0.183 1.00 0.00 H new ATOM 1580 N ASP A 101 -2.394 10.026 -2.881 1.00 0.00 N ATOM 1581 CA ASP A 101 -2.041 9.519 -4.202 1.00 0.00 C ATOM 1582 C ASP A 101 -0.675 8.843 -4.163 1.00 0.00 C ATOM 1583 O ASP A 101 0.323 9.406 -4.613 1.00 0.00 O ATOM 1584 CB ASP A 101 -2.036 10.656 -5.226 1.00 0.00 C ATOM 1585 CG ASP A 101 -1.071 11.766 -4.853 1.00 0.00 C ATOM 1586 OD1 ASP A 101 -0.661 11.827 -3.676 1.00 0.00 O ATOM 1587 OD2 ASP A 101 -0.727 12.575 -5.741 1.00 0.00 O ATOM 0 H ASP A 101 -2.266 11.031 -2.767 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.788 8.783 -4.500 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -1.768 10.259 -6.205 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -3.042 11.067 -5.314 1.00 0.00 H new ATOM 1592 N GLN A 102 -0.638 7.637 -3.607 1.00 0.00 N ATOM 1593 CA GLN A 102 0.602 6.882 -3.490 1.00 0.00 C ATOM 1594 C GLN A 102 0.818 5.961 -4.687 1.00 0.00 C ATOM 1595 O GLN A 102 1.756 5.168 -4.698 1.00 0.00 O ATOM 1596 CB GLN A 102 0.592 6.057 -2.201 1.00 0.00 C ATOM 1597 CG GLN A 102 1.296 6.728 -1.029 1.00 0.00 C ATOM 1598 CD GLN A 102 1.037 8.220 -0.960 1.00 0.00 C ATOM 1599 OE1 GLN A 102 -0.218 8.608 -1.147 1.00 0.00 O flip ATOM 1600 NE2 GLN A 102 1.952 9.014 -0.742 1.00 0.00 N flip ATOM 0 H GLN A 102 -1.457 7.161 -3.229 1.00 0.00 H new ATOM 0 HA GLN A 102 1.423 7.598 -3.464 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -0.441 5.852 -1.921 1.00 0.00 H new ATOM 0 HB3 GLN A 102 1.067 5.095 -2.394 1.00 0.00 H new ATOM 0 HG2 GLN A 102 0.966 6.264 -0.100 1.00 0.00 H new ATOM 0 HG3 GLN A 102 2.369 6.554 -1.109 1.00 0.00 H new ATOM 0 HE21 GLN A 102 2.903 8.671 -0.604 1.00 0.00 H new ATOM 0 HE22 GLN A 102 1.759 10.015 -0.699 1.00 0.00 H new ATOM 1609 N ARG A 103 -0.047 6.066 -5.695 1.00 0.00 N ATOM 1610 CA ARG A 103 0.067 5.231 -6.890 1.00 0.00 C ATOM 1611 C ARG A 103 1.514 5.160 -7.374 1.00 0.00 C ATOM 1612 O ARG A 103 1.944 4.151 -7.933 1.00 0.00 O ATOM 1613 CB ARG A 103 -0.829 5.774 -8.005 1.00 0.00 C ATOM 1614 CG ARG A 103 -0.422 7.154 -8.496 1.00 0.00 C ATOM 1615 CD ARG A 103 -1.009 7.454 -9.866 1.00 0.00 C ATOM 1616 NE ARG A 103 -1.772 8.700 -9.873 1.00 0.00 N ATOM 1617 CZ ARG A 103 -2.169 9.319 -10.980 1.00 0.00 C ATOM 1618 NH1 ARG A 103 -1.878 8.814 -12.173 1.00 0.00 N ATOM 1619 NH2 ARG A 103 -2.860 10.448 -10.896 1.00 0.00 N ATOM 0 H ARG A 103 -0.831 6.718 -5.708 1.00 0.00 H new ATOM 0 HA ARG A 103 -0.258 4.224 -6.628 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -0.811 5.079 -8.845 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -1.857 5.814 -7.646 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -0.756 7.908 -7.783 1.00 0.00 H new ATOM 0 HG3 ARG A 103 0.665 7.219 -8.543 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -0.205 7.517 -10.599 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -1.655 6.631 -10.172 1.00 0.00 H new ATOM 0 HE ARG A 103 -2.014 9.119 -8.975 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -1.347 7.946 -12.244 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -2.186 9.294 -13.019 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -3.086 10.841 -9.982 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -3.165 10.924 -11.745 1.00 0.00 H new ATOM 1633 N LYS A 104 2.259 6.235 -7.146 1.00 0.00 N ATOM 1634 CA LYS A 104 3.657 6.297 -7.550 1.00 0.00 C ATOM 1635 C LYS A 104 4.582 5.983 -6.375 1.00 0.00 C ATOM 1636 O LYS A 104 5.721 5.559 -6.567 1.00 0.00 O ATOM 1637 CB LYS A 104 3.983 7.680 -8.116 1.00 0.00 C ATOM 1638 CG LYS A 104 4.057 7.714 -9.634 1.00 0.00 C ATOM 1639 CD LYS A 104 2.824 8.363 -10.241 1.00 0.00 C ATOM 1640 CE LYS A 104 3.061 9.831 -10.551 1.00 0.00 C ATOM 1641 NZ LYS A 104 1.968 10.410 -11.380 1.00 0.00 N ATOM 0 H LYS A 104 1.917 7.077 -6.683 1.00 0.00 H new ATOM 0 HA LYS A 104 3.819 5.546 -8.324 1.00 0.00 H new ATOM 0 HB2 LYS A 104 3.225 8.388 -7.782 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.936 8.016 -7.706 1.00 0.00 H new ATOM 0 HG2 LYS A 104 4.947 8.263 -9.943 1.00 0.00 H new ATOM 0 HG3 LYS A 104 4.160 6.698 -10.016 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.548 7.837 -11.155 1.00 0.00 H new ATOM 0 HD3 LYS A 104 1.985 8.267 -9.552 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.144 10.390 -9.619 1.00 0.00 H new ATOM 0 HE3 LYS A 104 4.011 9.942 -11.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 2.169 11.413 -11.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.905 9.894 -12.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 1.065 10.328 -10.870 1.00 0.00 H new ATOM 1655 N ASN A 105 4.087 6.201 -5.160 1.00 0.00 N ATOM 1656 CA ASN A 105 4.874 5.946 -3.958 1.00 0.00 C ATOM 1657 C ASN A 105 4.847 4.468 -3.573 1.00 0.00 C ATOM 1658 O ASN A 105 5.868 3.904 -3.182 1.00 0.00 O ATOM 1659 CB ASN A 105 4.356 6.798 -2.796 1.00 0.00 C ATOM 1660 CG ASN A 105 4.955 8.191 -2.787 1.00 0.00 C ATOM 1661 OD1 ASN A 105 6.152 8.363 -2.558 1.00 0.00 O ATOM 1662 ND2 ASN A 105 4.122 9.195 -3.037 1.00 0.00 N ATOM 0 H ASN A 105 3.146 6.553 -4.982 1.00 0.00 H new ATOM 0 HA ASN A 105 5.907 6.219 -4.174 1.00 0.00 H new ATOM 0 HB2 ASN A 105 3.270 6.873 -2.860 1.00 0.00 H new ATOM 0 HB3 ASN A 105 4.586 6.301 -1.854 1.00 0.00 H new ATOM 0 HD21 ASN A 105 4.468 10.155 -3.044 1.00 0.00 H new ATOM 0 HD22 ASN A 105 3.137 9.006 -3.222 1.00 0.00 H new ATOM 1669 N ILE A 106 3.677 3.842 -3.679 1.00 0.00 N ATOM 1670 CA ILE A 106 3.545 2.431 -3.334 1.00 0.00 C ATOM 1671 C ILE A 106 4.316 1.555 -4.315 1.00 0.00 C ATOM 1672 O ILE A 106 5.090 0.690 -3.905 1.00 0.00 O ATOM 1673 CB ILE A 106 2.069 1.984 -3.281 1.00 0.00 C ATOM 1674 CG1 ILE A 106 1.965 0.562 -2.721 1.00 0.00 C ATOM 1675 CG2 ILE A 106 1.431 2.064 -4.657 1.00 0.00 C ATOM 1676 CD1 ILE A 106 2.699 0.366 -1.410 1.00 0.00 C ATOM 0 H ILE A 106 2.815 4.285 -3.998 1.00 0.00 H new ATOM 0 HA ILE A 106 3.970 2.309 -2.337 1.00 0.00 H new ATOM 0 HB ILE A 106 1.529 2.660 -2.618 1.00 0.00 H new ATOM 0 HG12 ILE A 106 0.913 0.314 -2.579 1.00 0.00 H new ATOM 0 HG13 ILE A 106 2.361 -0.138 -3.457 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.391 1.744 -4.595 1.00 0.00 H new ATOM 0 HG22 ILE A 106 1.474 3.091 -5.019 1.00 0.00 H new ATOM 0 HG23 ILE A 106 1.970 1.414 -5.346 1.00 0.00 H new ATOM 0 HD11 ILE A 106 2.579 -0.665 -1.077 1.00 0.00 H new ATOM 0 HD12 ILE A 106 3.758 0.582 -1.550 1.00 0.00 H new ATOM 0 HD13 ILE A 106 2.288 1.040 -0.659 1.00 0.00 H new ATOM 1688 N CYS A 107 4.129 1.796 -5.613 1.00 0.00 N ATOM 1689 CA CYS A 107 4.844 1.034 -6.632 1.00 0.00 C ATOM 1690 C CYS A 107 6.338 1.104 -6.349 1.00 0.00 C ATOM 1691 O CYS A 107 7.082 0.150 -6.581 1.00 0.00 O ATOM 1692 CB CYS A 107 4.541 1.585 -8.029 1.00 0.00 C ATOM 1693 SG CYS A 107 5.167 3.256 -8.322 1.00 0.00 S ATOM 0 H CYS A 107 3.495 2.506 -5.979 1.00 0.00 H new ATOM 0 HA CYS A 107 4.515 -0.005 -6.601 1.00 0.00 H new ATOM 0 HB2 CYS A 107 4.970 0.913 -8.773 1.00 0.00 H new ATOM 0 HB3 CYS A 107 3.462 1.582 -8.182 1.00 0.00 H new ATOM 0 HG CYS A 107 5.470 3.811 -7.186 1.00 0.00 H new ATOM 1699 N GLN A 108 6.755 2.246 -5.814 1.00 0.00 N ATOM 1700 CA GLN A 108 8.149 2.470 -5.452 1.00 0.00 C ATOM 1701 C GLN A 108 8.531 1.561 -4.295 1.00 0.00 C ATOM 1702 O GLN A 108 9.506 0.815 -4.361 1.00 0.00 O ATOM 1703 CB GLN A 108 8.365 3.929 -5.041 1.00 0.00 C ATOM 1704 CG GLN A 108 8.791 4.835 -6.179 1.00 0.00 C ATOM 1705 CD GLN A 108 10.297 4.988 -6.269 1.00 0.00 C ATOM 1706 OE1 GLN A 108 11.018 3.894 -6.049 1.00 0.00 O flip ATOM 1707 NE2 GLN A 108 10.808 6.076 -6.533 1.00 0.00 N flip ATOM 0 H GLN A 108 6.141 3.037 -5.620 1.00 0.00 H new ATOM 0 HA GLN A 108 8.774 2.247 -6.317 1.00 0.00 H new ATOM 0 HB2 GLN A 108 7.441 4.315 -4.610 1.00 0.00 H new ATOM 0 HB3 GLN A 108 9.122 3.967 -4.258 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.413 4.433 -7.119 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.337 5.817 -6.046 1.00 0.00 H new ATOM 0 HE21 GLN A 108 10.217 6.891 -6.695 1.00 0.00 H new ATOM 0 HE22 GLN A 108 11.823 6.162 -6.590 1.00 0.00 H new ATOM 1716 N PHE A 109 7.735 1.635 -3.234 1.00 0.00 N ATOM 1717 CA PHE A 109 7.952 0.830 -2.042 1.00 0.00 C ATOM 1718 C PHE A 109 7.996 -0.652 -2.389 1.00 0.00 C ATOM 1719 O PHE A 109 8.894 -1.376 -1.960 1.00 0.00 O ATOM 1720 CB PHE A 109 6.832 1.091 -1.037 1.00 0.00 C ATOM 1721 CG PHE A 109 7.051 0.441 0.296 1.00 0.00 C ATOM 1722 CD1 PHE A 109 8.038 0.902 1.149 1.00 0.00 C ATOM 1723 CD2 PHE A 109 6.262 -0.622 0.698 1.00 0.00 C ATOM 1724 CE1 PHE A 109 8.236 0.314 2.382 1.00 0.00 C ATOM 1725 CE2 PHE A 109 6.456 -1.218 1.928 1.00 0.00 C ATOM 1726 CZ PHE A 109 7.444 -0.748 2.771 1.00 0.00 C ATOM 0 H PHE A 109 6.925 2.252 -3.178 1.00 0.00 H new ATOM 0 HA PHE A 109 8.911 1.110 -1.605 1.00 0.00 H new ATOM 0 HB2 PHE A 109 6.729 2.167 -0.894 1.00 0.00 H new ATOM 0 HB3 PHE A 109 5.891 0.733 -1.455 1.00 0.00 H new ATOM 0 HD1 PHE A 109 8.660 1.731 0.847 1.00 0.00 H new ATOM 0 HD2 PHE A 109 5.486 -0.989 0.043 1.00 0.00 H new ATOM 0 HE1 PHE A 109 9.008 0.684 3.041 1.00 0.00 H new ATOM 0 HE2 PHE A 109 5.837 -2.050 2.230 1.00 0.00 H new ATOM 0 HZ PHE A 109 7.597 -1.211 3.735 1.00 0.00 H new ATOM 1736 N LEU A 110 7.020 -1.090 -3.174 1.00 0.00 N ATOM 1737 CA LEU A 110 6.932 -2.483 -3.590 1.00 0.00 C ATOM 1738 C LEU A 110 8.225 -2.932 -4.261 1.00 0.00 C ATOM 1739 O LEU A 110 8.605 -4.099 -4.188 1.00 0.00 O ATOM 1740 CB LEU A 110 5.753 -2.671 -4.546 1.00 0.00 C ATOM 1741 CG LEU A 110 4.419 -3.024 -3.881 1.00 0.00 C ATOM 1742 CD1 LEU A 110 4.199 -2.178 -2.635 1.00 0.00 C ATOM 1743 CD2 LEU A 110 3.269 -2.840 -4.863 1.00 0.00 C ATOM 0 H LEU A 110 6.274 -0.496 -3.537 1.00 0.00 H new ATOM 0 HA LEU A 110 6.775 -3.096 -2.703 1.00 0.00 H new ATOM 0 HB2 LEU A 110 5.622 -1.753 -5.120 1.00 0.00 H new ATOM 0 HB3 LEU A 110 6.005 -3.458 -5.257 1.00 0.00 H new ATOM 0 HG LEU A 110 4.452 -4.071 -3.581 1.00 0.00 H new ATOM 0 HD11 LEU A 110 3.246 -2.444 -2.178 1.00 0.00 H new ATOM 0 HD12 LEU A 110 5.006 -2.360 -1.925 1.00 0.00 H new ATOM 0 HD13 LEU A 110 4.188 -1.123 -2.909 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.329 -3.095 -4.374 1.00 0.00 H new ATOM 0 HD22 LEU A 110 3.236 -1.802 -5.194 1.00 0.00 H new ATOM 0 HD23 LEU A 110 3.418 -3.491 -5.724 1.00 0.00 H new ATOM 1755 N VAL A 111 8.897 -1.992 -4.913 1.00 0.00 N ATOM 1756 CA VAL A 111 10.149 -2.284 -5.597 1.00 0.00 C ATOM 1757 C VAL A 111 11.348 -1.978 -4.702 1.00 0.00 C ATOM 1758 O VAL A 111 12.421 -2.558 -4.866 1.00 0.00 O ATOM 1759 CB VAL A 111 10.269 -1.475 -6.902 1.00 0.00 C ATOM 1760 CG1 VAL A 111 11.581 -1.779 -7.612 1.00 0.00 C ATOM 1761 CG2 VAL A 111 9.086 -1.759 -7.815 1.00 0.00 C ATOM 0 H VAL A 111 8.595 -1.020 -4.982 1.00 0.00 H new ATOM 0 HA VAL A 111 10.145 -3.347 -5.836 1.00 0.00 H new ATOM 0 HB VAL A 111 10.262 -0.415 -6.647 1.00 0.00 H new ATOM 0 HG11 VAL A 111 11.641 -1.195 -8.531 1.00 0.00 H new ATOM 0 HG12 VAL A 111 12.416 -1.519 -6.961 1.00 0.00 H new ATOM 0 HG13 VAL A 111 11.627 -2.841 -7.853 1.00 0.00 H new ATOM 0 HG21 VAL A 111 9.187 -1.179 -8.732 1.00 0.00 H new ATOM 0 HG22 VAL A 111 9.061 -2.821 -8.058 1.00 0.00 H new ATOM 0 HG23 VAL A 111 8.161 -1.480 -7.310 1.00 0.00 H new ATOM 1771 N GLU A 112 11.159 -1.063 -3.755 1.00 0.00 N ATOM 1772 CA GLU A 112 12.227 -0.680 -2.839 1.00 0.00 C ATOM 1773 C GLU A 112 12.434 -1.743 -1.765 1.00 0.00 C ATOM 1774 O GLU A 112 13.568 -2.058 -1.402 1.00 0.00 O ATOM 1775 CB GLU A 112 11.912 0.668 -2.188 1.00 0.00 C ATOM 1776 CG GLU A 112 11.956 1.838 -3.158 1.00 0.00 C ATOM 1777 CD GLU A 112 13.226 2.657 -3.027 1.00 0.00 C ATOM 1778 OE1 GLU A 112 13.725 2.800 -1.891 1.00 0.00 O ATOM 1779 OE2 GLU A 112 13.720 3.155 -4.060 1.00 0.00 O ATOM 0 H GLU A 112 10.277 -0.574 -3.603 1.00 0.00 H new ATOM 0 HA GLU A 112 13.148 -0.590 -3.415 1.00 0.00 H new ATOM 0 HB2 GLU A 112 10.922 0.620 -1.734 1.00 0.00 H new ATOM 0 HB3 GLU A 112 12.624 0.848 -1.382 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.874 1.463 -4.178 1.00 0.00 H new ATOM 0 HG3 GLU A 112 11.094 2.482 -2.985 1.00 0.00 H new ATOM 1786 N ILE A 113 11.335 -2.295 -1.256 1.00 0.00 N ATOM 1787 CA ILE A 113 11.409 -3.323 -0.224 1.00 0.00 C ATOM 1788 C ILE A 113 11.474 -4.719 -0.836 1.00 0.00 C ATOM 1789 O ILE A 113 11.955 -5.661 -0.206 1.00 0.00 O ATOM 1790 CB ILE A 113 10.206 -3.244 0.745 1.00 0.00 C ATOM 1791 CG1 ILE A 113 8.932 -3.783 0.084 1.00 0.00 C ATOM 1792 CG2 ILE A 113 9.996 -1.812 1.212 1.00 0.00 C ATOM 1793 CD1 ILE A 113 7.724 -3.763 0.993 1.00 0.00 C ATOM 0 H ILE A 113 10.387 -2.048 -1.541 1.00 0.00 H new ATOM 0 HA ILE A 113 12.325 -3.138 0.338 1.00 0.00 H new ATOM 0 HB ILE A 113 10.427 -3.867 1.612 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.716 -3.192 -0.806 1.00 0.00 H new ATOM 0 HG13 ILE A 113 9.110 -4.806 -0.248 1.00 0.00 H new ATOM 0 HG21 ILE A 113 9.146 -1.772 1.893 1.00 0.00 H new ATOM 0 HG22 ILE A 113 10.891 -1.462 1.727 1.00 0.00 H new ATOM 0 HG23 ILE A 113 9.801 -1.173 0.351 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.860 -4.158 0.459 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.920 -4.378 1.872 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.520 -2.739 1.305 1.00 0.00 H new ATOM 1805 N GLY A 114 10.975 -4.847 -2.062 1.00 0.00 N ATOM 1806 CA GLY A 114 10.976 -6.134 -2.730 1.00 0.00 C ATOM 1807 C GLY A 114 9.640 -6.837 -2.602 1.00 0.00 C ATOM 1808 O GLY A 114 9.572 -8.066 -2.587 1.00 0.00 O ATOM 0 H GLY A 114 10.571 -4.083 -2.603 1.00 0.00 H new ATOM 0 HA2 GLY A 114 11.214 -5.996 -3.785 1.00 0.00 H new ATOM 0 HA3 GLY A 114 11.759 -6.763 -2.306 1.00 0.00 H new ATOM 1812 N LEU A 115 8.575 -6.049 -2.505 1.00 0.00 N ATOM 1813 CA LEU A 115 7.227 -6.586 -2.372 1.00 0.00 C ATOM 1814 C LEU A 115 6.696 -7.055 -3.724 1.00 0.00 C ATOM 1815 O LEU A 115 6.607 -8.254 -3.983 1.00 0.00 O ATOM 1816 CB LEU A 115 6.300 -5.528 -1.768 1.00 0.00 C ATOM 1817 CG LEU A 115 5.449 -5.997 -0.584 1.00 0.00 C ATOM 1818 CD1 LEU A 115 6.290 -6.765 0.428 1.00 0.00 C ATOM 1819 CD2 LEU A 115 4.757 -4.812 0.078 1.00 0.00 C ATOM 0 H LEU A 115 8.621 -5.030 -2.516 1.00 0.00 H new ATOM 0 HA LEU A 115 7.259 -7.448 -1.705 1.00 0.00 H new ATOM 0 HB2 LEU A 115 6.905 -4.681 -1.445 1.00 0.00 H new ATOM 0 HB3 LEU A 115 5.634 -5.164 -2.550 1.00 0.00 H new ATOM 0 HG LEU A 115 4.685 -6.675 -0.965 1.00 0.00 H new ATOM 0 HD11 LEU A 115 5.659 -7.085 1.257 1.00 0.00 H new ATOM 0 HD12 LEU A 115 6.729 -7.639 -0.053 1.00 0.00 H new ATOM 0 HD13 LEU A 115 7.084 -6.121 0.804 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.157 -5.164 0.917 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.507 -4.108 0.438 1.00 0.00 H new ATOM 0 HD23 LEU A 115 4.112 -4.316 -0.647 1.00 0.00 H new ATOM 1831 N ALA A 116 6.354 -6.103 -4.586 1.00 0.00 N ATOM 1832 CA ALA A 116 5.845 -6.426 -5.915 1.00 0.00 C ATOM 1833 C ALA A 116 6.999 -6.672 -6.882 1.00 0.00 C ATOM 1834 O ALA A 116 8.149 -6.805 -6.465 1.00 0.00 O ATOM 1835 CB ALA A 116 4.952 -5.308 -6.431 1.00 0.00 C ATOM 0 H ALA A 116 6.420 -5.104 -4.389 1.00 0.00 H new ATOM 0 HA ALA A 116 5.251 -7.337 -5.843 1.00 0.00 H new ATOM 0 HB1 ALA A 116 4.582 -5.567 -7.423 1.00 0.00 H new ATOM 0 HB2 ALA A 116 4.109 -5.173 -5.753 1.00 0.00 H new ATOM 0 HB3 ALA A 116 5.524 -4.382 -6.487 1.00 0.00 H new ATOM 1841 N LYS A 117 6.692 -6.724 -8.173 1.00 0.00 N ATOM 1842 CA LYS A 117 7.715 -6.946 -9.188 1.00 0.00 C ATOM 1843 C LYS A 117 7.581 -5.927 -10.314 1.00 0.00 C ATOM 1844 O LYS A 117 6.487 -5.440 -10.591 1.00 0.00 O ATOM 1845 CB LYS A 117 7.612 -8.365 -9.749 1.00 0.00 C ATOM 1846 CG LYS A 117 8.861 -9.202 -9.526 1.00 0.00 C ATOM 1847 CD LYS A 117 9.088 -9.488 -8.048 1.00 0.00 C ATOM 1848 CE LYS A 117 10.337 -8.796 -7.529 1.00 0.00 C ATOM 1849 NZ LYS A 117 11.111 -9.665 -6.599 1.00 0.00 N ATOM 0 H LYS A 117 5.747 -6.616 -8.541 1.00 0.00 H new ATOM 0 HA LYS A 117 8.692 -6.824 -8.721 1.00 0.00 H new ATOM 0 HB2 LYS A 117 6.762 -8.868 -9.288 1.00 0.00 H new ATOM 0 HB3 LYS A 117 7.409 -8.310 -10.818 1.00 0.00 H new ATOM 0 HG2 LYS A 117 8.771 -10.143 -10.069 1.00 0.00 H new ATOM 0 HG3 LYS A 117 9.727 -8.680 -9.933 1.00 0.00 H new ATOM 0 HD2 LYS A 117 8.222 -9.155 -7.475 1.00 0.00 H new ATOM 0 HD3 LYS A 117 9.177 -10.563 -7.895 1.00 0.00 H new ATOM 0 HE2 LYS A 117 10.969 -8.511 -8.370 1.00 0.00 H new ATOM 0 HE3 LYS A 117 10.055 -7.876 -7.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 11.955 -9.155 -6.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 10.517 -9.916 -5.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 11.403 -10.531 -7.095 1.00 0.00 H new ATOM 1863 N ASP A 118 8.696 -5.610 -10.964 1.00 0.00 N ATOM 1864 CA ASP A 118 8.679 -4.652 -12.063 1.00 0.00 C ATOM 1865 C ASP A 118 7.793 -5.156 -13.193 1.00 0.00 C ATOM 1866 O ASP A 118 7.193 -4.369 -13.925 1.00 0.00 O ATOM 1867 CB ASP A 118 10.094 -4.371 -12.573 1.00 0.00 C ATOM 1868 CG ASP A 118 10.958 -5.617 -12.634 1.00 0.00 C ATOM 1869 OD1 ASP A 118 11.282 -6.166 -11.559 1.00 0.00 O ATOM 1870 OD2 ASP A 118 11.310 -6.042 -13.753 1.00 0.00 O ATOM 0 H ASP A 118 9.615 -5.998 -10.751 1.00 0.00 H new ATOM 0 HA ASP A 118 8.267 -3.715 -11.688 1.00 0.00 H new ATOM 0 HB2 ASP A 118 10.035 -3.927 -13.567 1.00 0.00 H new ATOM 0 HB3 ASP A 118 10.570 -3.636 -11.923 1.00 0.00 H new ATOM 1875 N ASP A 119 7.694 -6.475 -13.313 1.00 0.00 N ATOM 1876 CA ASP A 119 6.853 -7.085 -14.333 1.00 0.00 C ATOM 1877 C ASP A 119 5.397 -7.082 -13.875 1.00 0.00 C ATOM 1878 O ASP A 119 4.480 -7.272 -14.674 1.00 0.00 O ATOM 1879 CB ASP A 119 7.312 -8.517 -14.619 1.00 0.00 C ATOM 1880 CG ASP A 119 6.779 -9.042 -15.938 1.00 0.00 C ATOM 1881 OD1 ASP A 119 6.509 -8.220 -16.839 1.00 0.00 O ATOM 1882 OD2 ASP A 119 6.632 -10.275 -16.070 1.00 0.00 O ATOM 0 H ASP A 119 8.186 -7.141 -12.717 1.00 0.00 H new ATOM 0 HA ASP A 119 6.939 -6.504 -15.251 1.00 0.00 H new ATOM 0 HB2 ASP A 119 8.401 -8.551 -14.631 1.00 0.00 H new ATOM 0 HB3 ASP A 119 6.982 -9.170 -13.811 1.00 0.00 H new ATOM 1887 N GLN A 120 5.197 -6.859 -12.575 1.00 0.00 N ATOM 1888 CA GLN A 120 3.863 -6.822 -11.994 1.00 0.00 C ATOM 1889 C GLN A 120 3.499 -5.409 -11.534 1.00 0.00 C ATOM 1890 O GLN A 120 2.413 -5.186 -11.000 1.00 0.00 O ATOM 1891 CB GLN A 120 3.777 -7.783 -10.809 1.00 0.00 C ATOM 1892 CG GLN A 120 4.421 -9.132 -11.076 1.00 0.00 C ATOM 1893 CD GLN A 120 4.084 -10.159 -10.012 1.00 0.00 C ATOM 1894 OE1 GLN A 120 3.859 -11.330 -10.312 1.00 0.00 O ATOM 1895 NE2 GLN A 120 4.052 -9.722 -8.759 1.00 0.00 N ATOM 0 H GLN A 120 5.950 -6.701 -11.905 1.00 0.00 H new ATOM 0 HA GLN A 120 3.155 -7.128 -12.764 1.00 0.00 H new ATOM 0 HB2 GLN A 120 4.257 -7.325 -9.944 1.00 0.00 H new ATOM 0 HB3 GLN A 120 2.729 -7.934 -10.549 1.00 0.00 H new ATOM 0 HG2 GLN A 120 4.094 -9.501 -12.048 1.00 0.00 H new ATOM 0 HG3 GLN A 120 5.503 -9.010 -11.129 1.00 0.00 H new ATOM 0 HE21 GLN A 120 4.245 -8.741 -8.556 1.00 0.00 H new ATOM 0 HE22 GLN A 120 3.834 -10.367 -7.999 1.00 0.00 H new ATOM 1904 N LEU A 121 4.413 -4.460 -11.738 1.00 0.00 N ATOM 1905 CA LEU A 121 4.181 -3.076 -11.338 1.00 0.00 C ATOM 1906 C LEU A 121 3.030 -2.469 -12.131 1.00 0.00 C ATOM 1907 O LEU A 121 3.245 -1.690 -13.060 1.00 0.00 O ATOM 1908 CB LEU A 121 5.450 -2.243 -11.536 1.00 0.00 C ATOM 1909 CG LEU A 121 6.417 -2.236 -10.349 1.00 0.00 C ATOM 1910 CD1 LEU A 121 7.735 -1.576 -10.734 1.00 0.00 C ATOM 1911 CD2 LEU A 121 5.788 -1.529 -9.153 1.00 0.00 C ATOM 0 H LEU A 121 5.319 -4.626 -12.177 1.00 0.00 H new ATOM 0 HA LEU A 121 3.915 -3.069 -10.281 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.979 -2.618 -12.412 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.160 -1.215 -11.754 1.00 0.00 H new ATOM 0 HG LEU A 121 6.624 -3.268 -10.067 1.00 0.00 H new ATOM 0 HD11 LEU A 121 8.408 -1.581 -9.877 1.00 0.00 H new ATOM 0 HD12 LEU A 121 8.191 -2.127 -11.557 1.00 0.00 H new ATOM 0 HD13 LEU A 121 7.550 -0.548 -11.044 1.00 0.00 H new ATOM 0 HD21 LEU A 121 6.489 -1.533 -8.318 1.00 0.00 H new ATOM 0 HD22 LEU A 121 5.550 -0.500 -9.422 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.875 -2.048 -8.863 1.00 0.00 H new ATOM 1923 N LYS A 122 1.808 -2.831 -11.758 1.00 0.00 N ATOM 1924 CA LYS A 122 0.624 -2.322 -12.436 1.00 0.00 C ATOM 1925 C LYS A 122 0.087 -1.080 -11.728 1.00 0.00 C ATOM 1926 O LYS A 122 -0.874 -1.156 -10.963 1.00 0.00 O ATOM 1927 CB LYS A 122 -0.454 -3.403 -12.501 1.00 0.00 C ATOM 1928 CG LYS A 122 -0.279 -4.351 -13.674 1.00 0.00 C ATOM 1929 CD LYS A 122 -0.666 -3.695 -14.989 1.00 0.00 C ATOM 1930 CE LYS A 122 0.248 -4.133 -16.121 1.00 0.00 C ATOM 1931 NZ LYS A 122 -0.222 -3.631 -17.441 1.00 0.00 N ATOM 0 H LYS A 122 1.612 -3.474 -10.991 1.00 0.00 H new ATOM 0 HA LYS A 122 0.904 -2.043 -13.452 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -0.441 -3.976 -11.574 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -1.433 -2.928 -12.569 1.00 0.00 H new ATOM 0 HG2 LYS A 122 0.759 -4.681 -13.723 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -0.889 -5.240 -13.517 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -1.697 -3.949 -15.234 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -0.621 -2.611 -14.883 1.00 0.00 H new ATOM 0 HE2 LYS A 122 1.258 -3.769 -15.933 1.00 0.00 H new ATOM 0 HE3 LYS A 122 0.300 -5.221 -16.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 0.429 -3.952 -18.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -1.176 -3.999 -17.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -0.248 -2.591 -17.428 1.00 0.00 H new ATOM 1945 N VAL A 123 0.722 0.060 -11.981 1.00 0.00 N ATOM 1946 CA VAL A 123 0.315 1.316 -11.361 1.00 0.00 C ATOM 1947 C VAL A 123 -0.763 2.022 -12.177 1.00 0.00 C ATOM 1948 O VAL A 123 -0.556 2.351 -13.344 1.00 0.00 O ATOM 1949 CB VAL A 123 1.516 2.268 -11.187 1.00 0.00 C ATOM 1950 CG1 VAL A 123 2.121 2.625 -12.538 1.00 0.00 C ATOM 1951 CG2 VAL A 123 1.100 3.522 -10.433 1.00 0.00 C ATOM 0 H VAL A 123 1.520 0.140 -12.611 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.091 1.063 -10.382 1.00 0.00 H new ATOM 0 HB VAL A 123 2.278 1.754 -10.600 1.00 0.00 H new ATOM 0 HG11 VAL A 123 2.966 3.297 -12.392 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.461 1.717 -13.036 1.00 0.00 H new ATOM 0 HG13 VAL A 123 1.369 3.117 -13.155 1.00 0.00 H new ATOM 0 HG21 VAL A 123 1.961 4.181 -10.320 1.00 0.00 H new ATOM 0 HG22 VAL A 123 0.318 4.039 -10.989 1.00 0.00 H new ATOM 0 HG23 VAL A 123 0.723 3.246 -9.448 1.00 0.00 H new ATOM 1961 N HIS A 124 -1.914 2.256 -11.552 1.00 0.00 N ATOM 1962 CA HIS A 124 -3.019 2.928 -12.221 1.00 0.00 C ATOM 1963 C HIS A 124 -3.567 4.066 -11.363 1.00 0.00 C ATOM 1964 O HIS A 124 -3.724 3.924 -10.152 1.00 0.00 O ATOM 1965 CB HIS A 124 -4.134 1.930 -12.534 1.00 0.00 C ATOM 1966 CG HIS A 124 -3.660 0.723 -13.282 1.00 0.00 C ATOM 1967 ND1 HIS A 124 -3.593 0.669 -14.659 1.00 0.00 N ATOM 1968 CD2 HIS A 124 -3.224 -0.480 -12.839 1.00 0.00 C ATOM 1969 CE1 HIS A 124 -3.137 -0.514 -15.029 1.00 0.00 C ATOM 1970 NE2 HIS A 124 -2.906 -1.229 -13.944 1.00 0.00 N ATOM 0 H HIS A 124 -2.103 1.990 -10.586 1.00 0.00 H new ATOM 0 HA HIS A 124 -2.643 3.349 -13.153 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -4.598 1.611 -11.601 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -4.906 2.431 -13.119 1.00 0.00 H new ATOM 0 HD1 HIS A 124 -3.855 1.425 -15.292 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -3.142 -0.792 -11.808 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -2.980 -0.841 -16.046 1.00 0.00 H new ATOM 1979 N GLY A 125 -3.858 5.194 -12.003 1.00 0.00 N ATOM 1980 CA GLY A 125 -4.389 6.339 -11.289 1.00 0.00 C ATOM 1981 C GLY A 125 -5.874 6.520 -11.527 1.00 0.00 C ATOM 1982 O GLY A 125 -6.323 6.573 -12.673 1.00 0.00 O ATOM 0 H GLY A 125 -3.735 5.335 -13.006 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -4.206 6.217 -10.221 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -3.860 7.239 -11.603 1.00 0.00 H new ATOM 1986 N PHE A 126 -6.642 6.609 -10.446 1.00 0.00 N ATOM 1987 CA PHE A 126 -8.089 6.778 -10.541 1.00 0.00 C ATOM 1988 C PHE A 126 -8.452 7.892 -11.524 1.00 0.00 C ATOM 1989 O PHE A 126 -7.599 8.772 -11.760 1.00 0.00 O ATOM 1990 CB PHE A 126 -8.680 7.064 -9.152 1.00 0.00 C ATOM 1991 CG PHE A 126 -8.897 8.524 -8.861 1.00 0.00 C ATOM 1992 CD1 PHE A 126 -7.821 9.376 -8.674 1.00 0.00 C ATOM 1993 CD2 PHE A 126 -10.180 9.041 -8.778 1.00 0.00 C ATOM 1994 CE1 PHE A 126 -8.022 10.717 -8.410 1.00 0.00 C ATOM 1995 CE2 PHE A 126 -10.386 10.381 -8.513 1.00 0.00 C ATOM 1996 CZ PHE A 126 -9.306 11.221 -8.329 1.00 0.00 C ATOM 1997 OXT PHE A 126 -9.587 7.872 -12.047 1.00 0.00 O ATOM 0 H PHE A 126 -6.286 6.567 -9.491 1.00 0.00 H new ATOM 0 HA PHE A 126 -8.518 5.850 -10.920 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -9.632 6.542 -9.061 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -8.015 6.649 -8.394 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -6.815 8.988 -8.735 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -11.029 8.389 -8.922 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -7.175 11.372 -8.267 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -11.391 10.771 -8.450 1.00 0.00 H new ATOM 0 HZ PHE A 126 -9.464 12.269 -8.122 1.00 0.00 H new TER 2007 PHE A 126