USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 785 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 Single : A 1 GLY N :NH3+ -103:sc= 0.095 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0171 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0132 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 170:sc= 0.802 (180deg=0.564) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 150:sc= -0.244 USER MOD Single : A 18 SER OG : rot 180:sc= -0.0364 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.268 USER MOD Single : A 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot -52:sc= 1.17 USER MOD Single : A 38 GLN : amide:sc= -0.216 X(o=-0.22,f=-0.22) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc=-0.00033 K(o=-0.00033,f=-0.51) USER MOD Single : A 48 ASN : amide:sc= -0.0125 X(o=-0.013,f=-0.1) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 ASN : amide:sc= -0.0166 X(o=-0.017,f=-0.04) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.487 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 CYS SG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -4.32 K(o=-4.3,f=-7.3!) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= -0.474 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.0961 K(o=-0.096,f=-2.9!) USER MOD Single : A 106 GLN : amide:sc= -0.211 K(o=-0.21,f=-2.8!) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=-0.0057) USER MOD Single : A 108 SER OG : rot -99:sc= -0.0288 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0289 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.155 USER MOD Single : A 115 SER OG : rot -150:sc= -1.54 USER MOD Single : A 117 MET CE :methyl -159:sc= -1.76 (180deg=-2.04!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -20.328 1.874 13.603 1.00 0.00 N ATOM 2 CA GLY A 1 -20.557 0.579 14.222 1.00 0.00 C ATOM 3 C GLY A 1 -20.457 -0.547 13.192 1.00 0.00 C ATOM 4 O GLY A 1 -20.374 -0.291 11.992 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.367 2.202 13.829 1.00 0.00 H new ATOM 0 H2 GLY A 1 -20.432 1.789 12.572 1.00 0.00 H new ATOM 0 H3 GLY A 1 -21.021 2.559 13.965 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -19.827 0.417 15.015 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -21.542 0.564 14.688 1.00 0.00 H new ATOM 8 N SER A 2 -20.468 -1.771 13.700 1.00 0.00 N ATOM 9 CA SER A 2 -20.378 -2.938 12.838 1.00 0.00 C ATOM 10 C SER A 2 -21.045 -4.139 13.512 1.00 0.00 C ATOM 11 O SER A 2 -22.023 -4.680 12.998 1.00 0.00 O ATOM 12 CB SER A 2 -18.923 -3.262 12.498 1.00 0.00 C ATOM 13 OG SER A 2 -18.092 -3.265 13.655 1.00 0.00 O ATOM 0 H SER A 2 -20.538 -1.980 14.696 1.00 0.00 H new ATOM 0 HA SER A 2 -20.899 -2.715 11.907 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.873 -4.237 12.013 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.546 -2.530 11.783 1.00 0.00 H new ATOM 0 HG SER A 2 -17.171 -3.478 13.396 1.00 0.00 H new ATOM 18 N SER A 3 -20.491 -4.519 14.654 1.00 0.00 N ATOM 19 CA SER A 3 -21.020 -5.646 15.404 1.00 0.00 C ATOM 20 C SER A 3 -20.991 -6.909 14.542 1.00 0.00 C ATOM 21 O SER A 3 -20.996 -6.827 13.313 1.00 0.00 O ATOM 22 CB SER A 3 -22.443 -5.365 15.887 1.00 0.00 C ATOM 23 OG SER A 3 -22.530 -5.341 17.310 1.00 0.00 O ATOM 0 H SER A 3 -19.681 -4.067 15.078 1.00 0.00 H new ATOM 0 HA SER A 3 -20.391 -5.799 16.281 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.779 -4.408 15.487 1.00 0.00 H new ATOM 0 HB3 SER A 3 -23.116 -6.128 15.496 1.00 0.00 H new ATOM 0 HG SER A 3 -23.454 -5.157 17.578 1.00 0.00 H new ATOM 28 N GLY A 4 -20.964 -8.048 15.217 1.00 0.00 N ATOM 29 CA GLY A 4 -20.934 -9.327 14.527 1.00 0.00 C ATOM 30 C GLY A 4 -19.529 -9.638 14.007 1.00 0.00 C ATOM 31 O GLY A 4 -18.602 -8.854 14.205 1.00 0.00 O ATOM 0 H GLY A 4 -20.962 -8.113 16.235 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -21.258 -10.117 15.204 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -21.638 -9.312 13.695 1.00 0.00 H new ATOM 35 N SER A 5 -19.414 -10.783 13.352 1.00 0.00 N ATOM 36 CA SER A 5 -18.139 -11.208 12.802 1.00 0.00 C ATOM 37 C SER A 5 -18.350 -11.867 11.438 1.00 0.00 C ATOM 38 O SER A 5 -19.431 -12.379 11.152 1.00 0.00 O ATOM 39 CB SER A 5 -17.422 -12.171 13.751 1.00 0.00 C ATOM 40 OG SER A 5 -16.197 -12.648 13.203 1.00 0.00 O ATOM 0 H SER A 5 -20.185 -11.431 13.190 1.00 0.00 H new ATOM 0 HA SER A 5 -17.510 -10.326 12.679 1.00 0.00 H new ATOM 0 HB2 SER A 5 -17.224 -11.667 14.697 1.00 0.00 H new ATOM 0 HB3 SER A 5 -18.074 -13.016 13.971 1.00 0.00 H new ATOM 0 HG SER A 5 -15.769 -13.258 13.840 1.00 0.00 H new ATOM 45 N SER A 6 -17.299 -11.834 10.630 1.00 0.00 N ATOM 46 CA SER A 6 -17.357 -12.421 9.303 1.00 0.00 C ATOM 47 C SER A 6 -15.951 -12.814 8.844 1.00 0.00 C ATOM 48 O SER A 6 -15.164 -11.959 8.440 1.00 0.00 O ATOM 49 CB SER A 6 -17.992 -11.456 8.300 1.00 0.00 C ATOM 50 OG SER A 6 -18.996 -12.090 7.512 1.00 0.00 O ATOM 0 H SER A 6 -16.403 -11.410 10.870 1.00 0.00 H new ATOM 0 HA SER A 6 -17.981 -13.314 9.351 1.00 0.00 H new ATOM 0 HB2 SER A 6 -18.429 -10.613 8.835 1.00 0.00 H new ATOM 0 HB3 SER A 6 -17.219 -11.052 7.646 1.00 0.00 H new ATOM 0 HG SER A 6 -19.378 -11.441 6.885 1.00 0.00 H new ATOM 55 N GLY A 7 -15.677 -14.108 8.921 1.00 0.00 N ATOM 56 CA GLY A 7 -14.380 -14.624 8.520 1.00 0.00 C ATOM 57 C GLY A 7 -14.047 -14.211 7.085 1.00 0.00 C ATOM 58 O GLY A 7 -14.865 -13.592 6.407 1.00 0.00 O ATOM 0 H GLY A 7 -16.332 -14.815 9.256 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -13.611 -14.252 9.197 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.376 -15.711 8.600 1.00 0.00 H new ATOM 62 N GLY A 8 -12.843 -14.570 6.665 1.00 0.00 N ATOM 63 CA GLY A 8 -12.390 -14.245 5.324 1.00 0.00 C ATOM 64 C GLY A 8 -11.105 -13.415 5.364 1.00 0.00 C ATOM 65 O GLY A 8 -10.019 -13.933 5.109 1.00 0.00 O ATOM 0 H GLY A 8 -12.167 -15.083 7.231 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -12.217 -15.163 4.763 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -13.168 -13.692 4.798 1.00 0.00 H new ATOM 69 N PRO A 9 -11.275 -12.107 5.697 1.00 0.00 N ATOM 70 CA PRO A 9 -10.142 -11.200 5.776 1.00 0.00 C ATOM 71 C PRO A 9 -9.324 -11.453 7.043 1.00 0.00 C ATOM 72 O PRO A 9 -9.780 -12.147 7.951 1.00 0.00 O ATOM 73 CB PRO A 9 -10.748 -9.808 5.727 1.00 0.00 C ATOM 74 CG PRO A 9 -12.215 -9.977 6.090 1.00 0.00 C ATOM 75 CD PRO A 9 -12.547 -11.458 6.006 1.00 0.00 C ATOM 0 HA PRO A 9 -9.434 -11.340 4.959 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -10.247 -9.139 6.427 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -10.639 -9.370 4.735 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -12.406 -9.599 7.094 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -12.845 -9.405 5.409 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -12.961 -11.825 6.945 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -13.290 -11.654 5.233 1.00 0.00 H new ATOM 80 N LYS A 10 -8.133 -10.874 7.066 1.00 0.00 N ATOM 81 CA LYS A 10 -7.249 -11.027 8.208 1.00 0.00 C ATOM 82 C LYS A 10 -6.815 -9.645 8.702 1.00 0.00 C ATOM 83 O LYS A 10 -6.193 -8.885 7.961 1.00 0.00 O ATOM 84 CB LYS A 10 -6.079 -11.949 7.860 1.00 0.00 C ATOM 85 CG LYS A 10 -4.804 -11.144 7.600 1.00 0.00 C ATOM 86 CD LYS A 10 -3.604 -12.071 7.392 1.00 0.00 C ATOM 87 CE LYS A 10 -2.352 -11.505 8.068 1.00 0.00 C ATOM 88 NZ LYS A 10 -1.496 -12.602 8.573 1.00 0.00 N ATOM 0 H LYS A 10 -7.760 -10.298 6.312 1.00 0.00 H new ATOM 0 HA LYS A 10 -7.773 -11.511 9.032 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -5.910 -12.651 8.676 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -6.327 -12.539 6.978 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -4.939 -10.515 6.720 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -4.612 -10.478 8.441 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -3.827 -13.058 7.798 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -3.420 -12.200 6.325 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -1.792 -10.896 7.358 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -2.640 -10.852 8.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -0.579 -12.216 8.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -1.961 -13.061 9.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -1.346 -13.301 7.818 1.00 0.00 H new ATOM 98 N THR A 11 -7.163 -9.361 9.949 1.00 0.00 N ATOM 99 CA THR A 11 -6.818 -8.083 10.549 1.00 0.00 C ATOM 100 C THR A 11 -5.542 -8.214 11.382 1.00 0.00 C ATOM 101 O THR A 11 -5.429 -9.110 12.217 1.00 0.00 O ATOM 102 CB THR A 11 -8.023 -7.600 11.357 1.00 0.00 C ATOM 103 OG1 THR A 11 -9.100 -7.629 10.423 1.00 0.00 O ATOM 104 CG2 THR A 11 -7.912 -6.126 11.752 1.00 0.00 C ATOM 0 H THR A 11 -7.680 -9.994 10.560 1.00 0.00 H new ATOM 0 HA THR A 11 -6.598 -7.335 9.788 1.00 0.00 H new ATOM 0 HB THR A 11 -8.125 -8.209 12.255 1.00 0.00 H new ATOM 0 HG1 THR A 11 -9.923 -7.332 10.864 1.00 0.00 H new ATOM 0 HG21 THR A 11 -8.793 -5.835 12.324 1.00 0.00 H new ATOM 0 HG22 THR A 11 -7.020 -5.979 12.361 1.00 0.00 H new ATOM 0 HG23 THR A 11 -7.844 -5.513 10.854 1.00 0.00 H new ATOM 112 N VAL A 12 -4.611 -7.305 11.127 1.00 0.00 N ATOM 113 CA VAL A 12 -3.347 -7.307 11.843 1.00 0.00 C ATOM 114 C VAL A 12 -3.097 -5.916 12.430 1.00 0.00 C ATOM 115 O VAL A 12 -3.403 -4.907 11.797 1.00 0.00 O ATOM 116 CB VAL A 12 -2.223 -7.777 10.919 1.00 0.00 C ATOM 117 CG1 VAL A 12 -2.148 -9.305 10.880 1.00 0.00 C ATOM 118 CG2 VAL A 12 -2.392 -7.200 9.513 1.00 0.00 C ATOM 0 H VAL A 12 -4.708 -6.562 10.434 1.00 0.00 H new ATOM 0 HA VAL A 12 -3.380 -8.010 12.675 1.00 0.00 H new ATOM 0 HB VAL A 12 -1.281 -7.406 11.322 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -1.341 -9.613 10.216 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -1.957 -9.686 11.883 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -3.093 -9.706 10.513 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -1.580 -7.550 8.876 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -3.345 -7.527 9.098 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -2.372 -6.111 9.562 1.00 0.00 H new ATOM 128 N THR A 13 -2.541 -5.908 13.633 1.00 0.00 N ATOM 129 CA THR A 13 -2.245 -4.657 14.311 1.00 0.00 C ATOM 130 C THR A 13 -0.733 -4.430 14.377 1.00 0.00 C ATOM 131 O THR A 13 0.038 -5.384 14.473 1.00 0.00 O ATOM 132 CB THR A 13 -2.915 -4.696 15.687 1.00 0.00 C ATOM 133 OG1 THR A 13 -4.280 -4.986 15.400 1.00 0.00 O ATOM 134 CG2 THR A 13 -2.958 -3.321 16.356 1.00 0.00 C ATOM 0 H THR A 13 -2.288 -6.747 14.155 1.00 0.00 H new ATOM 0 HA THR A 13 -2.645 -3.805 13.762 1.00 0.00 H new ATOM 0 HB THR A 13 -2.382 -5.396 16.331 1.00 0.00 H new ATOM 0 HG1 THR A 13 -4.788 -5.031 16.237 1.00 0.00 H new ATOM 0 HG21 THR A 13 -3.443 -3.405 17.329 1.00 0.00 H new ATOM 0 HG22 THR A 13 -1.942 -2.949 16.488 1.00 0.00 H new ATOM 0 HG23 THR A 13 -3.520 -2.629 15.729 1.00 0.00 H new ATOM 142 N LEU A 14 -0.354 -3.161 14.324 1.00 0.00 N ATOM 143 CA LEU A 14 1.051 -2.797 14.376 1.00 0.00 C ATOM 144 C LEU A 14 1.238 -1.646 15.364 1.00 0.00 C ATOM 145 O LEU A 14 0.284 -0.945 15.695 1.00 0.00 O ATOM 146 CB LEU A 14 1.579 -2.495 12.971 1.00 0.00 C ATOM 147 CG LEU A 14 1.621 -3.677 12.002 1.00 0.00 C ATOM 148 CD1 LEU A 14 0.274 -3.859 11.300 1.00 0.00 C ATOM 149 CD2 LEU A 14 2.772 -3.525 11.005 1.00 0.00 C ATOM 0 H LEU A 14 -0.996 -2.372 14.246 1.00 0.00 H new ATOM 0 HA LEU A 14 1.648 -3.632 14.742 1.00 0.00 H new ATOM 0 HB2 LEU A 14 0.960 -1.713 12.532 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.587 -2.090 13.062 1.00 0.00 H new ATOM 0 HG LEU A 14 1.809 -4.584 12.576 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.331 -4.706 10.617 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -0.502 -4.044 12.043 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.031 -2.956 10.739 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.781 -4.378 10.327 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.638 -2.607 10.432 1.00 0.00 H new ATOM 0 HD23 LEU A 14 3.718 -3.481 11.545 1.00 0.00 H new ATOM 160 N LYS A 15 2.476 -1.486 15.810 1.00 0.00 N ATOM 161 CA LYS A 15 2.801 -0.431 16.756 1.00 0.00 C ATOM 162 C LYS A 15 3.999 0.363 16.234 1.00 0.00 C ATOM 163 O LYS A 15 5.073 -0.196 16.017 1.00 0.00 O ATOM 164 CB LYS A 15 3.012 -1.013 18.155 1.00 0.00 C ATOM 165 CG LYS A 15 1.750 -1.723 18.649 1.00 0.00 C ATOM 166 CD LYS A 15 1.583 -1.556 20.161 1.00 0.00 C ATOM 167 CE LYS A 15 1.204 -2.883 20.821 1.00 0.00 C ATOM 168 NZ LYS A 15 1.184 -2.742 22.295 1.00 0.00 N ATOM 0 H LYS A 15 3.266 -2.069 15.534 1.00 0.00 H new ATOM 0 HA LYS A 15 1.970 0.268 16.848 1.00 0.00 H new ATOM 0 HB2 LYS A 15 3.846 -1.715 18.139 1.00 0.00 H new ATOM 0 HB3 LYS A 15 3.280 -0.215 18.848 1.00 0.00 H new ATOM 0 HG2 LYS A 15 0.877 -1.319 18.136 1.00 0.00 H new ATOM 0 HG3 LYS A 15 1.804 -2.783 18.400 1.00 0.00 H new ATOM 0 HD2 LYS A 15 2.511 -1.183 20.594 1.00 0.00 H new ATOM 0 HD3 LYS A 15 0.814 -0.811 20.365 1.00 0.00 H new ATOM 0 HE2 LYS A 15 0.225 -3.205 20.467 1.00 0.00 H new ATOM 0 HE3 LYS A 15 1.917 -3.656 20.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 0.925 -3.652 22.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 2.126 -2.456 22.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 0.487 -2.019 22.565 1.00 0.00 H new ATOM 178 N ARG A 16 3.775 1.657 16.046 1.00 0.00 N ATOM 179 CA ARG A 16 4.822 2.533 15.552 1.00 0.00 C ATOM 180 C ARG A 16 6.172 2.143 16.160 1.00 0.00 C ATOM 181 O ARG A 16 6.387 2.308 17.359 1.00 0.00 O ATOM 182 CB ARG A 16 4.522 3.995 15.893 1.00 0.00 C ATOM 183 CG ARG A 16 5.626 4.917 15.373 1.00 0.00 C ATOM 184 CD ARG A 16 5.036 6.097 14.598 1.00 0.00 C ATOM 185 NE ARG A 16 5.943 7.264 14.683 1.00 0.00 N ATOM 186 CZ ARG A 16 5.771 8.401 13.996 1.00 0.00 C ATOM 187 NH1 ARG A 16 4.725 8.531 13.169 1.00 0.00 N ATOM 188 NH2 ARG A 16 6.645 9.407 14.136 1.00 0.00 N ATOM 0 H ARG A 16 2.883 2.118 16.227 1.00 0.00 H new ATOM 0 HA ARG A 16 4.862 2.424 14.468 1.00 0.00 H new ATOM 0 HB2 ARG A 16 3.566 4.285 15.457 1.00 0.00 H new ATOM 0 HB3 ARG A 16 4.427 4.108 16.973 1.00 0.00 H new ATOM 0 HG2 ARG A 16 6.219 5.287 16.209 1.00 0.00 H new ATOM 0 HG3 ARG A 16 6.301 4.354 14.728 1.00 0.00 H new ATOM 0 HD2 ARG A 16 4.885 5.819 13.555 1.00 0.00 H new ATOM 0 HD3 ARG A 16 4.058 6.356 15.003 1.00 0.00 H new ATOM 0 HE ARG A 16 6.750 7.198 15.304 1.00 0.00 H new ATOM 0 HH11 ARG A 16 4.060 7.765 13.063 1.00 0.00 H new ATOM 0 HH12 ARG A 16 4.593 9.396 12.645 1.00 0.00 H new ATOM 0 HH21 ARG A 16 7.441 9.307 14.766 1.00 0.00 H new ATOM 0 HH22 ARG A 16 6.514 10.273 13.613 1.00 0.00 H new ATOM 199 N THR A 17 7.044 1.632 15.303 1.00 0.00 N ATOM 200 CA THR A 17 8.366 1.218 15.740 1.00 0.00 C ATOM 201 C THR A 17 9.446 1.967 14.959 1.00 0.00 C ATOM 202 O THR A 17 10.349 2.558 15.551 1.00 0.00 O ATOM 203 CB THR A 17 8.456 -0.303 15.595 1.00 0.00 C ATOM 204 OG1 THR A 17 7.817 -0.571 14.350 1.00 0.00 O ATOM 205 CG2 THR A 17 7.595 -1.043 16.622 1.00 0.00 C ATOM 0 H THR A 17 6.861 1.495 14.309 1.00 0.00 H new ATOM 0 HA THR A 17 8.533 1.471 16.787 1.00 0.00 H new ATOM 0 HB THR A 17 9.495 -0.616 15.700 1.00 0.00 H new ATOM 0 HG1 THR A 17 8.215 -1.369 13.943 1.00 0.00 H new ATOM 0 HG21 THR A 17 7.696 -2.118 16.474 1.00 0.00 H new ATOM 0 HG22 THR A 17 7.924 -0.783 17.628 1.00 0.00 H new ATOM 0 HG23 THR A 17 6.551 -0.756 16.496 1.00 0.00 H new ATOM 213 N SER A 18 9.319 1.920 13.641 1.00 0.00 N ATOM 214 CA SER A 18 10.274 2.586 12.772 1.00 0.00 C ATOM 215 C SER A 18 9.556 3.627 11.909 1.00 0.00 C ATOM 216 O SER A 18 8.361 3.861 12.078 1.00 0.00 O ATOM 217 CB SER A 18 11.011 1.580 11.888 1.00 0.00 C ATOM 218 OG SER A 18 10.114 0.694 11.224 1.00 0.00 O ATOM 0 H SER A 18 8.568 1.431 13.154 1.00 0.00 H new ATOM 0 HA SER A 18 11.014 3.087 13.396 1.00 0.00 H new ATOM 0 HB2 SER A 18 11.606 2.115 11.148 1.00 0.00 H new ATOM 0 HB3 SER A 18 11.706 1.002 12.498 1.00 0.00 H new ATOM 0 HG SER A 18 10.624 0.068 10.668 1.00 0.00 H new ATOM 223 N GLN A 19 10.317 4.221 11.002 1.00 0.00 N ATOM 224 CA GLN A 19 9.770 5.231 10.111 1.00 0.00 C ATOM 225 C GLN A 19 8.442 4.754 9.521 1.00 0.00 C ATOM 226 O GLN A 19 7.412 5.404 9.694 1.00 0.00 O ATOM 227 CB GLN A 19 10.765 5.586 9.006 1.00 0.00 C ATOM 228 CG GLN A 19 11.069 7.085 9.001 1.00 0.00 C ATOM 229 CD GLN A 19 12.505 7.353 8.546 1.00 0.00 C ATOM 230 OE1 GLN A 19 12.789 7.530 7.373 1.00 0.00 O ATOM 231 NE2 GLN A 19 13.391 7.372 9.537 1.00 0.00 N ATOM 0 H GLN A 19 11.308 4.023 10.865 1.00 0.00 H new ATOM 0 HA GLN A 19 9.584 6.136 10.690 1.00 0.00 H new ATOM 0 HB2 GLN A 19 11.688 5.025 9.149 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.360 5.291 8.038 1.00 0.00 H new ATOM 0 HG2 GLN A 19 10.372 7.599 8.338 1.00 0.00 H new ATOM 0 HG3 GLN A 19 10.918 7.493 10.000 1.00 0.00 H new ATOM 0 HE21 GLN A 19 13.085 7.216 10.498 1.00 0.00 H new ATOM 0 HE22 GLN A 19 14.377 7.542 9.337 1.00 0.00 H new ATOM 238 N GLY A 20 8.507 3.622 8.837 1.00 0.00 N ATOM 239 CA GLY A 20 7.324 3.049 8.220 1.00 0.00 C ATOM 240 C GLY A 20 7.072 1.628 8.730 1.00 0.00 C ATOM 241 O GLY A 20 6.873 0.706 7.939 1.00 0.00 O ATOM 0 H GLY A 20 9.363 3.085 8.696 1.00 0.00 H new ATOM 0 HA2 GLY A 20 6.458 3.675 8.435 1.00 0.00 H new ATOM 0 HA3 GLY A 20 7.446 3.034 7.137 1.00 0.00 H new ATOM 245 N PHE A 21 7.087 1.496 10.048 1.00 0.00 N ATOM 246 CA PHE A 21 6.862 0.202 10.671 1.00 0.00 C ATOM 247 C PHE A 21 7.769 -0.867 10.058 1.00 0.00 C ATOM 248 O PHE A 21 8.530 -0.585 9.135 1.00 0.00 O ATOM 249 CB PHE A 21 5.403 -0.173 10.412 1.00 0.00 C ATOM 250 CG PHE A 21 4.392 0.788 11.040 1.00 0.00 C ATOM 251 CD1 PHE A 21 4.035 0.643 12.345 1.00 0.00 C ATOM 252 CD2 PHE A 21 3.850 1.789 10.296 1.00 0.00 C ATOM 253 CE1 PHE A 21 3.098 1.534 12.928 1.00 0.00 C ATOM 254 CE2 PHE A 21 2.911 2.680 10.879 1.00 0.00 C ATOM 255 CZ PHE A 21 2.555 2.536 12.183 1.00 0.00 C ATOM 0 H PHE A 21 7.251 2.262 10.701 1.00 0.00 H new ATOM 0 HA PHE A 21 7.083 0.259 11.737 1.00 0.00 H new ATOM 0 HB2 PHE A 21 5.234 -0.210 9.336 1.00 0.00 H new ATOM 0 HB3 PHE A 21 5.223 -1.176 10.797 1.00 0.00 H new ATOM 0 HD1 PHE A 21 4.465 -0.151 12.937 1.00 0.00 H new ATOM 0 HD2 PHE A 21 4.134 1.906 9.261 1.00 0.00 H new ATOM 0 HE1 PHE A 21 2.815 1.418 13.964 1.00 0.00 H new ATOM 0 HE2 PHE A 21 2.479 3.473 10.286 1.00 0.00 H new ATOM 0 HZ PHE A 21 1.843 3.215 12.627 1.00 0.00 H new ATOM 264 N GLY A 22 7.655 -2.072 10.596 1.00 0.00 N ATOM 265 CA GLY A 22 8.454 -3.185 10.113 1.00 0.00 C ATOM 266 C GLY A 22 8.251 -3.397 8.612 1.00 0.00 C ATOM 267 O GLY A 22 9.091 -2.997 7.806 1.00 0.00 O ATOM 0 H GLY A 22 7.021 -2.302 11.362 1.00 0.00 H new ATOM 0 HA2 GLY A 22 9.508 -2.996 10.318 1.00 0.00 H new ATOM 0 HA3 GLY A 22 8.182 -4.093 10.652 1.00 0.00 H new ATOM 271 N PHE A 23 7.131 -4.023 8.281 1.00 0.00 N ATOM 272 CA PHE A 23 6.807 -4.292 6.890 1.00 0.00 C ATOM 273 C PHE A 23 6.923 -3.022 6.045 1.00 0.00 C ATOM 274 O PHE A 23 7.112 -1.931 6.581 1.00 0.00 O ATOM 275 CB PHE A 23 5.359 -4.783 6.856 1.00 0.00 C ATOM 276 CG PHE A 23 4.319 -3.661 6.905 1.00 0.00 C ATOM 277 CD1 PHE A 23 4.126 -2.964 8.057 1.00 0.00 C ATOM 278 CD2 PHE A 23 3.590 -3.362 5.797 1.00 0.00 C ATOM 279 CE1 PHE A 23 3.161 -1.924 8.103 1.00 0.00 C ATOM 280 CE2 PHE A 23 2.625 -2.322 5.843 1.00 0.00 C ATOM 281 CZ PHE A 23 2.431 -1.623 6.994 1.00 0.00 C ATOM 0 H PHE A 23 6.437 -4.352 8.952 1.00 0.00 H new ATOM 0 HA PHE A 23 7.497 -5.031 6.483 1.00 0.00 H new ATOM 0 HB2 PHE A 23 5.206 -5.367 5.949 1.00 0.00 H new ATOM 0 HB3 PHE A 23 5.194 -5.454 7.699 1.00 0.00 H new ATOM 0 HD1 PHE A 23 4.707 -3.202 8.936 1.00 0.00 H new ATOM 0 HD2 PHE A 23 3.745 -3.915 4.883 1.00 0.00 H new ATOM 0 HE1 PHE A 23 3.006 -1.371 9.018 1.00 0.00 H new ATOM 0 HE2 PHE A 23 2.044 -2.085 4.964 1.00 0.00 H new ATOM 0 HZ PHE A 23 1.699 -0.830 7.028 1.00 0.00 H new ATOM 290 N THR A 24 6.802 -3.205 4.739 1.00 0.00 N ATOM 291 CA THR A 24 6.890 -2.087 3.814 1.00 0.00 C ATOM 292 C THR A 24 6.202 -2.433 2.492 1.00 0.00 C ATOM 293 O THR A 24 5.996 -3.606 2.185 1.00 0.00 O ATOM 294 CB THR A 24 8.367 -1.722 3.654 1.00 0.00 C ATOM 295 OG1 THR A 24 8.422 -1.040 2.404 1.00 0.00 O ATOM 296 CG2 THR A 24 9.255 -2.951 3.448 1.00 0.00 C ATOM 0 H THR A 24 6.644 -4.111 4.298 1.00 0.00 H new ATOM 0 HA THR A 24 6.364 -1.213 4.198 1.00 0.00 H new ATOM 0 HB THR A 24 8.703 -1.175 4.535 1.00 0.00 H new ATOM 0 HG1 THR A 24 9.345 -0.766 2.221 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.293 -2.636 3.340 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.165 -3.614 4.309 1.00 0.00 H new ATOM 0 HG23 THR A 24 8.941 -3.480 2.548 1.00 0.00 H new ATOM 304 N LEU A 25 5.867 -1.391 1.746 1.00 0.00 N ATOM 305 CA LEU A 25 5.207 -1.570 0.464 1.00 0.00 C ATOM 306 C LEU A 25 6.172 -1.186 -0.659 1.00 0.00 C ATOM 307 O LEU A 25 7.286 -0.733 -0.399 1.00 0.00 O ATOM 308 CB LEU A 25 3.886 -0.798 0.431 1.00 0.00 C ATOM 309 CG LEU A 25 2.991 -0.948 1.661 1.00 0.00 C ATOM 310 CD1 LEU A 25 2.984 -2.393 2.163 1.00 0.00 C ATOM 311 CD2 LEU A 25 3.398 0.039 2.758 1.00 0.00 C ATOM 0 H LEU A 25 6.040 -0.420 2.005 1.00 0.00 H new ATOM 0 HA LEU A 25 4.943 -2.617 0.313 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.110 0.260 0.296 1.00 0.00 H new ATOM 0 HB3 LEU A 25 3.322 -1.119 -0.445 1.00 0.00 H new ATOM 0 HG LEU A 25 1.969 -0.705 1.371 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.339 -2.471 3.039 1.00 0.00 H new ATOM 0 HD12 LEU A 25 2.610 -3.049 1.377 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.998 -2.690 2.431 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.746 -0.088 3.622 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.431 -0.149 3.052 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.308 1.058 2.382 1.00 0.00 H new ATOM 322 N ARG A 26 5.711 -1.381 -1.886 1.00 0.00 N ATOM 323 CA ARG A 26 6.519 -1.062 -3.050 1.00 0.00 C ATOM 324 C ARG A 26 5.846 0.035 -3.878 1.00 0.00 C ATOM 325 O ARG A 26 4.681 0.361 -3.654 1.00 0.00 O ATOM 326 CB ARG A 26 6.732 -2.296 -3.927 1.00 0.00 C ATOM 327 CG ARG A 26 8.157 -2.335 -4.483 1.00 0.00 C ATOM 328 CD ARG A 26 8.578 -3.769 -4.812 1.00 0.00 C ATOM 329 NE ARG A 26 10.041 -3.829 -5.034 1.00 0.00 N ATOM 330 CZ ARG A 26 10.737 -4.968 -5.147 1.00 0.00 C ATOM 331 NH1 ARG A 26 10.109 -6.149 -5.060 1.00 0.00 N ATOM 332 NH2 ARG A 26 12.060 -4.926 -5.347 1.00 0.00 N ATOM 0 H ARG A 26 4.787 -1.756 -2.099 1.00 0.00 H new ATOM 0 HA ARG A 26 7.488 -0.711 -2.696 1.00 0.00 H new ATOM 0 HB2 ARG A 26 6.540 -3.197 -3.345 1.00 0.00 H new ATOM 0 HB3 ARG A 26 6.017 -2.290 -4.750 1.00 0.00 H new ATOM 0 HG2 ARG A 26 8.218 -1.719 -5.380 1.00 0.00 H new ATOM 0 HG3 ARG A 26 8.847 -1.907 -3.755 1.00 0.00 H new ATOM 0 HD2 ARG A 26 8.298 -4.435 -3.996 1.00 0.00 H new ATOM 0 HD3 ARG A 26 8.052 -4.116 -5.702 1.00 0.00 H new ATOM 0 HE ARG A 26 10.550 -2.948 -5.105 1.00 0.00 H new ATOM 0 HH11 ARG A 26 9.101 -6.181 -4.908 1.00 0.00 H new ATOM 0 HH12 ARG A 26 10.639 -7.016 -5.146 1.00 0.00 H new ATOM 0 HH21 ARG A 26 12.537 -4.027 -5.413 1.00 0.00 H new ATOM 0 HH22 ARG A 26 12.591 -5.793 -5.433 1.00 0.00 H new ATOM 343 N HIS A 27 6.610 0.576 -4.817 1.00 0.00 N ATOM 344 CA HIS A 27 6.102 1.629 -5.680 1.00 0.00 C ATOM 345 C HIS A 27 5.570 1.018 -6.978 1.00 0.00 C ATOM 346 O HIS A 27 5.798 1.555 -8.059 1.00 0.00 O ATOM 347 CB HIS A 27 7.173 2.696 -5.920 1.00 0.00 C ATOM 348 CG HIS A 27 7.291 3.710 -4.808 1.00 0.00 C ATOM 349 ND1 HIS A 27 7.975 3.457 -3.632 1.00 0.00 N ATOM 350 CD2 HIS A 27 6.806 4.981 -4.704 1.00 0.00 C ATOM 351 CE1 HIS A 27 7.899 4.533 -2.863 1.00 0.00 C ATOM 352 NE2 HIS A 27 7.173 5.476 -3.529 1.00 0.00 N ATOM 0 H HIS A 27 7.576 0.305 -4.999 1.00 0.00 H new ATOM 0 HA HIS A 27 5.269 2.136 -5.192 1.00 0.00 H new ATOM 0 HB2 HIS A 27 8.137 2.205 -6.053 1.00 0.00 H new ATOM 0 HB3 HIS A 27 6.949 3.217 -6.851 1.00 0.00 H new ATOM 0 HD2 HIS A 27 6.222 5.497 -5.452 1.00 0.00 H new ATOM 0 HE1 HIS A 27 8.335 4.644 -1.881 1.00 0.00 H new ATOM 0 HE2 HIS A 27 6.949 6.408 -3.181 1.00 0.00 H new ATOM 359 N PHE A 28 4.872 -0.097 -6.825 1.00 0.00 N ATOM 360 CA PHE A 28 4.305 -0.787 -7.972 1.00 0.00 C ATOM 361 C PHE A 28 3.554 0.187 -8.883 1.00 0.00 C ATOM 362 O PHE A 28 3.490 1.383 -8.599 1.00 0.00 O ATOM 363 CB PHE A 28 3.318 -1.821 -7.428 1.00 0.00 C ATOM 364 CG PHE A 28 2.518 -1.342 -6.216 1.00 0.00 C ATOM 365 CD1 PHE A 28 1.399 -0.591 -6.391 1.00 0.00 C ATOM 366 CD2 PHE A 28 2.929 -1.668 -4.959 1.00 0.00 C ATOM 367 CE1 PHE A 28 0.657 -0.147 -5.265 1.00 0.00 C ATOM 368 CE2 PHE A 28 2.187 -1.223 -3.833 1.00 0.00 C ATOM 369 CZ PHE A 28 1.067 -0.472 -4.009 1.00 0.00 C ATOM 0 H PHE A 28 4.686 -0.540 -5.925 1.00 0.00 H new ATOM 0 HA PHE A 28 5.099 -1.250 -8.557 1.00 0.00 H new ATOM 0 HB2 PHE A 28 2.624 -2.098 -8.222 1.00 0.00 H new ATOM 0 HB3 PHE A 28 3.866 -2.723 -7.155 1.00 0.00 H new ATOM 0 HD1 PHE A 28 1.074 -0.332 -7.388 1.00 0.00 H new ATOM 0 HD2 PHE A 28 3.818 -2.264 -4.819 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -0.233 0.449 -5.405 1.00 0.00 H new ATOM 0 HE2 PHE A 28 2.512 -1.481 -2.836 1.00 0.00 H new ATOM 0 HZ PHE A 28 0.503 -0.134 -3.152 1.00 0.00 H new ATOM 378 N ILE A 29 3.004 -0.359 -9.957 1.00 0.00 N ATOM 379 CA ILE A 29 2.262 0.447 -10.911 1.00 0.00 C ATOM 380 C ILE A 29 1.031 1.038 -10.221 1.00 0.00 C ATOM 381 O ILE A 29 0.023 0.354 -10.047 1.00 0.00 O ATOM 382 CB ILE A 29 1.932 -0.371 -12.161 1.00 0.00 C ATOM 383 CG1 ILE A 29 3.115 -0.385 -13.132 1.00 0.00 C ATOM 384 CG2 ILE A 29 0.651 0.135 -12.825 1.00 0.00 C ATOM 385 CD1 ILE A 29 2.906 -1.427 -14.235 1.00 0.00 C ATOM 0 H ILE A 29 3.057 -1.351 -10.188 1.00 0.00 H new ATOM 0 HA ILE A 29 2.868 1.284 -11.257 1.00 0.00 H new ATOM 0 HB ILE A 29 1.750 -1.402 -11.858 1.00 0.00 H new ATOM 0 HG12 ILE A 29 3.236 0.602 -13.578 1.00 0.00 H new ATOM 0 HG13 ILE A 29 4.034 -0.605 -12.588 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.439 -0.464 -13.711 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -0.180 0.052 -12.124 1.00 0.00 H new ATOM 0 HG23 ILE A 29 0.779 1.178 -13.114 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.760 -1.417 -14.912 1.00 0.00 H new ATOM 0 HD12 ILE A 29 2.809 -2.416 -13.787 1.00 0.00 H new ATOM 0 HD13 ILE A 29 1.999 -1.190 -14.792 1.00 0.00 H new ATOM 396 N VAL A 30 1.152 2.303 -9.847 1.00 0.00 N ATOM 397 CA VAL A 30 0.060 2.994 -9.180 1.00 0.00 C ATOM 398 C VAL A 30 -0.522 4.048 -10.124 1.00 0.00 C ATOM 399 O VAL A 30 -1.695 4.401 -10.017 1.00 0.00 O ATOM 400 CB VAL A 30 0.547 3.583 -7.854 1.00 0.00 C ATOM 401 CG1 VAL A 30 1.553 2.651 -7.177 1.00 0.00 C ATOM 402 CG2 VAL A 30 1.143 4.977 -8.059 1.00 0.00 C ATOM 0 H VAL A 30 1.989 2.868 -9.993 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.742 2.297 -8.936 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.315 3.681 -7.194 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.883 3.093 -6.237 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.081 1.688 -6.979 1.00 0.00 H new ATOM 0 HG13 VAL A 30 2.413 2.506 -7.832 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.481 5.373 -7.101 1.00 0.00 H new ATOM 0 HG22 VAL A 30 1.988 4.914 -8.744 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.385 5.639 -8.478 1.00 0.00 H new ATOM 412 N TYR A 31 0.325 4.520 -11.026 1.00 0.00 N ATOM 413 CA TYR A 31 -0.091 5.527 -11.989 1.00 0.00 C ATOM 414 C TYR A 31 -0.695 6.743 -11.283 1.00 0.00 C ATOM 415 O TYR A 31 -1.894 7.000 -11.399 1.00 0.00 O ATOM 416 CB TYR A 31 -1.167 4.866 -12.852 1.00 0.00 C ATOM 417 CG TYR A 31 -0.612 3.959 -13.953 1.00 0.00 C ATOM 418 CD1 TYR A 31 0.485 3.159 -13.700 1.00 0.00 C ATOM 419 CD2 TYR A 31 -1.207 3.942 -15.197 1.00 0.00 C ATOM 420 CE1 TYR A 31 1.008 2.306 -14.736 1.00 0.00 C ATOM 421 CE2 TYR A 31 -0.683 3.089 -16.233 1.00 0.00 C ATOM 422 CZ TYR A 31 0.398 2.312 -15.951 1.00 0.00 C ATOM 423 OH TYR A 31 0.892 1.506 -16.930 1.00 0.00 O ATOM 0 H TYR A 31 1.298 4.224 -11.111 1.00 0.00 H new ATOM 0 HA TYR A 31 0.760 5.873 -12.575 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -1.824 4.280 -12.210 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -1.779 5.643 -13.310 1.00 0.00 H new ATOM 0 HD1 TYR A 31 0.951 3.173 -12.726 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -2.065 4.568 -15.394 1.00 0.00 H new ATOM 0 HE1 TYR A 31 1.865 1.676 -14.552 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -1.138 3.067 -17.212 1.00 0.00 H new ATOM 0 HH TYR A 31 0.356 1.613 -17.743 1.00 0.00 H new ATOM 432 N PRO A 32 0.181 7.478 -10.550 1.00 0.00 N ATOM 433 CA PRO A 32 -0.253 8.661 -9.827 1.00 0.00 C ATOM 434 C PRO A 32 -0.489 9.832 -10.782 1.00 0.00 C ATOM 435 O PRO A 32 0.176 9.942 -11.811 1.00 0.00 O ATOM 436 CB PRO A 32 0.849 8.931 -8.817 1.00 0.00 C ATOM 437 CG PRO A 32 2.069 8.175 -9.318 1.00 0.00 C ATOM 438 CD PRO A 32 1.606 7.203 -10.392 1.00 0.00 C ATOM 0 HA PRO A 32 -1.210 8.519 -9.324 1.00 0.00 H new ATOM 0 HB2 PRO A 32 1.055 9.999 -8.740 1.00 0.00 H new ATOM 0 HB3 PRO A 32 0.560 8.590 -7.823 1.00 0.00 H new ATOM 0 HG2 PRO A 32 2.808 8.867 -9.722 1.00 0.00 H new ATOM 0 HG3 PRO A 32 2.549 7.639 -8.499 1.00 0.00 H new ATOM 0 HD2 PRO A 32 2.145 7.359 -11.326 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.779 6.169 -10.092 1.00 0.00 H new ATOM 443 N PRO A 33 -1.463 10.699 -10.398 1.00 0.00 N ATOM 444 CA PRO A 33 -1.795 11.858 -11.208 1.00 0.00 C ATOM 445 C PRO A 33 -0.727 12.945 -11.074 1.00 0.00 C ATOM 446 O PRO A 33 0.180 12.831 -10.251 1.00 0.00 O ATOM 447 CB PRO A 33 -3.162 12.305 -10.715 1.00 0.00 C ATOM 448 CG PRO A 33 -3.338 11.671 -9.344 1.00 0.00 C ATOM 449 CD PRO A 33 -2.272 10.600 -9.186 1.00 0.00 C ATOM 0 HA PRO A 33 -1.825 11.631 -12.274 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -3.219 13.392 -10.653 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -3.948 11.983 -11.398 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -3.243 12.423 -8.561 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -4.333 11.236 -9.249 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -1.670 10.769 -8.293 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -2.717 9.610 -9.087 1.00 0.00 H new ATOM 454 N GLU A 34 -0.869 13.975 -11.895 1.00 0.00 N ATOM 455 CA GLU A 34 0.073 15.081 -11.880 1.00 0.00 C ATOM 456 C GLU A 34 -0.336 16.110 -10.823 1.00 0.00 C ATOM 457 O GLU A 34 -1.500 16.176 -10.433 1.00 0.00 O ATOM 458 CB GLU A 34 0.181 15.729 -13.261 1.00 0.00 C ATOM 459 CG GLU A 34 -1.205 16.003 -13.850 1.00 0.00 C ATOM 460 CD GLU A 34 -1.269 17.400 -14.472 1.00 0.00 C ATOM 461 OE1 GLU A 34 -0.566 17.603 -15.484 1.00 0.00 O ATOM 462 OE2 GLU A 34 -2.023 18.231 -13.921 1.00 0.00 O ATOM 0 H GLU A 34 -1.623 14.067 -12.576 1.00 0.00 H new ATOM 0 HA GLU A 34 1.057 14.691 -11.620 1.00 0.00 H new ATOM 0 HB2 GLU A 34 0.739 16.662 -13.186 1.00 0.00 H new ATOM 0 HB3 GLU A 34 0.741 15.076 -13.930 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -1.438 15.253 -14.606 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -1.960 15.913 -13.069 1.00 0.00 H new ATOM 467 N SER A 35 0.647 16.887 -10.390 1.00 0.00 N ATOM 468 CA SER A 35 0.404 17.908 -9.386 1.00 0.00 C ATOM 469 C SER A 35 -0.559 17.379 -8.321 1.00 0.00 C ATOM 470 O SER A 35 -1.379 18.128 -7.792 1.00 0.00 O ATOM 471 CB SER A 35 -0.157 19.183 -10.020 1.00 0.00 C ATOM 472 OG SER A 35 -0.459 20.177 -9.046 1.00 0.00 O ATOM 0 H SER A 35 1.612 16.830 -10.716 1.00 0.00 H new ATOM 0 HA SER A 35 1.356 18.156 -8.916 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.566 19.582 -10.732 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.059 18.941 -10.582 1.00 0.00 H new ATOM 0 HG SER A 35 -1.030 19.790 -8.350 1.00 0.00 H new ATOM 477 N ALA A 36 -0.429 16.091 -8.039 1.00 0.00 N ATOM 478 CA ALA A 36 -1.276 15.452 -7.047 1.00 0.00 C ATOM 479 C ALA A 36 -0.443 15.117 -5.808 1.00 0.00 C ATOM 480 O ALA A 36 -0.125 13.954 -5.565 1.00 0.00 O ATOM 481 CB ALA A 36 -1.934 14.214 -7.659 1.00 0.00 C ATOM 0 H ALA A 36 0.251 15.472 -8.481 1.00 0.00 H new ATOM 0 HA ALA A 36 -2.074 16.125 -6.734 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.570 13.734 -6.915 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.539 14.510 -8.516 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -1.163 13.515 -7.983 1.00 0.00 H new ATOM 487 N ILE A 37 -0.112 16.159 -5.058 1.00 0.00 N ATOM 488 CA ILE A 37 0.678 15.989 -3.850 1.00 0.00 C ATOM 489 C ILE A 37 -0.226 16.154 -2.626 1.00 0.00 C ATOM 490 O ILE A 37 -0.940 15.227 -2.247 1.00 0.00 O ATOM 491 CB ILE A 37 1.880 16.936 -3.860 1.00 0.00 C ATOM 492 CG1 ILE A 37 2.768 16.682 -5.078 1.00 0.00 C ATOM 493 CG2 ILE A 37 2.663 16.841 -2.548 1.00 0.00 C ATOM 494 CD1 ILE A 37 3.196 15.215 -5.149 1.00 0.00 C ATOM 0 H ILE A 37 -0.376 17.123 -5.263 1.00 0.00 H new ATOM 0 HA ILE A 37 1.094 14.983 -3.805 1.00 0.00 H new ATOM 0 HB ILE A 37 1.510 17.958 -3.941 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.230 16.952 -5.987 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.650 17.320 -5.028 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.512 17.524 -2.581 1.00 0.00 H new ATOM 0 HG22 ILE A 37 2.013 17.110 -1.716 1.00 0.00 H new ATOM 0 HG23 ILE A 37 3.023 15.821 -2.412 1.00 0.00 H new ATOM 0 HD11 ILE A 37 3.827 15.062 -6.025 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.754 14.955 -4.250 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.312 14.581 -5.223 1.00 0.00 H new ATOM 505 N GLN A 38 -0.166 17.341 -2.042 1.00 0.00 N ATOM 506 CA GLN A 38 -0.970 17.640 -0.869 1.00 0.00 C ATOM 507 C GLN A 38 -0.530 16.770 0.311 1.00 0.00 C ATOM 508 O GLN A 38 -1.212 15.809 0.665 1.00 0.00 O ATOM 509 CB GLN A 38 -2.459 17.453 -1.163 1.00 0.00 C ATOM 510 CG GLN A 38 -3.077 18.744 -1.706 1.00 0.00 C ATOM 511 CD GLN A 38 -2.488 19.101 -3.072 1.00 0.00 C ATOM 512 OE1 GLN A 38 -1.603 19.933 -3.198 1.00 0.00 O ATOM 513 NE2 GLN A 38 -3.024 18.428 -4.086 1.00 0.00 N ATOM 0 H GLN A 38 0.427 18.108 -2.359 1.00 0.00 H new ATOM 0 HA GLN A 38 -0.815 18.685 -0.602 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -2.592 16.649 -1.887 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -2.978 17.152 -0.253 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -4.157 18.627 -1.791 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -2.899 19.559 -1.005 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.762 17.745 -3.912 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -2.698 18.594 -5.038 1.00 0.00 H new ATOM 520 N PHE A 39 0.604 17.139 0.887 1.00 0.00 N ATOM 521 CA PHE A 39 1.142 16.403 2.019 1.00 0.00 C ATOM 522 C PHE A 39 0.806 17.105 3.337 1.00 0.00 C ATOM 523 O PHE A 39 0.553 18.309 3.357 1.00 0.00 O ATOM 524 CB PHE A 39 2.662 16.368 1.847 1.00 0.00 C ATOM 525 CG PHE A 39 3.330 15.144 2.476 1.00 0.00 C ATOM 526 CD1 PHE A 39 3.152 13.914 1.922 1.00 0.00 C ATOM 527 CD2 PHE A 39 4.103 15.284 3.586 1.00 0.00 C ATOM 528 CE1 PHE A 39 3.772 12.776 2.505 1.00 0.00 C ATOM 529 CE2 PHE A 39 4.722 14.147 4.168 1.00 0.00 C ATOM 530 CZ PHE A 39 4.544 12.917 3.616 1.00 0.00 C ATOM 0 H PHE A 39 1.165 17.938 0.592 1.00 0.00 H new ATOM 0 HA PHE A 39 0.713 15.402 2.051 1.00 0.00 H new ATOM 0 HB2 PHE A 39 2.898 16.392 0.783 1.00 0.00 H new ATOM 0 HB3 PHE A 39 3.088 17.269 2.288 1.00 0.00 H new ATOM 0 HD1 PHE A 39 2.540 13.803 1.039 1.00 0.00 H new ATOM 0 HD2 PHE A 39 4.246 16.260 4.025 1.00 0.00 H new ATOM 0 HE1 PHE A 39 3.630 11.799 2.066 1.00 0.00 H new ATOM 0 HE2 PHE A 39 5.335 14.259 5.050 1.00 0.00 H new ATOM 0 HZ PHE A 39 5.015 12.052 4.060 1.00 0.00 H new ATOM 539 N SER A 40 0.813 16.322 4.404 1.00 0.00 N ATOM 540 CA SER A 40 0.512 16.851 5.724 1.00 0.00 C ATOM 541 C SER A 40 1.809 17.109 6.494 1.00 0.00 C ATOM 542 O SER A 40 2.467 16.169 6.939 1.00 0.00 O ATOM 543 CB SER A 40 -0.390 15.898 6.508 1.00 0.00 C ATOM 544 OG SER A 40 -1.238 16.591 7.420 1.00 0.00 O ATOM 0 H SER A 40 1.022 15.324 4.382 1.00 0.00 H new ATOM 0 HA SER A 40 -0.022 17.793 5.600 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.000 15.322 5.812 1.00 0.00 H new ATOM 0 HB3 SER A 40 0.226 15.185 7.056 1.00 0.00 H new ATOM 0 HG SER A 40 -1.799 15.946 7.899 1.00 0.00 H new ATOM 549 N TYR A 41 2.139 18.385 6.627 1.00 0.00 N ATOM 550 CA TYR A 41 3.345 18.778 7.335 1.00 0.00 C ATOM 551 C TYR A 41 3.358 20.282 7.605 1.00 0.00 C ATOM 552 O TYR A 41 3.261 20.712 8.753 1.00 0.00 O ATOM 553 CB TYR A 41 4.511 18.427 6.408 1.00 0.00 C ATOM 554 CG TYR A 41 5.660 17.694 7.102 1.00 0.00 C ATOM 555 CD1 TYR A 41 5.536 16.356 7.414 1.00 0.00 C ATOM 556 CD2 TYR A 41 6.819 18.372 7.417 1.00 0.00 C ATOM 557 CE1 TYR A 41 6.619 15.666 8.068 1.00 0.00 C ATOM 558 CE2 TYR A 41 7.902 17.683 8.071 1.00 0.00 C ATOM 559 CZ TYR A 41 7.748 16.364 8.364 1.00 0.00 C ATOM 560 OH TYR A 41 8.770 15.713 8.982 1.00 0.00 O ATOM 0 H TYR A 41 1.591 19.161 6.256 1.00 0.00 H new ATOM 0 HA TYR A 41 3.408 18.270 8.297 1.00 0.00 H new ATOM 0 HB2 TYR A 41 4.139 17.807 5.592 1.00 0.00 H new ATOM 0 HB3 TYR A 41 4.896 19.344 5.962 1.00 0.00 H new ATOM 0 HD1 TYR A 41 4.628 15.826 7.168 1.00 0.00 H new ATOM 0 HD2 TYR A 41 6.915 19.420 7.173 1.00 0.00 H new ATOM 0 HE1 TYR A 41 6.536 14.618 8.317 1.00 0.00 H new ATOM 0 HE2 TYR A 41 8.815 18.202 8.323 1.00 0.00 H new ATOM 0 HH TYR A 41 9.512 16.336 9.131 1.00 0.00 H new ATOM 569 N LYS A 42 3.478 21.043 6.526 1.00 0.00 N ATOM 570 CA LYS A 42 3.504 22.493 6.633 1.00 0.00 C ATOM 571 C LYS A 42 2.275 23.074 5.929 1.00 0.00 C ATOM 572 O LYS A 42 2.405 23.881 5.011 1.00 0.00 O ATOM 573 CB LYS A 42 4.831 23.044 6.107 1.00 0.00 C ATOM 574 CG LYS A 42 5.467 23.999 7.118 1.00 0.00 C ATOM 575 CD LYS A 42 6.566 23.297 7.919 1.00 0.00 C ATOM 576 CE LYS A 42 7.706 24.265 8.251 1.00 0.00 C ATOM 577 NZ LYS A 42 7.519 24.838 9.602 1.00 0.00 N ATOM 0 H LYS A 42 3.558 20.684 5.575 1.00 0.00 H new ATOM 0 HA LYS A 42 3.449 22.800 7.678 1.00 0.00 H new ATOM 0 HB2 LYS A 42 5.514 22.220 5.900 1.00 0.00 H new ATOM 0 HB3 LYS A 42 4.664 23.565 5.164 1.00 0.00 H new ATOM 0 HG2 LYS A 42 5.885 24.860 6.597 1.00 0.00 H new ATOM 0 HG3 LYS A 42 4.703 24.378 7.797 1.00 0.00 H new ATOM 0 HD2 LYS A 42 6.147 22.893 8.841 1.00 0.00 H new ATOM 0 HD3 LYS A 42 6.955 22.454 7.348 1.00 0.00 H new ATOM 0 HE2 LYS A 42 8.661 23.743 8.200 1.00 0.00 H new ATOM 0 HE3 LYS A 42 7.740 25.065 7.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 8.300 25.492 9.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 6.616 25.353 9.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 7.510 24.072 10.306 1.00 0.00 H new ATOM 587 N ASP A 43 1.111 22.640 6.387 1.00 0.00 N ATOM 588 CA ASP A 43 -0.140 23.106 5.815 1.00 0.00 C ATOM 589 C ASP A 43 -1.104 23.482 6.943 1.00 0.00 C ATOM 590 O ASP A 43 -0.880 23.127 8.099 1.00 0.00 O ATOM 591 CB ASP A 43 -0.801 22.015 4.971 1.00 0.00 C ATOM 592 CG ASP A 43 -0.246 21.868 3.554 1.00 0.00 C ATOM 593 OD1 ASP A 43 0.886 21.350 3.438 1.00 0.00 O ATOM 594 OD2 ASP A 43 -0.965 22.277 2.617 1.00 0.00 O ATOM 0 H ASP A 43 1.008 21.970 7.149 1.00 0.00 H new ATOM 0 HA ASP A 43 0.079 23.967 5.183 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -0.693 21.061 5.488 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -1.869 22.224 4.907 1.00 0.00 H new ATOM 598 N GLU A 44 -2.158 24.191 6.566 1.00 0.00 N ATOM 599 CA GLU A 44 -3.156 24.617 7.531 1.00 0.00 C ATOM 600 C GLU A 44 -4.486 23.907 7.268 1.00 0.00 C ATOM 601 O GLU A 44 -4.782 23.540 6.132 1.00 0.00 O ATOM 602 CB GLU A 44 -3.333 26.137 7.504 1.00 0.00 C ATOM 603 CG GLU A 44 -4.607 26.556 8.238 1.00 0.00 C ATOM 604 CD GLU A 44 -4.478 26.312 9.743 1.00 0.00 C ATOM 605 OE1 GLU A 44 -3.664 27.028 10.365 1.00 0.00 O ATOM 606 OE2 GLU A 44 -5.197 25.418 10.237 1.00 0.00 O ATOM 0 H GLU A 44 -2.342 24.481 5.606 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.809 24.342 8.527 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.469 26.615 7.966 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.374 26.483 6.471 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.807 27.611 8.053 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -5.457 25.997 7.847 1.00 0.00 H new ATOM 611 N GLU A 45 -5.251 23.736 8.337 1.00 0.00 N ATOM 612 CA GLU A 45 -6.541 23.077 8.235 1.00 0.00 C ATOM 613 C GLU A 45 -7.302 23.585 7.009 1.00 0.00 C ATOM 614 O GLU A 45 -6.955 24.621 6.443 1.00 0.00 O ATOM 615 CB GLU A 45 -7.361 23.277 9.512 1.00 0.00 C ATOM 616 CG GLU A 45 -7.222 22.074 10.446 1.00 0.00 C ATOM 617 CD GLU A 45 -5.854 22.067 11.134 1.00 0.00 C ATOM 618 OE1 GLU A 45 -5.537 23.092 11.772 1.00 0.00 O ATOM 619 OE2 GLU A 45 -5.160 21.036 11.003 1.00 0.00 O ATOM 0 H GLU A 45 -5.002 24.043 9.277 1.00 0.00 H new ATOM 0 HA GLU A 45 -6.372 22.007 8.115 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -7.029 24.180 10.024 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -8.410 23.424 9.256 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.011 22.100 11.198 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -7.352 21.152 9.879 1.00 0.00 H new ATOM 624 N ASN A 46 -8.327 22.833 6.634 1.00 0.00 N ATOM 625 CA ASN A 46 -9.139 23.194 5.486 1.00 0.00 C ATOM 626 C ASN A 46 -8.242 23.337 4.255 1.00 0.00 C ATOM 627 O ASN A 46 -7.551 24.343 4.101 1.00 0.00 O ATOM 628 CB ASN A 46 -9.849 24.530 5.713 1.00 0.00 C ATOM 629 CG ASN A 46 -10.958 24.393 6.758 1.00 0.00 C ATOM 630 OD1 ASN A 46 -11.707 23.431 6.783 1.00 0.00 O ATOM 631 ND2 ASN A 46 -11.018 25.406 7.618 1.00 0.00 N ATOM 0 H ASN A 46 -8.613 21.975 7.106 1.00 0.00 H new ATOM 0 HA ASN A 46 -9.883 22.411 5.339 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -9.127 25.278 6.040 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -10.272 24.885 4.773 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -11.723 25.408 8.355 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -10.359 26.181 7.540 1.00 0.00 H new ATOM 637 N GLY A 47 -8.281 22.316 3.412 1.00 0.00 N ATOM 638 CA GLY A 47 -7.479 22.317 2.200 1.00 0.00 C ATOM 639 C GLY A 47 -7.788 23.542 1.338 1.00 0.00 C ATOM 640 O GLY A 47 -7.429 24.663 1.694 1.00 0.00 O ATOM 0 H GLY A 47 -8.855 21.483 3.544 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.421 22.309 2.460 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.674 21.409 1.630 1.00 0.00 H new ATOM 644 N ASN A 48 -8.451 23.286 0.219 1.00 0.00 N ATOM 645 CA ASN A 48 -8.813 24.355 -0.696 1.00 0.00 C ATOM 646 C ASN A 48 -9.939 23.875 -1.614 1.00 0.00 C ATOM 647 O ASN A 48 -10.996 24.500 -1.685 1.00 0.00 O ATOM 648 CB ASN A 48 -7.625 24.753 -1.575 1.00 0.00 C ATOM 649 CG ASN A 48 -7.848 26.126 -2.211 1.00 0.00 C ATOM 650 OD1 ASN A 48 -8.128 27.110 -1.544 1.00 0.00 O ATOM 651 ND2 ASN A 48 -7.711 26.139 -3.534 1.00 0.00 N ATOM 0 H ASN A 48 -8.746 22.355 -0.074 1.00 0.00 H new ATOM 0 HA ASN A 48 -9.128 25.214 -0.103 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -6.715 24.770 -0.976 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -7.480 24.006 -2.356 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -7.841 27.008 -4.052 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -7.476 25.280 -4.031 1.00 0.00 H new ATOM 657 N ARG A 49 -9.674 22.768 -2.294 1.00 0.00 N ATOM 658 CA ARG A 49 -10.653 22.198 -3.203 1.00 0.00 C ATOM 659 C ARG A 49 -10.442 20.687 -3.330 1.00 0.00 C ATOM 660 O ARG A 49 -9.437 20.155 -2.858 1.00 0.00 O ATOM 661 CB ARG A 49 -10.554 22.837 -4.591 1.00 0.00 C ATOM 662 CG ARG A 49 -11.819 23.634 -4.916 1.00 0.00 C ATOM 663 CD ARG A 49 -11.528 24.723 -5.950 1.00 0.00 C ATOM 664 NE ARG A 49 -12.679 24.872 -6.868 1.00 0.00 N ATOM 665 CZ ARG A 49 -12.655 25.599 -7.992 1.00 0.00 C ATOM 666 NH1 ARG A 49 -11.539 26.249 -8.346 1.00 0.00 N ATOM 667 NH2 ARG A 49 -13.749 25.678 -8.764 1.00 0.00 N ATOM 0 H ARG A 49 -8.796 22.252 -2.233 1.00 0.00 H new ATOM 0 HA ARG A 49 -11.643 22.398 -2.792 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -9.685 23.494 -4.632 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -10.404 22.062 -5.343 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -12.589 22.963 -5.296 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -12.212 24.087 -4.006 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -11.329 25.669 -5.447 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -10.632 24.468 -6.516 1.00 0.00 H new ATOM 0 HE ARG A 49 -13.546 24.390 -6.629 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -10.707 26.190 -7.759 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -11.521 26.803 -9.202 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -14.600 25.184 -8.495 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -13.730 26.232 -9.620 1.00 0.00 H new ATOM 678 N GLY A 50 -11.404 20.038 -3.969 1.00 0.00 N ATOM 679 CA GLY A 50 -11.335 18.600 -4.164 1.00 0.00 C ATOM 680 C GLY A 50 -12.114 18.178 -5.412 1.00 0.00 C ATOM 681 O GLY A 50 -11.789 18.596 -6.521 1.00 0.00 O ATOM 0 H GLY A 50 -12.236 20.482 -4.358 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -10.294 18.292 -4.259 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -11.739 18.091 -3.289 1.00 0.00 H new ATOM 685 N GLY A 51 -13.127 17.355 -5.188 1.00 0.00 N ATOM 686 CA GLY A 51 -13.955 16.871 -6.280 1.00 0.00 C ATOM 687 C GLY A 51 -13.192 15.862 -7.140 1.00 0.00 C ATOM 688 O GLY A 51 -11.964 15.815 -7.106 1.00 0.00 O ATOM 0 H GLY A 51 -13.394 17.010 -4.266 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -14.856 16.406 -5.880 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -14.277 17.710 -6.897 1.00 0.00 H new ATOM 692 N LYS A 52 -13.952 15.080 -7.893 1.00 0.00 N ATOM 693 CA LYS A 52 -13.362 14.075 -8.762 1.00 0.00 C ATOM 694 C LYS A 52 -14.469 13.399 -9.574 1.00 0.00 C ATOM 695 O LYS A 52 -15.478 12.968 -9.020 1.00 0.00 O ATOM 696 CB LYS A 52 -12.511 13.097 -7.949 1.00 0.00 C ATOM 697 CG LYS A 52 -11.038 13.192 -8.347 1.00 0.00 C ATOM 698 CD LYS A 52 -10.152 12.445 -7.347 1.00 0.00 C ATOM 699 CE LYS A 52 -9.197 13.406 -6.636 1.00 0.00 C ATOM 700 NZ LYS A 52 -8.071 12.663 -6.027 1.00 0.00 N ATOM 0 H LYS A 52 -14.971 15.122 -7.919 1.00 0.00 H new ATOM 0 HA LYS A 52 -12.680 14.539 -9.474 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -12.619 13.312 -6.886 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -12.869 12.080 -8.106 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -10.899 12.775 -9.344 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -10.737 14.239 -8.395 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -10.776 11.937 -6.612 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -9.580 11.676 -7.866 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -8.815 14.139 -7.346 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -9.735 13.958 -5.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -7.433 13.331 -5.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -8.440 11.980 -5.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -7.548 12.156 -6.769 1.00 0.00 H new ATOM 710 N GLN A 53 -14.241 13.328 -10.877 1.00 0.00 N ATOM 711 CA GLN A 53 -15.205 12.711 -11.775 1.00 0.00 C ATOM 712 C GLN A 53 -15.124 11.187 -11.673 1.00 0.00 C ATOM 713 O GLN A 53 -14.385 10.654 -10.845 1.00 0.00 O ATOM 714 CB GLN A 53 -14.989 13.178 -13.216 1.00 0.00 C ATOM 715 CG GLN A 53 -15.999 14.262 -13.598 1.00 0.00 C ATOM 716 CD GLN A 53 -15.289 15.529 -14.075 1.00 0.00 C ATOM 717 OE1 GLN A 53 -14.947 15.681 -15.236 1.00 0.00 O ATOM 718 NE2 GLN A 53 -15.085 16.428 -13.116 1.00 0.00 N ATOM 0 H GLN A 53 -13.403 13.687 -11.334 1.00 0.00 H new ATOM 0 HA GLN A 53 -16.205 13.023 -11.474 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -13.976 13.564 -13.329 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -15.085 12.331 -13.895 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -16.656 13.891 -14.385 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -16.629 14.495 -12.740 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -15.397 16.238 -12.164 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -14.617 17.308 -13.333 1.00 0.00 H new ATOM 725 N ARG A 54 -15.895 10.528 -12.525 1.00 0.00 N ATOM 726 CA ARG A 54 -15.920 9.075 -12.542 1.00 0.00 C ATOM 727 C ARG A 54 -15.780 8.558 -13.976 1.00 0.00 C ATOM 728 O ARG A 54 -16.498 7.646 -14.384 1.00 0.00 O ATOM 729 CB ARG A 54 -17.220 8.540 -11.939 1.00 0.00 C ATOM 730 CG ARG A 54 -18.434 9.043 -12.721 1.00 0.00 C ATOM 731 CD ARG A 54 -19.738 8.561 -12.080 1.00 0.00 C ATOM 732 NE ARG A 54 -20.898 9.058 -12.855 1.00 0.00 N ATOM 733 CZ ARG A 54 -21.331 10.325 -12.828 1.00 0.00 C ATOM 734 NH1 ARG A 54 -20.703 11.232 -12.065 1.00 0.00 N ATOM 735 NH2 ARG A 54 -22.391 10.687 -13.563 1.00 0.00 N ATOM 0 H ARG A 54 -16.507 10.973 -13.209 1.00 0.00 H new ATOM 0 HA ARG A 54 -15.082 8.722 -11.942 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -17.206 7.450 -11.944 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -17.298 8.853 -10.898 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -18.423 10.132 -12.756 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -18.379 8.691 -13.751 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -19.754 7.472 -12.044 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -19.799 8.915 -11.051 1.00 0.00 H new ATOM 0 HE ARG A 54 -21.398 8.394 -13.446 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -19.896 10.957 -11.506 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -21.033 12.197 -12.044 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -22.869 9.997 -14.143 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -22.720 11.652 -13.542 1.00 0.00 H new ATOM 746 N ASN A 55 -14.851 9.164 -14.701 1.00 0.00 N ATOM 747 CA ASN A 55 -14.607 8.776 -16.079 1.00 0.00 C ATOM 748 C ASN A 55 -13.100 8.675 -16.318 1.00 0.00 C ATOM 749 O ASN A 55 -12.435 9.684 -16.543 1.00 0.00 O ATOM 750 CB ASN A 55 -15.171 9.814 -17.051 1.00 0.00 C ATOM 751 CG ASN A 55 -15.713 9.145 -18.316 1.00 0.00 C ATOM 752 OD1 ASN A 55 -15.033 8.389 -18.990 1.00 0.00 O ATOM 753 ND2 ASN A 55 -16.973 9.465 -18.600 1.00 0.00 N ATOM 0 H ASN A 55 -14.259 9.921 -14.360 1.00 0.00 H new ATOM 0 HA ASN A 55 -15.096 7.817 -16.250 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -15.967 10.378 -16.564 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -14.392 10.528 -17.318 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -17.426 9.071 -19.424 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -17.486 10.105 -17.993 1.00 0.00 H new ATOM 759 N ARG A 56 -12.605 7.448 -16.261 1.00 0.00 N ATOM 760 CA ARG A 56 -11.187 7.201 -16.467 1.00 0.00 C ATOM 761 C ARG A 56 -10.895 5.701 -16.409 1.00 0.00 C ATOM 762 O ARG A 56 -11.713 4.924 -15.919 1.00 0.00 O ATOM 763 CB ARG A 56 -10.344 7.920 -15.413 1.00 0.00 C ATOM 764 CG ARG A 56 -9.488 9.016 -16.049 1.00 0.00 C ATOM 765 CD ARG A 56 -8.520 8.429 -17.077 1.00 0.00 C ATOM 766 NE ARG A 56 -7.598 9.480 -17.564 1.00 0.00 N ATOM 767 CZ ARG A 56 -6.755 9.322 -18.592 1.00 0.00 C ATOM 768 NH1 ARG A 56 -6.710 8.155 -19.250 1.00 0.00 N ATOM 769 NH2 ARG A 56 -5.955 10.331 -18.964 1.00 0.00 N ATOM 0 H ARG A 56 -13.160 6.613 -16.075 1.00 0.00 H new ATOM 0 HA ARG A 56 -10.923 7.587 -17.451 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -10.996 8.356 -14.656 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.702 7.201 -14.904 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.132 9.752 -16.530 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -8.928 9.540 -15.275 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.951 7.614 -16.629 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.077 8.007 -17.913 1.00 0.00 H new ATOM 0 HE ARG A 56 -7.606 10.381 -17.086 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -7.318 7.387 -18.968 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -6.067 8.036 -20.033 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -5.988 11.219 -18.464 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -5.313 10.210 -19.747 1.00 0.00 H new ATOM 780 N LEU A 57 -9.726 5.338 -16.915 1.00 0.00 N ATOM 781 CA LEU A 57 -9.316 3.943 -16.927 1.00 0.00 C ATOM 782 C LEU A 57 -8.032 3.788 -16.108 1.00 0.00 C ATOM 783 O LEU A 57 -7.513 4.765 -15.570 1.00 0.00 O ATOM 784 CB LEU A 57 -9.194 3.432 -18.363 1.00 0.00 C ATOM 785 CG LEU A 57 -10.386 2.634 -18.893 1.00 0.00 C ATOM 786 CD1 LEU A 57 -11.608 3.535 -19.086 1.00 0.00 C ATOM 787 CD2 LEU A 57 -10.018 1.886 -20.177 1.00 0.00 C ATOM 0 H LEU A 57 -9.049 5.985 -17.320 1.00 0.00 H new ATOM 0 HA LEU A 57 -10.075 3.319 -16.455 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -9.033 4.287 -19.020 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -8.304 2.806 -18.431 1.00 0.00 H new ATOM 0 HG LEU A 57 -10.653 1.884 -18.148 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -12.441 2.942 -19.464 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -11.884 3.983 -18.131 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -11.370 4.323 -19.801 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -10.883 1.327 -20.533 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -9.710 2.602 -20.939 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -9.198 1.197 -19.974 1.00 0.00 H new ATOM 798 N GLU A 58 -7.560 2.551 -16.038 1.00 0.00 N ATOM 799 CA GLU A 58 -6.348 2.255 -15.294 1.00 0.00 C ATOM 800 C GLU A 58 -6.009 0.767 -15.400 1.00 0.00 C ATOM 801 O GLU A 58 -6.884 -0.053 -15.671 1.00 0.00 O ATOM 802 CB GLU A 58 -6.484 2.684 -13.830 1.00 0.00 C ATOM 803 CG GLU A 58 -7.095 1.562 -12.986 1.00 0.00 C ATOM 804 CD GLU A 58 -7.160 1.961 -11.511 1.00 0.00 C ATOM 805 OE1 GLU A 58 -6.073 2.119 -10.917 1.00 0.00 O ATOM 806 OE2 GLU A 58 -8.298 2.101 -11.011 1.00 0.00 O ATOM 0 H GLU A 58 -7.995 1.743 -16.484 1.00 0.00 H new ATOM 0 HA GLU A 58 -5.529 2.826 -15.731 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.505 2.951 -13.433 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.108 3.575 -13.765 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.097 1.333 -13.349 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -6.501 0.655 -13.095 1.00 0.00 H new ATOM 811 N PRO A 59 -4.705 0.457 -15.176 1.00 0.00 N ATOM 812 CA PRO A 59 -4.240 -0.918 -15.244 1.00 0.00 C ATOM 813 C PRO A 59 -4.676 -1.707 -14.008 1.00 0.00 C ATOM 814 O PRO A 59 -5.370 -2.716 -14.123 1.00 0.00 O ATOM 815 CB PRO A 59 -2.729 -0.817 -15.382 1.00 0.00 C ATOM 816 CG PRO A 59 -2.362 0.584 -14.919 1.00 0.00 C ATOM 817 CD PRO A 59 -3.640 1.403 -14.851 1.00 0.00 C ATOM 0 HA PRO A 59 -4.668 -1.465 -16.084 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -2.230 -1.572 -14.775 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -2.419 -0.981 -16.414 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -1.879 0.549 -13.943 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -1.653 1.040 -15.609 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -3.782 1.834 -13.860 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -3.617 2.232 -15.558 1.00 0.00 H new ATOM 822 N MET A 60 -4.253 -1.216 -12.853 1.00 0.00 N ATOM 823 CA MET A 60 -4.592 -1.861 -11.596 1.00 0.00 C ATOM 824 C MET A 60 -4.327 -0.931 -10.412 1.00 0.00 C ATOM 825 O MET A 60 -3.656 0.090 -10.558 1.00 0.00 O ATOM 826 CB MET A 60 -3.761 -3.136 -11.437 1.00 0.00 C ATOM 827 CG MET A 60 -4.429 -4.317 -12.143 1.00 0.00 C ATOM 828 SD MET A 60 -4.288 -5.788 -11.141 1.00 0.00 S ATOM 829 CE MET A 60 -3.887 -6.986 -12.402 1.00 0.00 C ATOM 0 H MET A 60 -3.678 -0.378 -12.761 1.00 0.00 H new ATOM 0 HA MET A 60 -5.654 -2.106 -11.611 1.00 0.00 H new ATOM 0 HB2 MET A 60 -2.764 -2.978 -11.848 1.00 0.00 H new ATOM 0 HB3 MET A 60 -3.637 -3.364 -10.378 1.00 0.00 H new ATOM 0 HG2 MET A 60 -5.479 -4.093 -12.329 1.00 0.00 H new ATOM 0 HG3 MET A 60 -3.962 -4.482 -13.114 1.00 0.00 H new ATOM 0 HE1 MET A 60 -3.764 -7.968 -11.945 1.00 0.00 H new ATOM 0 HE2 MET A 60 -4.692 -7.026 -13.135 1.00 0.00 H new ATOM 0 HE3 MET A 60 -2.960 -6.697 -12.897 1.00 0.00 H new ATOM 837 N ASP A 61 -4.871 -1.314 -9.265 1.00 0.00 N ATOM 838 CA ASP A 61 -4.702 -0.524 -8.057 1.00 0.00 C ATOM 839 C ASP A 61 -4.760 -1.448 -6.839 1.00 0.00 C ATOM 840 O ASP A 61 -5.828 -1.663 -6.269 1.00 0.00 O ATOM 841 CB ASP A 61 -5.817 0.514 -7.917 1.00 0.00 C ATOM 842 CG ASP A 61 -7.181 0.075 -8.454 1.00 0.00 C ATOM 843 OD1 ASP A 61 -7.199 -0.457 -9.586 1.00 0.00 O ATOM 844 OD2 ASP A 61 -8.172 0.281 -7.723 1.00 0.00 O ATOM 0 H ASP A 61 -5.428 -2.160 -9.147 1.00 0.00 H new ATOM 0 HA ASP A 61 -3.741 -0.014 -8.118 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -5.924 0.770 -6.863 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -5.514 1.423 -8.437 1.00 0.00 H new ATOM 848 N THR A 62 -3.598 -1.969 -6.475 1.00 0.00 N ATOM 849 CA THR A 62 -3.502 -2.864 -5.334 1.00 0.00 C ATOM 850 C THR A 62 -2.196 -2.623 -4.574 1.00 0.00 C ATOM 851 O THR A 62 -1.281 -1.988 -5.094 1.00 0.00 O ATOM 852 CB THR A 62 -3.652 -4.298 -5.844 1.00 0.00 C ATOM 853 OG1 THR A 62 -4.829 -4.261 -6.647 1.00 0.00 O ATOM 854 CG2 THR A 62 -3.994 -5.285 -4.727 1.00 0.00 C ATOM 0 H THR A 62 -2.714 -1.788 -6.950 1.00 0.00 H new ATOM 0 HA THR A 62 -4.299 -2.674 -4.615 1.00 0.00 H new ATOM 0 HB THR A 62 -2.727 -4.607 -6.331 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.999 -5.152 -7.019 1.00 0.00 H new ATOM 0 HG21 THR A 62 -4.089 -6.288 -5.144 1.00 0.00 H new ATOM 0 HG22 THR A 62 -3.201 -5.277 -3.979 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.936 -4.995 -4.261 1.00 0.00 H new ATOM 862 N ILE A 63 -2.154 -3.143 -3.357 1.00 0.00 N ATOM 863 CA ILE A 63 -0.976 -2.993 -2.519 1.00 0.00 C ATOM 864 C ILE A 63 -0.423 -4.376 -2.169 1.00 0.00 C ATOM 865 O ILE A 63 -1.186 -5.301 -1.893 1.00 0.00 O ATOM 866 CB ILE A 63 -1.293 -2.129 -1.297 1.00 0.00 C ATOM 867 CG1 ILE A 63 -1.569 -0.681 -1.705 1.00 0.00 C ATOM 868 CG2 ILE A 63 -0.180 -2.228 -0.251 1.00 0.00 C ATOM 869 CD1 ILE A 63 -3.002 -0.275 -1.350 1.00 0.00 C ATOM 0 H ILE A 63 -2.917 -3.669 -2.930 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.191 -2.464 -3.059 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.203 -2.512 -0.836 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.864 -0.017 -1.204 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.409 -0.565 -2.777 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -0.431 -1.604 0.607 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.075 -3.264 0.072 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.759 -1.886 -0.686 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.172 0.759 -1.651 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -3.704 -0.925 -1.872 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -3.151 -0.369 -0.274 1.00 0.00 H new ATOM 880 N PHE A 64 0.897 -4.475 -2.190 1.00 0.00 N ATOM 881 CA PHE A 64 1.559 -5.730 -1.879 1.00 0.00 C ATOM 882 C PHE A 64 2.749 -5.504 -0.943 1.00 0.00 C ATOM 883 O PHE A 64 3.496 -4.539 -1.104 1.00 0.00 O ATOM 884 CB PHE A 64 2.068 -6.308 -3.201 1.00 0.00 C ATOM 885 CG PHE A 64 0.985 -6.986 -4.041 1.00 0.00 C ATOM 886 CD1 PHE A 64 0.055 -6.234 -4.688 1.00 0.00 C ATOM 887 CD2 PHE A 64 0.951 -8.342 -4.140 1.00 0.00 C ATOM 888 CE1 PHE A 64 -0.950 -6.863 -5.468 1.00 0.00 C ATOM 889 CE2 PHE A 64 -0.055 -8.972 -4.920 1.00 0.00 C ATOM 890 CZ PHE A 64 -0.984 -8.219 -5.568 1.00 0.00 C ATOM 0 H PHE A 64 1.527 -3.706 -2.418 1.00 0.00 H new ATOM 0 HA PHE A 64 0.862 -6.405 -1.382 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.519 -5.507 -3.786 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.856 -7.031 -2.990 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.081 -5.157 -4.608 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.689 -8.940 -3.626 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.688 -6.265 -5.982 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.082 -10.049 -4.999 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.749 -8.698 -6.162 1.00 0.00 H new ATOM 899 N VAL A 65 2.889 -6.409 0.014 1.00 0.00 N ATOM 900 CA VAL A 65 3.974 -6.321 0.975 1.00 0.00 C ATOM 901 C VAL A 65 5.307 -6.526 0.251 1.00 0.00 C ATOM 902 O VAL A 65 5.418 -7.385 -0.621 1.00 0.00 O ATOM 903 CB VAL A 65 3.751 -7.321 2.111 1.00 0.00 C ATOM 904 CG1 VAL A 65 5.018 -7.492 2.950 1.00 0.00 C ATOM 905 CG2 VAL A 65 2.566 -6.903 2.984 1.00 0.00 C ATOM 0 H VAL A 65 2.268 -7.208 0.144 1.00 0.00 H new ATOM 0 HA VAL A 65 4.000 -5.332 1.432 1.00 0.00 H new ATOM 0 HB VAL A 65 3.514 -8.287 1.665 1.00 0.00 H new ATOM 0 HG11 VAL A 65 4.831 -8.208 3.750 1.00 0.00 H new ATOM 0 HG12 VAL A 65 5.827 -7.858 2.317 1.00 0.00 H new ATOM 0 HG13 VAL A 65 5.301 -6.532 3.381 1.00 0.00 H new ATOM 0 HG21 VAL A 65 2.429 -7.631 3.784 1.00 0.00 H new ATOM 0 HG22 VAL A 65 2.761 -5.921 3.416 1.00 0.00 H new ATOM 0 HG23 VAL A 65 1.663 -6.859 2.375 1.00 0.00 H new ATOM 915 N LYS A 66 6.285 -5.722 0.643 1.00 0.00 N ATOM 916 CA LYS A 66 7.607 -5.804 0.043 1.00 0.00 C ATOM 917 C LYS A 66 8.487 -6.733 0.883 1.00 0.00 C ATOM 918 O LYS A 66 9.056 -7.691 0.364 1.00 0.00 O ATOM 919 CB LYS A 66 8.196 -4.404 -0.149 1.00 0.00 C ATOM 920 CG LYS A 66 9.625 -4.481 -0.690 1.00 0.00 C ATOM 921 CD LYS A 66 10.626 -3.932 0.328 1.00 0.00 C ATOM 922 CE LYS A 66 11.698 -3.083 -0.359 1.00 0.00 C ATOM 923 NZ LYS A 66 12.931 -3.874 -0.566 1.00 0.00 N ATOM 0 H LYS A 66 6.189 -5.011 1.368 1.00 0.00 H new ATOM 0 HA LYS A 66 7.547 -6.238 -0.955 1.00 0.00 H new ATOM 0 HB2 LYS A 66 7.572 -3.834 -0.838 1.00 0.00 H new ATOM 0 HB3 LYS A 66 8.191 -3.870 0.801 1.00 0.00 H new ATOM 0 HG2 LYS A 66 9.873 -5.516 -0.928 1.00 0.00 H new ATOM 0 HG3 LYS A 66 9.697 -3.915 -1.619 1.00 0.00 H new ATOM 0 HD2 LYS A 66 10.102 -3.331 1.071 1.00 0.00 H new ATOM 0 HD3 LYS A 66 11.097 -4.758 0.861 1.00 0.00 H new ATOM 0 HE2 LYS A 66 11.325 -2.722 -1.318 1.00 0.00 H new ATOM 0 HE3 LYS A 66 11.920 -2.205 0.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 13.648 -3.283 -1.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 13.294 -4.198 0.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 12.719 -4.698 -1.164 1.00 0.00 H new ATOM 933 N GLN A 67 8.571 -6.414 2.167 1.00 0.00 N ATOM 934 CA GLN A 67 9.372 -7.205 3.083 1.00 0.00 C ATOM 935 C GLN A 67 8.800 -7.119 4.499 1.00 0.00 C ATOM 936 O GLN A 67 7.884 -6.340 4.756 1.00 0.00 O ATOM 937 CB GLN A 67 10.837 -6.763 3.055 1.00 0.00 C ATOM 938 CG GLN A 67 11.625 -7.542 2.001 1.00 0.00 C ATOM 939 CD GLN A 67 12.945 -8.062 2.575 1.00 0.00 C ATOM 940 OE1 GLN A 67 13.060 -9.197 3.004 1.00 0.00 O ATOM 941 NE2 GLN A 67 13.930 -7.168 2.560 1.00 0.00 N ATOM 0 H GLN A 67 8.097 -5.618 2.593 1.00 0.00 H new ATOM 0 HA GLN A 67 9.335 -8.245 2.760 1.00 0.00 H new ATOM 0 HB2 GLN A 67 10.894 -5.696 2.842 1.00 0.00 H new ATOM 0 HB3 GLN A 67 11.286 -6.916 4.036 1.00 0.00 H new ATOM 0 HG2 GLN A 67 11.027 -8.379 1.640 1.00 0.00 H new ATOM 0 HG3 GLN A 67 11.825 -6.900 1.143 1.00 0.00 H new ATOM 0 HE21 GLN A 67 13.765 -6.234 2.186 1.00 0.00 H new ATOM 0 HE22 GLN A 67 14.850 -7.417 2.923 1.00 0.00 H new ATOM 948 N VAL A 68 9.364 -7.931 5.382 1.00 0.00 N ATOM 949 CA VAL A 68 8.922 -7.955 6.765 1.00 0.00 C ATOM 950 C VAL A 68 10.140 -7.879 7.687 1.00 0.00 C ATOM 951 O VAL A 68 11.077 -8.662 7.549 1.00 0.00 O ATOM 952 CB VAL A 68 8.058 -9.193 7.017 1.00 0.00 C ATOM 953 CG1 VAL A 68 7.698 -9.318 8.499 1.00 0.00 C ATOM 954 CG2 VAL A 68 6.800 -9.170 6.146 1.00 0.00 C ATOM 0 H VAL A 68 10.123 -8.577 5.166 1.00 0.00 H new ATOM 0 HA VAL A 68 8.297 -7.089 6.981 1.00 0.00 H new ATOM 0 HB VAL A 68 8.641 -10.071 6.739 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.084 -10.206 8.651 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.610 -9.403 9.089 1.00 0.00 H new ATOM 0 HG13 VAL A 68 7.143 -8.435 8.814 1.00 0.00 H new ATOM 0 HG21 VAL A 68 6.204 -10.061 6.344 1.00 0.00 H new ATOM 0 HG22 VAL A 68 6.213 -8.281 6.378 1.00 0.00 H new ATOM 0 HG23 VAL A 68 7.086 -9.152 5.094 1.00 0.00 H new ATOM 964 N LYS A 69 10.086 -6.927 8.609 1.00 0.00 N ATOM 965 CA LYS A 69 11.174 -6.738 9.553 1.00 0.00 C ATOM 966 C LYS A 69 11.210 -7.919 10.526 1.00 0.00 C ATOM 967 O LYS A 69 10.288 -8.104 11.319 1.00 0.00 O ATOM 968 CB LYS A 69 11.054 -5.378 10.243 1.00 0.00 C ATOM 969 CG LYS A 69 11.622 -5.430 11.663 1.00 0.00 C ATOM 970 CD LYS A 69 13.130 -5.686 11.640 1.00 0.00 C ATOM 971 CE LYS A 69 13.729 -5.559 13.042 1.00 0.00 C ATOM 972 NZ LYS A 69 15.202 -5.700 12.991 1.00 0.00 N ATOM 0 H LYS A 69 9.306 -6.279 8.721 1.00 0.00 H new ATOM 0 HA LYS A 69 12.132 -6.723 9.032 1.00 0.00 H new ATOM 0 HB2 LYS A 69 11.585 -4.624 9.663 1.00 0.00 H new ATOM 0 HB3 LYS A 69 10.008 -5.075 10.277 1.00 0.00 H new ATOM 0 HG2 LYS A 69 11.417 -4.490 12.175 1.00 0.00 H new ATOM 0 HG3 LYS A 69 11.124 -6.217 12.229 1.00 0.00 H new ATOM 0 HD2 LYS A 69 13.327 -6.683 11.245 1.00 0.00 H new ATOM 0 HD3 LYS A 69 13.613 -4.976 10.969 1.00 0.00 H new ATOM 0 HE2 LYS A 69 13.465 -4.592 13.471 1.00 0.00 H new ATOM 0 HE3 LYS A 69 13.307 -6.323 13.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 15.593 -5.611 13.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 15.448 -6.632 12.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 15.601 -4.955 12.385 1.00 0.00 H new ATOM 982 N GLU A 70 12.285 -8.687 10.432 1.00 0.00 N ATOM 983 CA GLU A 70 12.453 -9.846 11.293 1.00 0.00 C ATOM 984 C GLU A 70 12.606 -9.405 12.752 1.00 0.00 C ATOM 985 O GLU A 70 13.716 -9.137 13.209 1.00 0.00 O ATOM 986 CB GLU A 70 13.649 -10.691 10.849 1.00 0.00 C ATOM 987 CG GLU A 70 13.596 -12.088 11.470 1.00 0.00 C ATOM 988 CD GLU A 70 14.512 -13.058 10.723 1.00 0.00 C ATOM 989 OE1 GLU A 70 15.708 -13.100 11.084 1.00 0.00 O ATOM 990 OE2 GLU A 70 13.997 -13.733 9.806 1.00 0.00 O ATOM 0 H GLU A 70 13.048 -8.530 9.774 1.00 0.00 H new ATOM 0 HA GLU A 70 11.561 -10.467 11.212 1.00 0.00 H new ATOM 0 HB2 GLU A 70 13.657 -10.773 9.762 1.00 0.00 H new ATOM 0 HB3 GLU A 70 14.576 -10.196 11.138 1.00 0.00 H new ATOM 0 HG2 GLU A 70 13.894 -12.035 12.517 1.00 0.00 H new ATOM 0 HG3 GLU A 70 12.572 -12.460 11.448 1.00 0.00 H new ATOM 995 N GLY A 71 11.475 -9.345 13.440 1.00 0.00 N ATOM 996 CA GLY A 71 11.468 -8.943 14.836 1.00 0.00 C ATOM 997 C GLY A 71 10.774 -7.592 15.012 1.00 0.00 C ATOM 998 O GLY A 71 11.083 -6.847 15.941 1.00 0.00 O ATOM 0 H GLY A 71 10.557 -9.568 13.056 1.00 0.00 H new ATOM 0 HA2 GLY A 71 10.958 -9.699 15.434 1.00 0.00 H new ATOM 0 HA3 GLY A 71 12.491 -8.881 15.206 1.00 0.00 H new ATOM 1002 N GLY A 72 9.847 -7.315 14.106 1.00 0.00 N ATOM 1003 CA GLY A 72 9.104 -6.066 14.152 1.00 0.00 C ATOM 1004 C GLY A 72 7.642 -6.311 14.529 1.00 0.00 C ATOM 1005 O GLY A 72 7.306 -7.357 15.082 1.00 0.00 O ATOM 0 H GLY A 72 9.593 -7.934 13.336 1.00 0.00 H new ATOM 0 HA2 GLY A 72 9.562 -5.393 14.877 1.00 0.00 H new ATOM 0 HA3 GLY A 72 9.155 -5.572 13.182 1.00 0.00 H new ATOM 1009 N PRO A 73 6.789 -5.302 14.206 1.00 0.00 N ATOM 1010 CA PRO A 73 5.370 -5.397 14.506 1.00 0.00 C ATOM 1011 C PRO A 73 4.668 -6.349 13.534 1.00 0.00 C ATOM 1012 O PRO A 73 4.123 -7.372 13.947 1.00 0.00 O ATOM 1013 CB PRO A 73 4.853 -3.972 14.417 1.00 0.00 C ATOM 1014 CG PRO A 73 5.894 -3.199 13.621 1.00 0.00 C ATOM 1015 CD PRO A 73 7.151 -4.050 13.549 1.00 0.00 C ATOM 0 HA PRO A 73 5.176 -5.816 15.493 1.00 0.00 H new ATOM 0 HB2 PRO A 73 3.881 -3.939 13.924 1.00 0.00 H new ATOM 0 HB3 PRO A 73 4.722 -3.542 15.410 1.00 0.00 H new ATOM 0 HG2 PRO A 73 5.524 -2.980 12.620 1.00 0.00 H new ATOM 0 HG3 PRO A 73 6.107 -2.243 14.099 1.00 0.00 H new ATOM 0 HD2 PRO A 73 7.456 -4.219 12.516 1.00 0.00 H new ATOM 0 HD3 PRO A 73 7.987 -3.565 14.054 1.00 0.00 H new ATOM 1020 N ALA A 74 4.704 -5.979 12.263 1.00 0.00 N ATOM 1021 CA ALA A 74 4.077 -6.787 11.230 1.00 0.00 C ATOM 1022 C ALA A 74 4.432 -8.258 11.453 1.00 0.00 C ATOM 1023 O ALA A 74 3.551 -9.114 11.495 1.00 0.00 O ATOM 1024 CB ALA A 74 4.514 -6.284 9.853 1.00 0.00 C ATOM 0 H ALA A 74 5.157 -5.130 11.924 1.00 0.00 H new ATOM 0 HA ALA A 74 2.992 -6.699 11.280 1.00 0.00 H new ATOM 0 HB1 ALA A 74 4.044 -6.890 9.078 1.00 0.00 H new ATOM 0 HB2 ALA A 74 4.212 -5.244 9.733 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.598 -6.360 9.765 1.00 0.00 H new ATOM 1030 N PHE A 75 5.727 -8.506 11.590 1.00 0.00 N ATOM 1031 CA PHE A 75 6.210 -9.859 11.809 1.00 0.00 C ATOM 1032 C PHE A 75 5.412 -10.555 12.914 1.00 0.00 C ATOM 1033 O PHE A 75 4.992 -11.700 12.754 1.00 0.00 O ATOM 1034 CB PHE A 75 7.672 -9.747 12.247 1.00 0.00 C ATOM 1035 CG PHE A 75 8.232 -11.022 12.880 1.00 0.00 C ATOM 1036 CD1 PHE A 75 8.271 -12.177 12.163 1.00 0.00 C ATOM 1037 CD2 PHE A 75 8.691 -11.001 14.160 1.00 0.00 C ATOM 1038 CE1 PHE A 75 8.790 -13.361 12.751 1.00 0.00 C ATOM 1039 CE2 PHE A 75 9.211 -12.183 14.748 1.00 0.00 C ATOM 1040 CZ PHE A 75 9.249 -13.339 14.032 1.00 0.00 C ATOM 0 H PHE A 75 6.456 -7.793 11.554 1.00 0.00 H new ATOM 0 HA PHE A 75 6.102 -10.444 10.896 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.281 -9.486 11.381 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.765 -8.928 12.961 1.00 0.00 H new ATOM 0 HD1 PHE A 75 7.907 -12.194 11.146 1.00 0.00 H new ATOM 0 HD2 PHE A 75 8.660 -10.084 14.729 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.820 -14.278 12.182 1.00 0.00 H new ATOM 0 HE2 PHE A 75 9.577 -12.165 15.764 1.00 0.00 H new ATOM 0 HZ PHE A 75 9.643 -14.239 14.480 1.00 0.00 H new ATOM 1049 N GLU A 76 5.228 -9.834 14.010 1.00 0.00 N ATOM 1050 CA GLU A 76 4.487 -10.368 15.141 1.00 0.00 C ATOM 1051 C GLU A 76 2.997 -10.452 14.807 1.00 0.00 C ATOM 1052 O GLU A 76 2.378 -11.502 14.972 1.00 0.00 O ATOM 1053 CB GLU A 76 4.722 -9.526 16.396 1.00 0.00 C ATOM 1054 CG GLU A 76 6.216 -9.378 16.687 1.00 0.00 C ATOM 1055 CD GLU A 76 6.622 -10.212 17.903 1.00 0.00 C ATOM 1056 OE1 GLU A 76 6.689 -11.449 17.747 1.00 0.00 O ATOM 1057 OE2 GLU A 76 6.858 -9.591 18.963 1.00 0.00 O ATOM 0 H GLU A 76 5.579 -8.885 14.139 1.00 0.00 H new ATOM 0 HA GLU A 76 4.850 -11.375 15.346 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.274 -8.541 16.266 1.00 0.00 H new ATOM 0 HB3 GLU A 76 4.227 -9.991 17.248 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.793 -9.692 15.817 1.00 0.00 H new ATOM 0 HG3 GLU A 76 6.453 -8.329 16.865 1.00 0.00 H new ATOM 1062 N ALA A 77 2.462 -9.332 14.344 1.00 0.00 N ATOM 1063 CA ALA A 77 1.056 -9.265 13.986 1.00 0.00 C ATOM 1064 C ALA A 77 0.677 -10.516 13.190 1.00 0.00 C ATOM 1065 O ALA A 77 -0.479 -10.936 13.200 1.00 0.00 O ATOM 1066 CB ALA A 77 0.786 -7.975 13.207 1.00 0.00 C ATOM 0 H ALA A 77 2.978 -8.463 14.208 1.00 0.00 H new ATOM 0 HA ALA A 77 0.434 -9.241 14.881 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.269 -7.926 12.939 1.00 0.00 H new ATOM 0 HB2 ALA A 77 1.044 -7.116 13.826 1.00 0.00 H new ATOM 0 HB3 ALA A 77 1.391 -7.964 12.301 1.00 0.00 H new ATOM 1072 N GLY A 78 1.674 -11.076 12.520 1.00 0.00 N ATOM 1073 CA GLY A 78 1.458 -12.270 11.720 1.00 0.00 C ATOM 1074 C GLY A 78 1.441 -11.935 10.228 1.00 0.00 C ATOM 1075 O GLY A 78 0.859 -12.669 9.429 1.00 0.00 O ATOM 0 H GLY A 78 2.632 -10.726 12.515 1.00 0.00 H new ATOM 0 HA2 GLY A 78 2.245 -12.996 11.924 1.00 0.00 H new ATOM 0 HA3 GLY A 78 0.514 -12.735 12.003 1.00 0.00 H new ATOM 1079 N LEU A 79 2.086 -10.827 9.895 1.00 0.00 N ATOM 1080 CA LEU A 79 2.153 -10.386 8.512 1.00 0.00 C ATOM 1081 C LEU A 79 3.284 -11.128 7.798 1.00 0.00 C ATOM 1082 O LEU A 79 4.130 -11.746 8.442 1.00 0.00 O ATOM 1083 CB LEU A 79 2.276 -8.862 8.441 1.00 0.00 C ATOM 1084 CG LEU A 79 1.614 -8.191 7.235 1.00 0.00 C ATOM 1085 CD1 LEU A 79 0.163 -7.815 7.545 1.00 0.00 C ATOM 1086 CD2 LEU A 79 2.430 -6.988 6.762 1.00 0.00 C ATOM 0 H LEU A 79 2.567 -10.221 10.559 1.00 0.00 H new ATOM 0 HA LEU A 79 1.229 -10.633 7.989 1.00 0.00 H new ATOM 0 HB2 LEU A 79 1.845 -8.440 9.349 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.335 -8.602 8.440 1.00 0.00 H new ATOM 0 HG LEU A 79 1.592 -8.908 6.414 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.284 -7.340 6.672 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.400 -8.714 7.797 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.138 -7.123 8.387 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.938 -6.529 5.904 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.506 -6.260 7.569 1.00 0.00 H new ATOM 0 HD23 LEU A 79 3.429 -7.316 6.475 1.00 0.00 H new ATOM 1097 N CYS A 80 3.263 -11.043 6.477 1.00 0.00 N ATOM 1098 CA CYS A 80 4.276 -11.698 5.667 1.00 0.00 C ATOM 1099 C CYS A 80 4.363 -10.972 4.324 1.00 0.00 C ATOM 1100 O CYS A 80 3.923 -9.831 4.201 1.00 0.00 O ATOM 1101 CB CYS A 80 3.984 -13.190 5.493 1.00 0.00 C ATOM 1102 SG CYS A 80 5.465 -14.174 5.924 1.00 0.00 S ATOM 0 H CYS A 80 2.559 -10.530 5.946 1.00 0.00 H new ATOM 0 HA CYS A 80 5.241 -11.641 6.171 1.00 0.00 H new ATOM 0 HB2 CYS A 80 3.147 -13.481 6.127 1.00 0.00 H new ATOM 0 HB3 CYS A 80 3.689 -13.393 4.463 1.00 0.00 H new ATOM 0 HG CYS A 80 5.204 -15.439 5.775 1.00 0.00 H new ATOM 1107 N THR A 81 4.932 -11.666 3.348 1.00 0.00 N ATOM 1108 CA THR A 81 5.081 -11.102 2.018 1.00 0.00 C ATOM 1109 C THR A 81 4.045 -11.701 1.064 1.00 0.00 C ATOM 1110 O THR A 81 3.542 -12.798 1.299 1.00 0.00 O ATOM 1111 CB THR A 81 6.525 -11.329 1.566 1.00 0.00 C ATOM 1112 OG1 THR A 81 7.212 -10.155 1.994 1.00 0.00 O ATOM 1113 CG2 THR A 81 6.673 -11.312 0.044 1.00 0.00 C ATOM 0 H THR A 81 5.295 -12.613 3.453 1.00 0.00 H new ATOM 0 HA THR A 81 4.891 -10.029 2.021 1.00 0.00 H new ATOM 0 HB THR A 81 6.880 -12.284 1.954 1.00 0.00 H new ATOM 0 HG1 THR A 81 8.157 -10.219 1.743 1.00 0.00 H new ATOM 0 HG21 THR A 81 7.717 -11.478 -0.222 1.00 0.00 H new ATOM 0 HG22 THR A 81 6.058 -12.101 -0.390 1.00 0.00 H new ATOM 0 HG23 THR A 81 6.349 -10.346 -0.342 1.00 0.00 H new ATOM 1121 N GLY A 82 3.756 -10.953 0.009 1.00 0.00 N ATOM 1122 CA GLY A 82 2.789 -11.398 -0.981 1.00 0.00 C ATOM 1123 C GLY A 82 1.370 -10.981 -0.586 1.00 0.00 C ATOM 1124 O GLY A 82 0.491 -10.879 -1.437 1.00 0.00 O ATOM 0 H GLY A 82 4.174 -10.042 -0.182 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.039 -10.976 -1.954 1.00 0.00 H new ATOM 0 HA3 GLY A 82 2.839 -12.482 -1.082 1.00 0.00 H new ATOM 1128 N ASP A 83 1.194 -10.754 0.707 1.00 0.00 N ATOM 1129 CA ASP A 83 -0.103 -10.352 1.225 1.00 0.00 C ATOM 1130 C ASP A 83 -0.409 -8.924 0.770 1.00 0.00 C ATOM 1131 O ASP A 83 0.431 -8.034 0.897 1.00 0.00 O ATOM 1132 CB ASP A 83 -0.115 -10.371 2.755 1.00 0.00 C ATOM 1133 CG ASP A 83 0.129 -11.744 3.386 1.00 0.00 C ATOM 1134 OD1 ASP A 83 0.202 -12.721 2.609 1.00 0.00 O ATOM 1135 OD2 ASP A 83 0.237 -11.785 4.630 1.00 0.00 O ATOM 0 H ASP A 83 1.927 -10.841 1.411 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.848 -11.053 0.849 1.00 0.00 H new ATOM 0 HB2 ASP A 83 0.646 -9.680 3.118 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -1.078 -9.995 3.101 1.00 0.00 H new ATOM 1139 N ARG A 84 -1.615 -8.749 0.247 1.00 0.00 N ATOM 1140 CA ARG A 84 -2.042 -7.445 -0.228 1.00 0.00 C ATOM 1141 C ARG A 84 -2.932 -6.765 0.813 1.00 0.00 C ATOM 1142 O ARG A 84 -3.643 -7.437 1.559 1.00 0.00 O ATOM 1143 CB ARG A 84 -2.810 -7.565 -1.546 1.00 0.00 C ATOM 1144 CG ARG A 84 -2.035 -8.408 -2.560 1.00 0.00 C ATOM 1145 CD ARG A 84 -2.952 -9.421 -3.247 1.00 0.00 C ATOM 1146 NE ARG A 84 -3.041 -10.655 -2.435 1.00 0.00 N ATOM 1147 CZ ARG A 84 -3.582 -11.802 -2.868 1.00 0.00 C ATOM 1148 NH1 ARG A 84 -4.084 -11.880 -4.108 1.00 0.00 N ATOM 1149 NH2 ARG A 84 -3.619 -12.872 -2.061 1.00 0.00 N ATOM 0 H ARG A 84 -2.309 -9.489 0.142 1.00 0.00 H new ATOM 0 HA ARG A 84 -1.148 -6.843 -0.394 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -3.785 -8.017 -1.363 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.991 -6.572 -1.957 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.581 -7.757 -3.308 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -1.222 -8.931 -2.057 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -3.945 -8.992 -3.382 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -2.569 -9.656 -4.240 1.00 0.00 H new ATOM 0 HE ARG A 84 -2.667 -10.631 -1.486 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -4.054 -11.066 -4.722 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -4.496 -12.753 -4.438 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -3.235 -12.813 -1.118 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -4.031 -13.745 -2.390 1.00 0.00 H new ATOM 1160 N ILE A 85 -2.865 -5.442 0.829 1.00 0.00 N ATOM 1161 CA ILE A 85 -3.656 -4.664 1.768 1.00 0.00 C ATOM 1162 C ILE A 85 -5.057 -4.449 1.191 1.00 0.00 C ATOM 1163 O ILE A 85 -5.207 -4.168 0.003 1.00 0.00 O ATOM 1164 CB ILE A 85 -2.934 -3.365 2.129 1.00 0.00 C ATOM 1165 CG1 ILE A 85 -1.446 -3.617 2.383 1.00 0.00 C ATOM 1166 CG2 ILE A 85 -3.608 -2.674 3.317 1.00 0.00 C ATOM 1167 CD1 ILE A 85 -1.247 -4.651 3.493 1.00 0.00 C ATOM 0 H ILE A 85 -2.275 -4.889 0.207 1.00 0.00 H new ATOM 0 HA ILE A 85 -3.776 -5.206 2.706 1.00 0.00 H new ATOM 0 HB ILE A 85 -3.006 -2.687 1.278 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -0.971 -3.966 1.466 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.957 -2.683 2.659 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -3.075 -1.753 3.553 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -4.642 -2.440 3.063 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -3.588 -3.336 4.182 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -0.181 -4.812 3.654 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -1.702 -4.288 4.414 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -1.716 -5.591 3.203 1.00 0.00 H new ATOM 1178 N ILE A 86 -6.048 -4.589 2.060 1.00 0.00 N ATOM 1179 CA ILE A 86 -7.432 -4.413 1.651 1.00 0.00 C ATOM 1180 C ILE A 86 -8.063 -3.291 2.477 1.00 0.00 C ATOM 1181 O ILE A 86 -8.820 -2.479 1.950 1.00 0.00 O ATOM 1182 CB ILE A 86 -8.188 -5.740 1.736 1.00 0.00 C ATOM 1183 CG1 ILE A 86 -8.264 -6.237 3.182 1.00 0.00 C ATOM 1184 CG2 ILE A 86 -7.569 -6.785 0.805 1.00 0.00 C ATOM 1185 CD1 ILE A 86 -8.953 -7.601 3.257 1.00 0.00 C ATOM 0 H ILE A 86 -5.920 -4.822 3.045 1.00 0.00 H new ATOM 0 HA ILE A 86 -7.486 -4.109 0.606 1.00 0.00 H new ATOM 0 HB ILE A 86 -9.211 -5.571 1.398 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -7.259 -6.310 3.599 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -8.810 -5.516 3.790 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -8.126 -7.719 0.885 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -7.609 -6.426 -0.223 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.531 -6.956 1.089 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -8.994 -7.931 4.295 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -9.966 -7.519 2.862 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -8.391 -8.325 2.668 1.00 0.00 H new ATOM 1196 N LYS A 87 -7.728 -3.283 3.759 1.00 0.00 N ATOM 1197 CA LYS A 87 -8.254 -2.274 4.663 1.00 0.00 C ATOM 1198 C LYS A 87 -7.099 -1.643 5.444 1.00 0.00 C ATOM 1199 O LYS A 87 -6.027 -2.235 5.560 1.00 0.00 O ATOM 1200 CB LYS A 87 -9.346 -2.869 5.555 1.00 0.00 C ATOM 1201 CG LYS A 87 -10.536 -3.345 4.719 1.00 0.00 C ATOM 1202 CD LYS A 87 -10.925 -4.780 5.085 1.00 0.00 C ATOM 1203 CE LYS A 87 -11.521 -5.509 3.879 1.00 0.00 C ATOM 1204 NZ LYS A 87 -12.478 -6.546 4.325 1.00 0.00 N ATOM 0 H LYS A 87 -7.099 -3.959 4.193 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.735 -1.474 4.101 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.940 -3.704 6.125 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.679 -2.122 6.276 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -11.386 -2.682 4.879 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.285 -3.291 3.660 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -10.048 -5.319 5.443 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -11.647 -4.768 5.901 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.025 -4.795 3.227 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -10.725 -5.968 3.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.874 -7.032 3.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.986 -7.236 4.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.247 -6.100 4.865 1.00 0.00 H new ATOM 1214 N VAL A 88 -7.357 -0.451 5.960 1.00 0.00 N ATOM 1215 CA VAL A 88 -6.353 0.267 6.726 1.00 0.00 C ATOM 1216 C VAL A 88 -7.042 1.283 7.638 1.00 0.00 C ATOM 1217 O VAL A 88 -7.975 1.967 7.217 1.00 0.00 O ATOM 1218 CB VAL A 88 -5.332 0.906 5.782 1.00 0.00 C ATOM 1219 CG1 VAL A 88 -4.425 1.881 6.535 1.00 0.00 C ATOM 1220 CG2 VAL A 88 -4.507 -0.163 5.062 1.00 0.00 C ATOM 0 H VAL A 88 -8.248 0.036 5.863 1.00 0.00 H new ATOM 0 HA VAL A 88 -5.799 -0.420 7.366 1.00 0.00 H new ATOM 0 HB VAL A 88 -5.881 1.471 5.028 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -3.709 2.321 5.841 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -5.030 2.670 6.981 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -3.889 1.347 7.320 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -3.789 0.318 4.397 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -3.974 -0.767 5.796 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -5.170 -0.802 4.479 1.00 0.00 H new ATOM 1230 N ASN A 89 -6.557 1.352 8.869 1.00 0.00 N ATOM 1231 CA ASN A 89 -7.116 2.273 9.843 1.00 0.00 C ATOM 1232 C ASN A 89 -8.643 2.202 9.791 1.00 0.00 C ATOM 1233 O ASN A 89 -9.318 3.225 9.870 1.00 0.00 O ATOM 1234 CB ASN A 89 -6.699 3.714 9.540 1.00 0.00 C ATOM 1235 CG ASN A 89 -5.176 3.852 9.517 1.00 0.00 C ATOM 1236 OD1 ASN A 89 -4.585 4.350 8.574 1.00 0.00 O ATOM 1237 ND2 ASN A 89 -4.573 3.383 10.607 1.00 0.00 N ATOM 0 H ASN A 89 -5.783 0.785 9.214 1.00 0.00 H new ATOM 0 HA ASN A 89 -6.744 1.988 10.827 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -7.110 4.020 8.578 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.117 4.383 10.292 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -3.557 3.429 10.688 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -5.127 2.978 11.362 1.00 0.00 H new ATOM 1243 N GLY A 90 -9.142 0.981 9.657 1.00 0.00 N ATOM 1244 CA GLY A 90 -10.576 0.763 9.592 1.00 0.00 C ATOM 1245 C GLY A 90 -11.214 1.622 8.499 1.00 0.00 C ATOM 1246 O GLY A 90 -12.346 2.080 8.645 1.00 0.00 O ATOM 0 H GLY A 90 -8.578 0.134 9.592 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -10.778 -0.290 9.396 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -11.027 1.000 10.555 1.00 0.00 H new ATOM 1250 N GLU A 91 -10.458 1.817 7.428 1.00 0.00 N ATOM 1251 CA GLU A 91 -10.936 2.615 6.311 1.00 0.00 C ATOM 1252 C GLU A 91 -11.058 1.748 5.055 1.00 0.00 C ATOM 1253 O GLU A 91 -10.447 0.684 4.968 1.00 0.00 O ATOM 1254 CB GLU A 91 -10.020 3.814 6.062 1.00 0.00 C ATOM 1255 CG GLU A 91 -10.786 5.129 6.205 1.00 0.00 C ATOM 1256 CD GLU A 91 -11.997 5.162 5.272 1.00 0.00 C ATOM 1257 OE1 GLU A 91 -11.792 4.907 4.067 1.00 0.00 O ATOM 1258 OE2 GLU A 91 -13.102 5.443 5.785 1.00 0.00 O ATOM 0 H GLU A 91 -9.519 1.437 7.310 1.00 0.00 H new ATOM 0 HA GLU A 91 -11.924 3.001 6.561 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -9.190 3.794 6.768 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -9.590 3.746 5.063 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -11.114 5.252 7.237 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -10.125 5.966 5.978 1.00 0.00 H new ATOM 1263 N SER A 92 -11.851 2.236 4.113 1.00 0.00 N ATOM 1264 CA SER A 92 -12.064 1.520 2.866 1.00 0.00 C ATOM 1265 C SER A 92 -11.114 2.052 1.791 1.00 0.00 C ATOM 1266 O SER A 92 -11.348 3.120 1.225 1.00 0.00 O ATOM 1267 CB SER A 92 -13.515 1.641 2.401 1.00 0.00 C ATOM 1268 OG SER A 92 -14.436 1.240 3.411 1.00 0.00 O ATOM 0 H SER A 92 -12.355 3.120 4.188 1.00 0.00 H new ATOM 0 HA SER A 92 -11.855 0.464 3.037 1.00 0.00 H new ATOM 0 HB2 SER A 92 -13.719 2.673 2.114 1.00 0.00 H new ATOM 0 HB3 SER A 92 -13.663 1.028 1.512 1.00 0.00 H new ATOM 0 HG SER A 92 -15.352 1.334 3.075 1.00 0.00 H new ATOM 1273 N VAL A 93 -10.064 1.285 1.541 1.00 0.00 N ATOM 1274 CA VAL A 93 -9.079 1.666 0.543 1.00 0.00 C ATOM 1275 C VAL A 93 -9.461 1.052 -0.805 1.00 0.00 C ATOM 1276 O VAL A 93 -8.593 0.632 -1.569 1.00 0.00 O ATOM 1277 CB VAL A 93 -7.678 1.260 1.009 1.00 0.00 C ATOM 1278 CG1 VAL A 93 -7.389 1.801 2.411 1.00 0.00 C ATOM 1279 CG2 VAL A 93 -7.502 -0.258 0.960 1.00 0.00 C ATOM 0 H VAL A 93 -9.873 0.401 2.012 1.00 0.00 H new ATOM 0 HA VAL A 93 -9.064 2.748 0.415 1.00 0.00 H new ATOM 0 HB VAL A 93 -6.955 1.703 0.323 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -6.388 1.499 2.718 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.453 2.889 2.401 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -8.120 1.401 3.113 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -6.498 -0.519 1.296 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -8.237 -0.731 1.611 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -7.645 -0.608 -0.062 1.00 0.00 H new ATOM 1289 N ILE A 94 -10.761 1.019 -1.056 1.00 0.00 N ATOM 1290 CA ILE A 94 -11.269 0.464 -2.300 1.00 0.00 C ATOM 1291 C ILE A 94 -11.286 1.556 -3.371 1.00 0.00 C ATOM 1292 O ILE A 94 -12.295 2.235 -3.554 1.00 0.00 O ATOM 1293 CB ILE A 94 -12.630 -0.197 -2.074 1.00 0.00 C ATOM 1294 CG1 ILE A 94 -12.534 -1.311 -1.029 1.00 0.00 C ATOM 1295 CG2 ILE A 94 -13.223 -0.697 -3.393 1.00 0.00 C ATOM 1296 CD1 ILE A 94 -11.873 -2.559 -1.620 1.00 0.00 C ATOM 0 H ILE A 94 -11.478 1.367 -0.420 1.00 0.00 H new ATOM 0 HA ILE A 94 -10.612 -0.327 -2.661 1.00 0.00 H new ATOM 0 HB ILE A 94 -13.313 0.555 -1.679 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -11.959 -0.962 -0.171 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -13.531 -1.560 -0.665 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -14.190 -1.163 -3.204 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -13.352 0.143 -4.076 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -12.550 -1.428 -3.841 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -11.816 -3.336 -0.858 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -12.464 -2.919 -2.462 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -10.868 -2.311 -1.961 1.00 0.00 H new ATOM 1307 N GLY A 95 -10.157 1.689 -4.052 1.00 0.00 N ATOM 1308 CA GLY A 95 -10.030 2.686 -5.101 1.00 0.00 C ATOM 1309 C GLY A 95 -8.920 3.687 -4.772 1.00 0.00 C ATOM 1310 O GLY A 95 -8.187 4.121 -5.661 1.00 0.00 O ATOM 0 H GLY A 95 -9.323 1.123 -3.898 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -9.813 2.196 -6.050 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -10.976 3.213 -5.223 1.00 0.00 H new ATOM 1314 N LYS A 96 -8.831 4.026 -3.495 1.00 0.00 N ATOM 1315 CA LYS A 96 -7.824 4.968 -3.039 1.00 0.00 C ATOM 1316 C LYS A 96 -6.480 4.624 -3.685 1.00 0.00 C ATOM 1317 O LYS A 96 -6.235 3.472 -4.040 1.00 0.00 O ATOM 1318 CB LYS A 96 -7.779 5.007 -1.509 1.00 0.00 C ATOM 1319 CG LYS A 96 -9.046 5.650 -0.941 1.00 0.00 C ATOM 1320 CD LYS A 96 -8.956 5.782 0.581 1.00 0.00 C ATOM 1321 CE LYS A 96 -9.645 7.061 1.061 1.00 0.00 C ATOM 1322 NZ LYS A 96 -11.116 6.922 0.976 1.00 0.00 N ATOM 0 H LYS A 96 -9.440 3.665 -2.761 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.080 5.980 -3.353 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -7.674 3.995 -1.119 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -6.904 5.568 -1.181 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -9.191 6.634 -1.387 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -9.915 5.048 -1.207 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -9.419 4.916 1.053 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -7.910 5.791 0.888 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -9.353 7.274 2.089 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -9.318 7.906 0.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -11.567 7.799 1.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -11.391 6.741 -0.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -11.425 6.128 1.573 1.00 0.00 H new ATOM 1332 N THR A 97 -5.645 5.645 -3.817 1.00 0.00 N ATOM 1333 CA THR A 97 -4.332 5.464 -4.414 1.00 0.00 C ATOM 1334 C THR A 97 -3.278 5.247 -3.327 1.00 0.00 C ATOM 1335 O THR A 97 -3.411 5.760 -2.217 1.00 0.00 O ATOM 1336 CB THR A 97 -4.047 6.675 -5.304 1.00 0.00 C ATOM 1337 OG1 THR A 97 -2.985 6.245 -6.149 1.00 0.00 O ATOM 1338 CG2 THR A 97 -3.451 7.848 -4.524 1.00 0.00 C ATOM 0 H THR A 97 -5.852 6.599 -3.521 1.00 0.00 H new ATOM 0 HA THR A 97 -4.300 4.570 -5.037 1.00 0.00 H new ATOM 0 HB THR A 97 -4.970 6.993 -5.789 1.00 0.00 H new ATOM 0 HG1 THR A 97 -2.739 6.971 -6.760 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.268 8.681 -5.203 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.149 8.160 -3.747 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.511 7.540 -4.066 1.00 0.00 H new ATOM 1346 N TYR A 98 -2.253 4.488 -3.685 1.00 0.00 N ATOM 1347 CA TYR A 98 -1.176 4.197 -2.755 1.00 0.00 C ATOM 1348 C TYR A 98 -0.831 5.428 -1.914 1.00 0.00 C ATOM 1349 O TYR A 98 -0.697 5.333 -0.695 1.00 0.00 O ATOM 1350 CB TYR A 98 0.034 3.826 -3.613 1.00 0.00 C ATOM 1351 CG TYR A 98 1.298 3.514 -2.808 1.00 0.00 C ATOM 1352 CD1 TYR A 98 1.340 2.398 -1.996 1.00 0.00 C ATOM 1353 CD2 TYR A 98 2.393 4.348 -2.892 1.00 0.00 C ATOM 1354 CE1 TYR A 98 2.529 2.106 -1.237 1.00 0.00 C ATOM 1355 CE2 TYR A 98 3.581 4.054 -2.133 1.00 0.00 C ATOM 1356 CZ TYR A 98 3.590 2.948 -1.344 1.00 0.00 C ATOM 1357 OH TYR A 98 4.713 2.670 -0.626 1.00 0.00 O ATOM 0 H TYR A 98 -2.146 4.065 -4.607 1.00 0.00 H new ATOM 0 HA TYR A 98 -1.465 3.398 -2.072 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -0.219 2.959 -4.223 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.246 4.647 -4.298 1.00 0.00 H new ATOM 0 HD1 TYR A 98 0.482 1.745 -1.930 1.00 0.00 H new ATOM 0 HD2 TYR A 98 2.360 5.221 -3.527 1.00 0.00 H new ATOM 0 HE1 TYR A 98 2.576 1.237 -0.597 1.00 0.00 H new ATOM 0 HE2 TYR A 98 4.446 4.699 -2.190 1.00 0.00 H new ATOM 0 HH TYR A 98 5.391 3.356 -0.801 1.00 0.00 H new ATOM 1366 N SER A 99 -0.697 6.555 -2.598 1.00 0.00 N ATOM 1367 CA SER A 99 -0.370 7.802 -1.929 1.00 0.00 C ATOM 1368 C SER A 99 -1.342 8.046 -0.773 1.00 0.00 C ATOM 1369 O SER A 99 -0.929 8.431 0.320 1.00 0.00 O ATOM 1370 CB SER A 99 -0.403 8.977 -2.908 1.00 0.00 C ATOM 1371 OG SER A 99 0.303 10.109 -2.408 1.00 0.00 O ATOM 0 H SER A 99 -0.809 6.630 -3.609 1.00 0.00 H new ATOM 0 HA SER A 99 0.642 7.723 -1.533 1.00 0.00 H new ATOM 0 HB2 SER A 99 0.033 8.669 -3.859 1.00 0.00 H new ATOM 0 HB3 SER A 99 -1.438 9.254 -3.107 1.00 0.00 H new ATOM 0 HG SER A 99 0.260 10.837 -3.063 1.00 0.00 H new ATOM 1376 N GLN A 100 -2.616 7.813 -1.053 1.00 0.00 N ATOM 1377 CA GLN A 100 -3.651 8.002 -0.050 1.00 0.00 C ATOM 1378 C GLN A 100 -3.419 7.064 1.135 1.00 0.00 C ATOM 1379 O GLN A 100 -3.097 7.513 2.233 1.00 0.00 O ATOM 1380 CB GLN A 100 -5.041 7.794 -0.653 1.00 0.00 C ATOM 1381 CG GLN A 100 -5.558 9.082 -1.297 1.00 0.00 C ATOM 1382 CD GLN A 100 -6.983 8.896 -1.825 1.00 0.00 C ATOM 1383 OE1 GLN A 100 -7.218 8.261 -2.840 1.00 0.00 O ATOM 1384 NE2 GLN A 100 -7.916 9.484 -1.083 1.00 0.00 N ATOM 0 H GLN A 100 -2.955 7.495 -1.961 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.598 9.029 0.311 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -5.003 7.000 -1.399 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -5.733 7.468 0.124 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -5.539 9.891 -0.567 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -4.899 9.375 -2.114 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -7.650 10.000 -0.245 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -8.898 9.419 -1.352 1.00 0.00 H new ATOM 1391 N VAL A 101 -3.592 5.776 0.872 1.00 0.00 N ATOM 1392 CA VAL A 101 -3.406 4.770 1.904 1.00 0.00 C ATOM 1393 C VAL A 101 -2.098 5.045 2.648 1.00 0.00 C ATOM 1394 O VAL A 101 -2.030 4.897 3.867 1.00 0.00 O ATOM 1395 CB VAL A 101 -3.461 3.371 1.287 1.00 0.00 C ATOM 1396 CG1 VAL A 101 -4.890 3.009 0.876 1.00 0.00 C ATOM 1397 CG2 VAL A 101 -2.504 3.259 0.099 1.00 0.00 C ATOM 0 H VAL A 101 -3.859 5.407 -0.041 1.00 0.00 H new ATOM 0 HA VAL A 101 -4.212 4.819 2.636 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.140 2.657 2.045 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.901 2.010 0.440 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.537 3.030 1.753 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.251 3.729 0.142 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.562 2.255 -0.322 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -2.782 3.988 -0.662 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.485 3.454 0.433 1.00 0.00 H new ATOM 1407 N ILE A 102 -1.091 5.439 1.883 1.00 0.00 N ATOM 1408 CA ILE A 102 0.210 5.736 2.454 1.00 0.00 C ATOM 1409 C ILE A 102 0.040 6.693 3.635 1.00 0.00 C ATOM 1410 O ILE A 102 0.596 6.465 4.708 1.00 0.00 O ATOM 1411 CB ILE A 102 1.164 6.257 1.375 1.00 0.00 C ATOM 1412 CG1 ILE A 102 1.665 5.114 0.488 1.00 0.00 C ATOM 1413 CG2 ILE A 102 2.318 7.048 1.997 1.00 0.00 C ATOM 1414 CD1 ILE A 102 2.960 4.516 1.043 1.00 0.00 C ATOM 0 H ILE A 102 -1.151 5.559 0.872 1.00 0.00 H new ATOM 0 HA ILE A 102 0.669 4.827 2.843 1.00 0.00 H new ATOM 0 HB ILE A 102 0.612 6.944 0.734 1.00 0.00 H new ATOM 0 HG12 ILE A 102 0.901 4.339 0.422 1.00 0.00 H new ATOM 0 HG13 ILE A 102 1.835 5.482 -0.524 1.00 0.00 H new ATOM 0 HG21 ILE A 102 2.980 7.406 1.209 1.00 0.00 H new ATOM 0 HG22 ILE A 102 1.920 7.898 2.551 1.00 0.00 H new ATOM 0 HG23 ILE A 102 2.877 6.403 2.675 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.294 3.706 0.394 1.00 0.00 H new ATOM 0 HD12 ILE A 102 3.728 5.288 1.085 1.00 0.00 H new ATOM 0 HD13 ILE A 102 2.781 4.127 2.045 1.00 0.00 H new ATOM 1425 N ALA A 103 -0.733 7.743 3.398 1.00 0.00 N ATOM 1426 CA ALA A 103 -0.985 8.735 4.430 1.00 0.00 C ATOM 1427 C ALA A 103 -1.676 8.064 5.618 1.00 0.00 C ATOM 1428 O ALA A 103 -1.284 8.269 6.765 1.00 0.00 O ATOM 1429 CB ALA A 103 -1.812 9.881 3.844 1.00 0.00 C ATOM 0 H ALA A 103 -1.193 7.928 2.507 1.00 0.00 H new ATOM 0 HA ALA A 103 -0.049 9.160 4.792 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -2.001 10.625 4.617 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.264 10.342 3.023 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -2.761 9.493 3.474 1.00 0.00 H new ATOM 1435 N LEU A 104 -2.694 7.276 5.302 1.00 0.00 N ATOM 1436 CA LEU A 104 -3.445 6.576 6.330 1.00 0.00 C ATOM 1437 C LEU A 104 -2.469 5.895 7.292 1.00 0.00 C ATOM 1438 O LEU A 104 -2.706 5.859 8.499 1.00 0.00 O ATOM 1439 CB LEU A 104 -4.453 5.614 5.696 1.00 0.00 C ATOM 1440 CG LEU A 104 -5.668 6.261 5.028 1.00 0.00 C ATOM 1441 CD1 LEU A 104 -6.639 5.199 4.510 1.00 0.00 C ATOM 1442 CD2 LEU A 104 -6.351 7.251 5.975 1.00 0.00 C ATOM 0 H LEU A 104 -3.016 7.107 4.349 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.035 7.280 6.917 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.932 5.012 4.952 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.808 4.931 6.467 1.00 0.00 H new ATOM 0 HG LEU A 104 -5.322 6.828 4.164 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -7.494 5.686 4.040 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.133 4.569 3.779 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.984 4.585 5.342 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.211 7.697 5.476 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.683 6.727 6.872 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.646 8.035 6.252 1.00 0.00 H new ATOM 1453 N ILE A 105 -1.392 5.373 6.723 1.00 0.00 N ATOM 1454 CA ILE A 105 -0.380 4.697 7.516 1.00 0.00 C ATOM 1455 C ILE A 105 0.445 5.737 8.277 1.00 0.00 C ATOM 1456 O ILE A 105 0.639 5.617 9.486 1.00 0.00 O ATOM 1457 CB ILE A 105 0.461 3.772 6.634 1.00 0.00 C ATOM 1458 CG1 ILE A 105 -0.364 2.577 6.150 1.00 0.00 C ATOM 1459 CG2 ILE A 105 1.734 3.332 7.358 1.00 0.00 C ATOM 1460 CD1 ILE A 105 0.234 1.977 4.876 1.00 0.00 C ATOM 0 H ILE A 105 -1.199 5.405 5.722 1.00 0.00 H new ATOM 0 HA ILE A 105 -0.847 4.053 8.261 1.00 0.00 H new ATOM 0 HB ILE A 105 0.770 4.331 5.750 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -0.402 1.817 6.931 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -1.390 2.892 5.961 1.00 0.00 H new ATOM 0 HG21 ILE A 105 2.313 2.675 6.709 1.00 0.00 H new ATOM 0 HG22 ILE A 105 2.330 4.209 7.612 1.00 0.00 H new ATOM 0 HG23 ILE A 105 1.468 2.798 8.270 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.371 1.130 4.554 1.00 0.00 H new ATOM 0 HD12 ILE A 105 0.249 2.732 4.090 1.00 0.00 H new ATOM 0 HD13 ILE A 105 1.252 1.641 5.075 1.00 0.00 H new ATOM 1471 N GLN A 106 0.908 6.734 7.538 1.00 0.00 N ATOM 1472 CA GLN A 106 1.708 7.795 8.129 1.00 0.00 C ATOM 1473 C GLN A 106 0.928 8.485 9.249 1.00 0.00 C ATOM 1474 O GLN A 106 1.521 9.087 10.143 1.00 0.00 O ATOM 1475 CB GLN A 106 2.151 8.803 7.067 1.00 0.00 C ATOM 1476 CG GLN A 106 3.148 8.170 6.093 1.00 0.00 C ATOM 1477 CD GLN A 106 4.233 9.172 5.692 1.00 0.00 C ATOM 1478 OE1 GLN A 106 4.281 10.297 6.163 1.00 0.00 O ATOM 1479 NE2 GLN A 106 5.099 8.702 4.800 1.00 0.00 N ATOM 0 H GLN A 106 0.745 6.830 6.536 1.00 0.00 H new ATOM 0 HA GLN A 106 2.606 7.351 8.558 1.00 0.00 H new ATOM 0 HB2 GLN A 106 1.281 9.165 6.519 1.00 0.00 H new ATOM 0 HB3 GLN A 106 2.607 9.668 7.549 1.00 0.00 H new ATOM 0 HG2 GLN A 106 3.608 7.296 6.554 1.00 0.00 H new ATOM 0 HG3 GLN A 106 2.622 7.822 5.204 1.00 0.00 H new ATOM 0 HE21 GLN A 106 5.001 7.750 4.447 1.00 0.00 H new ATOM 0 HE22 GLN A 106 5.862 9.293 4.469 1.00 0.00 H new ATOM 1486 N ASN A 107 -0.390 8.378 9.163 1.00 0.00 N ATOM 1487 CA ASN A 107 -1.258 8.985 10.159 1.00 0.00 C ATOM 1488 C ASN A 107 -1.916 7.885 10.995 1.00 0.00 C ATOM 1489 O ASN A 107 -2.907 8.130 11.680 1.00 0.00 O ATOM 1490 CB ASN A 107 -2.365 9.805 9.498 1.00 0.00 C ATOM 1491 CG ASN A 107 -1.848 11.176 9.060 1.00 0.00 C ATOM 1492 OD1 ASN A 107 -1.482 12.015 9.866 1.00 0.00 O ATOM 1493 ND2 ASN A 107 -1.837 11.355 7.742 1.00 0.00 N ATOM 0 H ASN A 107 -0.878 7.880 8.419 1.00 0.00 H new ATOM 0 HA ASN A 107 -0.649 9.640 10.783 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.754 9.267 8.634 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -3.194 9.931 10.195 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -1.508 12.237 7.350 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.158 10.610 7.123 1.00 0.00 H new ATOM 1499 N SER A 108 -1.338 6.695 10.910 1.00 0.00 N ATOM 1500 CA SER A 108 -1.856 5.557 11.649 1.00 0.00 C ATOM 1501 C SER A 108 -1.781 5.830 13.152 1.00 0.00 C ATOM 1502 O SER A 108 -2.418 5.141 13.945 1.00 0.00 O ATOM 1503 CB SER A 108 -1.090 4.279 11.302 1.00 0.00 C ATOM 1504 OG SER A 108 0.302 4.401 11.578 1.00 0.00 O ATOM 0 H SER A 108 -0.516 6.495 10.340 1.00 0.00 H new ATOM 0 HA SER A 108 -2.898 5.411 11.365 1.00 0.00 H new ATOM 0 HB2 SER A 108 -1.501 3.444 11.870 1.00 0.00 H new ATOM 0 HB3 SER A 108 -1.232 4.046 10.247 1.00 0.00 H new ATOM 0 HG SER A 108 0.784 4.602 10.749 1.00 0.00 H new ATOM 1509 N ASP A 109 -0.994 6.839 13.498 1.00 0.00 N ATOM 1510 CA ASP A 109 -0.826 7.213 14.893 1.00 0.00 C ATOM 1511 C ASP A 109 0.083 6.195 15.584 1.00 0.00 C ATOM 1512 O ASP A 109 0.862 5.505 14.926 1.00 0.00 O ATOM 1513 CB ASP A 109 -2.168 7.222 15.627 1.00 0.00 C ATOM 1514 CG ASP A 109 -2.279 8.244 16.759 1.00 0.00 C ATOM 1515 OD1 ASP A 109 -1.563 9.265 16.675 1.00 0.00 O ATOM 1516 OD2 ASP A 109 -3.079 7.983 17.684 1.00 0.00 O ATOM 0 H ASP A 109 -0.466 7.409 12.837 1.00 0.00 H new ATOM 0 HA ASP A 109 -0.392 8.212 14.923 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -2.959 7.417 14.903 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -2.348 6.228 16.036 1.00 0.00 H new ATOM 1520 N THR A 110 -0.047 6.129 16.900 1.00 0.00 N ATOM 1521 CA THR A 110 0.753 5.205 17.687 1.00 0.00 C ATOM 1522 C THR A 110 0.755 3.818 17.041 1.00 0.00 C ATOM 1523 O THR A 110 1.807 3.311 16.659 1.00 0.00 O ATOM 1524 CB THR A 110 0.210 5.209 19.116 1.00 0.00 C ATOM 1525 OG1 THR A 110 0.202 6.587 19.481 1.00 0.00 O ATOM 1526 CG2 THR A 110 1.177 4.566 20.112 1.00 0.00 C ATOM 0 H THR A 110 -0.695 6.701 17.442 1.00 0.00 H new ATOM 0 HA THR A 110 1.797 5.515 17.720 1.00 0.00 H new ATOM 0 HB THR A 110 -0.743 4.681 19.143 1.00 0.00 H new ATOM 0 HG1 THR A 110 -0.139 6.681 20.395 1.00 0.00 H new ATOM 0 HG21 THR A 110 0.743 4.595 21.111 1.00 0.00 H new ATOM 0 HG22 THR A 110 1.359 3.530 19.825 1.00 0.00 H new ATOM 0 HG23 THR A 110 2.119 5.114 20.110 1.00 0.00 H new ATOM 1534 N THR A 111 -0.435 3.247 16.941 1.00 0.00 N ATOM 1535 CA THR A 111 -0.584 1.928 16.348 1.00 0.00 C ATOM 1536 C THR A 111 -0.951 2.047 14.867 1.00 0.00 C ATOM 1537 O THR A 111 -1.152 3.150 14.361 1.00 0.00 O ATOM 1538 CB THR A 111 -1.617 1.154 17.169 1.00 0.00 C ATOM 1539 OG1 THR A 111 -2.477 2.166 17.688 1.00 0.00 O ATOM 1540 CG2 THR A 111 -1.008 0.507 18.415 1.00 0.00 C ATOM 0 H THR A 111 -1.305 3.672 17.260 1.00 0.00 H new ATOM 0 HA THR A 111 0.355 1.375 16.375 1.00 0.00 H new ATOM 0 HB THR A 111 -2.073 0.384 16.546 1.00 0.00 H new ATOM 0 HG1 THR A 111 -3.179 1.752 18.232 1.00 0.00 H new ATOM 0 HG21 THR A 111 -1.783 -0.030 18.962 1.00 0.00 H new ATOM 0 HG22 THR A 111 -0.225 -0.190 18.117 1.00 0.00 H new ATOM 0 HG23 THR A 111 -0.581 1.280 19.055 1.00 0.00 H new ATOM 1548 N LEU A 112 -1.028 0.896 14.215 1.00 0.00 N ATOM 1549 CA LEU A 112 -1.368 0.858 12.804 1.00 0.00 C ATOM 1550 C LEU A 112 -1.983 -0.502 12.467 1.00 0.00 C ATOM 1551 O LEU A 112 -1.288 -1.517 12.462 1.00 0.00 O ATOM 1552 CB LEU A 112 -0.147 1.208 11.949 1.00 0.00 C ATOM 1553 CG LEU A 112 -0.341 1.117 10.434 1.00 0.00 C ATOM 1554 CD1 LEU A 112 0.325 -0.139 9.869 1.00 0.00 C ATOM 1555 CD2 LEU A 112 -1.823 1.195 10.065 1.00 0.00 C ATOM 0 H LEU A 112 -0.861 -0.017 14.638 1.00 0.00 H new ATOM 0 HA LEU A 112 -2.119 1.614 12.574 1.00 0.00 H new ATOM 0 HB2 LEU A 112 0.165 2.223 12.195 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.671 0.545 12.231 1.00 0.00 H new ATOM 0 HG LEU A 112 0.151 1.975 9.976 1.00 0.00 H new ATOM 0 HD11 LEU A 112 0.172 -0.178 8.791 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.393 -0.112 10.083 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.115 -1.023 10.331 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -1.932 1.128 8.983 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -2.359 0.371 10.536 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -2.235 2.142 10.413 1.00 0.00 H new ATOM 1566 N GLU A 113 -3.280 -0.478 12.197 1.00 0.00 N ATOM 1567 CA GLU A 113 -3.997 -1.697 11.862 1.00 0.00 C ATOM 1568 C GLU A 113 -4.025 -1.896 10.346 1.00 0.00 C ATOM 1569 O GLU A 113 -4.221 -0.941 9.594 1.00 0.00 O ATOM 1570 CB GLU A 113 -5.413 -1.676 12.440 1.00 0.00 C ATOM 1571 CG GLU A 113 -6.137 -2.996 12.167 1.00 0.00 C ATOM 1572 CD GLU A 113 -7.635 -2.871 12.449 1.00 0.00 C ATOM 1573 OE1 GLU A 113 -8.295 -2.129 11.691 1.00 0.00 O ATOM 1574 OE2 GLU A 113 -8.086 -3.517 13.419 1.00 0.00 O ATOM 0 H GLU A 113 -3.853 0.366 12.203 1.00 0.00 H new ATOM 0 HA GLU A 113 -3.471 -2.540 12.309 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -5.368 -1.497 13.514 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -5.976 -0.851 12.003 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -5.983 -3.291 11.129 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -5.711 -3.783 12.789 1.00 0.00 H new ATOM 1579 N LEU A 114 -3.829 -3.142 9.940 1.00 0.00 N ATOM 1580 CA LEU A 114 -3.830 -3.478 8.527 1.00 0.00 C ATOM 1581 C LEU A 114 -4.818 -4.620 8.278 1.00 0.00 C ATOM 1582 O LEU A 114 -5.424 -5.136 9.217 1.00 0.00 O ATOM 1583 CB LEU A 114 -2.410 -3.780 8.046 1.00 0.00 C ATOM 1584 CG LEU A 114 -1.406 -2.629 8.154 1.00 0.00 C ATOM 1585 CD1 LEU A 114 0.031 -3.155 8.181 1.00 0.00 C ATOM 1586 CD2 LEU A 114 -1.622 -1.605 7.037 1.00 0.00 C ATOM 0 H LEU A 114 -3.668 -3.931 10.566 1.00 0.00 H new ATOM 0 HA LEU A 114 -4.169 -2.628 7.935 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.026 -4.625 8.617 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -2.460 -4.096 7.004 1.00 0.00 H new ATOM 0 HG LEU A 114 -1.578 -2.114 9.099 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.724 -2.317 8.258 1.00 0.00 H new ATOM 0 HD12 LEU A 114 0.161 -3.814 9.040 1.00 0.00 H new ATOM 0 HD13 LEU A 114 0.233 -3.709 7.264 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.896 -0.798 7.137 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -1.494 -2.090 6.069 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -2.630 -1.197 7.108 1.00 0.00 H new ATOM 1597 N SER A 115 -4.951 -4.980 7.011 1.00 0.00 N ATOM 1598 CA SER A 115 -5.856 -6.050 6.627 1.00 0.00 C ATOM 1599 C SER A 115 -5.473 -6.590 5.249 1.00 0.00 C ATOM 1600 O SER A 115 -5.246 -5.819 4.318 1.00 0.00 O ATOM 1601 CB SER A 115 -7.308 -5.571 6.626 1.00 0.00 C ATOM 1602 OG SER A 115 -7.547 -4.589 7.631 1.00 0.00 O ATOM 0 H SER A 115 -4.447 -4.550 6.236 1.00 0.00 H new ATOM 0 HA SER A 115 -5.768 -6.851 7.361 1.00 0.00 H new ATOM 0 HB2 SER A 115 -7.552 -5.156 5.648 1.00 0.00 H new ATOM 0 HB3 SER A 115 -7.971 -6.422 6.786 1.00 0.00 H new ATOM 0 HG SER A 115 -8.478 -4.649 7.932 1.00 0.00 H new ATOM 1607 N VAL A 116 -5.413 -7.911 5.160 1.00 0.00 N ATOM 1608 CA VAL A 116 -5.062 -8.563 3.910 1.00 0.00 C ATOM 1609 C VAL A 116 -6.034 -9.716 3.651 1.00 0.00 C ATOM 1610 O VAL A 116 -6.985 -9.912 4.405 1.00 0.00 O ATOM 1611 CB VAL A 116 -3.600 -9.012 3.947 1.00 0.00 C ATOM 1612 CG1 VAL A 116 -2.680 -7.854 4.343 1.00 0.00 C ATOM 1613 CG2 VAL A 116 -3.415 -10.204 4.888 1.00 0.00 C ATOM 0 H VAL A 116 -5.602 -8.548 5.934 1.00 0.00 H new ATOM 0 HA VAL A 116 -5.154 -7.866 3.077 1.00 0.00 H new ATOM 0 HB VAL A 116 -3.323 -9.332 2.942 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -1.647 -8.200 4.362 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -2.779 -7.046 3.618 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -2.959 -7.490 5.332 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -2.367 -10.503 4.895 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -3.719 -9.922 5.896 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -4.027 -11.038 4.544 1.00 0.00 H new ATOM 1623 N MET A 117 -5.762 -10.447 2.581 1.00 0.00 N ATOM 1624 CA MET A 117 -6.600 -11.575 2.212 1.00 0.00 C ATOM 1625 C MET A 117 -5.768 -12.848 2.054 1.00 0.00 C ATOM 1626 O MET A 117 -5.339 -13.183 0.951 1.00 0.00 O ATOM 1627 CB MET A 117 -7.319 -11.268 0.896 1.00 0.00 C ATOM 1628 CG MET A 117 -8.499 -10.320 1.123 1.00 0.00 C ATOM 1629 SD MET A 117 -10.037 -11.186 0.870 1.00 0.00 S ATOM 1630 CE MET A 117 -10.223 -11.960 2.468 1.00 0.00 C ATOM 0 H MET A 117 -4.973 -10.280 1.957 1.00 0.00 H new ATOM 0 HA MET A 117 -7.329 -11.737 3.006 1.00 0.00 H new ATOM 0 HB2 MET A 117 -6.619 -10.820 0.191 1.00 0.00 H new ATOM 0 HB3 MET A 117 -7.674 -12.195 0.447 1.00 0.00 H new ATOM 0 HG2 MET A 117 -8.462 -9.916 2.135 1.00 0.00 H new ATOM 0 HG3 MET A 117 -8.432 -9.474 0.439 1.00 0.00 H new ATOM 0 HE1 MET A 117 -10.898 -12.812 2.383 1.00 0.00 H new ATOM 0 HE2 MET A 117 -9.250 -12.301 2.822 1.00 0.00 H new ATOM 0 HE3 MET A 117 -10.635 -11.240 3.175 1.00 0.00 H new ATOM 1638 N PRO A 118 -5.560 -13.546 3.204 1.00 0.00 N ATOM 1639 CA PRO A 118 -4.787 -14.775 3.203 1.00 0.00 C ATOM 1640 C PRO A 118 -5.595 -15.930 2.611 1.00 0.00 C ATOM 1641 O PRO A 118 -6.815 -15.836 2.479 1.00 0.00 O ATOM 1642 CB PRO A 118 -4.408 -15.000 4.658 1.00 0.00 C ATOM 1643 CG PRO A 118 -5.366 -14.151 5.476 1.00 0.00 C ATOM 1644 CD PRO A 118 -6.053 -13.180 4.529 1.00 0.00 C ATOM 0 HA PRO A 118 -3.897 -14.712 2.577 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -4.494 -16.053 4.925 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -3.374 -14.708 4.842 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -6.101 -14.780 5.977 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.827 -13.609 6.254 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -7.138 -13.270 4.587 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -5.806 -12.147 4.773 1.00 0.00 H new ATOM 1649 N LYS A 119 -4.884 -16.995 2.268 1.00 0.00 N ATOM 1650 CA LYS A 119 -5.519 -18.168 1.692 1.00 0.00 C ATOM 1651 C LYS A 119 -5.327 -19.359 2.631 1.00 0.00 C ATOM 1652 O LYS A 119 -4.482 -19.321 3.525 1.00 0.00 O ATOM 1653 CB LYS A 119 -5.003 -18.413 0.273 1.00 0.00 C ATOM 1654 CG LYS A 119 -6.136 -18.288 -0.750 1.00 0.00 C ATOM 1655 CD LYS A 119 -5.627 -18.566 -2.167 1.00 0.00 C ATOM 1656 CE LYS A 119 -6.785 -18.893 -3.110 1.00 0.00 C ATOM 1657 NZ LYS A 119 -6.563 -20.199 -3.772 1.00 0.00 N ATOM 0 H LYS A 119 -3.873 -17.069 2.378 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.593 -18.011 1.593 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -4.216 -17.696 0.039 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -4.559 -19.406 0.210 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -6.934 -18.988 -0.502 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -6.565 -17.287 -0.703 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.084 -17.697 -2.539 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.923 -19.398 -2.148 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -7.721 -18.916 -2.552 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.882 -18.110 -3.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -7.359 -20.405 -4.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -5.680 -20.164 -4.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -6.493 -20.946 -3.052 1.00 0.00 H new ATOM 1667 N ASP A 120 -6.123 -20.392 2.396 1.00 0.00 N ATOM 1668 CA ASP A 120 -6.051 -21.594 3.210 1.00 0.00 C ATOM 1669 C ASP A 120 -4.648 -22.193 3.102 1.00 0.00 C ATOM 1670 O ASP A 120 -4.075 -22.254 2.015 1.00 0.00 O ATOM 1671 CB ASP A 120 -7.053 -22.645 2.727 1.00 0.00 C ATOM 1672 CG ASP A 120 -8.125 -23.032 3.748 1.00 0.00 C ATOM 1673 OD1 ASP A 120 -7.764 -23.745 4.709 1.00 0.00 O ATOM 1674 OD2 ASP A 120 -9.282 -22.605 3.544 1.00 0.00 O ATOM 0 H ASP A 120 -6.821 -20.421 1.653 1.00 0.00 H new ATOM 0 HA ASP A 120 -6.283 -21.320 4.239 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -7.545 -22.271 1.829 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -6.505 -23.542 2.439 1.00 0.00 H new ATOM 1678 N SER A 121 -4.133 -22.621 4.247 1.00 0.00 N ATOM 1679 CA SER A 121 -2.807 -23.214 4.294 1.00 0.00 C ATOM 1680 C SER A 121 -1.750 -22.158 3.964 1.00 0.00 C ATOM 1681 O SER A 121 -1.856 -21.463 2.955 1.00 0.00 O ATOM 1682 CB SER A 121 -2.696 -24.396 3.330 1.00 0.00 C ATOM 1683 OG SER A 121 -2.667 -25.644 4.017 1.00 0.00 O ATOM 0 H SER A 121 -4.610 -22.569 5.147 1.00 0.00 H new ATOM 0 HA SER A 121 -2.636 -23.588 5.303 1.00 0.00 H new ATOM 0 HB2 SER A 121 -3.540 -24.382 2.640 1.00 0.00 H new ATOM 0 HB3 SER A 121 -1.792 -24.291 2.730 1.00 0.00 H new ATOM 0 HG SER A 121 -2.597 -26.374 3.367 1.00 0.00 H new ATOM 1688 N GLY A 122 -0.754 -22.071 4.835 1.00 0.00 N ATOM 1689 CA GLY A 122 0.322 -21.113 4.648 1.00 0.00 C ATOM 1690 C GLY A 122 1.370 -21.243 5.754 1.00 0.00 C ATOM 1691 O GLY A 122 1.062 -21.690 6.857 1.00 0.00 O ATOM 0 H GLY A 122 -0.670 -22.648 5.672 1.00 0.00 H new ATOM 0 HA2 GLY A 122 0.791 -21.273 3.677 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -0.084 -20.101 4.644 1.00 0.00 H new ATOM 1695 N PRO A 123 2.620 -20.834 5.411 1.00 0.00 N ATOM 1696 CA PRO A 123 3.718 -20.900 6.362 1.00 0.00 C ATOM 1697 C PRO A 123 3.604 -19.789 7.409 1.00 0.00 C ATOM 1698 O PRO A 123 3.288 -18.649 7.075 1.00 0.00 O ATOM 1699 CB PRO A 123 4.977 -20.794 5.519 1.00 0.00 C ATOM 1700 CG PRO A 123 4.539 -20.209 4.186 1.00 0.00 C ATOM 1701 CD PRO A 123 3.023 -20.300 4.113 1.00 0.00 C ATOM 0 HA PRO A 123 3.719 -21.825 6.939 1.00 0.00 H new ATOM 0 HB2 PRO A 123 5.717 -20.155 6.001 1.00 0.00 H new ATOM 0 HB3 PRO A 123 5.439 -21.772 5.383 1.00 0.00 H new ATOM 0 HG2 PRO A 123 4.864 -19.172 4.099 1.00 0.00 H new ATOM 0 HG3 PRO A 123 4.995 -20.756 3.361 1.00 0.00 H new ATOM 0 HD2 PRO A 123 2.576 -19.323 3.931 1.00 0.00 H new ATOM 0 HD3 PRO A 123 2.704 -20.953 3.300 1.00 0.00 H new ATOM 1706 N SER A 124 3.867 -20.162 8.653 1.00 0.00 N ATOM 1707 CA SER A 124 3.799 -19.212 9.748 1.00 0.00 C ATOM 1708 C SER A 124 4.946 -19.459 10.729 1.00 0.00 C ATOM 1709 O SER A 124 5.792 -18.590 10.933 1.00 0.00 O ATOM 1710 CB SER A 124 2.454 -19.302 10.472 1.00 0.00 C ATOM 1711 OG SER A 124 1.546 -18.291 10.042 1.00 0.00 O ATOM 0 H SER A 124 4.128 -21.110 8.926 1.00 0.00 H new ATOM 0 HA SER A 124 3.893 -18.208 9.335 1.00 0.00 H new ATOM 0 HB2 SER A 124 2.013 -20.283 10.297 1.00 0.00 H new ATOM 0 HB3 SER A 124 2.614 -19.212 11.546 1.00 0.00 H new ATOM 0 HG SER A 124 0.699 -18.384 10.527 1.00 0.00 H new ATOM 1716 N SER A 125 4.938 -20.650 11.310 1.00 0.00 N ATOM 1717 CA SER A 125 5.969 -21.024 12.265 1.00 0.00 C ATOM 1718 C SER A 125 6.765 -22.218 11.734 1.00 0.00 C ATOM 1719 O SER A 125 7.981 -22.137 11.574 1.00 0.00 O ATOM 1720 CB SER A 125 5.362 -21.353 13.629 1.00 0.00 C ATOM 1721 OG SER A 125 5.509 -20.278 14.553 1.00 0.00 O ATOM 0 H SER A 125 4.235 -21.368 11.138 1.00 0.00 H new ATOM 0 HA SER A 125 6.642 -20.176 12.393 1.00 0.00 H new ATOM 0 HB2 SER A 125 4.304 -21.585 13.508 1.00 0.00 H new ATOM 0 HB3 SER A 125 5.840 -22.246 14.033 1.00 0.00 H new ATOM 0 HG SER A 125 5.107 -20.527 15.411 1.00 0.00 H new ATOM 1726 N GLY A 126 6.046 -23.301 11.477 1.00 0.00 N ATOM 1727 CA GLY A 126 6.669 -24.510 10.970 1.00 0.00 C ATOM 1728 C GLY A 126 7.561 -25.155 12.032 1.00 0.00 C ATOM 1729 O GLY A 126 7.244 -25.118 13.220 1.00 0.00 O ATOM 0 H GLY A 126 5.037 -23.365 11.611 1.00 0.00 H new ATOM 0 HA2 GLY A 126 5.900 -25.216 10.659 1.00 0.00 H new ATOM 0 HA3 GLY A 126 7.262 -24.274 10.086 1.00 0.00 H new TER 1733 GLY A 126