USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1078 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 50 GLN : amide:sc= -0.0275 K(o=2.4,f=0.12!) USER MOD Set 1.2: A 71 TYR OH : rot 6:sc= 1.04 USER MOD Set 1.3: A 74 SER OG : rot -122:sc= 0.342 USER MOD Set 1.4: A 85 HIS :FLIP no HD1:sc= 0 F(o=1.9,f=2.4) USER MOD Set 1.5: A 87 HIS : no HD1:sc= 1.06 K(o=2.4,f=-3.9!) USER MOD Set 2.1: A 49 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 52 GLN : amide:sc=-0.00838 K(o=-0.0084,f=-0.95) USER MOD Set 3.1: A 31 SER OG : rot 120:sc= 0.867 USER MOD Set 3.2: A 33 GLN : amide:sc= 1.01 K(o=1.9,f=0.26) USER MOD Set 4.1: A 26 GLN : amide:sc= -1.42! C(o=-1.5!,f=-2.3!) USER MOD Set 4.2: A 104 GLN : amide:sc= -0.0656 X(o=-1.5,f=-1.3) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl 159:sc= -0.146 (180deg=-0.743) USER MOD Single : A 7 LYS NZ :NH3+ -168:sc= -0.0192 (180deg=-0.194) USER MOD Single : A 8 MET CE :methyl 158:sc= -0.242 (180deg=-0.906) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 1.05 K(o=1.1,f=-4.2!) USER MOD Single : A 43 LYS NZ :NH3+ -155:sc= 1.52 (180deg=1.03) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 HIS : no HD1:sc= -0.387 X(o=-0.39,f=-0.088) USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 90 HIS : +bothHN:sc= -4.94! C(o=-4.9!,f=-14!) USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0.179 X(o=0.18,f=0) USER MOD Single : A 101 HIS : no HE2:sc= 1.18 K(o=1.2,f=-5.8!) USER MOD Single : A 103 HIS : +bothHN:sc= -3.18! C(o=-3.2!,f=-14!) USER MOD Single : A 109 CYS SG : rot 28:sc= -1.37 USER MOD Single : A 110 SER OG : rot 180:sc= 0.0111 USER MOD Single : A 116 GLN : amide:sc= -0.0809 X(o=-0.081,f=-0.14) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 MET CE :methyl 175:sc= -0.0434 (180deg=-0.108) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -28.299 -9.844 0.390 1.00 0.00 N ATOM 2 CA GLY A 1 -28.096 -10.991 -0.523 1.00 0.00 C ATOM 3 C GLY A 1 -28.380 -12.315 0.154 1.00 0.00 C ATOM 4 O GLY A 1 -27.620 -12.736 1.025 1.00 0.00 O ATOM 0 H1 GLY A 1 -28.094 -8.958 -0.115 1.00 0.00 H new ATOM 0 H2 GLY A 1 -29.285 -9.834 0.720 1.00 0.00 H new ATOM 0 H3 GLY A 1 -27.661 -9.933 1.207 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -28.745 -10.882 -1.392 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -27.070 -10.985 -0.890 1.00 0.00 H new ATOM 10 N PRO A 2 -29.486 -12.991 -0.213 1.00 0.00 N ATOM 11 CA PRO A 2 -29.824 -14.316 0.322 1.00 0.00 C ATOM 12 C PRO A 2 -28.803 -15.370 -0.102 1.00 0.00 C ATOM 13 O PRO A 2 -28.511 -16.310 0.641 1.00 0.00 O ATOM 14 CB PRO A 2 -31.197 -14.628 -0.296 1.00 0.00 C ATOM 15 CG PRO A 2 -31.711 -13.323 -0.803 1.00 0.00 C ATOM 16 CD PRO A 2 -30.500 -12.513 -1.164 1.00 0.00 C ATOM 0 HA PRO A 2 -29.830 -14.326 1.412 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -31.108 -15.355 -1.103 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -31.873 -15.055 0.445 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -32.356 -13.468 -1.670 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -32.307 -12.817 -0.043 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -30.195 -12.681 -2.197 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -30.683 -11.444 -1.056 1.00 0.00 H new ATOM 24 N LEU A 3 -28.276 -15.207 -1.309 1.00 0.00 N ATOM 25 CA LEU A 3 -27.225 -16.073 -1.817 1.00 0.00 C ATOM 26 C LEU A 3 -25.897 -15.328 -1.789 1.00 0.00 C ATOM 27 O LEU A 3 -25.874 -14.097 -1.709 1.00 0.00 O ATOM 28 CB LEU A 3 -27.536 -16.556 -3.245 1.00 0.00 C ATOM 29 CG LEU A 3 -27.545 -15.480 -4.343 1.00 0.00 C ATOM 30 CD1 LEU A 3 -27.477 -16.137 -5.715 1.00 0.00 C ATOM 31 CD2 LEU A 3 -28.793 -14.611 -4.249 1.00 0.00 C ATOM 0 H LEU A 3 -28.564 -14.475 -1.958 1.00 0.00 H new ATOM 0 HA LEU A 3 -27.164 -16.954 -1.178 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -26.802 -17.315 -3.516 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -28.511 -17.044 -3.236 1.00 0.00 H new ATOM 0 HG LEU A 3 -26.672 -14.843 -4.201 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -27.484 -15.368 -6.487 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -26.561 -16.722 -5.793 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -28.338 -16.792 -5.848 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -28.773 -13.859 -5.038 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -29.680 -15.234 -4.365 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -28.820 -14.118 -3.277 1.00 0.00 H new ATOM 43 N GLY A 4 -24.802 -16.066 -1.868 1.00 0.00 N ATOM 44 CA GLY A 4 -23.493 -15.465 -1.743 1.00 0.00 C ATOM 45 C GLY A 4 -23.006 -14.829 -3.030 1.00 0.00 C ATOM 46 O GLY A 4 -22.117 -15.362 -3.692 1.00 0.00 O ATOM 0 H GLY A 4 -24.797 -17.075 -2.017 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.520 -14.709 -0.959 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.779 -16.226 -1.428 1.00 0.00 H new ATOM 50 N SER A 5 -23.604 -13.704 -3.398 1.00 0.00 N ATOM 51 CA SER A 5 -23.137 -12.935 -4.542 1.00 0.00 C ATOM 52 C SER A 5 -21.932 -12.104 -4.114 1.00 0.00 C ATOM 53 O SER A 5 -22.052 -11.206 -3.276 1.00 0.00 O ATOM 54 CB SER A 5 -24.255 -12.030 -5.071 1.00 0.00 C ATOM 55 OG SER A 5 -23.908 -11.454 -6.321 1.00 0.00 O ATOM 0 H SER A 5 -24.412 -13.305 -2.921 1.00 0.00 H new ATOM 0 HA SER A 5 -22.847 -13.611 -5.346 1.00 0.00 H new ATOM 0 HB2 SER A 5 -25.173 -12.608 -5.177 1.00 0.00 H new ATOM 0 HB3 SER A 5 -24.458 -11.240 -4.348 1.00 0.00 H new ATOM 0 HG SER A 5 -24.641 -10.884 -6.633 1.00 0.00 H new ATOM 61 N MET A 6 -20.771 -12.415 -4.671 1.00 0.00 N ATOM 62 CA MET A 6 -19.533 -11.815 -4.203 1.00 0.00 C ATOM 63 C MET A 6 -19.365 -10.395 -4.731 1.00 0.00 C ATOM 64 O MET A 6 -19.460 -10.139 -5.930 1.00 0.00 O ATOM 65 CB MET A 6 -18.321 -12.677 -4.584 1.00 0.00 C ATOM 66 CG MET A 6 -17.993 -12.684 -6.069 1.00 0.00 C ATOM 67 SD MET A 6 -16.555 -13.707 -6.463 1.00 0.00 S ATOM 68 CE MET A 6 -17.125 -15.317 -5.917 1.00 0.00 C ATOM 0 H MET A 6 -20.661 -13.074 -5.442 1.00 0.00 H new ATOM 0 HA MET A 6 -19.590 -11.764 -3.116 1.00 0.00 H new ATOM 0 HB2 MET A 6 -17.450 -12.320 -4.034 1.00 0.00 H new ATOM 0 HB3 MET A 6 -18.504 -13.702 -4.261 1.00 0.00 H new ATOM 0 HG2 MET A 6 -18.856 -13.049 -6.626 1.00 0.00 H new ATOM 0 HG3 MET A 6 -17.808 -11.662 -6.401 1.00 0.00 H new ATOM 0 HE1 MET A 6 -16.543 -16.096 -6.410 1.00 0.00 H new ATOM 0 HE2 MET A 6 -17.001 -15.400 -4.837 1.00 0.00 H new ATOM 0 HE3 MET A 6 -18.178 -15.435 -6.171 1.00 0.00 H new ATOM 78 N LYS A 7 -19.138 -9.475 -3.814 1.00 0.00 N ATOM 79 CA LYS A 7 -18.812 -8.107 -4.160 1.00 0.00 C ATOM 80 C LYS A 7 -17.317 -7.905 -4.013 1.00 0.00 C ATOM 81 O LYS A 7 -16.705 -8.436 -3.082 1.00 0.00 O ATOM 82 CB LYS A 7 -19.575 -7.123 -3.268 1.00 0.00 C ATOM 83 CG LYS A 7 -20.886 -6.645 -3.869 1.00 0.00 C ATOM 84 CD LYS A 7 -20.637 -5.788 -5.102 1.00 0.00 C ATOM 85 CE LYS A 7 -21.934 -5.328 -5.747 1.00 0.00 C ATOM 86 NZ LYS A 7 -22.758 -6.470 -6.222 1.00 0.00 N ATOM 0 H LYS A 7 -19.174 -9.655 -2.811 1.00 0.00 H new ATOM 0 HA LYS A 7 -19.108 -7.917 -5.192 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -19.777 -7.598 -2.308 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -18.940 -6.259 -3.069 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -21.503 -7.503 -4.136 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -21.442 -6.071 -3.128 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -20.042 -4.918 -4.825 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -20.053 -6.356 -5.826 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -22.507 -4.742 -5.029 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -21.708 -4.671 -6.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -23.525 -6.116 -6.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -22.161 -7.126 -6.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -23.165 -6.968 -5.405 1.00 0.00 H new ATOM 100 N MET A 8 -16.724 -7.159 -4.924 1.00 0.00 N ATOM 101 CA MET A 8 -15.289 -6.958 -4.895 1.00 0.00 C ATOM 102 C MET A 8 -14.928 -5.601 -4.319 1.00 0.00 C ATOM 103 O MET A 8 -15.562 -4.583 -4.611 1.00 0.00 O ATOM 104 CB MET A 8 -14.682 -7.139 -6.286 1.00 0.00 C ATOM 105 CG MET A 8 -14.660 -8.586 -6.748 1.00 0.00 C ATOM 106 SD MET A 8 -13.944 -8.786 -8.390 1.00 0.00 S ATOM 107 CE MET A 8 -12.309 -8.098 -8.131 1.00 0.00 C ATOM 0 H MET A 8 -17.208 -6.686 -5.687 1.00 0.00 H new ATOM 0 HA MET A 8 -14.865 -7.718 -4.238 1.00 0.00 H new ATOM 0 HB2 MET A 8 -15.249 -6.545 -7.002 1.00 0.00 H new ATOM 0 HB3 MET A 8 -13.664 -6.750 -6.284 1.00 0.00 H new ATOM 0 HG2 MET A 8 -14.091 -9.182 -6.034 1.00 0.00 H new ATOM 0 HG3 MET A 8 -15.677 -8.977 -6.750 1.00 0.00 H new ATOM 0 HE1 MET A 8 -11.628 -8.484 -8.889 1.00 0.00 H new ATOM 0 HE2 MET A 8 -12.356 -7.011 -8.205 1.00 0.00 H new ATOM 0 HE3 MET A 8 -11.948 -8.380 -7.142 1.00 0.00 H new ATOM 117 N ILE A 9 -13.922 -5.620 -3.467 1.00 0.00 N ATOM 118 CA ILE A 9 -13.419 -4.431 -2.813 1.00 0.00 C ATOM 119 C ILE A 9 -12.017 -4.139 -3.309 1.00 0.00 C ATOM 120 O ILE A 9 -11.103 -4.935 -3.120 1.00 0.00 O ATOM 121 CB ILE A 9 -13.393 -4.638 -1.285 1.00 0.00 C ATOM 122 CG1 ILE A 9 -14.806 -4.916 -0.763 1.00 0.00 C ATOM 123 CG2 ILE A 9 -12.767 -3.456 -0.554 1.00 0.00 C ATOM 124 CD1 ILE A 9 -14.878 -5.077 0.740 1.00 0.00 C ATOM 0 H ILE A 9 -13.426 -6.472 -3.207 1.00 0.00 H new ATOM 0 HA ILE A 9 -14.073 -3.591 -3.046 1.00 0.00 H new ATOM 0 HB ILE A 9 -12.764 -5.505 -1.082 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.462 -4.099 -1.064 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.187 -5.822 -1.235 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -12.771 -3.648 0.519 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.740 -3.320 -0.894 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -13.341 -2.553 -0.763 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -15.909 -5.271 1.036 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -14.249 -5.912 1.047 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -14.528 -4.163 1.221 1.00 0.00 H new ATOM 136 N GLU A 10 -11.840 -3.007 -3.946 1.00 0.00 N ATOM 137 CA GLU A 10 -10.546 -2.659 -4.492 1.00 0.00 C ATOM 138 C GLU A 10 -9.819 -1.732 -3.536 1.00 0.00 C ATOM 139 O GLU A 10 -10.341 -0.683 -3.160 1.00 0.00 O ATOM 140 CB GLU A 10 -10.672 -1.996 -5.865 1.00 0.00 C ATOM 141 CG GLU A 10 -11.301 -2.883 -6.930 1.00 0.00 C ATOM 142 CD GLU A 10 -12.799 -3.018 -6.775 1.00 0.00 C ATOM 143 OE1 GLU A 10 -13.477 -1.984 -6.594 1.00 0.00 O ATOM 144 OE2 GLU A 10 -13.305 -4.155 -6.846 1.00 0.00 O ATOM 0 H GLU A 10 -12.571 -2.312 -4.100 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.976 -3.580 -4.618 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.268 -1.089 -5.765 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.681 -1.691 -6.201 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.078 -2.473 -7.915 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -10.846 -3.872 -6.887 1.00 0.00 H new ATOM 151 N VAL A 11 -8.626 -2.126 -3.136 1.00 0.00 N ATOM 152 CA VAL A 11 -7.827 -1.331 -2.226 1.00 0.00 C ATOM 153 C VAL A 11 -6.455 -1.101 -2.834 1.00 0.00 C ATOM 154 O VAL A 11 -5.799 -2.040 -3.287 1.00 0.00 O ATOM 155 CB VAL A 11 -7.679 -2.012 -0.845 1.00 0.00 C ATOM 156 CG1 VAL A 11 -6.799 -1.187 0.082 1.00 0.00 C ATOM 157 CG2 VAL A 11 -9.042 -2.245 -0.208 1.00 0.00 C ATOM 0 H VAL A 11 -8.187 -2.998 -3.430 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.336 -0.379 -2.072 1.00 0.00 H new ATOM 0 HB VAL A 11 -7.199 -2.978 -1.002 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -6.713 -1.690 1.045 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -5.809 -1.077 -0.359 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -7.244 -0.202 0.225 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -8.913 -2.725 0.762 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -9.550 -1.290 -0.076 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.640 -2.888 -0.854 1.00 0.00 H new ATOM 167 N VAL A 12 -6.035 0.143 -2.872 1.00 0.00 N ATOM 168 CA VAL A 12 -4.744 0.476 -3.433 1.00 0.00 C ATOM 169 C VAL A 12 -3.763 0.839 -2.334 1.00 0.00 C ATOM 170 O VAL A 12 -4.100 1.563 -1.394 1.00 0.00 O ATOM 171 CB VAL A 12 -4.842 1.619 -4.464 1.00 0.00 C ATOM 172 CG1 VAL A 12 -5.449 1.106 -5.758 1.00 0.00 C ATOM 173 CG2 VAL A 12 -5.666 2.776 -3.913 1.00 0.00 C ATOM 0 H VAL A 12 -6.567 0.940 -2.522 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.379 -0.408 -3.956 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.836 1.985 -4.668 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.513 1.922 -6.478 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -4.822 0.312 -6.164 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.448 0.716 -5.562 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -5.721 3.570 -4.657 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -6.672 2.427 -3.679 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -5.195 3.159 -3.008 1.00 0.00 H new ATOM 183 N ALA A 13 -2.560 0.310 -2.444 1.00 0.00 N ATOM 184 CA ALA A 13 -1.528 0.539 -1.456 1.00 0.00 C ATOM 185 C ALA A 13 -0.361 1.285 -2.084 1.00 0.00 C ATOM 186 O ALA A 13 0.143 0.893 -3.139 1.00 0.00 O ATOM 187 CB ALA A 13 -1.066 -0.788 -0.868 1.00 0.00 C ATOM 0 H ALA A 13 -2.273 -0.288 -3.218 1.00 0.00 H new ATOM 0 HA ALA A 13 -1.934 1.151 -0.650 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.289 -0.606 -0.125 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -1.910 -1.290 -0.395 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.668 -1.419 -1.663 1.00 0.00 H new ATOM 193 N ALA A 14 0.062 2.358 -1.440 1.00 0.00 N ATOM 194 CA ALA A 14 1.157 3.161 -1.943 1.00 0.00 C ATOM 195 C ALA A 14 2.424 2.849 -1.176 1.00 0.00 C ATOM 196 O ALA A 14 2.541 3.158 0.011 1.00 0.00 O ATOM 197 CB ALA A 14 0.832 4.646 -1.829 1.00 0.00 C ATOM 0 H ALA A 14 -0.340 2.693 -0.564 1.00 0.00 H new ATOM 0 HA ALA A 14 1.307 2.919 -2.995 1.00 0.00 H new ATOM 0 HB1 ALA A 14 1.668 5.232 -2.212 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -0.063 4.868 -2.410 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.659 4.901 -0.784 1.00 0.00 H new ATOM 203 N ILE A 15 3.374 2.233 -1.853 1.00 0.00 N ATOM 204 CA ILE A 15 4.645 1.924 -1.244 1.00 0.00 C ATOM 205 C ILE A 15 5.635 3.027 -1.566 1.00 0.00 C ATOM 206 O ILE A 15 6.187 3.090 -2.667 1.00 0.00 O ATOM 207 CB ILE A 15 5.197 0.562 -1.720 1.00 0.00 C ATOM 208 CG1 ILE A 15 4.277 -0.566 -1.242 1.00 0.00 C ATOM 209 CG2 ILE A 15 6.618 0.356 -1.217 1.00 0.00 C ATOM 210 CD1 ILE A 15 4.908 -1.939 -1.303 1.00 0.00 C ATOM 0 H ILE A 15 3.286 1.938 -2.825 1.00 0.00 H new ATOM 0 HA ILE A 15 4.497 1.856 -0.166 1.00 0.00 H new ATOM 0 HB ILE A 15 5.224 0.551 -2.810 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.972 -0.362 -0.216 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.372 -0.566 -1.850 1.00 0.00 H new ATOM 0 HG21 ILE A 15 6.990 -0.609 -1.562 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.258 1.150 -1.601 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.625 0.379 -0.127 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.195 -2.683 -0.949 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.188 -2.165 -2.332 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.797 -1.959 -0.673 1.00 0.00 H new ATOM 222 N ILE A 16 5.830 3.915 -0.611 1.00 0.00 N ATOM 223 CA ILE A 16 6.732 5.031 -0.788 1.00 0.00 C ATOM 224 C ILE A 16 8.113 4.646 -0.294 1.00 0.00 C ATOM 225 O ILE A 16 8.344 4.528 0.907 1.00 0.00 O ATOM 226 CB ILE A 16 6.222 6.273 -0.031 1.00 0.00 C ATOM 227 CG1 ILE A 16 4.772 6.546 -0.424 1.00 0.00 C ATOM 228 CG2 ILE A 16 7.093 7.491 -0.320 1.00 0.00 C ATOM 229 CD1 ILE A 16 4.177 7.763 0.239 1.00 0.00 C ATOM 0 H ILE A 16 5.372 3.883 0.300 1.00 0.00 H new ATOM 0 HA ILE A 16 6.782 5.279 -1.848 1.00 0.00 H new ATOM 0 HB ILE A 16 6.276 6.077 1.040 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.716 6.670 -1.505 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.167 5.675 -0.172 1.00 0.00 H new ATOM 0 HG21 ILE A 16 6.709 8.351 0.228 1.00 0.00 H new ATOM 0 HG22 ILE A 16 8.117 7.289 -0.006 1.00 0.00 H new ATOM 0 HG23 ILE A 16 7.077 7.705 -1.389 1.00 0.00 H new ATOM 0 HD11 ILE A 16 3.146 7.890 -0.091 1.00 0.00 H new ATOM 0 HD12 ILE A 16 4.199 7.635 1.321 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.756 8.645 -0.033 1.00 0.00 H new ATOM 241 N GLU A 17 9.014 4.423 -1.227 1.00 0.00 N ATOM 242 CA GLU A 17 10.349 3.969 -0.901 1.00 0.00 C ATOM 243 C GLU A 17 11.361 5.054 -1.217 1.00 0.00 C ATOM 244 O GLU A 17 11.425 5.550 -2.340 1.00 0.00 O ATOM 245 CB GLU A 17 10.674 2.700 -1.682 1.00 0.00 C ATOM 246 CG GLU A 17 12.104 2.218 -1.512 1.00 0.00 C ATOM 247 CD GLU A 17 12.532 1.328 -2.652 1.00 0.00 C ATOM 248 OE1 GLU A 17 12.650 1.843 -3.786 1.00 0.00 O ATOM 249 OE2 GLU A 17 12.730 0.117 -2.432 1.00 0.00 O ATOM 0 H GLU A 17 8.844 4.550 -2.225 1.00 0.00 H new ATOM 0 HA GLU A 17 10.397 3.747 0.165 1.00 0.00 H new ATOM 0 HB2 GLU A 17 9.995 1.908 -1.367 1.00 0.00 H new ATOM 0 HB3 GLU A 17 10.485 2.879 -2.741 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.772 3.077 -1.450 1.00 0.00 H new ATOM 0 HG3 GLU A 17 12.195 1.674 -0.572 1.00 0.00 H new ATOM 256 N ARG A 18 12.139 5.427 -0.221 1.00 0.00 N ATOM 257 CA ARG A 18 13.169 6.424 -0.399 1.00 0.00 C ATOM 258 C ARG A 18 14.412 6.008 0.370 1.00 0.00 C ATOM 259 O ARG A 18 14.319 5.627 1.536 1.00 0.00 O ATOM 260 CB ARG A 18 12.677 7.794 0.080 1.00 0.00 C ATOM 261 CG ARG A 18 13.372 8.964 -0.600 1.00 0.00 C ATOM 262 CD ARG A 18 12.789 9.254 -1.982 1.00 0.00 C ATOM 263 NE ARG A 18 12.856 8.103 -2.887 1.00 0.00 N ATOM 264 CZ ARG A 18 12.373 8.098 -4.131 1.00 0.00 C ATOM 265 NH1 ARG A 18 11.816 9.193 -4.635 1.00 0.00 N ATOM 266 NH2 ARG A 18 12.451 6.998 -4.872 1.00 0.00 N ATOM 0 H ARG A 18 12.075 5.051 0.725 1.00 0.00 H new ATOM 0 HA ARG A 18 13.412 6.503 -1.459 1.00 0.00 H new ATOM 0 HB2 ARG A 18 11.604 7.867 -0.097 1.00 0.00 H new ATOM 0 HB3 ARG A 18 12.828 7.869 1.157 1.00 0.00 H new ATOM 0 HG2 ARG A 18 13.281 9.852 0.025 1.00 0.00 H new ATOM 0 HG3 ARG A 18 14.436 8.748 -0.694 1.00 0.00 H new ATOM 0 HD2 ARG A 18 11.749 9.563 -1.874 1.00 0.00 H new ATOM 0 HD3 ARG A 18 13.326 10.091 -2.428 1.00 0.00 H new ATOM 0 HE ARG A 18 13.300 7.251 -2.544 1.00 0.00 H new ATOM 0 HH11 ARG A 18 11.757 10.041 -4.071 1.00 0.00 H new ATOM 0 HH12 ARG A 18 11.448 9.186 -5.586 1.00 0.00 H new ATOM 0 HH21 ARG A 18 12.881 6.155 -4.490 1.00 0.00 H new ATOM 0 HH22 ARG A 18 12.081 6.996 -5.823 1.00 0.00 H new ATOM 280 N ASP A 19 15.556 6.037 -0.308 1.00 0.00 N ATOM 281 CA ASP A 19 16.849 5.686 0.290 1.00 0.00 C ATOM 282 C ASP A 19 16.920 4.201 0.625 1.00 0.00 C ATOM 283 O ASP A 19 17.784 3.772 1.388 1.00 0.00 O ATOM 284 CB ASP A 19 17.131 6.515 1.554 1.00 0.00 C ATOM 285 CG ASP A 19 17.344 7.987 1.249 1.00 0.00 C ATOM 286 OD1 ASP A 19 16.350 8.714 1.040 1.00 0.00 O ATOM 287 OD2 ASP A 19 18.513 8.425 1.207 1.00 0.00 O ATOM 0 H ASP A 19 15.617 6.305 -1.290 1.00 0.00 H new ATOM 0 HA ASP A 19 17.612 5.916 -0.453 1.00 0.00 H new ATOM 0 HB2 ASP A 19 16.297 6.408 2.248 1.00 0.00 H new ATOM 0 HB3 ASP A 19 18.015 6.119 2.054 1.00 0.00 H new ATOM 292 N GLY A 20 16.027 3.410 0.042 1.00 0.00 N ATOM 293 CA GLY A 20 16.004 1.993 0.332 1.00 0.00 C ATOM 294 C GLY A 20 15.088 1.673 1.492 1.00 0.00 C ATOM 295 O GLY A 20 15.085 0.555 1.999 1.00 0.00 O ATOM 0 H GLY A 20 15.322 3.725 -0.624 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.676 1.446 -0.552 1.00 0.00 H new ATOM 0 HA3 GLY A 20 17.014 1.652 0.561 1.00 0.00 H new ATOM 299 N LYS A 21 14.313 2.664 1.913 1.00 0.00 N ATOM 300 CA LYS A 21 13.406 2.509 3.036 1.00 0.00 C ATOM 301 C LYS A 21 11.971 2.769 2.589 1.00 0.00 C ATOM 302 O LYS A 21 11.720 3.658 1.779 1.00 0.00 O ATOM 303 CB LYS A 21 13.794 3.495 4.134 1.00 0.00 C ATOM 304 CG LYS A 21 15.290 3.559 4.377 1.00 0.00 C ATOM 305 CD LYS A 21 15.729 2.550 5.415 1.00 0.00 C ATOM 306 CE LYS A 21 17.244 2.433 5.486 1.00 0.00 C ATOM 307 NZ LYS A 21 17.870 3.623 6.119 1.00 0.00 N ATOM 0 H LYS A 21 14.297 3.591 1.487 1.00 0.00 H new ATOM 0 HA LYS A 21 13.474 1.491 3.419 1.00 0.00 H new ATOM 0 HB2 LYS A 21 13.433 4.488 3.866 1.00 0.00 H new ATOM 0 HB3 LYS A 21 13.294 3.213 5.060 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.819 3.374 3.442 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.563 4.562 4.705 1.00 0.00 H new ATOM 0 HD2 LYS A 21 15.341 2.841 6.391 1.00 0.00 H new ATOM 0 HD3 LYS A 21 15.300 1.576 5.179 1.00 0.00 H new ATOM 0 HE2 LYS A 21 17.512 1.540 6.051 1.00 0.00 H new ATOM 0 HE3 LYS A 21 17.644 2.306 4.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 18.902 3.499 6.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 17.637 4.473 5.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 17.509 3.731 7.088 1.00 0.00 H new ATOM 321 N ILE A 22 11.042 2.001 3.126 1.00 0.00 N ATOM 322 CA ILE A 22 9.638 2.119 2.772 1.00 0.00 C ATOM 323 C ILE A 22 8.882 2.838 3.877 1.00 0.00 C ATOM 324 O ILE A 22 9.144 2.621 5.064 1.00 0.00 O ATOM 325 CB ILE A 22 9.002 0.732 2.546 1.00 0.00 C ATOM 326 CG1 ILE A 22 9.835 -0.081 1.560 1.00 0.00 C ATOM 327 CG2 ILE A 22 7.569 0.868 2.043 1.00 0.00 C ATOM 328 CD1 ILE A 22 9.309 -1.480 1.352 1.00 0.00 C ATOM 0 H ILE A 22 11.238 1.279 3.819 1.00 0.00 H new ATOM 0 HA ILE A 22 9.574 2.689 1.845 1.00 0.00 H new ATOM 0 HB ILE A 22 8.981 0.208 3.501 1.00 0.00 H new ATOM 0 HG12 ILE A 22 9.860 0.437 0.601 1.00 0.00 H new ATOM 0 HG13 ILE A 22 10.862 -0.135 1.920 1.00 0.00 H new ATOM 0 HG21 ILE A 22 7.141 -0.123 1.891 1.00 0.00 H new ATOM 0 HG22 ILE A 22 6.975 1.411 2.779 1.00 0.00 H new ATOM 0 HG23 ILE A 22 7.565 1.414 1.099 1.00 0.00 H new ATOM 0 HD11 ILE A 22 9.945 -2.006 0.640 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.309 -2.014 2.302 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.292 -1.432 0.963 1.00 0.00 H new ATOM 340 N LEU A 23 7.961 3.703 3.483 1.00 0.00 N ATOM 341 CA LEU A 23 7.168 4.462 4.428 1.00 0.00 C ATOM 342 C LEU A 23 6.064 3.603 5.036 1.00 0.00 C ATOM 343 O LEU A 23 5.169 3.130 4.335 1.00 0.00 O ATOM 344 CB LEU A 23 6.556 5.680 3.735 1.00 0.00 C ATOM 345 CG LEU A 23 5.780 6.632 4.647 1.00 0.00 C ATOM 346 CD1 LEU A 23 6.699 7.222 5.700 1.00 0.00 C ATOM 347 CD2 LEU A 23 5.124 7.736 3.833 1.00 0.00 C ATOM 0 H LEU A 23 7.745 3.896 2.505 1.00 0.00 H new ATOM 0 HA LEU A 23 7.824 4.793 5.233 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.355 6.240 3.249 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.887 5.331 2.948 1.00 0.00 H new ATOM 0 HG LEU A 23 4.996 6.065 5.150 1.00 0.00 H new ATOM 0 HD11 LEU A 23 6.132 7.897 6.341 1.00 0.00 H new ATOM 0 HD12 LEU A 23 7.123 6.420 6.304 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.503 7.774 5.213 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.577 8.403 4.499 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.890 8.301 3.303 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.434 7.296 3.113 1.00 0.00 H new ATOM 359 N LEU A 24 6.149 3.408 6.339 1.00 0.00 N ATOM 360 CA LEU A 24 5.114 2.701 7.078 1.00 0.00 C ATOM 361 C LEU A 24 4.440 3.643 8.051 1.00 0.00 C ATOM 362 O LEU A 24 5.104 4.378 8.782 1.00 0.00 O ATOM 363 CB LEU A 24 5.673 1.487 7.817 1.00 0.00 C ATOM 364 CG LEU A 24 6.006 0.294 6.928 1.00 0.00 C ATOM 365 CD1 LEU A 24 6.615 -0.832 7.746 1.00 0.00 C ATOM 366 CD2 LEU A 24 4.767 -0.183 6.180 1.00 0.00 C ATOM 0 H LEU A 24 6.928 3.731 6.912 1.00 0.00 H new ATOM 0 HA LEU A 24 4.380 2.337 6.359 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.575 1.788 8.350 1.00 0.00 H new ATOM 0 HB3 LEU A 24 4.949 1.171 8.568 1.00 0.00 H new ATOM 0 HG LEU A 24 6.743 0.612 6.191 1.00 0.00 H new ATOM 0 HD11 LEU A 24 6.845 -1.673 7.092 1.00 0.00 H new ATOM 0 HD12 LEU A 24 7.531 -0.482 8.222 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.907 -1.150 8.511 1.00 0.00 H new ATOM 0 HD21 LEU A 24 5.027 -1.035 5.552 1.00 0.00 H new ATOM 0 HD22 LEU A 24 4.002 -0.481 6.897 1.00 0.00 H new ATOM 0 HD23 LEU A 24 4.385 0.625 5.556 1.00 0.00 H new ATOM 378 N ALA A 25 3.121 3.633 8.040 1.00 0.00 N ATOM 379 CA ALA A 25 2.357 4.532 8.876 1.00 0.00 C ATOM 380 C ALA A 25 1.505 3.772 9.886 1.00 0.00 C ATOM 381 O ALA A 25 0.715 2.900 9.523 1.00 0.00 O ATOM 382 CB ALA A 25 1.503 5.432 8.005 1.00 0.00 C ATOM 0 H ALA A 25 2.558 3.011 7.460 1.00 0.00 H new ATOM 0 HA ALA A 25 3.051 5.147 9.449 1.00 0.00 H new ATOM 0 HB1 ALA A 25 0.927 6.109 8.636 1.00 0.00 H new ATOM 0 HB2 ALA A 25 2.145 6.012 7.341 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.822 4.823 7.410 1.00 0.00 H new ATOM 388 N GLN A 26 1.681 4.114 11.154 1.00 0.00 N ATOM 389 CA GLN A 26 0.975 3.456 12.251 1.00 0.00 C ATOM 390 C GLN A 26 -0.487 3.876 12.298 1.00 0.00 C ATOM 391 O GLN A 26 -0.787 5.036 12.588 1.00 0.00 O ATOM 392 CB GLN A 26 1.654 3.787 13.581 1.00 0.00 C ATOM 393 CG GLN A 26 0.927 3.237 14.797 1.00 0.00 C ATOM 394 CD GLN A 26 1.596 3.628 16.103 1.00 0.00 C ATOM 395 OE1 GLN A 26 1.505 2.914 17.101 1.00 0.00 O ATOM 396 NE2 GLN A 26 2.284 4.763 16.102 1.00 0.00 N ATOM 0 H GLN A 26 2.316 4.854 11.454 1.00 0.00 H new ATOM 0 HA GLN A 26 1.013 2.380 12.080 1.00 0.00 H new ATOM 0 HB2 GLN A 26 2.670 3.392 13.567 1.00 0.00 H new ATOM 0 HB3 GLN A 26 1.735 4.870 13.677 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -0.101 3.600 14.796 1.00 0.00 H new ATOM 0 HG3 GLN A 26 0.881 2.150 14.728 1.00 0.00 H new ATOM 0 HE21 GLN A 26 2.336 5.327 15.254 1.00 0.00 H new ATOM 0 HE22 GLN A 26 2.761 5.071 16.949 1.00 0.00 H new ATOM 405 N ARG A 27 -1.372 2.921 11.998 1.00 0.00 N ATOM 406 CA ARG A 27 -2.830 3.114 11.999 1.00 0.00 C ATOM 407 C ARG A 27 -3.444 2.003 11.164 1.00 0.00 C ATOM 408 O ARG A 27 -3.402 2.082 9.946 1.00 0.00 O ATOM 409 CB ARG A 27 -3.210 4.481 11.386 1.00 0.00 C ATOM 410 CG ARG A 27 -4.632 4.980 11.657 1.00 0.00 C ATOM 411 CD ARG A 27 -5.710 4.206 10.898 1.00 0.00 C ATOM 412 NE ARG A 27 -5.325 3.879 9.518 1.00 0.00 N ATOM 413 CZ ARG A 27 -5.836 4.452 8.424 1.00 0.00 C ATOM 414 NH1 ARG A 27 -6.690 5.466 8.530 1.00 0.00 N ATOM 415 NH2 ARG A 27 -5.486 4.004 7.222 1.00 0.00 N ATOM 0 H ARG A 27 -1.093 1.974 11.743 1.00 0.00 H new ATOM 0 HA ARG A 27 -3.200 3.090 13.024 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -2.509 5.228 11.758 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.069 4.422 10.307 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -4.834 4.913 12.726 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -4.695 6.034 11.386 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -5.932 3.284 11.435 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -6.628 4.794 10.883 1.00 0.00 H new ATOM 0 HE ARG A 27 -4.614 3.160 9.385 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -6.959 5.812 9.451 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -7.076 5.898 7.690 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -4.831 3.227 7.138 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -5.873 4.437 6.384 1.00 0.00 H new ATOM 429 N PRO A 28 -3.989 0.944 11.783 1.00 0.00 N ATOM 430 CA PRO A 28 -4.627 -0.145 11.044 1.00 0.00 C ATOM 431 C PRO A 28 -6.084 0.178 10.730 1.00 0.00 C ATOM 432 O PRO A 28 -6.473 1.341 10.684 1.00 0.00 O ATOM 433 CB PRO A 28 -4.518 -1.302 12.024 1.00 0.00 C ATOM 434 CG PRO A 28 -4.705 -0.653 13.342 1.00 0.00 C ATOM 435 CD PRO A 28 -4.043 0.705 13.239 1.00 0.00 C ATOM 0 HA PRO A 28 -4.168 -0.345 10.076 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -5.279 -2.060 11.838 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -3.550 -1.798 11.954 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -5.764 -0.553 13.581 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -4.254 -1.247 14.137 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -4.620 1.474 13.752 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -3.048 0.703 13.684 1.00 0.00 H new ATOM 443 N ALA A 29 -6.901 -0.844 10.548 1.00 0.00 N ATOM 444 CA ALA A 29 -8.287 -0.622 10.164 1.00 0.00 C ATOM 445 C ALA A 29 -9.219 -1.647 10.788 1.00 0.00 C ATOM 446 O ALA A 29 -10.105 -1.304 11.571 1.00 0.00 O ATOM 447 CB ALA A 29 -8.416 -0.639 8.650 1.00 0.00 C ATOM 0 H ALA A 29 -6.636 -1.823 10.657 1.00 0.00 H new ATOM 0 HA ALA A 29 -8.584 0.357 10.540 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.457 -0.472 8.372 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.795 0.149 8.223 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.089 -1.606 8.268 1.00 0.00 H new ATOM 453 N GLN A 30 -9.008 -2.908 10.453 1.00 0.00 N ATOM 454 CA GLN A 30 -9.886 -3.975 10.919 1.00 0.00 C ATOM 455 C GLN A 30 -9.363 -4.574 12.213 1.00 0.00 C ATOM 456 O GLN A 30 -9.746 -5.673 12.610 1.00 0.00 O ATOM 457 CB GLN A 30 -10.025 -5.055 9.851 1.00 0.00 C ATOM 458 CG GLN A 30 -10.497 -4.515 8.513 1.00 0.00 C ATOM 459 CD GLN A 30 -10.916 -5.610 7.558 1.00 0.00 C ATOM 460 OE1 GLN A 30 -10.104 -6.131 6.794 1.00 0.00 O ATOM 461 NE2 GLN A 30 -12.190 -5.962 7.590 1.00 0.00 N ATOM 0 H GLN A 30 -8.238 -3.221 9.861 1.00 0.00 H new ATOM 0 HA GLN A 30 -10.870 -3.548 11.112 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -9.063 -5.550 9.717 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -10.728 -5.812 10.198 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -11.336 -3.838 8.674 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -9.698 -3.929 8.060 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -12.829 -5.504 8.239 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -12.533 -6.692 6.965 1.00 0.00 H new ATOM 470 N SER A 31 -8.488 -3.835 12.868 1.00 0.00 N ATOM 471 CA SER A 31 -7.886 -4.275 14.105 1.00 0.00 C ATOM 472 C SER A 31 -7.677 -3.079 15.010 1.00 0.00 C ATOM 473 O SER A 31 -7.037 -2.107 14.616 1.00 0.00 O ATOM 474 CB SER A 31 -6.542 -4.937 13.819 1.00 0.00 C ATOM 475 OG SER A 31 -6.195 -5.866 14.828 1.00 0.00 O ATOM 0 H SER A 31 -8.177 -2.915 12.556 1.00 0.00 H new ATOM 0 HA SER A 31 -8.543 -4.995 14.592 1.00 0.00 H new ATOM 0 HB2 SER A 31 -6.583 -5.444 12.855 1.00 0.00 H new ATOM 0 HB3 SER A 31 -5.768 -4.173 13.745 1.00 0.00 H new ATOM 0 HG SER A 31 -6.095 -6.757 14.432 1.00 0.00 H new ATOM 481 N ASP A 32 -8.221 -3.132 16.206 1.00 0.00 N ATOM 482 CA ASP A 32 -7.998 -2.065 17.165 1.00 0.00 C ATOM 483 C ASP A 32 -6.814 -2.423 18.042 1.00 0.00 C ATOM 484 O ASP A 32 -6.969 -2.831 19.193 1.00 0.00 O ATOM 485 CB ASP A 32 -9.233 -1.800 18.027 1.00 0.00 C ATOM 486 CG ASP A 32 -9.074 -0.551 18.877 1.00 0.00 C ATOM 487 OD1 ASP A 32 -9.251 0.567 18.344 1.00 0.00 O ATOM 488 OD2 ASP A 32 -8.756 -0.678 20.078 1.00 0.00 O ATOM 0 H ASP A 32 -8.815 -3.892 16.538 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.791 -1.149 16.612 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.107 -1.693 17.385 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.415 -2.658 18.674 1.00 0.00 H new ATOM 493 N GLN A 33 -5.632 -2.335 17.457 1.00 0.00 N ATOM 494 CA GLN A 33 -4.401 -2.657 18.153 1.00 0.00 C ATOM 495 C GLN A 33 -3.344 -1.627 17.799 1.00 0.00 C ATOM 496 O GLN A 33 -3.135 -1.320 16.622 1.00 0.00 O ATOM 497 CB GLN A 33 -3.911 -4.062 17.781 1.00 0.00 C ATOM 498 CG GLN A 33 -4.947 -5.156 17.998 1.00 0.00 C ATOM 499 CD GLN A 33 -4.367 -6.545 17.837 1.00 0.00 C ATOM 500 OE1 GLN A 33 -3.888 -7.149 18.799 1.00 0.00 O ATOM 501 NE2 GLN A 33 -4.410 -7.063 16.624 1.00 0.00 N ATOM 0 H GLN A 33 -5.500 -2.039 16.490 1.00 0.00 H new ATOM 0 HA GLN A 33 -4.589 -2.640 19.227 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -3.608 -4.065 16.734 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -3.024 -4.294 18.370 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -5.371 -5.057 18.997 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -5.765 -5.023 17.290 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -4.815 -6.529 15.855 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -4.038 -7.998 16.455 1.00 0.00 H new ATOM 510 N ALA A 34 -2.694 -1.086 18.810 1.00 0.00 N ATOM 511 CA ALA A 34 -1.705 -0.045 18.602 1.00 0.00 C ATOM 512 C ALA A 34 -0.336 -0.653 18.345 1.00 0.00 C ATOM 513 O ALA A 34 0.007 -1.694 18.911 1.00 0.00 O ATOM 514 CB ALA A 34 -1.658 0.886 19.801 1.00 0.00 C ATOM 0 H ALA A 34 -2.833 -1.350 19.785 1.00 0.00 H new ATOM 0 HA ALA A 34 -1.992 0.535 17.725 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.912 1.662 19.630 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.635 1.348 19.942 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.393 0.318 20.693 1.00 0.00 H new ATOM 520 N GLY A 35 0.434 -0.010 17.482 1.00 0.00 N ATOM 521 CA GLY A 35 1.784 -0.460 17.210 1.00 0.00 C ATOM 522 C GLY A 35 1.974 -0.949 15.795 1.00 0.00 C ATOM 523 O GLY A 35 3.090 -0.954 15.280 1.00 0.00 O ATOM 0 H GLY A 35 0.147 0.820 16.962 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.478 0.358 17.401 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.039 -1.262 17.902 1.00 0.00 H new ATOM 527 N LEU A 36 0.892 -1.375 15.167 1.00 0.00 N ATOM 528 CA LEU A 36 0.946 -1.918 13.817 1.00 0.00 C ATOM 529 C LEU A 36 1.108 -0.823 12.767 1.00 0.00 C ATOM 530 O LEU A 36 0.603 0.291 12.924 1.00 0.00 O ATOM 531 CB LEU A 36 -0.336 -2.711 13.538 1.00 0.00 C ATOM 532 CG LEU A 36 -0.450 -4.096 14.203 1.00 0.00 C ATOM 533 CD1 LEU A 36 -0.152 -4.050 15.697 1.00 0.00 C ATOM 534 CD2 LEU A 36 -1.843 -4.643 13.992 1.00 0.00 C ATOM 0 H LEU A 36 -0.043 -1.356 15.573 1.00 0.00 H new ATOM 0 HA LEU A 36 1.818 -2.569 13.752 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.186 -2.108 13.859 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.427 -2.842 12.460 1.00 0.00 H new ATOM 0 HG LEU A 36 0.293 -4.743 13.737 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.246 -5.051 16.118 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.863 -3.684 15.855 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.859 -3.382 16.189 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -1.924 -5.623 14.462 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -2.571 -3.965 14.437 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.040 -4.736 12.924 1.00 0.00 H new ATOM 546 N TRP A 37 1.809 -1.161 11.690 1.00 0.00 N ATOM 547 CA TRP A 37 2.047 -0.231 10.595 1.00 0.00 C ATOM 548 C TRP A 37 1.469 -0.809 9.309 1.00 0.00 C ATOM 549 O TRP A 37 1.286 -2.021 9.201 1.00 0.00 O ATOM 550 CB TRP A 37 3.549 0.033 10.406 1.00 0.00 C ATOM 551 CG TRP A 37 4.288 0.339 11.678 1.00 0.00 C ATOM 552 CD1 TRP A 37 4.740 -0.561 12.600 1.00 0.00 C ATOM 553 CD2 TRP A 37 4.677 1.633 12.162 1.00 0.00 C ATOM 554 NE1 TRP A 37 5.373 0.093 13.628 1.00 0.00 N ATOM 555 CE2 TRP A 37 5.347 1.439 13.383 1.00 0.00 C ATOM 556 CE3 TRP A 37 4.519 2.936 11.684 1.00 0.00 C ATOM 557 CZ2 TRP A 37 5.859 2.497 14.131 1.00 0.00 C ATOM 558 CZ3 TRP A 37 5.028 3.986 12.427 1.00 0.00 C ATOM 559 CH2 TRP A 37 5.691 3.761 13.638 1.00 0.00 C ATOM 0 H TRP A 37 2.225 -2.082 11.553 1.00 0.00 H new ATOM 0 HA TRP A 37 1.561 0.715 10.835 1.00 0.00 H new ATOM 0 HB2 TRP A 37 4.003 -0.840 9.937 1.00 0.00 H new ATOM 0 HB3 TRP A 37 3.675 0.868 9.716 1.00 0.00 H new ATOM 0 HD1 TRP A 37 4.617 -1.632 12.531 1.00 0.00 H new ATOM 0 HE1 TRP A 37 5.795 -0.353 14.443 1.00 0.00 H new ATOM 0 HE3 TRP A 37 4.008 3.120 10.750 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 6.370 2.325 15.067 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 4.911 4.997 12.066 1.00 0.00 H new ATOM 0 HH2 TRP A 37 6.078 4.602 14.194 1.00 0.00 H new ATOM 570 N GLU A 38 1.169 0.054 8.349 1.00 0.00 N ATOM 571 CA GLU A 38 0.627 -0.378 7.066 1.00 0.00 C ATOM 572 C GLU A 38 1.104 0.559 5.965 1.00 0.00 C ATOM 573 O GLU A 38 1.708 1.604 6.248 1.00 0.00 O ATOM 574 CB GLU A 38 -0.912 -0.392 7.106 1.00 0.00 C ATOM 575 CG GLU A 38 -1.526 0.961 7.445 1.00 0.00 C ATOM 576 CD GLU A 38 -3.047 0.978 7.357 1.00 0.00 C ATOM 577 OE1 GLU A 38 -3.686 -0.014 7.762 1.00 0.00 O ATOM 578 OE2 GLU A 38 -3.606 2.023 6.929 1.00 0.00 O ATOM 0 H GLU A 38 1.292 1.063 8.434 1.00 0.00 H new ATOM 0 HA GLU A 38 0.979 -1.389 6.861 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.289 -0.720 6.138 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.241 -1.126 7.842 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.225 1.245 8.453 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.122 1.714 6.768 1.00 0.00 H new ATOM 585 N PHE A 39 0.846 0.187 4.720 1.00 0.00 N ATOM 586 CA PHE A 39 1.141 1.060 3.596 1.00 0.00 C ATOM 587 C PHE A 39 0.020 2.085 3.448 1.00 0.00 C ATOM 588 O PHE A 39 -1.140 1.786 3.722 1.00 0.00 O ATOM 589 CB PHE A 39 1.304 0.260 2.295 1.00 0.00 C ATOM 590 CG PHE A 39 2.418 -0.734 2.319 1.00 0.00 C ATOM 591 CD1 PHE A 39 3.735 -0.326 2.367 1.00 0.00 C ATOM 592 CD2 PHE A 39 2.138 -2.082 2.283 1.00 0.00 C ATOM 593 CE1 PHE A 39 4.756 -1.248 2.383 1.00 0.00 C ATOM 594 CE2 PHE A 39 3.150 -3.011 2.298 1.00 0.00 C ATOM 595 CZ PHE A 39 4.465 -2.597 2.349 1.00 0.00 C ATOM 0 H PHE A 39 0.434 -0.710 4.464 1.00 0.00 H new ATOM 0 HA PHE A 39 2.084 1.570 3.790 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.371 -0.263 2.085 1.00 0.00 H new ATOM 0 HB3 PHE A 39 1.472 0.956 1.473 1.00 0.00 H new ATOM 0 HD1 PHE A 39 3.967 0.728 2.392 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.111 -2.413 2.242 1.00 0.00 H new ATOM 0 HE1 PHE A 39 5.783 -0.917 2.422 1.00 0.00 H new ATOM 0 HE2 PHE A 39 2.916 -4.065 2.270 1.00 0.00 H new ATOM 0 HZ PHE A 39 5.263 -3.325 2.362 1.00 0.00 H new ATOM 605 N ALA A 40 0.368 3.292 3.031 1.00 0.00 N ATOM 606 CA ALA A 40 -0.612 4.361 2.889 1.00 0.00 C ATOM 607 C ALA A 40 -1.488 4.130 1.663 1.00 0.00 C ATOM 608 O ALA A 40 -1.112 3.384 0.757 1.00 0.00 O ATOM 609 CB ALA A 40 0.095 5.703 2.805 1.00 0.00 C ATOM 0 H ALA A 40 1.321 3.558 2.785 1.00 0.00 H new ATOM 0 HA ALA A 40 -1.260 4.363 3.766 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -0.644 6.497 2.699 1.00 0.00 H new ATOM 0 HB2 ALA A 40 0.675 5.866 3.713 1.00 0.00 H new ATOM 0 HB3 ALA A 40 0.761 5.710 1.942 1.00 0.00 H new ATOM 615 N GLY A 41 -2.651 4.766 1.626 1.00 0.00 N ATOM 616 CA GLY A 41 -3.565 4.568 0.522 1.00 0.00 C ATOM 617 C GLY A 41 -5.000 4.439 0.987 1.00 0.00 C ATOM 618 O GLY A 41 -5.444 5.188 1.857 1.00 0.00 O ATOM 0 H GLY A 41 -2.977 5.416 2.342 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.483 5.405 -0.171 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.280 3.671 -0.027 1.00 0.00 H new ATOM 622 N GLY A 42 -5.724 3.476 0.430 1.00 0.00 N ATOM 623 CA GLY A 42 -7.118 3.308 0.785 1.00 0.00 C ATOM 624 C GLY A 42 -7.909 2.566 -0.273 1.00 0.00 C ATOM 625 O GLY A 42 -7.338 2.032 -1.224 1.00 0.00 O ATOM 0 H GLY A 42 -5.371 2.811 -0.259 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.185 2.766 1.728 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.567 4.288 0.947 1.00 0.00 H new ATOM 629 N LYS A 43 -9.224 2.524 -0.098 1.00 0.00 N ATOM 630 CA LYS A 43 -10.108 1.847 -1.038 1.00 0.00 C ATOM 631 C LYS A 43 -10.346 2.707 -2.278 1.00 0.00 C ATOM 632 O LYS A 43 -10.238 3.932 -2.228 1.00 0.00 O ATOM 633 CB LYS A 43 -11.450 1.523 -0.364 1.00 0.00 C ATOM 634 CG LYS A 43 -12.439 0.810 -1.277 1.00 0.00 C ATOM 635 CD LYS A 43 -13.801 0.653 -0.629 1.00 0.00 C ATOM 636 CE LYS A 43 -14.810 0.058 -1.601 1.00 0.00 C ATOM 637 NZ LYS A 43 -14.946 0.875 -2.838 1.00 0.00 N ATOM 0 H LYS A 43 -9.704 2.954 0.692 1.00 0.00 H new ATOM 0 HA LYS A 43 -9.628 0.919 -1.347 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -11.265 0.902 0.512 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.901 2.450 -0.008 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -12.542 1.370 -2.207 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -12.047 -0.173 -1.539 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -13.717 0.012 0.249 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -14.155 1.624 -0.282 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -14.503 -0.953 -1.867 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -15.781 -0.022 -1.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -15.883 0.713 -3.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -14.843 1.883 -2.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -14.208 0.601 -3.518 1.00 0.00 H new ATOM 651 N VAL A 44 -10.681 2.052 -3.379 1.00 0.00 N ATOM 652 CA VAL A 44 -10.979 2.730 -4.628 1.00 0.00 C ATOM 653 C VAL A 44 -12.476 2.686 -4.882 1.00 0.00 C ATOM 654 O VAL A 44 -13.098 1.625 -4.782 1.00 0.00 O ATOM 655 CB VAL A 44 -10.253 2.067 -5.821 1.00 0.00 C ATOM 656 CG1 VAL A 44 -10.538 2.809 -7.117 1.00 0.00 C ATOM 657 CG2 VAL A 44 -8.759 1.991 -5.565 1.00 0.00 C ATOM 0 H VAL A 44 -10.754 1.036 -3.430 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.633 3.760 -4.540 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.636 1.052 -5.924 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -10.014 2.320 -7.939 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -11.610 2.800 -7.313 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -10.194 3.840 -7.029 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.267 1.521 -6.417 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.362 2.997 -5.426 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -8.573 1.401 -4.668 1.00 0.00 H new ATOM 667 N GLU A 45 -13.062 3.832 -5.168 1.00 0.00 N ATOM 668 CA GLU A 45 -14.459 3.880 -5.545 1.00 0.00 C ATOM 669 C GLU A 45 -14.575 3.777 -7.059 1.00 0.00 C ATOM 670 O GLU A 45 -13.662 4.178 -7.776 1.00 0.00 O ATOM 671 CB GLU A 45 -15.107 5.175 -5.053 1.00 0.00 C ATOM 672 CG GLU A 45 -15.031 5.362 -3.549 1.00 0.00 C ATOM 673 CD GLU A 45 -15.545 4.156 -2.796 1.00 0.00 C ATOM 674 OE1 GLU A 45 -16.768 3.918 -2.803 1.00 0.00 O ATOM 675 OE2 GLU A 45 -14.726 3.436 -2.192 1.00 0.00 O ATOM 0 H GLU A 45 -12.594 4.738 -5.146 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.981 3.043 -5.082 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -14.623 6.021 -5.540 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -16.153 5.187 -5.359 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.998 5.555 -3.261 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.611 6.240 -3.264 1.00 0.00 H new ATOM 682 N PRO A 46 -15.700 3.252 -7.578 1.00 0.00 N ATOM 683 CA PRO A 46 -15.927 3.141 -9.029 1.00 0.00 C ATOM 684 C PRO A 46 -16.103 4.509 -9.699 1.00 0.00 C ATOM 685 O PRO A 46 -16.510 4.607 -10.857 1.00 0.00 O ATOM 686 CB PRO A 46 -17.218 2.320 -9.125 1.00 0.00 C ATOM 687 CG PRO A 46 -17.914 2.542 -7.828 1.00 0.00 C ATOM 688 CD PRO A 46 -16.831 2.712 -6.798 1.00 0.00 C ATOM 0 HA PRO A 46 -15.080 2.685 -9.541 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -17.832 2.648 -9.964 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -17.003 1.263 -9.281 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -18.551 3.425 -7.874 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -18.558 1.698 -7.581 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -17.135 3.395 -6.005 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -16.576 1.765 -6.323 1.00 0.00 H new ATOM 696 N ASP A 47 -15.778 5.556 -8.954 1.00 0.00 N ATOM 697 CA ASP A 47 -15.896 6.927 -9.423 1.00 0.00 C ATOM 698 C ASP A 47 -14.520 7.497 -9.752 1.00 0.00 C ATOM 699 O ASP A 47 -14.395 8.551 -10.374 1.00 0.00 O ATOM 700 CB ASP A 47 -16.582 7.770 -8.340 1.00 0.00 C ATOM 701 CG ASP A 47 -16.702 9.238 -8.702 1.00 0.00 C ATOM 702 OD1 ASP A 47 -17.445 9.564 -9.649 1.00 0.00 O ATOM 703 OD2 ASP A 47 -16.062 10.073 -8.030 1.00 0.00 O ATOM 0 H ASP A 47 -15.423 5.476 -8.001 1.00 0.00 H new ATOM 0 HA ASP A 47 -16.496 6.949 -10.333 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -17.578 7.367 -8.154 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -16.022 7.678 -7.410 1.00 0.00 H new ATOM 708 N GLU A 48 -13.491 6.766 -9.363 1.00 0.00 N ATOM 709 CA GLU A 48 -12.122 7.241 -9.492 1.00 0.00 C ATOM 710 C GLU A 48 -11.217 6.157 -10.043 1.00 0.00 C ATOM 711 O GLU A 48 -11.608 4.992 -10.150 1.00 0.00 O ATOM 712 CB GLU A 48 -11.604 7.698 -8.132 1.00 0.00 C ATOM 713 CG GLU A 48 -11.460 6.559 -7.140 1.00 0.00 C ATOM 714 CD GLU A 48 -11.247 7.035 -5.727 1.00 0.00 C ATOM 715 OE1 GLU A 48 -10.436 7.960 -5.516 1.00 0.00 O ATOM 716 OE2 GLU A 48 -11.892 6.481 -4.817 1.00 0.00 O ATOM 0 H GLU A 48 -13.577 5.836 -8.953 1.00 0.00 H new ATOM 0 HA GLU A 48 -12.117 8.079 -10.189 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -10.637 8.184 -8.262 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -12.284 8.445 -7.723 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -12.354 5.936 -7.177 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -10.621 5.930 -7.436 1.00 0.00 H new ATOM 723 N SER A 49 -10.010 6.551 -10.402 1.00 0.00 N ATOM 724 CA SER A 49 -9.015 5.619 -10.879 1.00 0.00 C ATOM 725 C SER A 49 -8.162 5.120 -9.717 1.00 0.00 C ATOM 726 O SER A 49 -8.102 5.759 -8.666 1.00 0.00 O ATOM 727 CB SER A 49 -8.152 6.294 -11.937 1.00 0.00 C ATOM 728 OG SER A 49 -8.957 6.847 -12.966 1.00 0.00 O ATOM 0 H SER A 49 -9.696 7.521 -10.370 1.00 0.00 H new ATOM 0 HA SER A 49 -9.509 4.758 -11.329 1.00 0.00 H new ATOM 0 HB2 SER A 49 -7.552 7.079 -11.477 1.00 0.00 H new ATOM 0 HB3 SER A 49 -7.457 5.570 -12.362 1.00 0.00 H new ATOM 0 HG SER A 49 -8.384 7.277 -13.634 1.00 0.00 H new ATOM 734 N GLN A 50 -7.499 3.989 -9.905 1.00 0.00 N ATOM 735 CA GLN A 50 -6.763 3.353 -8.821 1.00 0.00 C ATOM 736 C GLN A 50 -5.514 4.147 -8.443 1.00 0.00 C ATOM 737 O GLN A 50 -5.226 4.330 -7.262 1.00 0.00 O ATOM 738 CB GLN A 50 -6.411 1.918 -9.198 1.00 0.00 C ATOM 739 CG GLN A 50 -7.639 1.094 -9.555 1.00 0.00 C ATOM 740 CD GLN A 50 -7.355 -0.388 -9.690 1.00 0.00 C ATOM 741 OE1 GLN A 50 -6.251 -0.799 -10.045 1.00 0.00 O ATOM 742 NE2 GLN A 50 -8.359 -1.205 -9.407 1.00 0.00 N ATOM 0 H GLN A 50 -7.455 3.493 -10.795 1.00 0.00 H new ATOM 0 HA GLN A 50 -7.406 3.335 -7.941 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -5.724 1.926 -10.044 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -5.888 1.445 -8.367 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -8.401 1.241 -8.789 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -8.054 1.463 -10.493 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -9.260 -0.825 -9.116 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -8.231 -2.214 -9.480 1.00 0.00 H new ATOM 751 N ARG A 51 -4.779 4.635 -9.439 1.00 0.00 N ATOM 752 CA ARG A 51 -3.626 5.488 -9.166 1.00 0.00 C ATOM 753 C ARG A 51 -4.111 6.825 -8.635 1.00 0.00 C ATOM 754 O ARG A 51 -3.458 7.460 -7.809 1.00 0.00 O ATOM 755 CB ARG A 51 -2.783 5.737 -10.416 1.00 0.00 C ATOM 756 CG ARG A 51 -2.263 4.485 -11.100 1.00 0.00 C ATOM 757 CD ARG A 51 -1.273 4.851 -12.194 1.00 0.00 C ATOM 758 NE ARG A 51 -0.788 3.686 -12.928 1.00 0.00 N ATOM 759 CZ ARG A 51 0.241 3.717 -13.772 1.00 0.00 C ATOM 760 NH1 ARG A 51 0.950 4.832 -13.920 1.00 0.00 N ATOM 761 NH2 ARG A 51 0.579 2.627 -14.452 1.00 0.00 N ATOM 0 H ARG A 51 -4.957 4.458 -10.428 1.00 0.00 H new ATOM 0 HA ARG A 51 -3.003 4.975 -8.434 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.380 6.302 -11.132 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.934 6.364 -10.144 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -1.782 3.836 -10.368 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.095 3.924 -11.526 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.747 5.543 -12.891 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -0.426 5.375 -11.751 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.266 2.796 -12.786 1.00 0.00 H new ATOM 0 HH11 ARG A 51 0.706 5.666 -13.386 1.00 0.00 H new ATOM 0 HH12 ARG A 51 1.738 4.853 -14.567 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.050 1.764 -14.328 1.00 0.00 H new ATOM 0 HH22 ARG A 51 1.368 2.653 -15.098 1.00 0.00 H new ATOM 775 N GLN A 52 -5.284 7.221 -9.109 1.00 0.00 N ATOM 776 CA GLN A 52 -5.897 8.481 -8.728 1.00 0.00 C ATOM 777 C GLN A 52 -6.242 8.459 -7.248 1.00 0.00 C ATOM 778 O GLN A 52 -6.029 9.437 -6.533 1.00 0.00 O ATOM 779 CB GLN A 52 -7.154 8.705 -9.577 1.00 0.00 C ATOM 780 CG GLN A 52 -7.952 9.949 -9.225 1.00 0.00 C ATOM 781 CD GLN A 52 -9.157 10.126 -10.132 1.00 0.00 C ATOM 782 OE1 GLN A 52 -9.139 9.713 -11.291 1.00 0.00 O ATOM 783 NE2 GLN A 52 -10.212 10.734 -9.617 1.00 0.00 N ATOM 0 H GLN A 52 -5.837 6.675 -9.770 1.00 0.00 H new ATOM 0 HA GLN A 52 -5.201 9.301 -8.904 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -6.861 8.764 -10.625 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.802 7.835 -9.476 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -8.284 9.886 -8.189 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -7.309 10.826 -9.301 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -10.190 11.063 -8.652 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -11.048 10.874 -10.185 1.00 0.00 H new ATOM 792 N ALA A 53 -6.740 7.314 -6.794 1.00 0.00 N ATOM 793 CA ALA A 53 -7.104 7.126 -5.400 1.00 0.00 C ATOM 794 C ALA A 53 -5.887 7.280 -4.495 1.00 0.00 C ATOM 795 O ALA A 53 -5.956 7.948 -3.467 1.00 0.00 O ATOM 796 CB ALA A 53 -7.752 5.765 -5.203 1.00 0.00 C ATOM 0 H ALA A 53 -6.901 6.496 -7.381 1.00 0.00 H new ATOM 0 HA ALA A 53 -7.825 7.896 -5.126 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -8.020 5.638 -4.154 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -8.650 5.697 -5.817 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -7.052 4.983 -5.496 1.00 0.00 H new ATOM 802 N LEU A 54 -4.768 6.686 -4.892 1.00 0.00 N ATOM 803 CA LEU A 54 -3.536 6.802 -4.120 1.00 0.00 C ATOM 804 C LEU A 54 -3.071 8.247 -4.060 1.00 0.00 C ATOM 805 O LEU A 54 -2.750 8.762 -2.990 1.00 0.00 O ATOM 806 CB LEU A 54 -2.432 5.935 -4.725 1.00 0.00 C ATOM 807 CG LEU A 54 -2.580 4.434 -4.493 1.00 0.00 C ATOM 808 CD1 LEU A 54 -1.423 3.679 -5.125 1.00 0.00 C ATOM 809 CD2 LEU A 54 -2.662 4.143 -3.003 1.00 0.00 C ATOM 0 H LEU A 54 -4.688 6.122 -5.738 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.746 6.454 -3.108 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.397 6.118 -5.799 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.475 6.257 -4.315 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.502 4.096 -4.965 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -1.546 2.610 -4.949 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.406 3.870 -6.198 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.485 4.014 -4.682 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.768 3.069 -2.847 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.753 4.493 -2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.524 4.658 -2.579 1.00 0.00 H new ATOM 821 N VAL A 55 -3.052 8.896 -5.214 1.00 0.00 N ATOM 822 CA VAL A 55 -2.584 10.268 -5.312 1.00 0.00 C ATOM 823 C VAL A 55 -3.420 11.202 -4.440 1.00 0.00 C ATOM 824 O VAL A 55 -2.874 12.026 -3.704 1.00 0.00 O ATOM 825 CB VAL A 55 -2.590 10.760 -6.776 1.00 0.00 C ATOM 826 CG1 VAL A 55 -2.320 12.257 -6.853 1.00 0.00 C ATOM 827 CG2 VAL A 55 -1.559 9.995 -7.592 1.00 0.00 C ATOM 0 H VAL A 55 -3.357 8.491 -6.099 1.00 0.00 H new ATOM 0 HA VAL A 55 -1.557 10.285 -4.948 1.00 0.00 H new ATOM 0 HB VAL A 55 -3.580 10.574 -7.192 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.330 12.575 -7.895 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -3.092 12.795 -6.302 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.345 12.474 -6.417 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -1.573 10.351 -8.622 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.568 10.154 -7.167 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.796 8.931 -7.573 1.00 0.00 H new ATOM 837 N ARG A 56 -4.740 11.057 -4.499 1.00 0.00 N ATOM 838 CA ARG A 56 -5.613 11.915 -3.708 1.00 0.00 C ATOM 839 C ARG A 56 -5.489 11.599 -2.218 1.00 0.00 C ATOM 840 O ARG A 56 -5.418 12.513 -1.401 1.00 0.00 O ATOM 841 CB ARG A 56 -7.078 11.856 -4.193 1.00 0.00 C ATOM 842 CG ARG A 56 -7.718 10.471 -4.233 1.00 0.00 C ATOM 843 CD ARG A 56 -8.538 10.172 -2.986 1.00 0.00 C ATOM 844 NE ARG A 56 -9.484 9.072 -3.207 1.00 0.00 N ATOM 845 CZ ARG A 56 -10.223 8.511 -2.251 1.00 0.00 C ATOM 846 NH1 ARG A 56 -10.082 8.881 -0.988 1.00 0.00 N ATOM 847 NH2 ARG A 56 -11.092 7.562 -2.557 1.00 0.00 N ATOM 0 H ARG A 56 -5.221 10.367 -5.075 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.282 12.943 -3.854 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.680 12.493 -3.545 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -7.125 12.285 -5.194 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -8.358 10.395 -5.112 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.938 9.717 -4.341 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.869 9.917 -2.164 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.084 11.067 -2.687 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.582 8.713 -4.157 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.403 9.601 -0.740 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.652 8.446 -0.262 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.197 7.259 -3.525 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.657 7.133 -1.825 1.00 0.00 H new ATOM 861 N GLU A 57 -5.425 10.317 -1.868 1.00 0.00 N ATOM 862 CA GLU A 57 -5.280 9.925 -0.468 1.00 0.00 C ATOM 863 C GLU A 57 -3.988 10.456 0.138 1.00 0.00 C ATOM 864 O GLU A 57 -4.022 11.109 1.176 1.00 0.00 O ATOM 865 CB GLU A 57 -5.346 8.404 -0.300 1.00 0.00 C ATOM 866 CG GLU A 57 -6.755 7.841 -0.387 1.00 0.00 C ATOM 867 CD GLU A 57 -7.682 8.410 0.673 1.00 0.00 C ATOM 868 OE1 GLU A 57 -8.051 9.600 0.568 1.00 0.00 O ATOM 869 OE2 GLU A 57 -8.080 7.666 1.595 1.00 0.00 O ATOM 0 H GLU A 57 -5.471 9.539 -2.526 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.118 10.371 0.067 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -4.729 7.935 -1.067 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -4.915 8.135 0.664 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -7.166 8.053 -1.374 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -6.715 6.757 -0.284 1.00 0.00 H new ATOM 876 N LEU A 58 -2.853 10.206 -0.511 1.00 0.00 N ATOM 877 CA LEU A 58 -1.566 10.634 0.040 1.00 0.00 C ATOM 878 C LEU A 58 -1.513 12.153 0.156 1.00 0.00 C ATOM 879 O LEU A 58 -0.911 12.685 1.076 1.00 0.00 O ATOM 880 CB LEU A 58 -0.392 10.162 -0.817 1.00 0.00 C ATOM 881 CG LEU A 58 -0.399 8.682 -1.197 1.00 0.00 C ATOM 882 CD1 LEU A 58 0.875 8.314 -1.936 1.00 0.00 C ATOM 883 CD2 LEU A 58 -0.580 7.802 0.030 1.00 0.00 C ATOM 0 H LEU A 58 -2.795 9.718 -1.405 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.479 10.181 1.027 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.375 10.753 -1.733 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.533 10.376 -0.282 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.246 8.510 -1.861 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.851 7.256 -2.198 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.954 8.911 -2.844 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.736 8.510 -1.297 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.581 6.754 -0.271 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.238 7.978 0.728 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.527 8.042 0.513 1.00 0.00 H new ATOM 895 N ARG A 59 -2.125 12.849 -0.793 1.00 0.00 N ATOM 896 CA ARG A 59 -2.234 14.301 -0.711 1.00 0.00 C ATOM 897 C ARG A 59 -2.985 14.721 0.551 1.00 0.00 C ATOM 898 O ARG A 59 -2.675 15.746 1.162 1.00 0.00 O ATOM 899 CB ARG A 59 -2.932 14.851 -1.958 1.00 0.00 C ATOM 900 CG ARG A 59 -3.293 16.325 -1.857 1.00 0.00 C ATOM 901 CD ARG A 59 -3.904 16.838 -3.149 1.00 0.00 C ATOM 902 NE ARG A 59 -4.593 18.113 -2.962 1.00 0.00 N ATOM 903 CZ ARG A 59 -4.396 19.191 -3.720 1.00 0.00 C ATOM 904 NH1 ARG A 59 -3.447 19.196 -4.652 1.00 0.00 N ATOM 905 NH2 ARG A 59 -5.143 20.270 -3.529 1.00 0.00 N ATOM 0 H ARG A 59 -2.551 12.436 -1.623 1.00 0.00 H new ATOM 0 HA ARG A 59 -1.228 14.718 -0.660 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.283 14.703 -2.821 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -3.840 14.275 -2.139 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.996 16.473 -1.037 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -2.400 16.904 -1.620 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.121 16.956 -3.898 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.607 16.100 -3.536 1.00 0.00 H new ATOM 0 HE ARG A 59 -5.269 18.182 -2.201 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.864 18.371 -4.790 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -3.302 20.025 -5.228 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -5.862 20.271 -2.806 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -4.998 21.099 -4.105 1.00 0.00 H new ATOM 919 N GLU A 60 -3.955 13.917 0.954 1.00 0.00 N ATOM 920 CA GLU A 60 -4.769 14.245 2.110 1.00 0.00 C ATOM 921 C GLU A 60 -4.133 13.745 3.406 1.00 0.00 C ATOM 922 O GLU A 60 -4.156 14.443 4.420 1.00 0.00 O ATOM 923 CB GLU A 60 -6.187 13.685 1.954 1.00 0.00 C ATOM 924 CG GLU A 60 -6.885 14.163 0.690 1.00 0.00 C ATOM 925 CD GLU A 60 -8.395 14.056 0.764 1.00 0.00 C ATOM 926 OE1 GLU A 60 -9.022 14.942 1.381 1.00 0.00 O ATOM 927 OE2 GLU A 60 -8.967 13.099 0.200 1.00 0.00 O ATOM 0 H GLU A 60 -4.196 13.036 0.499 1.00 0.00 H new ATOM 0 HA GLU A 60 -4.830 15.332 2.169 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.142 12.596 1.946 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -6.782 13.973 2.821 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -6.610 15.201 0.501 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -6.527 13.579 -0.158 1.00 0.00 H new ATOM 934 N GLU A 61 -3.562 12.546 3.385 1.00 0.00 N ATOM 935 CA GLU A 61 -2.985 11.986 4.595 1.00 0.00 C ATOM 936 C GLU A 61 -1.501 12.296 4.737 1.00 0.00 C ATOM 937 O GLU A 61 -1.045 12.636 5.825 1.00 0.00 O ATOM 938 CB GLU A 61 -3.204 10.478 4.690 1.00 0.00 C ATOM 939 CG GLU A 61 -2.662 9.662 3.534 1.00 0.00 C ATOM 940 CD GLU A 61 -2.398 8.230 3.950 1.00 0.00 C ATOM 941 OE1 GLU A 61 -1.655 8.033 4.938 1.00 0.00 O ATOM 942 OE2 GLU A 61 -2.936 7.300 3.315 1.00 0.00 O ATOM 0 H GLU A 61 -3.488 11.954 2.558 1.00 0.00 H new ATOM 0 HA GLU A 61 -3.512 12.470 5.417 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -2.744 10.120 5.611 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -4.274 10.289 4.774 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -3.374 9.678 2.709 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -1.740 10.113 3.168 1.00 0.00 H new ATOM 949 N LEU A 62 -0.749 12.187 3.656 1.00 0.00 N ATOM 950 CA LEU A 62 0.696 12.318 3.738 1.00 0.00 C ATOM 951 C LEU A 62 1.157 13.690 3.275 1.00 0.00 C ATOM 952 O LEU A 62 2.356 13.960 3.250 1.00 0.00 O ATOM 953 CB LEU A 62 1.385 11.235 2.904 1.00 0.00 C ATOM 954 CG LEU A 62 1.017 9.794 3.262 1.00 0.00 C ATOM 955 CD1 LEU A 62 1.847 8.828 2.444 1.00 0.00 C ATOM 956 CD2 LEU A 62 1.209 9.533 4.748 1.00 0.00 C ATOM 0 H LEU A 62 -1.110 12.010 2.719 1.00 0.00 H new ATOM 0 HA LEU A 62 0.974 12.196 4.785 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.146 11.402 1.854 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.464 11.352 3.008 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.037 9.642 3.029 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.578 7.805 2.706 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.657 8.993 1.383 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.905 8.990 2.653 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.940 8.501 4.974 1.00 0.00 H new ATOM 0 HD22 LEU A 62 2.252 9.703 5.015 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.573 10.208 5.321 1.00 0.00 H new ATOM 968 N GLY A 63 0.207 14.560 2.933 1.00 0.00 N ATOM 969 CA GLY A 63 0.543 15.886 2.441 1.00 0.00 C ATOM 970 C GLY A 63 1.510 15.885 1.266 1.00 0.00 C ATOM 971 O GLY A 63 2.247 16.852 1.070 1.00 0.00 O ATOM 0 H GLY A 63 -0.793 14.368 2.989 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -0.374 16.395 2.143 1.00 0.00 H new ATOM 0 HA3 GLY A 63 0.978 16.465 3.256 1.00 0.00 H new ATOM 975 N ILE A 64 1.528 14.810 0.483 1.00 0.00 N ATOM 976 CA ILE A 64 2.412 14.754 -0.673 1.00 0.00 C ATOM 977 C ILE A 64 1.655 14.449 -1.955 1.00 0.00 C ATOM 978 O ILE A 64 0.711 13.662 -1.975 1.00 0.00 O ATOM 979 CB ILE A 64 3.567 13.735 -0.519 1.00 0.00 C ATOM 980 CG1 ILE A 64 3.047 12.313 -0.273 1.00 0.00 C ATOM 981 CG2 ILE A 64 4.510 14.164 0.591 1.00 0.00 C ATOM 982 CD1 ILE A 64 4.157 11.292 -0.105 1.00 0.00 C ATOM 0 H ILE A 64 0.951 13.981 0.625 1.00 0.00 H new ATOM 0 HA ILE A 64 2.848 15.751 -0.733 1.00 0.00 H new ATOM 0 HB ILE A 64 4.118 13.719 -1.459 1.00 0.00 H new ATOM 0 HG12 ILE A 64 2.422 12.311 0.620 1.00 0.00 H new ATOM 0 HG13 ILE A 64 2.412 12.016 -1.107 1.00 0.00 H new ATOM 0 HG21 ILE A 64 5.316 13.436 0.685 1.00 0.00 H new ATOM 0 HG22 ILE A 64 4.930 15.142 0.354 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.962 14.223 1.531 1.00 0.00 H new ATOM 0 HD11 ILE A 64 3.723 10.307 0.066 1.00 0.00 H new ATOM 0 HD12 ILE A 64 4.768 11.267 -1.007 1.00 0.00 H new ATOM 0 HD13 ILE A 64 4.779 11.567 0.747 1.00 0.00 H new ATOM 994 N GLU A 65 2.091 15.095 -3.017 1.00 0.00 N ATOM 995 CA GLU A 65 1.550 14.877 -4.341 1.00 0.00 C ATOM 996 C GLU A 65 2.398 13.829 -5.047 1.00 0.00 C ATOM 997 O GLU A 65 3.439 14.142 -5.632 1.00 0.00 O ATOM 998 CB GLU A 65 1.542 16.199 -5.112 1.00 0.00 C ATOM 999 CG GLU A 65 0.651 17.253 -4.472 1.00 0.00 C ATOM 1000 CD GLU A 65 0.789 18.615 -5.117 1.00 0.00 C ATOM 1001 OE1 GLU A 65 1.846 19.255 -4.932 1.00 0.00 O ATOM 1002 OE2 GLU A 65 -0.152 19.052 -5.809 1.00 0.00 O ATOM 0 H GLU A 65 2.836 15.791 -2.984 1.00 0.00 H new ATOM 0 HA GLU A 65 0.523 14.516 -4.283 1.00 0.00 H new ATOM 0 HB2 GLU A 65 2.560 16.582 -5.177 1.00 0.00 H new ATOM 0 HB3 GLU A 65 1.205 16.017 -6.132 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -0.388 16.930 -4.537 1.00 0.00 H new ATOM 0 HG3 GLU A 65 0.895 17.332 -3.413 1.00 0.00 H new ATOM 1009 N ALA A 66 1.973 12.582 -4.939 1.00 0.00 N ATOM 1010 CA ALA A 66 2.761 11.459 -5.423 1.00 0.00 C ATOM 1011 C ALA A 66 2.521 11.193 -6.903 1.00 0.00 C ATOM 1012 O ALA A 66 1.493 11.573 -7.459 1.00 0.00 O ATOM 1013 CB ALA A 66 2.444 10.211 -4.612 1.00 0.00 C ATOM 0 H ALA A 66 1.082 12.320 -4.518 1.00 0.00 H new ATOM 0 HA ALA A 66 3.813 11.717 -5.300 1.00 0.00 H new ATOM 0 HB1 ALA A 66 3.039 9.376 -4.982 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.681 10.389 -3.563 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.385 9.973 -4.709 1.00 0.00 H new ATOM 1019 N THR A 67 3.483 10.540 -7.531 1.00 0.00 N ATOM 1020 CA THR A 67 3.352 10.124 -8.913 1.00 0.00 C ATOM 1021 C THR A 67 3.417 8.602 -8.992 1.00 0.00 C ATOM 1022 O THR A 67 4.478 8.007 -8.813 1.00 0.00 O ATOM 1023 CB THR A 67 4.453 10.746 -9.794 1.00 0.00 C ATOM 1024 OG1 THR A 67 4.476 12.167 -9.600 1.00 0.00 O ATOM 1025 CG2 THR A 67 4.216 10.441 -11.268 1.00 0.00 C ATOM 0 H THR A 67 4.371 10.285 -7.099 1.00 0.00 H new ATOM 0 HA THR A 67 2.390 10.473 -9.288 1.00 0.00 H new ATOM 0 HB THR A 67 5.410 10.313 -9.502 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.177 12.562 -10.159 1.00 0.00 H new ATOM 0 HG21 THR A 67 5.008 10.893 -11.865 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.217 9.362 -11.421 1.00 0.00 H new ATOM 0 HG23 THR A 67 3.253 10.850 -11.574 1.00 0.00 H new ATOM 1033 N VAL A 68 2.265 7.978 -9.201 1.00 0.00 N ATOM 1034 CA VAL A 68 2.189 6.526 -9.282 1.00 0.00 C ATOM 1035 C VAL A 68 2.604 6.054 -10.673 1.00 0.00 C ATOM 1036 O VAL A 68 1.985 6.436 -11.670 1.00 0.00 O ATOM 1037 CB VAL A 68 0.767 6.014 -8.963 1.00 0.00 C ATOM 1038 CG1 VAL A 68 0.724 4.498 -8.958 1.00 0.00 C ATOM 1039 CG2 VAL A 68 0.287 6.564 -7.631 1.00 0.00 C ATOM 0 H VAL A 68 1.371 8.455 -9.317 1.00 0.00 H new ATOM 0 HA VAL A 68 2.873 6.117 -8.538 1.00 0.00 H new ATOM 0 HB VAL A 68 0.097 6.370 -9.746 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.288 4.163 -8.731 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.019 4.122 -9.938 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.410 4.117 -8.202 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -0.716 6.192 -7.424 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.964 6.242 -6.839 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.269 7.653 -7.672 1.00 0.00 H new ATOM 1049 N GLY A 69 3.634 5.215 -10.744 1.00 0.00 N ATOM 1050 CA GLY A 69 4.162 4.830 -12.035 1.00 0.00 C ATOM 1051 C GLY A 69 5.151 3.681 -11.975 1.00 0.00 C ATOM 1052 O GLY A 69 6.333 3.884 -12.250 1.00 0.00 O ATOM 0 H GLY A 69 4.105 4.801 -9.940 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.334 4.551 -12.687 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.649 5.693 -12.490 1.00 0.00 H new ATOM 1056 N GLU A 70 4.650 2.480 -11.637 1.00 0.00 N ATOM 1057 CA GLU A 70 5.430 1.230 -11.626 1.00 0.00 C ATOM 1058 C GLU A 70 4.729 0.201 -10.736 1.00 0.00 C ATOM 1059 O GLU A 70 4.175 0.542 -9.692 1.00 0.00 O ATOM 1060 CB GLU A 70 6.882 1.407 -11.170 1.00 0.00 C ATOM 1061 CG GLU A 70 7.040 1.829 -9.728 1.00 0.00 C ATOM 1062 CD GLU A 70 8.490 1.965 -9.338 1.00 0.00 C ATOM 1063 OE1 GLU A 70 9.153 0.932 -9.129 1.00 0.00 O ATOM 1064 OE2 GLU A 70 8.970 3.112 -9.219 1.00 0.00 O ATOM 0 H GLU A 70 3.677 2.349 -11.360 1.00 0.00 H new ATOM 0 HA GLU A 70 5.477 0.885 -12.659 1.00 0.00 H new ATOM 0 HB2 GLU A 70 7.414 0.467 -11.320 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.361 2.150 -11.807 1.00 0.00 H new ATOM 0 HG2 GLU A 70 6.531 2.780 -9.570 1.00 0.00 H new ATOM 0 HG3 GLU A 70 6.557 1.097 -9.080 1.00 0.00 H new ATOM 1071 N TYR A 71 4.779 -1.051 -11.153 1.00 0.00 N ATOM 1072 CA TYR A 71 3.979 -2.099 -10.523 1.00 0.00 C ATOM 1073 C TYR A 71 4.833 -2.998 -9.632 1.00 0.00 C ATOM 1074 O TYR A 71 5.850 -3.529 -10.074 1.00 0.00 O ATOM 1075 CB TYR A 71 3.266 -2.932 -11.590 1.00 0.00 C ATOM 1076 CG TYR A 71 2.026 -3.627 -11.078 1.00 0.00 C ATOM 1077 CD1 TYR A 71 0.957 -2.885 -10.599 1.00 0.00 C ATOM 1078 CD2 TYR A 71 1.919 -5.013 -11.073 1.00 0.00 C ATOM 1079 CE1 TYR A 71 -0.185 -3.496 -10.129 1.00 0.00 C ATOM 1080 CE2 TYR A 71 0.775 -5.635 -10.605 1.00 0.00 C ATOM 1081 CZ TYR A 71 -0.273 -4.868 -10.134 1.00 0.00 C ATOM 1082 OH TYR A 71 -1.416 -5.472 -9.664 1.00 0.00 O ATOM 0 H TYR A 71 5.363 -1.372 -11.925 1.00 0.00 H new ATOM 0 HA TYR A 71 3.235 -1.616 -9.890 1.00 0.00 H new ATOM 0 HB2 TYR A 71 2.993 -2.285 -12.423 1.00 0.00 H new ATOM 0 HB3 TYR A 71 3.958 -3.679 -11.980 1.00 0.00 H new ATOM 0 HD1 TYR A 71 1.021 -1.807 -10.594 1.00 0.00 H new ATOM 0 HD2 TYR A 71 2.740 -5.612 -11.439 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -1.006 -2.901 -9.759 1.00 0.00 H new ATOM 0 HE2 TYR A 71 0.702 -6.713 -10.608 1.00 0.00 H new ATOM 0 HH TYR A 71 -2.085 -4.787 -9.454 1.00 0.00 H new ATOM 1092 N VAL A 72 4.427 -3.156 -8.375 1.00 0.00 N ATOM 1093 CA VAL A 72 5.112 -4.079 -7.474 1.00 0.00 C ATOM 1094 C VAL A 72 4.408 -5.429 -7.439 1.00 0.00 C ATOM 1095 O VAL A 72 4.918 -6.415 -7.974 1.00 0.00 O ATOM 1096 CB VAL A 72 5.188 -3.527 -6.037 1.00 0.00 C ATOM 1097 CG1 VAL A 72 5.845 -4.540 -5.101 1.00 0.00 C ATOM 1098 CG2 VAL A 72 5.940 -2.206 -6.016 1.00 0.00 C ATOM 0 H VAL A 72 3.636 -2.663 -7.960 1.00 0.00 H new ATOM 0 HA VAL A 72 6.124 -4.198 -7.862 1.00 0.00 H new ATOM 0 HB VAL A 72 4.173 -3.350 -5.682 1.00 0.00 H new ATOM 0 HG11 VAL A 72 5.888 -4.129 -4.092 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.261 -5.460 -5.093 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.856 -4.755 -5.449 1.00 0.00 H new ATOM 0 HG21 VAL A 72 5.985 -1.829 -4.994 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.952 -2.357 -6.392 1.00 0.00 H new ATOM 0 HG23 VAL A 72 5.423 -1.483 -6.647 1.00 0.00 H new ATOM 1108 N ALA A 73 3.224 -5.466 -6.837 1.00 0.00 N ATOM 1109 CA ALA A 73 2.454 -6.704 -6.767 1.00 0.00 C ATOM 1110 C ALA A 73 0.994 -6.438 -6.444 1.00 0.00 C ATOM 1111 O ALA A 73 0.588 -5.296 -6.240 1.00 0.00 O ATOM 1112 CB ALA A 73 3.047 -7.638 -5.724 1.00 0.00 C ATOM 0 H ALA A 73 2.779 -4.662 -6.394 1.00 0.00 H new ATOM 0 HA ALA A 73 2.504 -7.176 -7.748 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.462 -8.557 -5.684 1.00 0.00 H new ATOM 0 HB2 ALA A 73 4.077 -7.875 -5.991 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.028 -7.153 -4.748 1.00 0.00 H new ATOM 1118 N SER A 74 0.208 -7.499 -6.418 1.00 0.00 N ATOM 1119 CA SER A 74 -1.184 -7.421 -6.025 1.00 0.00 C ATOM 1120 C SER A 74 -1.580 -8.670 -5.253 1.00 0.00 C ATOM 1121 O SER A 74 -1.056 -9.755 -5.505 1.00 0.00 O ATOM 1122 CB SER A 74 -2.062 -7.250 -7.264 1.00 0.00 C ATOM 1123 OG SER A 74 -1.590 -8.049 -8.338 1.00 0.00 O ATOM 0 H SER A 74 0.518 -8.438 -6.669 1.00 0.00 H new ATOM 0 HA SER A 74 -1.327 -6.558 -5.375 1.00 0.00 H new ATOM 0 HB2 SER A 74 -3.090 -7.525 -7.026 1.00 0.00 H new ATOM 0 HB3 SER A 74 -2.074 -6.202 -7.564 1.00 0.00 H new ATOM 0 HG SER A 74 -1.385 -7.476 -9.106 1.00 0.00 H new ATOM 1129 N HIS A 75 -2.492 -8.516 -4.307 1.00 0.00 N ATOM 1130 CA HIS A 75 -2.928 -9.632 -3.485 1.00 0.00 C ATOM 1131 C HIS A 75 -4.447 -9.668 -3.408 1.00 0.00 C ATOM 1132 O HIS A 75 -5.090 -8.632 -3.221 1.00 0.00 O ATOM 1133 CB HIS A 75 -2.336 -9.526 -2.074 1.00 0.00 C ATOM 1134 CG HIS A 75 -2.723 -10.656 -1.160 1.00 0.00 C ATOM 1135 ND1 HIS A 75 -3.565 -10.496 -0.080 1.00 0.00 N ATOM 1136 CD2 HIS A 75 -2.365 -11.962 -1.161 1.00 0.00 C ATOM 1137 CE1 HIS A 75 -3.704 -11.655 0.542 1.00 0.00 C ATOM 1138 NE2 HIS A 75 -2.987 -12.559 -0.095 1.00 0.00 N ATOM 0 H HIS A 75 -2.945 -7.628 -4.089 1.00 0.00 H new ATOM 0 HA HIS A 75 -2.574 -10.555 -3.944 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -1.249 -9.490 -2.149 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -2.656 -8.585 -1.627 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -1.710 -12.445 -1.871 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -4.304 -11.831 1.423 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -2.908 -13.543 0.163 1.00 0.00 H new ATOM 1147 N GLN A 76 -5.012 -10.852 -3.566 1.00 0.00 N ATOM 1148 CA GLN A 76 -6.437 -11.043 -3.380 1.00 0.00 C ATOM 1149 C GLN A 76 -6.704 -11.752 -2.066 1.00 0.00 C ATOM 1150 O GLN A 76 -5.979 -12.667 -1.680 1.00 0.00 O ATOM 1151 CB GLN A 76 -7.049 -11.849 -4.525 1.00 0.00 C ATOM 1152 CG GLN A 76 -7.428 -11.015 -5.731 1.00 0.00 C ATOM 1153 CD GLN A 76 -8.048 -11.855 -6.830 1.00 0.00 C ATOM 1154 OE1 GLN A 76 -7.711 -13.024 -6.998 1.00 0.00 O ATOM 1155 NE2 GLN A 76 -8.970 -11.269 -7.576 1.00 0.00 N ATOM 0 H GLN A 76 -4.503 -11.697 -3.824 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.901 -10.057 -3.367 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -6.340 -12.617 -4.835 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -7.937 -12.365 -4.159 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -8.130 -10.238 -5.428 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.542 -10.511 -6.116 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -9.222 -10.296 -7.404 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -9.429 -11.791 -8.323 1.00 0.00 H new ATOM 1164 N ARG A 77 -7.731 -11.304 -1.379 1.00 0.00 N ATOM 1165 CA ARG A 77 -8.186 -11.940 -0.158 1.00 0.00 C ATOM 1166 C ARG A 77 -9.662 -11.649 -0.019 1.00 0.00 C ATOM 1167 O ARG A 77 -10.213 -10.917 -0.832 1.00 0.00 O ATOM 1168 CB ARG A 77 -7.421 -11.434 1.072 1.00 0.00 C ATOM 1169 CG ARG A 77 -7.715 -9.989 1.446 1.00 0.00 C ATOM 1170 CD ARG A 77 -7.090 -9.632 2.784 1.00 0.00 C ATOM 1171 NE ARG A 77 -7.493 -8.304 3.249 1.00 0.00 N ATOM 1172 CZ ARG A 77 -8.209 -8.090 4.358 1.00 0.00 C ATOM 1173 NH1 ARG A 77 -8.632 -9.114 5.089 1.00 0.00 N ATOM 1174 NH2 ARG A 77 -8.510 -6.848 4.724 1.00 0.00 N ATOM 0 H ARG A 77 -8.277 -10.486 -1.650 1.00 0.00 H new ATOM 0 HA ARG A 77 -8.002 -13.013 -0.216 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -7.662 -12.072 1.922 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -6.352 -11.538 0.888 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -7.330 -9.324 0.673 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -8.793 -9.834 1.492 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -7.376 -10.377 3.526 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -6.004 -9.670 2.697 1.00 0.00 H new ATOM 0 HE ARG A 77 -7.211 -7.495 2.695 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -8.411 -10.069 4.806 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -9.178 -8.946 5.934 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -8.195 -6.059 4.159 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -9.056 -6.684 5.570 1.00 0.00 H new ATOM 1188 N GLU A 78 -10.316 -12.215 0.970 1.00 0.00 N ATOM 1189 CA GLU A 78 -11.723 -11.931 1.157 1.00 0.00 C ATOM 1190 C GLU A 78 -11.981 -11.326 2.527 1.00 0.00 C ATOM 1191 O GLU A 78 -11.248 -11.579 3.485 1.00 0.00 O ATOM 1192 CB GLU A 78 -12.571 -13.190 0.953 1.00 0.00 C ATOM 1193 CG GLU A 78 -12.491 -14.192 2.089 1.00 0.00 C ATOM 1194 CD GLU A 78 -13.328 -15.424 1.824 1.00 0.00 C ATOM 1195 OE1 GLU A 78 -14.571 -15.334 1.929 1.00 0.00 O ATOM 1196 OE2 GLU A 78 -12.748 -16.483 1.498 1.00 0.00 O ATOM 0 H GLU A 78 -9.908 -12.862 1.645 1.00 0.00 H new ATOM 0 HA GLU A 78 -12.016 -11.200 0.404 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -13.611 -12.894 0.819 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.257 -13.679 0.031 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -11.452 -14.486 2.239 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -12.825 -13.719 3.012 1.00 0.00 H new ATOM 1203 N VAL A 79 -13.011 -10.504 2.601 1.00 0.00 N ATOM 1204 CA VAL A 79 -13.480 -9.993 3.866 1.00 0.00 C ATOM 1205 C VAL A 79 -14.899 -10.498 4.081 1.00 0.00 C ATOM 1206 O VAL A 79 -15.868 -9.906 3.603 1.00 0.00 O ATOM 1207 CB VAL A 79 -13.415 -8.443 3.956 1.00 0.00 C ATOM 1208 CG1 VAL A 79 -13.997 -7.775 2.715 1.00 0.00 C ATOM 1209 CG2 VAL A 79 -14.112 -7.939 5.212 1.00 0.00 C ATOM 0 H VAL A 79 -13.539 -10.177 1.792 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.821 -10.356 4.655 1.00 0.00 H new ATOM 0 HB VAL A 79 -12.361 -8.170 4.012 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.931 -6.692 2.820 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -13.435 -8.089 1.835 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -15.041 -8.066 2.601 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.052 -6.851 5.250 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -15.158 -8.244 5.195 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.626 -8.360 6.092 1.00 0.00 H new ATOM 1219 N SER A 80 -14.995 -11.626 4.774 1.00 0.00 N ATOM 1220 CA SER A 80 -16.260 -12.300 5.031 1.00 0.00 C ATOM 1221 C SER A 80 -17.173 -12.312 3.795 1.00 0.00 C ATOM 1222 O SER A 80 -18.174 -11.596 3.737 1.00 0.00 O ATOM 1223 CB SER A 80 -16.953 -11.651 6.231 1.00 0.00 C ATOM 1224 OG SER A 80 -16.074 -11.622 7.346 1.00 0.00 O ATOM 0 H SER A 80 -14.188 -12.103 5.177 1.00 0.00 H new ATOM 0 HA SER A 80 -16.048 -13.343 5.264 1.00 0.00 H new ATOM 0 HB2 SER A 80 -17.264 -10.638 5.977 1.00 0.00 H new ATOM 0 HB3 SER A 80 -17.856 -12.207 6.484 1.00 0.00 H new ATOM 0 HG SER A 80 -16.526 -11.203 8.108 1.00 0.00 H new ATOM 1230 N GLY A 81 -16.807 -13.113 2.797 1.00 0.00 N ATOM 1231 CA GLY A 81 -17.635 -13.259 1.610 1.00 0.00 C ATOM 1232 C GLY A 81 -17.322 -12.276 0.489 1.00 0.00 C ATOM 1233 O GLY A 81 -17.617 -12.557 -0.672 1.00 0.00 O ATOM 0 H GLY A 81 -15.949 -13.665 2.789 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -17.521 -14.273 1.227 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -18.680 -13.141 1.896 1.00 0.00 H new ATOM 1237 N ARG A 82 -16.737 -11.129 0.811 1.00 0.00 N ATOM 1238 CA ARG A 82 -16.409 -10.136 -0.215 1.00 0.00 C ATOM 1239 C ARG A 82 -14.948 -10.265 -0.626 1.00 0.00 C ATOM 1240 O ARG A 82 -14.084 -10.437 0.221 1.00 0.00 O ATOM 1241 CB ARG A 82 -16.678 -8.716 0.290 1.00 0.00 C ATOM 1242 CG ARG A 82 -18.105 -8.482 0.753 1.00 0.00 C ATOM 1243 CD ARG A 82 -18.341 -7.022 1.110 1.00 0.00 C ATOM 1244 NE ARG A 82 -19.690 -6.784 1.618 1.00 0.00 N ATOM 1245 CZ ARG A 82 -20.450 -5.749 1.261 1.00 0.00 C ATOM 1246 NH1 ARG A 82 -20.015 -4.873 0.363 1.00 0.00 N ATOM 1247 NH2 ARG A 82 -21.651 -5.586 1.802 1.00 0.00 N ATOM 0 H ARG A 82 -16.481 -10.861 1.761 1.00 0.00 H new ATOM 0 HA ARG A 82 -17.045 -10.324 -1.080 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -16.000 -8.501 1.116 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -16.445 -8.009 -0.506 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -18.798 -8.782 -0.033 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -18.315 -9.109 1.620 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -17.613 -6.712 1.860 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.173 -6.403 0.228 1.00 0.00 H new ATOM 0 HE ARG A 82 -20.074 -7.451 2.287 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -19.094 -4.990 -0.059 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -20.602 -4.083 0.095 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -21.994 -6.254 2.493 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -22.231 -4.793 1.527 1.00 0.00 H new ATOM 1261 N ILE A 83 -14.669 -10.162 -1.915 1.00 0.00 N ATOM 1262 CA ILE A 83 -13.308 -10.358 -2.412 1.00 0.00 C ATOM 1263 C ILE A 83 -12.575 -9.026 -2.542 1.00 0.00 C ATOM 1264 O ILE A 83 -12.976 -8.155 -3.311 1.00 0.00 O ATOM 1265 CB ILE A 83 -13.283 -11.107 -3.774 1.00 0.00 C ATOM 1266 CG1 ILE A 83 -13.572 -12.605 -3.591 1.00 0.00 C ATOM 1267 CG2 ILE A 83 -11.942 -10.924 -4.477 1.00 0.00 C ATOM 1268 CD1 ILE A 83 -14.980 -12.926 -3.143 1.00 0.00 C ATOM 0 H ILE A 83 -15.358 -9.946 -2.635 1.00 0.00 H new ATOM 0 HA ILE A 83 -12.795 -10.979 -1.678 1.00 0.00 H new ATOM 0 HB ILE A 83 -14.067 -10.674 -4.395 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -13.380 -13.116 -4.534 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -12.872 -13.010 -2.861 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -11.953 -11.459 -5.427 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.769 -9.863 -4.660 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.144 -11.319 -3.848 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -15.092 -14.005 -3.040 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -15.174 -12.448 -2.183 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -15.690 -12.556 -3.882 1.00 0.00 H new ATOM 1280 N ILE A 84 -11.510 -8.872 -1.771 1.00 0.00 N ATOM 1281 CA ILE A 84 -10.698 -7.666 -1.813 1.00 0.00 C ATOM 1282 C ILE A 84 -9.530 -7.827 -2.784 1.00 0.00 C ATOM 1283 O ILE A 84 -8.863 -8.866 -2.817 1.00 0.00 O ATOM 1284 CB ILE A 84 -10.144 -7.285 -0.422 1.00 0.00 C ATOM 1285 CG1 ILE A 84 -10.798 -8.106 0.683 1.00 0.00 C ATOM 1286 CG2 ILE A 84 -10.379 -5.817 -0.141 1.00 0.00 C ATOM 1287 CD1 ILE A 84 -10.743 -7.415 2.028 1.00 0.00 C ATOM 0 H ILE A 84 -11.186 -9.573 -1.104 1.00 0.00 H new ATOM 0 HA ILE A 84 -11.355 -6.866 -2.154 1.00 0.00 H new ATOM 0 HB ILE A 84 -9.074 -7.495 -0.434 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -11.838 -8.300 0.420 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.301 -9.074 0.755 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -9.982 -5.567 0.843 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -9.876 -5.216 -0.899 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -11.449 -5.609 -0.165 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -11.223 -8.042 2.779 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -9.703 -7.245 2.307 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -11.264 -6.459 1.968 1.00 0.00 H new ATOM 1299 N HIS A 85 -9.287 -6.786 -3.562 1.00 0.00 N ATOM 1300 CA HIS A 85 -8.251 -6.795 -4.581 1.00 0.00 C ATOM 1301 C HIS A 85 -7.270 -5.651 -4.343 1.00 0.00 C ATOM 1302 O HIS A 85 -7.534 -4.508 -4.718 1.00 0.00 O ATOM 1303 CB HIS A 85 -8.906 -6.656 -5.960 1.00 0.00 C ATOM 1304 CG HIS A 85 -7.993 -6.929 -7.116 1.00 0.00 C ATOM 1305 ND1 HIS A 85 -7.067 -7.899 -7.309 1.00 0.00 N flip ATOM 1306 CD2 HIS A 85 -7.999 -6.175 -8.269 1.00 0.00 C flip ATOM 1307 CE1 HIS A 85 -6.539 -7.715 -8.564 1.00 0.00 C flip ATOM 1308 NE2 HIS A 85 -7.120 -6.670 -9.118 1.00 0.00 N flip ATOM 0 H HIS A 85 -9.804 -5.909 -3.505 1.00 0.00 H new ATOM 0 HA HIS A 85 -7.700 -7.734 -4.534 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -9.754 -7.339 -6.015 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -9.303 -5.646 -6.059 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -8.625 -5.314 -8.449 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -5.774 -8.326 -9.021 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -6.922 -6.305 -10.050 1.00 0.00 H new ATOM 1317 N LEU A 86 -6.146 -5.957 -3.710 1.00 0.00 N ATOM 1318 CA LEU A 86 -5.159 -4.936 -3.375 1.00 0.00 C ATOM 1319 C LEU A 86 -4.124 -4.774 -4.482 1.00 0.00 C ATOM 1320 O LEU A 86 -3.635 -5.757 -5.038 1.00 0.00 O ATOM 1321 CB LEU A 86 -4.452 -5.261 -2.053 1.00 0.00 C ATOM 1322 CG LEU A 86 -5.278 -5.023 -0.792 1.00 0.00 C ATOM 1323 CD1 LEU A 86 -6.096 -6.252 -0.436 1.00 0.00 C ATOM 1324 CD2 LEU A 86 -4.370 -4.609 0.354 1.00 0.00 C ATOM 0 H LEU A 86 -5.894 -6.901 -3.418 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.700 -3.996 -3.265 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.144 -6.306 -2.073 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -3.543 -4.662 -1.990 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.981 -4.212 -0.982 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.675 -6.055 0.466 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -6.773 -6.489 -1.257 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -5.428 -7.096 -0.262 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -4.968 -4.441 1.250 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.643 -5.398 0.546 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.847 -3.690 0.090 1.00 0.00 H new ATOM 1336 N HIS A 87 -3.815 -3.522 -4.808 1.00 0.00 N ATOM 1337 CA HIS A 87 -2.741 -3.202 -5.747 1.00 0.00 C ATOM 1338 C HIS A 87 -1.619 -2.471 -5.028 1.00 0.00 C ATOM 1339 O HIS A 87 -1.835 -1.396 -4.471 1.00 0.00 O ATOM 1340 CB HIS A 87 -3.233 -2.317 -6.898 1.00 0.00 C ATOM 1341 CG HIS A 87 -4.070 -3.014 -7.927 1.00 0.00 C ATOM 1342 ND1 HIS A 87 -3.537 -3.736 -8.973 1.00 0.00 N ATOM 1343 CD2 HIS A 87 -5.410 -3.045 -8.097 1.00 0.00 C ATOM 1344 CE1 HIS A 87 -4.512 -4.174 -9.744 1.00 0.00 C ATOM 1345 NE2 HIS A 87 -5.664 -3.771 -9.237 1.00 0.00 N ATOM 0 H HIS A 87 -4.297 -2.705 -4.433 1.00 0.00 H new ATOM 0 HA HIS A 87 -2.384 -4.147 -6.157 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -3.812 -1.493 -6.480 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -2.367 -1.879 -7.394 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -6.146 -2.584 -7.455 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -4.390 -4.764 -10.640 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -6.587 -3.966 -9.626 1.00 0.00 H new ATOM 1354 N ALA A 88 -0.432 -3.055 -5.034 1.00 0.00 N ATOM 1355 CA ALA A 88 0.729 -2.415 -4.441 1.00 0.00 C ATOM 1356 C ALA A 88 1.578 -1.750 -5.511 1.00 0.00 C ATOM 1357 O ALA A 88 2.222 -2.423 -6.321 1.00 0.00 O ATOM 1358 CB ALA A 88 1.561 -3.417 -3.656 1.00 0.00 C ATOM 0 H ALA A 88 -0.248 -3.971 -5.443 1.00 0.00 H new ATOM 0 HA ALA A 88 0.374 -1.649 -3.751 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.424 -2.912 -3.222 1.00 0.00 H new ATOM 0 HB2 ALA A 88 0.955 -3.849 -2.860 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.901 -4.209 -4.323 1.00 0.00 H new ATOM 1364 N TRP A 89 1.559 -0.429 -5.520 1.00 0.00 N ATOM 1365 CA TRP A 89 2.381 0.342 -6.435 1.00 0.00 C ATOM 1366 C TRP A 89 3.543 0.982 -5.692 1.00 0.00 C ATOM 1367 O TRP A 89 3.435 1.305 -4.509 1.00 0.00 O ATOM 1368 CB TRP A 89 1.559 1.431 -7.137 1.00 0.00 C ATOM 1369 CG TRP A 89 0.767 0.948 -8.315 1.00 0.00 C ATOM 1370 CD1 TRP A 89 1.266 0.495 -9.501 1.00 0.00 C ATOM 1371 CD2 TRP A 89 -0.659 0.901 -8.440 1.00 0.00 C ATOM 1372 NE1 TRP A 89 0.243 0.154 -10.348 1.00 0.00 N ATOM 1373 CE2 TRP A 89 -0.947 0.392 -9.721 1.00 0.00 C ATOM 1374 CE3 TRP A 89 -1.720 1.233 -7.597 1.00 0.00 C ATOM 1375 CZ2 TRP A 89 -2.247 0.205 -10.176 1.00 0.00 C ATOM 1376 CZ3 TRP A 89 -3.011 1.049 -8.052 1.00 0.00 C ATOM 1377 CH2 TRP A 89 -3.264 0.540 -9.330 1.00 0.00 C ATOM 0 H TRP A 89 0.979 0.135 -4.899 1.00 0.00 H new ATOM 0 HA TRP A 89 2.767 -0.343 -7.190 1.00 0.00 H new ATOM 0 HB2 TRP A 89 0.876 1.876 -6.414 1.00 0.00 H new ATOM 0 HB3 TRP A 89 2.233 2.221 -7.467 1.00 0.00 H new ATOM 0 HD1 TRP A 89 2.317 0.416 -9.739 1.00 0.00 H new ATOM 0 HE1 TRP A 89 0.353 -0.217 -11.292 1.00 0.00 H new ATOM 0 HE3 TRP A 89 -1.535 1.626 -6.608 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -2.445 -0.190 -11.161 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 -3.841 1.303 -7.409 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -4.286 0.409 -9.654 1.00 0.00 H new ATOM 1388 N HIS A 90 4.647 1.164 -6.394 1.00 0.00 N ATOM 1389 CA HIS A 90 5.816 1.815 -5.825 1.00 0.00 C ATOM 1390 C HIS A 90 5.789 3.285 -6.194 1.00 0.00 C ATOM 1391 O HIS A 90 5.588 3.629 -7.355 1.00 0.00 O ATOM 1392 CB HIS A 90 7.106 1.155 -6.335 1.00 0.00 C ATOM 1393 CG HIS A 90 8.383 1.795 -5.850 1.00 0.00 C ATOM 1394 ND1 HIS A 90 9.065 2.758 -6.562 1.00 0.00 N ATOM 1395 CD2 HIS A 90 9.122 1.570 -4.739 1.00 0.00 C ATOM 1396 CE1 HIS A 90 10.161 3.095 -5.913 1.00 0.00 C ATOM 1397 NE2 HIS A 90 10.225 2.389 -4.802 1.00 0.00 N ATOM 0 H HIS A 90 4.760 0.869 -7.364 1.00 0.00 H new ATOM 0 HA HIS A 90 5.796 1.711 -4.740 1.00 0.00 H new ATOM 0 HB2 HIS A 90 7.105 0.108 -6.033 1.00 0.00 H new ATOM 0 HB3 HIS A 90 7.099 1.173 -7.425 1.00 0.00 H new ATOM 0 HD1 HIS A 90 8.767 3.150 -7.455 1.00 0.00 H new ATOM 0 HD2 HIS A 90 8.888 0.874 -3.947 1.00 0.00 H new ATOM 0 HE1 HIS A 90 10.886 3.827 -6.237 1.00 0.00 H new ATOM 0 HE2 HIS A 90 10.968 2.441 -4.105 1.00 0.00 H new ATOM 1406 N VAL A 91 5.964 4.142 -5.205 1.00 0.00 N ATOM 1407 CA VAL A 91 5.989 5.574 -5.441 1.00 0.00 C ATOM 1408 C VAL A 91 7.416 6.033 -5.709 1.00 0.00 C ATOM 1409 O VAL A 91 8.237 6.109 -4.794 1.00 0.00 O ATOM 1410 CB VAL A 91 5.400 6.357 -4.247 1.00 0.00 C ATOM 1411 CG1 VAL A 91 5.417 7.854 -4.517 1.00 0.00 C ATOM 1412 CG2 VAL A 91 3.986 5.881 -3.947 1.00 0.00 C ATOM 0 H VAL A 91 6.091 3.871 -4.230 1.00 0.00 H new ATOM 0 HA VAL A 91 5.370 5.779 -6.314 1.00 0.00 H new ATOM 0 HB VAL A 91 6.023 6.166 -3.373 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.997 8.383 -3.661 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.444 8.183 -4.679 1.00 0.00 H new ATOM 0 HG13 VAL A 91 4.823 8.070 -5.405 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.585 6.442 -3.103 1.00 0.00 H new ATOM 0 HG22 VAL A 91 3.355 6.040 -4.822 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.004 4.819 -3.701 1.00 0.00 H new ATOM 1422 N PRO A 92 7.735 6.306 -6.982 1.00 0.00 N ATOM 1423 CA PRO A 92 9.071 6.723 -7.390 1.00 0.00 C ATOM 1424 C PRO A 92 9.322 8.204 -7.143 1.00 0.00 C ATOM 1425 O PRO A 92 10.467 8.630 -6.980 1.00 0.00 O ATOM 1426 CB PRO A 92 9.082 6.416 -8.886 1.00 0.00 C ATOM 1427 CG PRO A 92 7.663 6.577 -9.320 1.00 0.00 C ATOM 1428 CD PRO A 92 6.812 6.213 -8.133 1.00 0.00 C ATOM 0 HA PRO A 92 9.852 6.213 -6.826 1.00 0.00 H new ATOM 0 HB2 PRO A 92 9.740 7.098 -9.425 1.00 0.00 H new ATOM 0 HB3 PRO A 92 9.442 5.406 -9.080 1.00 0.00 H new ATOM 0 HG2 PRO A 92 7.468 7.601 -9.638 1.00 0.00 H new ATOM 0 HG3 PRO A 92 7.441 5.931 -10.170 1.00 0.00 H new ATOM 0 HD2 PRO A 92 5.969 6.895 -8.023 1.00 0.00 H new ATOM 0 HD3 PRO A 92 6.399 5.209 -8.232 1.00 0.00 H new ATOM 1436 N ASP A 93 8.245 8.981 -7.098 1.00 0.00 N ATOM 1437 CA ASP A 93 8.351 10.427 -6.967 1.00 0.00 C ATOM 1438 C ASP A 93 7.162 10.984 -6.192 1.00 0.00 C ATOM 1439 O ASP A 93 6.025 10.546 -6.380 1.00 0.00 O ATOM 1440 CB ASP A 93 8.407 11.063 -8.355 1.00 0.00 C ATOM 1441 CG ASP A 93 8.772 12.531 -8.322 1.00 0.00 C ATOM 1442 OD1 ASP A 93 7.866 13.370 -8.165 1.00 0.00 O ATOM 1443 OD2 ASP A 93 9.968 12.851 -8.488 1.00 0.00 O ATOM 0 H ASP A 93 7.288 8.632 -7.151 1.00 0.00 H new ATOM 0 HA ASP A 93 9.263 10.664 -6.419 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.135 10.527 -8.964 1.00 0.00 H new ATOM 0 HB3 ASP A 93 7.438 10.947 -8.841 1.00 0.00 H new ATOM 1448 N PHE A 94 7.435 11.933 -5.314 1.00 0.00 N ATOM 1449 CA PHE A 94 6.395 12.589 -4.533 1.00 0.00 C ATOM 1450 C PHE A 94 6.772 14.045 -4.271 1.00 0.00 C ATOM 1451 O PHE A 94 7.928 14.351 -3.968 1.00 0.00 O ATOM 1452 CB PHE A 94 6.151 11.848 -3.205 1.00 0.00 C ATOM 1453 CG PHE A 94 7.373 11.712 -2.338 1.00 0.00 C ATOM 1454 CD1 PHE A 94 8.258 10.660 -2.520 1.00 0.00 C ATOM 1455 CD2 PHE A 94 7.635 12.634 -1.337 1.00 0.00 C ATOM 1456 CE1 PHE A 94 9.380 10.536 -1.725 1.00 0.00 C ATOM 1457 CE2 PHE A 94 8.755 12.515 -0.541 1.00 0.00 C ATOM 1458 CZ PHE A 94 9.628 11.463 -0.732 1.00 0.00 C ATOM 0 H PHE A 94 8.378 12.271 -5.121 1.00 0.00 H new ATOM 0 HA PHE A 94 5.469 12.563 -5.107 1.00 0.00 H new ATOM 0 HB2 PHE A 94 5.379 12.376 -2.645 1.00 0.00 H new ATOM 0 HB3 PHE A 94 5.762 10.853 -3.424 1.00 0.00 H new ATOM 0 HD1 PHE A 94 8.067 9.929 -3.292 1.00 0.00 H new ATOM 0 HD2 PHE A 94 6.953 13.456 -1.178 1.00 0.00 H new ATOM 0 HE1 PHE A 94 10.063 9.714 -1.880 1.00 0.00 H new ATOM 0 HE2 PHE A 94 8.949 13.245 0.231 1.00 0.00 H new ATOM 0 HZ PHE A 94 10.503 11.365 -0.106 1.00 0.00 H new ATOM 1468 N HIS A 95 5.807 14.938 -4.413 1.00 0.00 N ATOM 1469 CA HIS A 95 6.042 16.358 -4.200 1.00 0.00 C ATOM 1470 C HIS A 95 5.398 16.827 -2.903 1.00 0.00 C ATOM 1471 O HIS A 95 4.187 16.716 -2.727 1.00 0.00 O ATOM 1472 CB HIS A 95 5.494 17.164 -5.381 1.00 0.00 C ATOM 1473 CG HIS A 95 6.236 16.924 -6.658 1.00 0.00 C ATOM 1474 ND1 HIS A 95 7.489 17.433 -6.909 1.00 0.00 N ATOM 1475 CD2 HIS A 95 5.902 16.205 -7.752 1.00 0.00 C ATOM 1476 CE1 HIS A 95 7.893 17.039 -8.099 1.00 0.00 C ATOM 1477 NE2 HIS A 95 6.948 16.292 -8.633 1.00 0.00 N ATOM 0 H HIS A 95 4.850 14.704 -4.676 1.00 0.00 H new ATOM 0 HA HIS A 95 7.117 16.519 -4.125 1.00 0.00 H new ATOM 0 HB2 HIS A 95 4.443 16.913 -5.527 1.00 0.00 H new ATOM 0 HB3 HIS A 95 5.537 18.226 -5.138 1.00 0.00 H new ATOM 0 HD2 HIS A 95 4.981 15.662 -7.904 1.00 0.00 H new ATOM 0 HE1 HIS A 95 8.838 17.286 -8.559 1.00 0.00 H new ATOM 0 HE2 HIS A 95 6.988 15.851 -9.552 1.00 0.00 H new ATOM 1486 N GLY A 96 6.209 17.347 -1.999 1.00 0.00 N ATOM 1487 CA GLY A 96 5.699 17.834 -0.732 1.00 0.00 C ATOM 1488 C GLY A 96 6.464 17.262 0.441 1.00 0.00 C ATOM 1489 O GLY A 96 7.579 16.770 0.277 1.00 0.00 O ATOM 0 H GLY A 96 7.218 17.442 -2.118 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.761 18.922 -0.710 1.00 0.00 H new ATOM 0 HA3 GLY A 96 4.645 17.573 -0.640 1.00 0.00 H new ATOM 1493 N THR A 97 5.874 17.327 1.627 1.00 0.00 N ATOM 1494 CA THR A 97 6.487 16.759 2.811 1.00 0.00 C ATOM 1495 C THR A 97 5.587 15.684 3.394 1.00 0.00 C ATOM 1496 O THR A 97 4.441 15.952 3.760 1.00 0.00 O ATOM 1497 CB THR A 97 6.769 17.834 3.873 1.00 0.00 C ATOM 1498 OG1 THR A 97 7.451 18.936 3.259 1.00 0.00 O ATOM 1499 CG2 THR A 97 7.621 17.263 5.001 1.00 0.00 C ATOM 0 H THR A 97 4.970 17.769 1.791 1.00 0.00 H new ATOM 0 HA THR A 97 7.440 16.320 2.516 1.00 0.00 H new ATOM 0 HB THR A 97 5.823 18.174 4.295 1.00 0.00 H new ATOM 0 HG1 THR A 97 7.632 19.625 3.932 1.00 0.00 H new ATOM 0 HG21 THR A 97 7.810 18.039 5.743 1.00 0.00 H new ATOM 0 HG22 THR A 97 7.094 16.433 5.471 1.00 0.00 H new ATOM 0 HG23 THR A 97 8.569 16.909 4.597 1.00 0.00 H new ATOM 1507 N LEU A 98 6.119 14.476 3.470 1.00 0.00 N ATOM 1508 CA LEU A 98 5.344 13.328 3.909 1.00 0.00 C ATOM 1509 C LEU A 98 5.086 13.394 5.404 1.00 0.00 C ATOM 1510 O LEU A 98 6.009 13.355 6.219 1.00 0.00 O ATOM 1511 CB LEU A 98 6.008 11.999 3.518 1.00 0.00 C ATOM 1512 CG LEU A 98 7.486 11.825 3.886 1.00 0.00 C ATOM 1513 CD1 LEU A 98 7.822 10.352 3.954 1.00 0.00 C ATOM 1514 CD2 LEU A 98 8.393 12.501 2.867 1.00 0.00 C ATOM 0 H LEU A 98 7.088 14.264 3.232 1.00 0.00 H new ATOM 0 HA LEU A 98 4.385 13.366 3.393 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.445 11.189 3.983 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.911 11.876 2.439 1.00 0.00 H new ATOM 0 HG LEU A 98 7.650 12.293 4.857 1.00 0.00 H new ATOM 0 HD11 LEU A 98 8.873 10.230 4.216 1.00 0.00 H new ATOM 0 HD12 LEU A 98 7.202 9.872 4.711 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.634 9.891 2.985 1.00 0.00 H new ATOM 0 HD21 LEU A 98 9.434 12.360 3.156 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.227 12.061 1.884 1.00 0.00 H new ATOM 0 HD23 LEU A 98 8.168 13.567 2.830 1.00 0.00 H new ATOM 1526 N GLN A 99 3.815 13.499 5.736 1.00 0.00 N ATOM 1527 CA GLN A 99 3.370 13.700 7.102 1.00 0.00 C ATOM 1528 C GLN A 99 2.231 12.737 7.412 1.00 0.00 C ATOM 1529 O GLN A 99 1.729 12.063 6.517 1.00 0.00 O ATOM 1530 CB GLN A 99 2.910 15.150 7.261 1.00 0.00 C ATOM 1531 CG GLN A 99 1.778 15.524 6.319 1.00 0.00 C ATOM 1532 CD GLN A 99 1.561 17.017 6.232 1.00 0.00 C ATOM 1533 OE1 GLN A 99 0.778 17.590 6.988 1.00 0.00 O ATOM 1534 NE2 GLN A 99 2.253 17.658 5.303 1.00 0.00 N ATOM 0 H GLN A 99 3.054 13.447 5.059 1.00 0.00 H new ATOM 0 HA GLN A 99 4.185 13.505 7.799 1.00 0.00 H new ATOM 0 HB2 GLN A 99 2.587 15.311 8.289 1.00 0.00 H new ATOM 0 HB3 GLN A 99 3.756 15.814 7.085 1.00 0.00 H new ATOM 0 HG2 GLN A 99 1.994 15.134 5.324 1.00 0.00 H new ATOM 0 HG3 GLN A 99 0.858 15.046 6.655 1.00 0.00 H new ATOM 0 HE21 GLN A 99 2.892 17.143 4.697 1.00 0.00 H new ATOM 0 HE22 GLN A 99 2.147 18.667 5.193 1.00 0.00 H new ATOM 1543 N ALA A 100 1.826 12.656 8.667 1.00 0.00 N ATOM 1544 CA ALA A 100 0.728 11.781 9.039 1.00 0.00 C ATOM 1545 C ALA A 100 -0.504 12.591 9.422 1.00 0.00 C ATOM 1546 O ALA A 100 -0.488 13.345 10.397 1.00 0.00 O ATOM 1547 CB ALA A 100 1.136 10.851 10.170 1.00 0.00 C ATOM 0 H ALA A 100 2.236 13.180 9.440 1.00 0.00 H new ATOM 0 HA ALA A 100 0.475 11.169 8.173 1.00 0.00 H new ATOM 0 HB1 ALA A 100 0.297 10.206 10.431 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.980 10.239 9.851 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.424 11.441 11.040 1.00 0.00 H new ATOM 1553 N HIS A 101 -1.560 12.445 8.632 1.00 0.00 N ATOM 1554 CA HIS A 101 -2.822 13.130 8.882 1.00 0.00 C ATOM 1555 C HIS A 101 -3.842 12.134 9.416 1.00 0.00 C ATOM 1556 O HIS A 101 -4.422 12.326 10.483 1.00 0.00 O ATOM 1557 CB HIS A 101 -3.350 13.739 7.581 1.00 0.00 C ATOM 1558 CG HIS A 101 -4.294 14.888 7.762 1.00 0.00 C ATOM 1559 ND1 HIS A 101 -5.664 14.742 7.779 1.00 0.00 N ATOM 1560 CD2 HIS A 101 -4.059 16.215 7.896 1.00 0.00 C ATOM 1561 CE1 HIS A 101 -6.229 15.926 7.909 1.00 0.00 C ATOM 1562 NE2 HIS A 101 -5.279 16.838 7.984 1.00 0.00 N ATOM 0 H HIS A 101 -1.566 11.851 7.803 1.00 0.00 H new ATOM 0 HA HIS A 101 -2.659 13.922 9.613 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -2.502 14.074 6.983 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -3.854 12.959 7.010 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -6.163 13.856 7.703 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -3.092 16.694 7.928 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -7.291 16.117 7.948 1.00 0.00 H new ATOM 1571 N GLU A 102 -4.056 11.067 8.649 1.00 0.00 N ATOM 1572 CA GLU A 102 -4.996 10.020 9.026 1.00 0.00 C ATOM 1573 C GLU A 102 -4.281 8.927 9.807 1.00 0.00 C ATOM 1574 O GLU A 102 -4.823 8.367 10.759 1.00 0.00 O ATOM 1575 CB GLU A 102 -5.661 9.424 7.781 1.00 0.00 C ATOM 1576 CG GLU A 102 -6.360 10.458 6.915 1.00 0.00 C ATOM 1577 CD GLU A 102 -7.319 11.321 7.703 1.00 0.00 C ATOM 1578 OE1 GLU A 102 -8.394 10.822 8.093 1.00 0.00 O ATOM 1579 OE2 GLU A 102 -6.994 12.503 7.944 1.00 0.00 O ATOM 0 H GLU A 102 -3.587 10.907 7.758 1.00 0.00 H new ATOM 0 HA GLU A 102 -5.767 10.460 9.658 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -4.905 8.913 7.185 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.386 8.671 8.091 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -5.613 11.093 6.438 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -6.904 9.951 6.117 1.00 0.00 H new ATOM 1586 N HIS A 103 -3.061 8.617 9.386 1.00 0.00 N ATOM 1587 CA HIS A 103 -2.210 7.701 10.128 1.00 0.00 C ATOM 1588 C HIS A 103 -1.568 8.452 11.296 1.00 0.00 C ATOM 1589 O HIS A 103 -1.519 9.679 11.284 1.00 0.00 O ATOM 1590 CB HIS A 103 -1.139 7.093 9.213 1.00 0.00 C ATOM 1591 CG HIS A 103 -1.662 6.080 8.225 1.00 0.00 C ATOM 1592 ND1 HIS A 103 -1.806 6.328 6.873 1.00 0.00 N ATOM 1593 CD2 HIS A 103 -2.026 4.785 8.398 1.00 0.00 C ATOM 1594 CE1 HIS A 103 -2.233 5.234 6.269 1.00 0.00 C ATOM 1595 NE2 HIS A 103 -2.372 4.288 7.171 1.00 0.00 N ATOM 0 H HIS A 103 -2.640 8.988 8.534 1.00 0.00 H new ATOM 0 HA HIS A 103 -2.813 6.880 10.517 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -0.649 7.897 8.664 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -0.377 6.619 9.832 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -1.613 7.218 6.413 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -2.040 4.245 9.333 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -2.434 5.134 5.213 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -2.687 3.336 6.986 1.00 0.00 H new ATOM 1604 N GLN A 104 -1.085 7.729 12.300 1.00 0.00 N ATOM 1605 CA GLN A 104 -0.587 8.363 13.519 1.00 0.00 C ATOM 1606 C GLN A 104 0.860 8.838 13.365 1.00 0.00 C ATOM 1607 O GLN A 104 1.173 9.994 13.644 1.00 0.00 O ATOM 1608 CB GLN A 104 -0.710 7.399 14.704 1.00 0.00 C ATOM 1609 CG GLN A 104 -0.508 8.059 16.059 1.00 0.00 C ATOM 1610 CD GLN A 104 -0.844 7.136 17.214 1.00 0.00 C ATOM 1611 OE1 GLN A 104 -1.993 7.065 17.652 1.00 0.00 O ATOM 1612 NE2 GLN A 104 0.152 6.438 17.734 1.00 0.00 N ATOM 0 H GLN A 104 -1.027 6.711 12.297 1.00 0.00 H new ATOM 0 HA GLN A 104 -1.201 9.244 13.708 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -1.696 6.934 14.681 1.00 0.00 H new ATOM 0 HB3 GLN A 104 0.022 6.600 14.587 1.00 0.00 H new ATOM 0 HG2 GLN A 104 0.528 8.385 16.149 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -1.130 8.952 16.120 1.00 0.00 H new ATOM 0 HE21 GLN A 104 1.091 6.522 17.345 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -0.019 5.816 18.524 1.00 0.00 H new ATOM 1621 N ALA A 105 1.741 7.946 12.926 1.00 0.00 N ATOM 1622 CA ALA A 105 3.156 8.277 12.784 1.00 0.00 C ATOM 1623 C ALA A 105 3.768 7.521 11.615 1.00 0.00 C ATOM 1624 O ALA A 105 3.171 6.565 11.115 1.00 0.00 O ATOM 1625 CB ALA A 105 3.906 7.960 14.070 1.00 0.00 C ATOM 0 H ALA A 105 1.502 6.990 12.663 1.00 0.00 H new ATOM 0 HA ALA A 105 3.241 9.345 12.585 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.959 8.212 13.948 1.00 0.00 H new ATOM 0 HB2 ALA A 105 3.486 8.543 14.890 1.00 0.00 H new ATOM 0 HB3 ALA A 105 3.811 6.898 14.294 1.00 0.00 H new ATOM 1631 N LEU A 106 4.960 7.940 11.190 1.00 0.00 N ATOM 1632 CA LEU A 106 5.643 7.315 10.060 1.00 0.00 C ATOM 1633 C LEU A 106 6.960 6.699 10.517 1.00 0.00 C ATOM 1634 O LEU A 106 7.657 7.268 11.358 1.00 0.00 O ATOM 1635 CB LEU A 106 5.967 8.334 8.949 1.00 0.00 C ATOM 1636 CG LEU A 106 4.802 9.119 8.339 1.00 0.00 C ATOM 1637 CD1 LEU A 106 3.612 8.217 8.064 1.00 0.00 C ATOM 1638 CD2 LEU A 106 4.416 10.294 9.223 1.00 0.00 C ATOM 0 H LEU A 106 5.473 8.713 11.614 1.00 0.00 H new ATOM 0 HA LEU A 106 4.968 6.554 9.668 1.00 0.00 H new ATOM 0 HB2 LEU A 106 6.681 9.053 9.351 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.471 7.801 8.142 1.00 0.00 H new ATOM 0 HG LEU A 106 5.134 9.519 7.381 1.00 0.00 H new ATOM 0 HD11 LEU A 106 2.802 8.805 7.631 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.904 7.432 7.366 1.00 0.00 H new ATOM 0 HD13 LEU A 106 3.274 7.766 8.997 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.587 10.835 8.767 1.00 0.00 H new ATOM 0 HD22 LEU A 106 4.115 9.927 10.204 1.00 0.00 H new ATOM 0 HD23 LEU A 106 5.269 10.963 9.332 1.00 0.00 H new ATOM 1650 N VAL A 107 7.289 5.538 9.982 1.00 0.00 N ATOM 1651 CA VAL A 107 8.611 4.961 10.170 1.00 0.00 C ATOM 1652 C VAL A 107 9.200 4.569 8.817 1.00 0.00 C ATOM 1653 O VAL A 107 8.506 4.003 7.969 1.00 0.00 O ATOM 1654 CB VAL A 107 8.585 3.733 11.119 1.00 0.00 C ATOM 1655 CG1 VAL A 107 7.814 2.570 10.508 1.00 0.00 C ATOM 1656 CG2 VAL A 107 9.999 3.306 11.486 1.00 0.00 C ATOM 0 H VAL A 107 6.659 4.973 9.412 1.00 0.00 H new ATOM 0 HA VAL A 107 9.239 5.718 10.640 1.00 0.00 H new ATOM 0 HB VAL A 107 8.066 4.032 12.030 1.00 0.00 H new ATOM 0 HG11 VAL A 107 7.817 1.728 11.200 1.00 0.00 H new ATOM 0 HG12 VAL A 107 6.786 2.877 10.314 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.287 2.272 9.572 1.00 0.00 H new ATOM 0 HG21 VAL A 107 9.958 2.444 12.152 1.00 0.00 H new ATOM 0 HG22 VAL A 107 10.545 3.040 10.581 1.00 0.00 H new ATOM 0 HG23 VAL A 107 10.508 4.128 11.989 1.00 0.00 H new ATOM 1666 N TRP A 108 10.460 4.915 8.593 1.00 0.00 N ATOM 1667 CA TRP A 108 11.147 4.526 7.370 1.00 0.00 C ATOM 1668 C TRP A 108 12.042 3.327 7.635 1.00 0.00 C ATOM 1669 O TRP A 108 13.013 3.423 8.384 1.00 0.00 O ATOM 1670 CB TRP A 108 11.992 5.685 6.833 1.00 0.00 C ATOM 1671 CG TRP A 108 11.194 6.902 6.479 1.00 0.00 C ATOM 1672 CD1 TRP A 108 10.575 7.159 5.290 1.00 0.00 C ATOM 1673 CD2 TRP A 108 10.936 8.035 7.318 1.00 0.00 C ATOM 1674 NE1 TRP A 108 9.949 8.379 5.340 1.00 0.00 N ATOM 1675 CE2 TRP A 108 10.154 8.936 6.574 1.00 0.00 C ATOM 1676 CE3 TRP A 108 11.289 8.375 8.629 1.00 0.00 C ATOM 1677 CZ2 TRP A 108 9.719 10.154 7.094 1.00 0.00 C ATOM 1678 CZ3 TRP A 108 10.856 9.583 9.144 1.00 0.00 C ATOM 1679 CH2 TRP A 108 10.078 10.460 8.378 1.00 0.00 C ATOM 0 H TRP A 108 11.026 5.463 9.241 1.00 0.00 H new ATOM 0 HA TRP A 108 10.396 4.262 6.625 1.00 0.00 H new ATOM 0 HB2 TRP A 108 12.737 5.956 7.581 1.00 0.00 H new ATOM 0 HB3 TRP A 108 12.534 5.348 5.950 1.00 0.00 H new ATOM 0 HD1 TRP A 108 10.578 6.499 4.435 1.00 0.00 H new ATOM 0 HE1 TRP A 108 9.417 8.803 4.580 1.00 0.00 H new ATOM 0 HE3 TRP A 108 11.889 7.706 9.228 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 9.120 10.832 6.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 11.122 9.855 10.155 1.00 0.00 H new ATOM 0 HH2 TRP A 108 9.755 11.396 8.809 1.00 0.00 H new ATOM 1690 N CYS A 109 11.706 2.200 7.041 1.00 0.00 N ATOM 1691 CA CYS A 109 12.500 0.993 7.214 1.00 0.00 C ATOM 1692 C CYS A 109 12.689 0.285 5.882 1.00 0.00 C ATOM 1693 O CYS A 109 11.851 0.400 4.994 1.00 0.00 O ATOM 1694 CB CYS A 109 11.834 0.063 8.231 1.00 0.00 C ATOM 1695 SG CYS A 109 10.102 -0.303 7.875 1.00 0.00 S ATOM 0 H CYS A 109 10.892 2.091 6.436 1.00 0.00 H new ATOM 0 HA CYS A 109 13.483 1.273 7.593 1.00 0.00 H new ATOM 0 HB2 CYS A 109 12.391 -0.873 8.270 1.00 0.00 H new ATOM 0 HB3 CYS A 109 11.902 0.516 9.220 1.00 0.00 H new ATOM 0 HG CYS A 109 9.895 -0.217 6.595 1.00 0.00 H new ATOM 1701 N SER A 110 13.782 -0.452 5.758 1.00 0.00 N ATOM 1702 CA SER A 110 14.108 -1.161 4.527 1.00 0.00 C ATOM 1703 C SER A 110 13.072 -2.258 4.263 1.00 0.00 C ATOM 1704 O SER A 110 12.361 -2.663 5.182 1.00 0.00 O ATOM 1705 CB SER A 110 15.501 -1.784 4.653 1.00 0.00 C ATOM 1706 OG SER A 110 16.409 -0.885 5.270 1.00 0.00 O ATOM 0 H SER A 110 14.467 -0.576 6.504 1.00 0.00 H new ATOM 0 HA SER A 110 14.097 -0.458 3.694 1.00 0.00 H new ATOM 0 HB2 SER A 110 15.440 -2.702 5.237 1.00 0.00 H new ATOM 0 HB3 SER A 110 15.871 -2.058 3.665 1.00 0.00 H new ATOM 0 HG SER A 110 17.291 -1.307 5.340 1.00 0.00 H new ATOM 1712 N PRO A 111 12.966 -2.754 3.016 1.00 0.00 N ATOM 1713 CA PRO A 111 12.020 -3.818 2.662 1.00 0.00 C ATOM 1714 C PRO A 111 12.088 -5.013 3.617 1.00 0.00 C ATOM 1715 O PRO A 111 11.064 -5.477 4.114 1.00 0.00 O ATOM 1716 CB PRO A 111 12.436 -4.236 1.241 1.00 0.00 C ATOM 1717 CG PRO A 111 13.717 -3.521 0.959 1.00 0.00 C ATOM 1718 CD PRO A 111 13.735 -2.310 1.845 1.00 0.00 C ATOM 0 HA PRO A 111 10.990 -3.467 2.725 1.00 0.00 H new ATOM 0 HB2 PRO A 111 12.569 -5.316 1.175 1.00 0.00 H new ATOM 0 HB3 PRO A 111 11.670 -3.965 0.515 1.00 0.00 H new ATOM 0 HG2 PRO A 111 14.573 -4.164 1.164 1.00 0.00 H new ATOM 0 HG3 PRO A 111 13.778 -3.234 -0.091 1.00 0.00 H new ATOM 0 HD2 PRO A 111 14.751 -2.020 2.114 1.00 0.00 H new ATOM 0 HD3 PRO A 111 13.275 -1.448 1.362 1.00 0.00 H new ATOM 1726 N GLU A 112 13.295 -5.494 3.892 1.00 0.00 N ATOM 1727 CA GLU A 112 13.475 -6.629 4.796 1.00 0.00 C ATOM 1728 C GLU A 112 13.057 -6.269 6.221 1.00 0.00 C ATOM 1729 O GLU A 112 12.548 -7.111 6.959 1.00 0.00 O ATOM 1730 CB GLU A 112 14.928 -7.112 4.769 1.00 0.00 C ATOM 1731 CG GLU A 112 15.942 -6.020 5.065 1.00 0.00 C ATOM 1732 CD GLU A 112 17.369 -6.485 4.878 1.00 0.00 C ATOM 1733 OE1 GLU A 112 17.810 -6.601 3.712 1.00 0.00 O ATOM 1734 OE2 GLU A 112 18.056 -6.726 5.889 1.00 0.00 O ATOM 0 H GLU A 112 14.161 -5.119 3.505 1.00 0.00 H new ATOM 0 HA GLU A 112 12.833 -7.439 4.451 1.00 0.00 H new ATOM 0 HB2 GLU A 112 15.048 -7.914 5.497 1.00 0.00 H new ATOM 0 HB3 GLU A 112 15.142 -7.537 3.788 1.00 0.00 H new ATOM 0 HG2 GLU A 112 15.753 -5.167 4.413 1.00 0.00 H new ATOM 0 HG3 GLU A 112 15.808 -5.673 6.090 1.00 0.00 H new ATOM 1741 N GLU A 113 13.256 -5.008 6.587 1.00 0.00 N ATOM 1742 CA GLU A 113 12.889 -4.520 7.909 1.00 0.00 C ATOM 1743 C GLU A 113 11.375 -4.415 8.047 1.00 0.00 C ATOM 1744 O GLU A 113 10.820 -4.723 9.095 1.00 0.00 O ATOM 1745 CB GLU A 113 13.520 -3.147 8.162 1.00 0.00 C ATOM 1746 CG GLU A 113 15.037 -3.157 8.177 1.00 0.00 C ATOM 1747 CD GLU A 113 15.599 -3.941 9.343 1.00 0.00 C ATOM 1748 OE1 GLU A 113 15.654 -3.388 10.463 1.00 0.00 O ATOM 1749 OE2 GLU A 113 15.992 -5.104 9.146 1.00 0.00 O ATOM 0 H GLU A 113 13.673 -4.301 5.981 1.00 0.00 H new ATOM 0 HA GLU A 113 13.261 -5.232 8.646 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.179 -2.455 7.392 1.00 0.00 H new ATOM 0 HB3 GLU A 113 13.160 -2.764 9.117 1.00 0.00 H new ATOM 0 HG2 GLU A 113 15.404 -3.586 7.244 1.00 0.00 H new ATOM 0 HG3 GLU A 113 15.404 -2.132 8.222 1.00 0.00 H new ATOM 1756 N ALA A 114 10.717 -3.991 6.972 1.00 0.00 N ATOM 1757 CA ALA A 114 9.274 -3.765 6.979 1.00 0.00 C ATOM 1758 C ALA A 114 8.506 -5.027 7.349 1.00 0.00 C ATOM 1759 O ALA A 114 7.539 -4.974 8.103 1.00 0.00 O ATOM 1760 CB ALA A 114 8.819 -3.249 5.623 1.00 0.00 C ATOM 0 H ALA A 114 11.165 -3.795 6.077 1.00 0.00 H new ATOM 0 HA ALA A 114 9.059 -3.015 7.740 1.00 0.00 H new ATOM 0 HB1 ALA A 114 7.742 -3.084 5.639 1.00 0.00 H new ATOM 0 HB2 ALA A 114 9.327 -2.310 5.402 1.00 0.00 H new ATOM 0 HB3 ALA A 114 9.062 -3.983 4.854 1.00 0.00 H new ATOM 1766 N LEU A 115 8.960 -6.165 6.845 1.00 0.00 N ATOM 1767 CA LEU A 115 8.275 -7.428 7.090 1.00 0.00 C ATOM 1768 C LEU A 115 8.528 -7.907 8.519 1.00 0.00 C ATOM 1769 O LEU A 115 7.835 -8.793 9.018 1.00 0.00 O ATOM 1770 CB LEU A 115 8.720 -8.480 6.065 1.00 0.00 C ATOM 1771 CG LEU A 115 7.588 -9.269 5.382 1.00 0.00 C ATOM 1772 CD1 LEU A 115 7.060 -10.374 6.278 1.00 0.00 C ATOM 1773 CD2 LEU A 115 6.448 -8.344 4.993 1.00 0.00 C ATOM 0 H LEU A 115 9.796 -6.241 6.266 1.00 0.00 H new ATOM 0 HA LEU A 115 7.202 -7.275 6.975 1.00 0.00 H new ATOM 0 HB2 LEU A 115 9.308 -7.983 5.293 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.382 -9.188 6.563 1.00 0.00 H new ATOM 0 HG LEU A 115 8.007 -9.723 4.484 1.00 0.00 H new ATOM 0 HD11 LEU A 115 6.262 -10.910 5.763 1.00 0.00 H new ATOM 0 HD12 LEU A 115 7.867 -11.066 6.516 1.00 0.00 H new ATOM 0 HD13 LEU A 115 6.670 -9.941 7.199 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.659 -8.922 4.512 1.00 0.00 H new ATOM 0 HD22 LEU A 115 6.051 -7.860 5.886 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.815 -7.585 4.302 1.00 0.00 H new ATOM 1785 N GLN A 116 9.515 -7.308 9.181 1.00 0.00 N ATOM 1786 CA GLN A 116 9.791 -7.599 10.583 1.00 0.00 C ATOM 1787 C GLN A 116 8.825 -6.841 11.486 1.00 0.00 C ATOM 1788 O GLN A 116 8.707 -7.132 12.676 1.00 0.00 O ATOM 1789 CB GLN A 116 11.219 -7.203 10.932 1.00 0.00 C ATOM 1790 CG GLN A 116 12.271 -8.024 10.214 1.00 0.00 C ATOM 1791 CD GLN A 116 12.284 -9.473 10.650 1.00 0.00 C ATOM 1792 OE1 GLN A 116 11.607 -10.319 10.067 1.00 0.00 O ATOM 1793 NE2 GLN A 116 13.052 -9.764 11.686 1.00 0.00 N ATOM 0 H GLN A 116 10.138 -6.616 8.766 1.00 0.00 H new ATOM 0 HA GLN A 116 9.662 -8.670 10.739 1.00 0.00 H new ATOM 0 HB2 GLN A 116 11.364 -6.150 10.690 1.00 0.00 H new ATOM 0 HB3 GLN A 116 11.363 -7.305 12.008 1.00 0.00 H new ATOM 0 HG2 GLN A 116 12.093 -7.974 9.140 1.00 0.00 H new ATOM 0 HG3 GLN A 116 13.253 -7.586 10.395 1.00 0.00 H new ATOM 0 HE21 GLN A 116 13.597 -9.030 12.139 1.00 0.00 H new ATOM 0 HE22 GLN A 116 13.100 -10.722 12.032 1.00 0.00 H new ATOM 1802 N TYR A 117 8.135 -5.872 10.904 1.00 0.00 N ATOM 1803 CA TYR A 117 7.195 -5.048 11.645 1.00 0.00 C ATOM 1804 C TYR A 117 5.810 -5.671 11.619 1.00 0.00 C ATOM 1805 O TYR A 117 5.514 -6.501 10.758 1.00 0.00 O ATOM 1806 CB TYR A 117 7.139 -3.631 11.059 1.00 0.00 C ATOM 1807 CG TYR A 117 8.267 -2.734 11.516 1.00 0.00 C ATOM 1808 CD1 TYR A 117 9.523 -2.821 10.943 1.00 0.00 C ATOM 1809 CD2 TYR A 117 8.071 -1.795 12.521 1.00 0.00 C ATOM 1810 CE1 TYR A 117 10.557 -2.004 11.352 1.00 0.00 C ATOM 1811 CE2 TYR A 117 9.100 -0.970 12.939 1.00 0.00 C ATOM 1812 CZ TYR A 117 10.340 -1.081 12.349 1.00 0.00 C ATOM 1813 OH TYR A 117 11.370 -0.262 12.754 1.00 0.00 O ATOM 0 H TYR A 117 8.210 -5.637 9.914 1.00 0.00 H new ATOM 0 HA TYR A 117 7.538 -4.987 12.678 1.00 0.00 H new ATOM 0 HB2 TYR A 117 7.159 -3.697 9.971 1.00 0.00 H new ATOM 0 HB3 TYR A 117 6.189 -3.172 11.333 1.00 0.00 H new ATOM 0 HD1 TYR A 117 9.698 -3.543 10.159 1.00 0.00 H new ATOM 0 HD2 TYR A 117 7.099 -1.708 12.984 1.00 0.00 H new ATOM 0 HE1 TYR A 117 11.531 -2.089 10.892 1.00 0.00 H new ATOM 0 HE2 TYR A 117 8.933 -0.245 13.722 1.00 0.00 H new ATOM 0 HH TYR A 117 11.054 0.334 13.465 1.00 0.00 H new ATOM 1823 N PRO A 118 4.946 -5.289 12.569 1.00 0.00 N ATOM 1824 CA PRO A 118 3.569 -5.767 12.607 1.00 0.00 C ATOM 1825 C PRO A 118 2.739 -5.182 11.468 1.00 0.00 C ATOM 1826 O PRO A 118 2.053 -4.170 11.630 1.00 0.00 O ATOM 1827 CB PRO A 118 3.052 -5.293 13.967 1.00 0.00 C ATOM 1828 CG PRO A 118 3.910 -4.127 14.321 1.00 0.00 C ATOM 1829 CD PRO A 118 5.248 -4.370 13.681 1.00 0.00 C ATOM 0 HA PRO A 118 3.503 -6.848 12.484 1.00 0.00 H new ATOM 0 HB2 PRO A 118 2.001 -5.008 13.912 1.00 0.00 H new ATOM 0 HB3 PRO A 118 3.130 -6.082 14.715 1.00 0.00 H new ATOM 0 HG2 PRO A 118 3.470 -3.198 13.959 1.00 0.00 H new ATOM 0 HG3 PRO A 118 4.009 -4.033 15.402 1.00 0.00 H new ATOM 0 HD2 PRO A 118 5.694 -3.442 13.323 1.00 0.00 H new ATOM 0 HD3 PRO A 118 5.953 -4.812 14.385 1.00 0.00 H new ATOM 1837 N LEU A 119 2.855 -5.802 10.302 1.00 0.00 N ATOM 1838 CA LEU A 119 2.099 -5.397 9.129 1.00 0.00 C ATOM 1839 C LEU A 119 0.786 -6.165 9.059 1.00 0.00 C ATOM 1840 O LEU A 119 0.681 -7.281 9.577 1.00 0.00 O ATOM 1841 CB LEU A 119 2.909 -5.644 7.853 1.00 0.00 C ATOM 1842 CG LEU A 119 4.157 -4.776 7.679 1.00 0.00 C ATOM 1843 CD1 LEU A 119 4.838 -5.097 6.357 1.00 0.00 C ATOM 1844 CD2 LEU A 119 3.796 -3.303 7.744 1.00 0.00 C ATOM 0 H LEU A 119 3.474 -6.597 10.144 1.00 0.00 H new ATOM 0 HA LEU A 119 1.888 -4.331 9.210 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.212 -6.691 7.834 1.00 0.00 H new ATOM 0 HB3 LEU A 119 2.256 -5.486 6.994 1.00 0.00 H new ATOM 0 HG LEU A 119 4.849 -4.995 8.492 1.00 0.00 H new ATOM 0 HD11 LEU A 119 5.725 -4.473 6.244 1.00 0.00 H new ATOM 0 HD12 LEU A 119 5.129 -6.147 6.343 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.149 -4.900 5.536 1.00 0.00 H new ATOM 0 HD21 LEU A 119 4.696 -2.702 7.618 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.088 -3.067 6.950 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.344 -3.081 8.711 1.00 0.00 H new ATOM 1856 N ALA A 120 -0.213 -5.564 8.428 1.00 0.00 N ATOM 1857 CA ALA A 120 -1.505 -6.210 8.248 1.00 0.00 C ATOM 1858 C ALA A 120 -1.374 -7.422 7.324 1.00 0.00 C ATOM 1859 O ALA A 120 -0.443 -7.496 6.521 1.00 0.00 O ATOM 1860 CB ALA A 120 -2.514 -5.213 7.697 1.00 0.00 C ATOM 0 H ALA A 120 -0.153 -4.626 8.031 1.00 0.00 H new ATOM 0 HA ALA A 120 -1.861 -6.562 9.216 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.478 -5.705 7.566 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.623 -4.382 8.394 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.165 -4.836 6.736 1.00 0.00 H new ATOM 1866 N PRO A 121 -2.301 -8.393 7.429 1.00 0.00 N ATOM 1867 CA PRO A 121 -2.258 -9.636 6.643 1.00 0.00 C ATOM 1868 C PRO A 121 -2.188 -9.401 5.134 1.00 0.00 C ATOM 1869 O PRO A 121 -1.718 -10.260 4.389 1.00 0.00 O ATOM 1870 CB PRO A 121 -3.567 -10.352 7.008 1.00 0.00 C ATOM 1871 CG PRO A 121 -4.411 -9.321 7.680 1.00 0.00 C ATOM 1872 CD PRO A 121 -3.454 -8.376 8.340 1.00 0.00 C ATOM 0 HA PRO A 121 -1.360 -10.208 6.874 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.061 -10.745 6.119 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -3.380 -11.198 7.669 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -5.040 -8.800 6.958 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -5.077 -9.778 8.412 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.876 -7.376 8.439 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.183 -8.709 9.342 1.00 0.00 H new ATOM 1880 N ALA A 122 -2.646 -8.239 4.684 1.00 0.00 N ATOM 1881 CA ALA A 122 -2.645 -7.923 3.261 1.00 0.00 C ATOM 1882 C ALA A 122 -1.318 -7.302 2.837 1.00 0.00 C ATOM 1883 O ALA A 122 -0.891 -7.457 1.695 1.00 0.00 O ATOM 1884 CB ALA A 122 -3.797 -6.990 2.918 1.00 0.00 C ATOM 0 H ALA A 122 -3.022 -7.502 5.281 1.00 0.00 H new ATOM 0 HA ALA A 122 -2.775 -8.856 2.712 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.779 -6.766 1.851 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.742 -7.470 3.172 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.697 -6.064 3.485 1.00 0.00 H new ATOM 1890 N ASP A 123 -0.661 -6.633 3.774 1.00 0.00 N ATOM 1891 CA ASP A 123 0.573 -5.905 3.492 1.00 0.00 C ATOM 1892 C ASP A 123 1.748 -6.862 3.411 1.00 0.00 C ATOM 1893 O ASP A 123 2.755 -6.581 2.759 1.00 0.00 O ATOM 1894 CB ASP A 123 0.839 -4.867 4.584 1.00 0.00 C ATOM 1895 CG ASP A 123 -0.242 -3.809 4.671 1.00 0.00 C ATOM 1896 OD1 ASP A 123 -1.399 -4.170 4.979 1.00 0.00 O ATOM 1897 OD2 ASP A 123 0.067 -2.621 4.436 1.00 0.00 O ATOM 0 H ASP A 123 -0.964 -6.578 4.746 1.00 0.00 H new ATOM 0 HA ASP A 123 0.457 -5.399 2.534 1.00 0.00 H new ATOM 0 HB2 ASP A 123 0.923 -5.373 5.546 1.00 0.00 H new ATOM 0 HB3 ASP A 123 1.798 -4.384 4.393 1.00 0.00 H new ATOM 1902 N ILE A 124 1.597 -8.006 4.061 1.00 0.00 N ATOM 1903 CA ILE A 124 2.654 -9.004 4.125 1.00 0.00 C ATOM 1904 C ILE A 124 3.019 -9.514 2.724 1.00 0.00 C ATOM 1905 O ILE A 124 4.155 -9.346 2.290 1.00 0.00 O ATOM 1906 CB ILE A 124 2.259 -10.188 5.038 1.00 0.00 C ATOM 1907 CG1 ILE A 124 1.964 -9.688 6.453 1.00 0.00 C ATOM 1908 CG2 ILE A 124 3.360 -11.240 5.062 1.00 0.00 C ATOM 1909 CD1 ILE A 124 1.433 -10.761 7.379 1.00 0.00 C ATOM 0 H ILE A 124 0.744 -8.268 4.556 1.00 0.00 H new ATOM 0 HA ILE A 124 3.530 -8.519 4.556 1.00 0.00 H new ATOM 0 HB ILE A 124 1.357 -10.649 4.636 1.00 0.00 H new ATOM 0 HG12 ILE A 124 2.877 -9.272 6.879 1.00 0.00 H new ATOM 0 HG13 ILE A 124 1.239 -8.876 6.398 1.00 0.00 H new ATOM 0 HG21 ILE A 124 3.062 -12.064 5.710 1.00 0.00 H new ATOM 0 HG22 ILE A 124 3.527 -11.615 4.052 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.280 -10.795 5.441 1.00 0.00 H new ATOM 0 HD11 ILE A 124 1.247 -10.332 8.364 1.00 0.00 H new ATOM 0 HD12 ILE A 124 0.503 -11.162 6.976 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.166 -11.563 7.465 1.00 0.00 H new ATOM 1921 N PRO A 125 2.061 -10.120 1.979 1.00 0.00 N ATOM 1922 CA PRO A 125 2.326 -10.659 0.636 1.00 0.00 C ATOM 1923 C PRO A 125 2.724 -9.578 -0.363 1.00 0.00 C ATOM 1924 O PRO A 125 3.399 -9.854 -1.359 1.00 0.00 O ATOM 1925 CB PRO A 125 0.995 -11.297 0.223 1.00 0.00 C ATOM 1926 CG PRO A 125 -0.028 -10.648 1.086 1.00 0.00 C ATOM 1927 CD PRO A 125 0.660 -10.340 2.379 1.00 0.00 C ATOM 0 HA PRO A 125 3.162 -11.359 0.648 1.00 0.00 H new ATOM 0 HB2 PRO A 125 0.786 -11.126 -0.833 1.00 0.00 H new ATOM 0 HB3 PRO A 125 1.011 -12.376 0.374 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -0.411 -9.739 0.621 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -0.880 -11.308 1.245 1.00 0.00 H new ATOM 0 HD2 PRO A 125 0.236 -9.458 2.859 1.00 0.00 H new ATOM 0 HD3 PRO A 125 0.569 -11.163 3.088 1.00 0.00 H new ATOM 1935 N LEU A 126 2.312 -8.347 -0.094 1.00 0.00 N ATOM 1936 CA LEU A 126 2.660 -7.229 -0.956 1.00 0.00 C ATOM 1937 C LEU A 126 4.123 -6.866 -0.760 1.00 0.00 C ATOM 1938 O LEU A 126 4.852 -6.640 -1.724 1.00 0.00 O ATOM 1939 CB LEU A 126 1.767 -6.019 -0.666 1.00 0.00 C ATOM 1940 CG LEU A 126 0.273 -6.239 -0.914 1.00 0.00 C ATOM 1941 CD1 LEU A 126 -0.513 -4.985 -0.569 1.00 0.00 C ATOM 1942 CD2 LEU A 126 0.021 -6.646 -2.357 1.00 0.00 C ATOM 0 H LEU A 126 1.738 -8.099 0.712 1.00 0.00 H new ATOM 0 HA LEU A 126 2.501 -7.525 -1.993 1.00 0.00 H new ATOM 0 HB2 LEU A 126 1.907 -5.725 0.374 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.102 -5.184 -1.281 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.066 -7.049 -0.267 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -1.574 -5.159 -0.751 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.361 -4.738 0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -0.169 -4.158 -1.190 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.047 -6.797 -2.511 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.376 -5.860 -3.024 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.553 -7.573 -2.572 1.00 0.00 H new ATOM 1954 N LEU A 127 4.551 -6.835 0.496 1.00 0.00 N ATOM 1955 CA LEU A 127 5.935 -6.535 0.816 1.00 0.00 C ATOM 1956 C LEU A 127 6.829 -7.712 0.436 1.00 0.00 C ATOM 1957 O LEU A 127 7.949 -7.514 -0.039 1.00 0.00 O ATOM 1958 CB LEU A 127 6.079 -6.195 2.306 1.00 0.00 C ATOM 1959 CG LEU A 127 7.399 -5.520 2.717 1.00 0.00 C ATOM 1960 CD1 LEU A 127 8.555 -6.506 2.748 1.00 0.00 C ATOM 1961 CD2 LEU A 127 7.715 -4.376 1.775 1.00 0.00 C ATOM 0 H LEU A 127 3.958 -7.014 1.306 1.00 0.00 H new ATOM 0 HA LEU A 127 6.250 -5.665 0.240 1.00 0.00 H new ATOM 0 HB2 LEU A 127 5.255 -5.541 2.591 1.00 0.00 H new ATOM 0 HB3 LEU A 127 5.969 -7.115 2.881 1.00 0.00 H new ATOM 0 HG LEU A 127 7.270 -5.133 3.728 1.00 0.00 H new ATOM 0 HD11 LEU A 127 9.467 -5.988 3.043 1.00 0.00 H new ATOM 0 HD12 LEU A 127 8.339 -7.297 3.466 1.00 0.00 H new ATOM 0 HD13 LEU A 127 8.689 -6.941 1.758 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.651 -3.905 2.075 1.00 0.00 H new ATOM 0 HD22 LEU A 127 7.810 -4.758 0.758 1.00 0.00 H new ATOM 0 HD23 LEU A 127 6.911 -3.641 1.813 1.00 0.00 H new ATOM 1973 N GLU A 128 6.332 -8.933 0.636 1.00 0.00 N ATOM 1974 CA GLU A 128 7.051 -10.130 0.214 1.00 0.00 C ATOM 1975 C GLU A 128 7.464 -10.026 -1.248 1.00 0.00 C ATOM 1976 O GLU A 128 8.602 -10.322 -1.603 1.00 0.00 O ATOM 1977 CB GLU A 128 6.183 -11.375 0.414 1.00 0.00 C ATOM 1978 CG GLU A 128 6.036 -11.801 1.865 1.00 0.00 C ATOM 1979 CD GLU A 128 7.308 -12.396 2.437 1.00 0.00 C ATOM 1980 OE1 GLU A 128 8.262 -12.629 1.667 1.00 0.00 O ATOM 1981 OE2 GLU A 128 7.345 -12.665 3.655 1.00 0.00 O ATOM 0 H GLU A 128 5.436 -9.116 1.087 1.00 0.00 H new ATOM 0 HA GLU A 128 7.948 -10.216 0.828 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.193 -11.185 0.000 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.613 -12.200 -0.154 1.00 0.00 H new ATOM 0 HG2 GLU A 128 5.743 -10.939 2.464 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.231 -12.532 1.944 1.00 0.00 H new ATOM 1988 N ALA A 129 6.548 -9.575 -2.095 1.00 0.00 N ATOM 1989 CA ALA A 129 6.853 -9.437 -3.508 1.00 0.00 C ATOM 1990 C ALA A 129 7.624 -8.163 -3.789 1.00 0.00 C ATOM 1991 O ALA A 129 8.212 -8.020 -4.854 1.00 0.00 O ATOM 1992 CB ALA A 129 5.605 -9.476 -4.360 1.00 0.00 C ATOM 0 H ALA A 129 5.601 -9.303 -1.831 1.00 0.00 H new ATOM 0 HA ALA A 129 7.477 -10.290 -3.773 1.00 0.00 H new ATOM 0 HB1 ALA A 129 5.878 -9.369 -5.410 1.00 0.00 H new ATOM 0 HB2 ALA A 129 5.093 -10.427 -4.213 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.943 -8.659 -4.073 1.00 0.00 H new ATOM 1998 N PHE A 130 7.639 -7.235 -2.842 1.00 0.00 N ATOM 1999 CA PHE A 130 8.401 -6.015 -3.013 1.00 0.00 C ATOM 2000 C PHE A 130 9.870 -6.323 -2.796 1.00 0.00 C ATOM 2001 O PHE A 130 10.727 -5.928 -3.588 1.00 0.00 O ATOM 2002 CB PHE A 130 7.941 -4.933 -2.035 1.00 0.00 C ATOM 2003 CG PHE A 130 8.619 -3.617 -2.268 1.00 0.00 C ATOM 2004 CD1 PHE A 130 8.112 -2.727 -3.196 1.00 0.00 C ATOM 2005 CD2 PHE A 130 9.769 -3.276 -1.576 1.00 0.00 C ATOM 2006 CE1 PHE A 130 8.730 -1.518 -3.427 1.00 0.00 C ATOM 2007 CE2 PHE A 130 10.395 -2.068 -1.806 1.00 0.00 C ATOM 2008 CZ PHE A 130 9.875 -1.188 -2.733 1.00 0.00 C ATOM 0 H PHE A 130 7.136 -7.306 -1.957 1.00 0.00 H new ATOM 0 HA PHE A 130 8.242 -5.636 -4.023 1.00 0.00 H new ATOM 0 HB2 PHE A 130 6.863 -4.802 -2.125 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.138 -5.263 -1.015 1.00 0.00 H new ATOM 0 HD1 PHE A 130 7.219 -2.983 -3.747 1.00 0.00 H new ATOM 0 HD2 PHE A 130 10.180 -3.962 -0.850 1.00 0.00 H new ATOM 0 HE1 PHE A 130 8.319 -0.830 -4.150 1.00 0.00 H new ATOM 0 HE2 PHE A 130 11.291 -1.811 -1.261 1.00 0.00 H new ATOM 0 HZ PHE A 130 10.364 -0.242 -2.915 1.00 0.00 H new ATOM 2018 N MET A 131 10.153 -7.043 -1.718 1.00 0.00 N ATOM 2019 CA MET A 131 11.505 -7.497 -1.460 1.00 0.00 C ATOM 2020 C MET A 131 11.915 -8.488 -2.544 1.00 0.00 C ATOM 2021 O MET A 131 13.066 -8.497 -2.975 1.00 0.00 O ATOM 2022 CB MET A 131 11.637 -8.118 -0.057 1.00 0.00 C ATOM 2023 CG MET A 131 10.967 -9.475 0.099 1.00 0.00 C ATOM 2024 SD MET A 131 11.459 -10.334 1.607 1.00 0.00 S ATOM 2025 CE MET A 131 10.855 -9.215 2.870 1.00 0.00 C ATOM 0 H MET A 131 9.468 -7.321 -1.016 1.00 0.00 H new ATOM 0 HA MET A 131 12.176 -6.638 -1.486 1.00 0.00 H new ATOM 0 HB2 MET A 131 12.695 -8.220 0.183 1.00 0.00 H new ATOM 0 HB3 MET A 131 11.210 -7.430 0.672 1.00 0.00 H new ATOM 0 HG2 MET A 131 9.885 -9.342 0.100 1.00 0.00 H new ATOM 0 HG3 MET A 131 11.211 -10.096 -0.763 1.00 0.00 H new ATOM 0 HE1 MET A 131 11.009 -9.659 3.853 1.00 0.00 H new ATOM 0 HE2 MET A 131 11.397 -8.271 2.809 1.00 0.00 H new ATOM 0 HE3 MET A 131 9.791 -9.033 2.717 1.00 0.00 H new ATOM 2035 N ALA A 132 10.963 -9.306 -3.009 1.00 0.00 N ATOM 2036 CA ALA A 132 11.185 -10.174 -4.160 1.00 0.00 C ATOM 2037 C ALA A 132 11.546 -9.355 -5.390 1.00 0.00 C ATOM 2038 O ALA A 132 12.431 -9.726 -6.161 1.00 0.00 O ATOM 2039 CB ALA A 132 9.943 -11.019 -4.437 1.00 0.00 C ATOM 0 H ALA A 132 10.031 -9.381 -2.601 1.00 0.00 H new ATOM 0 HA ALA A 132 12.018 -10.838 -3.930 1.00 0.00 H new ATOM 0 HB1 ALA A 132 10.125 -11.661 -5.299 1.00 0.00 H new ATOM 0 HB2 ALA A 132 9.720 -11.635 -3.566 1.00 0.00 H new ATOM 0 HB3 ALA A 132 9.096 -10.364 -4.644 1.00 0.00 H new ATOM 2045 N LEU A 133 10.879 -8.220 -5.552 1.00 0.00 N ATOM 2046 CA LEU A 133 11.096 -7.359 -6.704 1.00 0.00 C ATOM 2047 C LEU A 133 12.481 -6.736 -6.664 1.00 0.00 C ATOM 2048 O LEU A 133 13.060 -6.428 -7.703 1.00 0.00 O ATOM 2049 CB LEU A 133 10.041 -6.254 -6.758 1.00 0.00 C ATOM 2050 CG LEU A 133 9.168 -6.248 -8.010 1.00 0.00 C ATOM 2051 CD1 LEU A 133 8.243 -7.458 -8.028 1.00 0.00 C ATOM 2052 CD2 LEU A 133 8.376 -4.955 -8.086 1.00 0.00 C ATOM 0 H LEU A 133 10.180 -7.874 -4.895 1.00 0.00 H new ATOM 0 HA LEU A 133 11.013 -7.977 -7.598 1.00 0.00 H new ATOM 0 HB2 LEU A 133 9.395 -6.348 -5.885 1.00 0.00 H new ATOM 0 HB3 LEU A 133 10.544 -5.290 -6.681 1.00 0.00 H new ATOM 0 HG LEU A 133 9.812 -6.310 -8.887 1.00 0.00 H new ATOM 0 HD11 LEU A 133 7.630 -7.434 -8.929 1.00 0.00 H new ATOM 0 HD12 LEU A 133 8.838 -8.371 -8.019 1.00 0.00 H new ATOM 0 HD13 LEU A 133 7.598 -7.436 -7.149 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.756 -4.960 -8.983 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.740 -4.866 -7.206 1.00 0.00 H new ATOM 0 HD23 LEU A 133 9.063 -4.109 -8.124 1.00 0.00 H new ATOM 2064 N ARG A 134 13.001 -6.519 -5.467 1.00 0.00 N ATOM 2065 CA ARG A 134 14.343 -5.982 -5.315 1.00 0.00 C ATOM 2066 C ARG A 134 15.404 -7.079 -5.340 1.00 0.00 C ATOM 2067 O ARG A 134 16.557 -6.815 -5.675 1.00 0.00 O ATOM 2068 CB ARG A 134 14.460 -5.192 -4.014 1.00 0.00 C ATOM 2069 CG ARG A 134 13.626 -3.923 -3.987 1.00 0.00 C ATOM 2070 CD ARG A 134 13.976 -3.069 -2.779 1.00 0.00 C ATOM 2071 NE ARG A 134 15.409 -2.767 -2.736 1.00 0.00 N ATOM 2072 CZ ARG A 134 15.935 -1.574 -3.029 1.00 0.00 C ATOM 2073 NH1 ARG A 134 15.152 -0.520 -3.226 1.00 0.00 N ATOM 2074 NH2 ARG A 134 17.253 -1.425 -3.081 1.00 0.00 N ATOM 0 H ARG A 134 12.516 -6.706 -4.589 1.00 0.00 H new ATOM 0 HA ARG A 134 14.519 -5.320 -6.163 1.00 0.00 H new ATOM 0 HB2 ARG A 134 14.158 -5.831 -3.184 1.00 0.00 H new ATOM 0 HB3 ARG A 134 15.506 -4.931 -3.852 1.00 0.00 H new ATOM 0 HG2 ARG A 134 13.794 -3.353 -4.901 1.00 0.00 H new ATOM 0 HG3 ARG A 134 12.567 -4.180 -3.961 1.00 0.00 H new ATOM 0 HD2 ARG A 134 13.407 -2.140 -2.811 1.00 0.00 H new ATOM 0 HD3 ARG A 134 13.685 -3.589 -1.867 1.00 0.00 H new ATOM 0 HE ARG A 134 16.046 -3.516 -2.465 1.00 0.00 H new ATOM 0 HH11 ARG A 134 14.139 -0.617 -3.154 1.00 0.00 H new ATOM 0 HH12 ARG A 134 15.563 0.386 -3.449 1.00 0.00 H new ATOM 0 HH21 ARG A 134 17.864 -2.221 -2.897 1.00 0.00 H new ATOM 0 HH22 ARG A 134 17.655 -0.515 -3.305 1.00 0.00 H new ATOM 2088 N ALA A 135 15.027 -8.305 -5.001 1.00 0.00 N ATOM 2089 CA ALA A 135 15.994 -9.392 -4.927 1.00 0.00 C ATOM 2090 C ALA A 135 16.139 -10.079 -6.278 1.00 0.00 C ATOM 2091 O ALA A 135 17.245 -10.430 -6.689 1.00 0.00 O ATOM 2092 CB ALA A 135 15.585 -10.399 -3.861 1.00 0.00 C ATOM 0 H ALA A 135 14.068 -8.570 -4.775 1.00 0.00 H new ATOM 0 HA ALA A 135 16.960 -8.969 -4.652 1.00 0.00 H new ATOM 0 HB1 ALA A 135 16.319 -11.204 -3.820 1.00 0.00 H new ATOM 0 HB2 ALA A 135 15.536 -9.903 -2.892 1.00 0.00 H new ATOM 0 HB3 ALA A 135 14.607 -10.812 -4.107 1.00 0.00 H new ATOM 2098 N ALA A 136 15.019 -10.249 -6.971 1.00 0.00 N ATOM 2099 CA ALA A 136 15.019 -10.866 -8.288 1.00 0.00 C ATOM 2100 C ALA A 136 15.163 -9.799 -9.361 1.00 0.00 C ATOM 2101 O ALA A 136 15.849 -10.002 -10.361 1.00 0.00 O ATOM 2102 CB ALA A 136 13.742 -11.667 -8.505 1.00 0.00 C ATOM 0 H ALA A 136 14.097 -9.966 -6.639 1.00 0.00 H new ATOM 0 HA ALA A 136 15.866 -11.549 -8.353 1.00 0.00 H new ATOM 0 HB1 ALA A 136 13.761 -12.121 -9.496 1.00 0.00 H new ATOM 0 HB2 ALA A 136 13.670 -12.449 -7.749 1.00 0.00 H new ATOM 0 HB3 ALA A 136 12.880 -11.005 -8.426 1.00 0.00 H new ATOM 2108 N ARG A 137 14.513 -8.661 -9.123 1.00 0.00 N ATOM 2109 CA ARG A 137 14.570 -7.500 -10.017 1.00 0.00 C ATOM 2110 C ARG A 137 14.051 -7.824 -11.418 1.00 0.00 C ATOM 2111 O ARG A 137 14.804 -8.276 -12.282 1.00 0.00 O ATOM 2112 CB ARG A 137 15.997 -6.945 -10.103 1.00 0.00 C ATOM 2113 CG ARG A 137 16.119 -5.687 -10.953 1.00 0.00 C ATOM 2114 CD ARG A 137 15.726 -4.427 -10.187 1.00 0.00 C ATOM 2115 NE ARG A 137 14.390 -4.505 -9.587 1.00 0.00 N ATOM 2116 CZ ARG A 137 13.390 -3.668 -9.878 1.00 0.00 C ATOM 2117 NH1 ARG A 137 13.506 -2.816 -10.889 1.00 0.00 N ATOM 2118 NH2 ARG A 137 12.258 -3.716 -9.182 1.00 0.00 N ATOM 0 H ARG A 137 13.928 -8.515 -8.300 1.00 0.00 H new ATOM 0 HA ARG A 137 13.917 -6.741 -9.588 1.00 0.00 H new ATOM 0 HB2 ARG A 137 16.353 -6.727 -9.096 1.00 0.00 H new ATOM 0 HB3 ARG A 137 16.651 -7.714 -10.513 1.00 0.00 H new ATOM 0 HG2 ARG A 137 17.145 -5.589 -11.306 1.00 0.00 H new ATOM 0 HG3 ARG A 137 15.486 -5.785 -11.835 1.00 0.00 H new ATOM 0 HD2 ARG A 137 16.459 -4.244 -9.401 1.00 0.00 H new ATOM 0 HD3 ARG A 137 15.764 -3.573 -10.863 1.00 0.00 H new ATOM 0 HE ARG A 137 14.213 -5.243 -8.906 1.00 0.00 H new ATOM 0 HH11 ARG A 137 14.360 -2.799 -11.446 1.00 0.00 H new ATOM 0 HH12 ARG A 137 12.741 -2.178 -11.109 1.00 0.00 H new ATOM 0 HH21 ARG A 137 12.153 -4.392 -8.425 1.00 0.00 H new ATOM 0 HH22 ARG A 137 11.495 -3.077 -9.405 1.00 0.00 H new ATOM 2132 N PRO A 138 12.747 -7.616 -11.657 1.00 0.00 N ATOM 2133 CA PRO A 138 12.159 -7.763 -12.990 1.00 0.00 C ATOM 2134 C PRO A 138 12.761 -6.776 -13.978 1.00 0.00 C ATOM 2135 O PRO A 138 13.047 -5.628 -13.631 1.00 0.00 O ATOM 2136 CB PRO A 138 10.676 -7.455 -12.773 1.00 0.00 C ATOM 2137 CG PRO A 138 10.459 -7.672 -11.323 1.00 0.00 C ATOM 2138 CD PRO A 138 11.736 -7.247 -10.659 1.00 0.00 C ATOM 0 HA PRO A 138 12.338 -8.753 -13.409 1.00 0.00 H new ATOM 0 HB2 PRO A 138 10.437 -6.431 -13.061 1.00 0.00 H new ATOM 0 HB3 PRO A 138 10.043 -8.110 -13.371 1.00 0.00 H new ATOM 0 HG2 PRO A 138 9.614 -7.086 -10.961 1.00 0.00 H new ATOM 0 HG3 PRO A 138 10.236 -8.718 -11.112 1.00 0.00 H new ATOM 0 HD2 PRO A 138 11.747 -6.178 -10.445 1.00 0.00 H new ATOM 0 HD3 PRO A 138 11.893 -7.763 -9.712 1.00 0.00 H new ATOM 2146 N ALA A 139 12.951 -7.229 -15.202 1.00 0.00 N ATOM 2147 CA ALA A 139 13.536 -6.398 -16.236 1.00 0.00 C ATOM 2148 C ALA A 139 12.552 -5.331 -16.696 1.00 0.00 C ATOM 2149 O ALA A 139 12.799 -4.135 -16.543 1.00 0.00 O ATOM 2150 CB ALA A 139 13.968 -7.268 -17.401 1.00 0.00 C ATOM 0 H ALA A 139 12.708 -8.172 -15.505 1.00 0.00 H new ATOM 0 HA ALA A 139 14.409 -5.889 -15.828 1.00 0.00 H new ATOM 0 HB1 ALA A 139 14.408 -6.643 -18.178 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.705 -7.994 -17.059 1.00 0.00 H new ATOM 0 HB3 ALA A 139 13.102 -7.793 -17.804 1.00 0.00 H new ATOM 2156 N ASP A 140 11.427 -5.771 -17.241 1.00 0.00 N ATOM 2157 CA ASP A 140 10.421 -4.853 -17.750 1.00 0.00 C ATOM 2158 C ASP A 140 9.271 -4.743 -16.766 1.00 0.00 C ATOM 2159 O ASP A 140 8.346 -5.582 -16.833 1.00 0.00 O ATOM 2160 CB ASP A 140 9.892 -5.321 -19.108 1.00 0.00 C ATOM 2161 CG ASP A 140 10.996 -5.599 -20.108 1.00 0.00 C ATOM 2162 OD1 ASP A 140 11.556 -4.639 -20.677 1.00 0.00 O ATOM 2163 OD2 ASP A 140 11.303 -6.788 -20.336 1.00 0.00 O ATOM 2164 OXT ASP A 140 9.294 -3.825 -15.924 1.00 0.00 O ATOM 0 H ASP A 140 11.189 -6.758 -17.342 1.00 0.00 H new ATOM 0 HA ASP A 140 10.886 -3.875 -17.876 1.00 0.00 H new ATOM 0 HB2 ASP A 140 9.299 -6.225 -18.969 1.00 0.00 H new ATOM 0 HB3 ASP A 140 9.224 -4.561 -19.514 1.00 0.00 H new TER 2169 ASP A 140