USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1209 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 66 CYS SG : rot -32:sc= -1.11 USER MOD Set 1.2: A 141 HIS : no HE2:sc= -5 K(o=-6.1,f=-7.4!) USER MOD Set 2.1: A 41 THR OG1 : rot 80:sc= 1.5 USER MOD Set 2.2: A 87 HIS : no HE2:sc= -5.34 K(o=-3.8,f=-5.3!) USER MOD Set 3.1: A 46 MET CE :methyl -113:sc= -0.417 (180deg=-1.81!) USER MOD Set 3.2: A 61 THR OG1 : rot 100:sc= 0.806 USER MOD Set 4.1: A 11 ASN :FLIP amide:sc= -3.02! C(o=-3.7!,f=-3!) USER MOD Set 4.2: A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 13 ASN : amide:sc= -0.778 K(o=-0.33,f=-5.9!) USER MOD Set 5.2: A 21 TYR OH : rot -116:sc= 0.448 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 21:sc= 0.0898 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 13:sc= 0.267! USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot -66:sc= 1.18 USER MOD Single : A 15 SER OG : rot 67:sc= 0.00374 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 MET CE :methyl 150:sc= 0 (180deg=-1.29) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.098) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= -2.59 K(o=-2.6,f=-5!) USER MOD Single : A 51 LYS NZ :NH3+ 159:sc= -0.0552 (180deg=-0.345) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.112 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 72 THR OG1 : rot -170:sc= -0.0152 USER MOD Single : A 73 GLN : amide:sc= -0.111 X(o=-0.11,f=-0.067) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 TYR OH : rot 0:sc= -0.569 USER MOD Single : A 84 ASN :FLIP amide:sc= -0.0445 F(o=-1.4,f=-0.044) USER MOD Single : A 86 SER OG : rot 21:sc= 0.749! USER MOD Single : A 90 ASN : amide:sc= -0.0703 X(o=-0.07,f=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= -0.507 X(o=-0.51,f=-0.26) USER MOD Single : A 95 MET CE :methyl -120:sc= -0.0101 (180deg=-2.47!) USER MOD Single : A 101 LYS NZ :NH3+ -178:sc= -0.988 (180deg=-1.02) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 ASN : amide:sc= -3.26 K(o=-3.3,f=-12!) USER MOD Single : A 114 THR OG1 : rot -105:sc= 1.06 USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 ASN : amide:sc= 0 K(o=0,f=-2.3) USER MOD Single : A 121 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.486) USER MOD Single : A 122 LYS NZ :NH3+ 169:sc=-0.00251 (180deg=-0.118) USER MOD Single : A 123 GLN :FLIP amide:sc= -3.92! C(o=-4.8!,f=-3.9!) USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -3.83! C(o=-3.8!,f=-9.3!) USER MOD Single : A 128 SER OG : rot 180:sc= -0.766 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot -170:sc= -0.0807 USER MOD Single : A 142 HIS :FLIP no HD1:sc= -0.322 F(o=-1,f=-0.32) USER MOD Single : A 143 LYS NZ :NH3+ 150:sc= -0.347 (180deg=-1.21!) USER MOD Single : A 145 CYS SG : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot 96:sc= 1.07 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 ASN :FLIP amide:sc= 0.732 F(o=-0.5,f=0.73) USER MOD Single : A 155 ASN : amide:sc= -0.0736 K(o=-0.074,f=-2.1!) USER MOD Single : A 156 SER OG : rot 180:sc= -0.0601 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 27.344 -1.417 -24.860 1.00 0.00 N ATOM 2 CA GLY A 1 28.017 -1.317 -23.578 1.00 0.00 C ATOM 3 C GLY A 1 27.436 -2.259 -22.543 1.00 0.00 C ATOM 4 O GLY A 1 28.044 -3.277 -22.209 1.00 0.00 O ATOM 0 H1 GLY A 1 27.778 -0.753 -25.533 1.00 0.00 H new ATOM 0 H2 GLY A 1 27.433 -2.387 -25.224 1.00 0.00 H new ATOM 0 H3 GLY A 1 26.338 -1.182 -24.743 1.00 0.00 H new ATOM 0 HA2 GLY A 1 29.077 -1.536 -23.709 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.946 -0.292 -23.213 1.00 0.00 H new ATOM 8 N SER A 2 26.257 -1.920 -22.032 1.00 0.00 N ATOM 9 CA SER A 2 25.596 -2.741 -21.024 1.00 0.00 C ATOM 10 C SER A 2 24.081 -2.697 -21.195 1.00 0.00 C ATOM 11 O SER A 2 23.558 -1.919 -21.993 1.00 0.00 O ATOM 12 CB SER A 2 25.976 -2.267 -19.620 1.00 0.00 C ATOM 13 OG SER A 2 27.214 -2.822 -19.211 1.00 0.00 O ATOM 0 H SER A 2 25.740 -1.083 -22.299 1.00 0.00 H new ATOM 0 HA SER A 2 25.929 -3.771 -21.155 1.00 0.00 H new ATOM 0 HB2 SER A 2 26.039 -1.179 -19.605 1.00 0.00 H new ATOM 0 HB3 SER A 2 25.196 -2.551 -18.914 1.00 0.00 H new ATOM 0 HG SER A 2 27.720 -3.110 -19.999 1.00 0.00 H new ATOM 19 N SER A 3 23.382 -3.539 -20.441 1.00 0.00 N ATOM 20 CA SER A 3 21.926 -3.600 -20.511 1.00 0.00 C ATOM 21 C SER A 3 21.306 -3.366 -19.137 1.00 0.00 C ATOM 22 O SER A 3 21.896 -3.703 -18.112 1.00 0.00 O ATOM 23 CB SER A 3 21.477 -4.954 -21.062 1.00 0.00 C ATOM 24 OG SER A 3 22.076 -6.020 -20.345 1.00 0.00 O ATOM 0 H SER A 3 23.800 -4.188 -19.775 1.00 0.00 H new ATOM 0 HA SER A 3 21.586 -2.812 -21.183 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.392 -5.034 -20.999 1.00 0.00 H new ATOM 0 HB3 SER A 3 21.742 -5.027 -22.117 1.00 0.00 H new ATOM 0 HG SER A 3 21.772 -6.875 -20.715 1.00 0.00 H new ATOM 30 N GLY A 4 20.109 -2.786 -19.126 1.00 0.00 N ATOM 31 CA GLY A 4 19.428 -2.516 -17.873 1.00 0.00 C ATOM 32 C GLY A 4 19.586 -1.077 -17.425 1.00 0.00 C ATOM 33 O GLY A 4 20.520 -0.747 -16.694 1.00 0.00 O ATOM 0 H GLY A 4 19.599 -2.499 -19.962 1.00 0.00 H new ATOM 0 HA2 GLY A 4 18.368 -2.745 -17.983 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.819 -3.179 -17.101 1.00 0.00 H new ATOM 37 N SER A 5 18.673 -0.217 -17.865 1.00 0.00 N ATOM 38 CA SER A 5 18.719 1.196 -17.509 1.00 0.00 C ATOM 39 C SER A 5 17.933 1.459 -16.228 1.00 0.00 C ATOM 40 O SER A 5 16.703 1.421 -16.222 1.00 0.00 O ATOM 41 CB SER A 5 18.159 2.049 -18.648 1.00 0.00 C ATOM 42 OG SER A 5 17.965 3.390 -18.234 1.00 0.00 O ATOM 0 H SER A 5 17.892 -0.474 -18.469 1.00 0.00 H new ATOM 0 HA SER A 5 19.760 1.469 -17.339 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.843 2.023 -19.496 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.212 1.630 -18.989 1.00 0.00 H new ATOM 0 HG SER A 5 17.608 3.915 -18.981 1.00 0.00 H new ATOM 48 N SER A 6 18.654 1.726 -15.143 1.00 0.00 N ATOM 49 CA SER A 6 18.025 1.992 -13.854 1.00 0.00 C ATOM 50 C SER A 6 18.912 2.885 -12.992 1.00 0.00 C ATOM 51 O SER A 6 20.093 2.603 -12.796 1.00 0.00 O ATOM 52 CB SER A 6 17.739 0.679 -13.122 1.00 0.00 C ATOM 53 OG SER A 6 18.912 0.168 -12.513 1.00 0.00 O ATOM 0 H SER A 6 19.673 1.764 -15.131 1.00 0.00 H new ATOM 0 HA SER A 6 17.084 2.511 -14.036 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.973 0.841 -12.364 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.342 -0.054 -13.825 1.00 0.00 H new ATOM 0 HG SER A 6 19.607 0.859 -12.510 1.00 0.00 H new ATOM 59 N GLY A 7 18.331 3.966 -12.479 1.00 0.00 N ATOM 60 CA GLY A 7 19.082 4.885 -11.643 1.00 0.00 C ATOM 61 C GLY A 7 18.278 5.378 -10.456 1.00 0.00 C ATOM 62 O GLY A 7 18.083 4.649 -9.485 1.00 0.00 O ATOM 0 H GLY A 7 17.355 4.221 -12.627 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.986 4.391 -11.286 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.401 5.738 -12.242 1.00 0.00 H new ATOM 66 N MET A 8 17.812 6.620 -10.534 1.00 0.00 N ATOM 67 CA MET A 8 17.025 7.210 -9.457 1.00 0.00 C ATOM 68 C MET A 8 15.953 6.239 -8.973 1.00 0.00 C ATOM 69 O MET A 8 14.946 6.025 -9.648 1.00 0.00 O ATOM 70 CB MET A 8 16.376 8.513 -9.925 1.00 0.00 C ATOM 71 CG MET A 8 17.379 9.573 -10.352 1.00 0.00 C ATOM 72 SD MET A 8 18.229 10.328 -8.953 1.00 0.00 S ATOM 73 CE MET A 8 19.428 11.356 -9.799 1.00 0.00 C ATOM 0 H MET A 8 17.966 7.237 -11.331 1.00 0.00 H new ATOM 0 HA MET A 8 17.697 7.426 -8.626 1.00 0.00 H new ATOM 0 HB2 MET A 8 15.710 8.298 -10.760 1.00 0.00 H new ATOM 0 HB3 MET A 8 15.759 8.912 -9.120 1.00 0.00 H new ATOM 0 HG2 MET A 8 18.114 9.124 -11.020 1.00 0.00 H new ATOM 0 HG3 MET A 8 16.864 10.347 -10.920 1.00 0.00 H new ATOM 0 HE1 MET A 8 20.032 11.889 -9.065 1.00 0.00 H new ATOM 0 HE2 MET A 8 20.074 10.730 -10.415 1.00 0.00 H new ATOM 0 HE3 MET A 8 18.908 12.075 -10.432 1.00 0.00 H new ATOM 83 N SER A 9 16.175 5.655 -7.800 1.00 0.00 N ATOM 84 CA SER A 9 15.229 4.704 -7.228 1.00 0.00 C ATOM 85 C SER A 9 15.527 4.463 -5.751 1.00 0.00 C ATOM 86 O SER A 9 16.664 4.612 -5.303 1.00 0.00 O ATOM 87 CB SER A 9 15.280 3.380 -7.993 1.00 0.00 C ATOM 88 OG SER A 9 16.596 2.857 -8.023 1.00 0.00 O ATOM 0 H SER A 9 17.002 5.824 -7.227 1.00 0.00 H new ATOM 0 HA SER A 9 14.228 5.127 -7.314 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.610 2.660 -7.524 1.00 0.00 H new ATOM 0 HB3 SER A 9 14.922 3.531 -9.012 1.00 0.00 H new ATOM 0 HG SER A 9 17.172 3.450 -8.550 1.00 0.00 H new ATOM 94 N VAL A 10 14.497 4.088 -5.000 1.00 0.00 N ATOM 95 CA VAL A 10 14.647 3.825 -3.574 1.00 0.00 C ATOM 96 C VAL A 10 14.249 2.392 -3.235 1.00 0.00 C ATOM 97 O VAL A 10 13.927 1.601 -4.119 1.00 0.00 O ATOM 98 CB VAL A 10 13.797 4.795 -2.731 1.00 0.00 C ATOM 99 CG1 VAL A 10 14.162 6.237 -3.048 1.00 0.00 C ATOM 100 CG2 VAL A 10 12.315 4.547 -2.968 1.00 0.00 C ATOM 0 H VAL A 10 13.550 3.959 -5.355 1.00 0.00 H new ATOM 0 HA VAL A 10 15.700 3.974 -3.334 1.00 0.00 H new ATOM 0 HB VAL A 10 14.008 4.615 -1.677 1.00 0.00 H new ATOM 0 HG11 VAL A 10 13.552 6.908 -2.443 1.00 0.00 H new ATOM 0 HG12 VAL A 10 15.216 6.403 -2.824 1.00 0.00 H new ATOM 0 HG13 VAL A 10 13.981 6.434 -4.105 1.00 0.00 H new ATOM 0 HG21 VAL A 10 11.729 5.241 -2.365 1.00 0.00 H new ATOM 0 HG22 VAL A 10 12.085 4.699 -4.022 1.00 0.00 H new ATOM 0 HG23 VAL A 10 12.068 3.523 -2.687 1.00 0.00 H new ATOM 110 N ASN A 11 14.274 2.066 -1.946 1.00 0.00 N ATOM 111 CA ASN A 11 13.916 0.728 -1.489 1.00 0.00 C ATOM 112 C ASN A 11 12.414 0.493 -1.618 1.00 0.00 C ATOM 113 O ASN A 11 11.624 1.437 -1.604 1.00 0.00 O ATOM 114 CB ASN A 11 14.352 0.529 -0.036 1.00 0.00 C ATOM 115 CG ASN A 11 15.823 0.834 0.173 1.00 0.00 C ATOM 116 OD1 ASN A 11 16.634 -0.212 0.279 1.00 0.00 O flip ATOM 117 ND2 ASN A 11 16.225 1.996 0.238 1.00 0.00 N flip ATOM 0 H ASN A 11 14.538 2.710 -1.200 1.00 0.00 H new ATOM 0 HA ASN A 11 14.434 0.005 -2.119 1.00 0.00 H new ATOM 0 HB2 ASN A 11 13.755 1.172 0.611 1.00 0.00 H new ATOM 0 HB3 ASN A 11 14.151 -0.500 0.263 1.00 0.00 H new ATOM 0 HD21 ASN A 11 15.566 2.769 0.151 1.00 0.00 H new ATOM 0 HD22 ASN A 11 17.217 2.185 0.379 1.00 0.00 H new ATOM 124 N VAL A 12 12.027 -0.772 -1.742 1.00 0.00 N ATOM 125 CA VAL A 12 10.620 -1.132 -1.872 1.00 0.00 C ATOM 126 C VAL A 12 9.885 -0.960 -0.547 1.00 0.00 C ATOM 127 O VAL A 12 8.674 -0.748 -0.521 1.00 0.00 O ATOM 128 CB VAL A 12 10.455 -2.586 -2.353 1.00 0.00 C ATOM 129 CG1 VAL A 12 9.017 -2.849 -2.775 1.00 0.00 C ATOM 130 CG2 VAL A 12 11.417 -2.882 -3.494 1.00 0.00 C ATOM 0 H VAL A 12 12.668 -1.565 -1.755 1.00 0.00 H new ATOM 0 HA VAL A 12 10.188 -0.461 -2.614 1.00 0.00 H new ATOM 0 HB VAL A 12 10.693 -3.254 -1.525 1.00 0.00 H new ATOM 0 HG11 VAL A 12 8.920 -3.881 -3.112 1.00 0.00 H new ATOM 0 HG12 VAL A 12 8.352 -2.679 -1.928 1.00 0.00 H new ATOM 0 HG13 VAL A 12 8.747 -2.175 -3.588 1.00 0.00 H new ATOM 0 HG21 VAL A 12 11.287 -3.913 -3.821 1.00 0.00 H new ATOM 0 HG22 VAL A 12 11.212 -2.209 -4.326 1.00 0.00 H new ATOM 0 HG23 VAL A 12 12.442 -2.736 -3.153 1.00 0.00 H new ATOM 140 N ASN A 13 10.627 -1.054 0.552 1.00 0.00 N ATOM 141 CA ASN A 13 10.045 -0.908 1.881 1.00 0.00 C ATOM 142 C ASN A 13 10.408 0.444 2.489 1.00 0.00 C ATOM 143 O ASN A 13 9.753 0.912 3.420 1.00 0.00 O ATOM 144 CB ASN A 13 10.526 -2.036 2.797 1.00 0.00 C ATOM 145 CG ASN A 13 10.381 -3.403 2.155 1.00 0.00 C ATOM 146 OD1 ASN A 13 9.749 -3.546 1.109 1.00 0.00 O ATOM 147 ND2 ASN A 13 10.969 -4.415 2.782 1.00 0.00 N ATOM 0 H ASN A 13 11.632 -1.230 0.548 1.00 0.00 H new ATOM 0 HA ASN A 13 8.961 -0.964 1.784 1.00 0.00 H new ATOM 0 HB2 ASN A 13 11.571 -1.869 3.057 1.00 0.00 H new ATOM 0 HB3 ASN A 13 9.958 -2.012 3.727 1.00 0.00 H new ATOM 0 HD21 ASN A 13 10.907 -5.358 2.398 1.00 0.00 H new ATOM 0 HD22 ASN A 13 11.483 -4.249 3.647 1.00 0.00 H new ATOM 154 N ARG A 14 11.453 1.066 1.954 1.00 0.00 N ATOM 155 CA ARG A 14 11.903 2.363 2.443 1.00 0.00 C ATOM 156 C ARG A 14 12.272 2.289 3.922 1.00 0.00 C ATOM 157 O ARG A 14 12.207 3.287 4.639 1.00 0.00 O ATOM 158 CB ARG A 14 10.814 3.417 2.231 1.00 0.00 C ATOM 159 CG ARG A 14 10.925 4.149 0.903 1.00 0.00 C ATOM 160 CD ARG A 14 11.824 5.371 1.014 1.00 0.00 C ATOM 161 NE ARG A 14 11.111 6.528 1.547 1.00 0.00 N ATOM 162 CZ ARG A 14 11.108 6.862 2.833 1.00 0.00 C ATOM 163 NH1 ARG A 14 11.779 6.130 3.713 1.00 0.00 N ATOM 164 NH2 ARG A 14 10.435 7.930 3.241 1.00 0.00 N ATOM 0 H ARG A 14 12.004 0.692 1.181 1.00 0.00 H new ATOM 0 HA ARG A 14 12.791 2.648 1.878 1.00 0.00 H new ATOM 0 HB2 ARG A 14 9.838 2.936 2.290 1.00 0.00 H new ATOM 0 HB3 ARG A 14 10.861 4.144 3.042 1.00 0.00 H new ATOM 0 HG2 ARG A 14 11.321 3.473 0.145 1.00 0.00 H new ATOM 0 HG3 ARG A 14 9.933 4.455 0.571 1.00 0.00 H new ATOM 0 HD2 ARG A 14 12.672 5.140 1.658 1.00 0.00 H new ATOM 0 HD3 ARG A 14 12.227 5.615 0.031 1.00 0.00 H new ATOM 0 HE ARG A 14 10.586 7.112 0.896 1.00 0.00 H new ATOM 0 HH11 ARG A 14 12.299 5.309 3.403 1.00 0.00 H new ATOM 0 HH12 ARG A 14 11.775 6.388 4.700 1.00 0.00 H new ATOM 0 HH21 ARG A 14 9.919 8.496 2.567 1.00 0.00 H new ATOM 0 HH22 ARG A 14 10.433 8.185 4.229 1.00 0.00 H new ATOM 178 N SER A 15 12.660 1.099 4.370 1.00 0.00 N ATOM 179 CA SER A 15 13.035 0.893 5.764 1.00 0.00 C ATOM 180 C SER A 15 14.427 0.276 5.866 1.00 0.00 C ATOM 181 O SER A 15 15.140 0.483 6.848 1.00 0.00 O ATOM 182 CB SER A 15 12.014 -0.008 6.461 1.00 0.00 C ATOM 183 OG SER A 15 10.763 0.646 6.592 1.00 0.00 O ATOM 0 H SER A 15 12.723 0.264 3.788 1.00 0.00 H new ATOM 0 HA SER A 15 13.049 1.864 6.258 1.00 0.00 H new ATOM 0 HB2 SER A 15 11.889 -0.929 5.892 1.00 0.00 H new ATOM 0 HB3 SER A 15 12.386 -0.290 7.446 1.00 0.00 H new ATOM 0 HG SER A 15 10.369 0.780 5.705 1.00 0.00 H new ATOM 189 N VAL A 16 14.808 -0.483 4.843 1.00 0.00 N ATOM 190 CA VAL A 16 16.114 -1.130 4.816 1.00 0.00 C ATOM 191 C VAL A 16 17.200 -0.156 4.373 1.00 0.00 C ATOM 192 O VAL A 16 17.030 0.580 3.401 1.00 0.00 O ATOM 193 CB VAL A 16 16.117 -2.348 3.873 1.00 0.00 C ATOM 194 CG1 VAL A 16 15.681 -1.942 2.474 1.00 0.00 C ATOM 195 CG2 VAL A 16 17.494 -2.995 3.844 1.00 0.00 C ATOM 0 H VAL A 16 14.230 -0.665 4.022 1.00 0.00 H new ATOM 0 HA VAL A 16 16.323 -1.465 5.832 1.00 0.00 H new ATOM 0 HB VAL A 16 15.404 -3.080 4.251 1.00 0.00 H new ATOM 0 HG11 VAL A 16 15.689 -2.816 1.822 1.00 0.00 H new ATOM 0 HG12 VAL A 16 14.673 -1.528 2.513 1.00 0.00 H new ATOM 0 HG13 VAL A 16 16.367 -1.191 2.083 1.00 0.00 H new ATOM 0 HG21 VAL A 16 17.478 -3.854 3.173 1.00 0.00 H new ATOM 0 HG22 VAL A 16 18.229 -2.272 3.490 1.00 0.00 H new ATOM 0 HG23 VAL A 16 17.763 -3.324 4.848 1.00 0.00 H new ATOM 205 N SER A 17 18.317 -0.157 5.093 1.00 0.00 N ATOM 206 CA SER A 17 19.431 0.729 4.777 1.00 0.00 C ATOM 207 C SER A 17 20.581 -0.048 4.143 1.00 0.00 C ATOM 208 O SER A 17 21.742 0.127 4.513 1.00 0.00 O ATOM 209 CB SER A 17 19.918 1.441 6.041 1.00 0.00 C ATOM 210 OG SER A 17 18.851 2.102 6.698 1.00 0.00 O ATOM 0 H SER A 17 18.475 -0.762 5.899 1.00 0.00 H new ATOM 0 HA SER A 17 19.080 1.472 4.061 1.00 0.00 H new ATOM 0 HB2 SER A 17 20.373 0.717 6.717 1.00 0.00 H new ATOM 0 HB3 SER A 17 20.692 2.163 5.780 1.00 0.00 H new ATOM 0 HG SER A 17 19.188 2.547 7.503 1.00 0.00 H new ATOM 216 N ASP A 18 20.248 -0.907 3.185 1.00 0.00 N ATOM 217 CA ASP A 18 21.251 -1.711 2.497 1.00 0.00 C ATOM 218 C ASP A 18 21.180 -1.495 0.989 1.00 0.00 C ATOM 219 O ASP A 18 20.313 -0.773 0.497 1.00 0.00 O ATOM 220 CB ASP A 18 21.058 -3.193 2.823 1.00 0.00 C ATOM 221 CG ASP A 18 21.667 -3.577 4.157 1.00 0.00 C ATOM 222 OD1 ASP A 18 22.911 -3.646 4.244 1.00 0.00 O ATOM 223 OD2 ASP A 18 20.900 -3.807 5.114 1.00 0.00 O ATOM 0 H ASP A 18 19.291 -1.064 2.868 1.00 0.00 H new ATOM 0 HA ASP A 18 22.235 -1.396 2.844 1.00 0.00 H new ATOM 0 HB2 ASP A 18 19.993 -3.424 2.833 1.00 0.00 H new ATOM 0 HB3 ASP A 18 21.507 -3.797 2.035 1.00 0.00 H new ATOM 228 N GLN A 19 22.097 -2.124 0.262 1.00 0.00 N ATOM 229 CA GLN A 19 22.138 -1.999 -1.190 1.00 0.00 C ATOM 230 C GLN A 19 21.923 -3.352 -1.860 1.00 0.00 C ATOM 231 O GLN A 19 22.025 -3.476 -3.081 1.00 0.00 O ATOM 232 CB GLN A 19 23.476 -1.404 -1.634 1.00 0.00 C ATOM 233 CG GLN A 19 24.681 -2.212 -1.180 1.00 0.00 C ATOM 234 CD GLN A 19 25.996 -1.579 -1.592 1.00 0.00 C ATOM 235 OE1 GLN A 19 26.659 -0.920 -0.790 1.00 0.00 O ATOM 236 NE2 GLN A 19 26.381 -1.777 -2.847 1.00 0.00 N ATOM 0 H GLN A 19 22.822 -2.725 0.654 1.00 0.00 H new ATOM 0 HA GLN A 19 21.332 -1.331 -1.494 1.00 0.00 H new ATOM 0 HB2 GLN A 19 23.488 -1.329 -2.721 1.00 0.00 H new ATOM 0 HB3 GLN A 19 23.561 -0.390 -1.244 1.00 0.00 H new ATOM 0 HG2 GLN A 19 24.656 -2.316 -0.095 1.00 0.00 H new ATOM 0 HG3 GLN A 19 24.619 -3.217 -1.598 1.00 0.00 H new ATOM 0 HE21 GLN A 19 25.800 -2.330 -3.477 1.00 0.00 H new ATOM 0 HE22 GLN A 19 27.258 -1.376 -3.181 1.00 0.00 H new ATOM 245 N PHE A 20 21.624 -4.365 -1.053 1.00 0.00 N ATOM 246 CA PHE A 20 21.395 -5.710 -1.567 1.00 0.00 C ATOM 247 C PHE A 20 19.972 -5.855 -2.097 1.00 0.00 C ATOM 248 O PHE A 20 19.715 -6.636 -3.013 1.00 0.00 O ATOM 249 CB PHE A 20 21.653 -6.748 -0.473 1.00 0.00 C ATOM 250 CG PHE A 20 23.085 -6.804 -0.025 1.00 0.00 C ATOM 251 CD1 PHE A 20 23.580 -5.874 0.874 1.00 0.00 C ATOM 252 CD2 PHE A 20 23.937 -7.787 -0.503 1.00 0.00 C ATOM 253 CE1 PHE A 20 24.899 -5.923 1.288 1.00 0.00 C ATOM 254 CE2 PHE A 20 25.256 -7.841 -0.093 1.00 0.00 C ATOM 255 CZ PHE A 20 25.737 -6.908 0.804 1.00 0.00 C ATOM 0 H PHE A 20 21.535 -4.280 -0.041 1.00 0.00 H new ATOM 0 HA PHE A 20 22.089 -5.880 -2.390 1.00 0.00 H new ATOM 0 HB2 PHE A 20 21.021 -6.524 0.386 1.00 0.00 H new ATOM 0 HB3 PHE A 20 21.357 -7.731 -0.839 1.00 0.00 H new ATOM 0 HD1 PHE A 20 22.929 -5.102 1.256 1.00 0.00 H new ATOM 0 HD2 PHE A 20 23.566 -8.520 -1.204 1.00 0.00 H new ATOM 0 HE1 PHE A 20 25.273 -5.192 1.989 1.00 0.00 H new ATOM 0 HE2 PHE A 20 25.909 -8.612 -0.474 1.00 0.00 H new ATOM 0 HZ PHE A 20 26.767 -6.949 1.127 1.00 0.00 H new ATOM 265 N TYR A 21 19.050 -5.098 -1.513 1.00 0.00 N ATOM 266 CA TYR A 21 17.651 -5.143 -1.922 1.00 0.00 C ATOM 267 C TYR A 21 17.525 -5.046 -3.439 1.00 0.00 C ATOM 268 O TYR A 21 17.446 -3.952 -3.998 1.00 0.00 O ATOM 269 CB TYR A 21 16.867 -4.009 -1.260 1.00 0.00 C ATOM 270 CG TYR A 21 15.425 -4.359 -0.970 1.00 0.00 C ATOM 271 CD1 TYR A 21 14.577 -4.791 -1.982 1.00 0.00 C ATOM 272 CD2 TYR A 21 14.911 -4.259 0.317 1.00 0.00 C ATOM 273 CE1 TYR A 21 13.258 -5.111 -1.722 1.00 0.00 C ATOM 274 CE2 TYR A 21 13.594 -4.579 0.587 1.00 0.00 C ATOM 275 CZ TYR A 21 12.772 -5.003 -0.436 1.00 0.00 C ATOM 276 OH TYR A 21 11.459 -5.323 -0.172 1.00 0.00 O ATOM 0 H TYR A 21 19.246 -4.445 -0.754 1.00 0.00 H new ATOM 0 HA TYR A 21 17.235 -6.098 -1.601 1.00 0.00 H new ATOM 0 HB2 TYR A 21 17.360 -3.734 -0.328 1.00 0.00 H new ATOM 0 HB3 TYR A 21 16.896 -3.132 -1.907 1.00 0.00 H new ATOM 0 HD1 TYR A 21 14.955 -4.878 -2.990 1.00 0.00 H new ATOM 0 HD2 TYR A 21 15.552 -3.926 1.120 1.00 0.00 H new ATOM 0 HE1 TYR A 21 12.612 -5.444 -2.521 1.00 0.00 H new ATOM 0 HE2 TYR A 21 13.211 -4.498 1.593 1.00 0.00 H new ATOM 0 HH TYR A 21 10.983 -4.523 0.135 1.00 0.00 H new ATOM 286 N ARG A 22 17.505 -6.199 -4.100 1.00 0.00 N ATOM 287 CA ARG A 22 17.389 -6.245 -5.553 1.00 0.00 C ATOM 288 C ARG A 22 16.201 -5.414 -6.030 1.00 0.00 C ATOM 289 O ARG A 22 16.373 -4.390 -6.691 1.00 0.00 O ATOM 290 CB ARG A 22 17.236 -7.691 -6.028 1.00 0.00 C ATOM 291 CG ARG A 22 17.625 -7.899 -7.482 1.00 0.00 C ATOM 292 CD ARG A 22 16.461 -7.610 -8.417 1.00 0.00 C ATOM 293 NE ARG A 22 16.422 -6.208 -8.825 1.00 0.00 N ATOM 294 CZ ARG A 22 15.637 -5.746 -9.792 1.00 0.00 C ATOM 295 NH1 ARG A 22 14.831 -6.570 -10.447 1.00 0.00 N ATOM 296 NH2 ARG A 22 15.658 -4.457 -10.106 1.00 0.00 N ATOM 0 H ARG A 22 17.568 -7.114 -3.653 1.00 0.00 H new ATOM 0 HA ARG A 22 18.300 -5.824 -5.979 1.00 0.00 H new ATOM 0 HB2 ARG A 22 17.850 -8.337 -5.401 1.00 0.00 H new ATOM 0 HB3 ARG A 22 16.201 -8.002 -5.890 1.00 0.00 H new ATOM 0 HG2 ARG A 22 18.464 -7.249 -7.732 1.00 0.00 H new ATOM 0 HG3 ARG A 22 17.963 -8.925 -7.626 1.00 0.00 H new ATOM 0 HD2 ARG A 22 16.540 -8.243 -9.301 1.00 0.00 H new ATOM 0 HD3 ARG A 22 15.525 -7.870 -7.922 1.00 0.00 H new ATOM 0 HE ARG A 22 17.031 -5.548 -8.341 1.00 0.00 H new ATOM 0 HH11 ARG A 22 14.812 -7.562 -10.209 1.00 0.00 H new ATOM 0 HH12 ARG A 22 14.229 -6.212 -11.189 1.00 0.00 H new ATOM 0 HH21 ARG A 22 16.277 -3.820 -9.605 1.00 0.00 H new ATOM 0 HH22 ARG A 22 15.055 -4.103 -10.849 1.00 0.00 H new ATOM 310 N TYR A 23 14.998 -5.862 -5.690 1.00 0.00 N ATOM 311 CA TYR A 23 13.782 -5.162 -6.085 1.00 0.00 C ATOM 312 C TYR A 23 13.804 -3.715 -5.601 1.00 0.00 C ATOM 313 O TYR A 23 14.095 -3.442 -4.437 1.00 0.00 O ATOM 314 CB TYR A 23 12.551 -5.879 -5.528 1.00 0.00 C ATOM 315 CG TYR A 23 12.656 -7.387 -5.573 1.00 0.00 C ATOM 316 CD1 TYR A 23 13.086 -8.039 -6.723 1.00 0.00 C ATOM 317 CD2 TYR A 23 12.327 -8.159 -4.466 1.00 0.00 C ATOM 318 CE1 TYR A 23 13.183 -9.416 -6.768 1.00 0.00 C ATOM 319 CE2 TYR A 23 12.422 -9.537 -4.503 1.00 0.00 C ATOM 320 CZ TYR A 23 12.850 -10.161 -5.656 1.00 0.00 C ATOM 321 OH TYR A 23 12.947 -11.533 -5.698 1.00 0.00 O ATOM 0 H TYR A 23 14.839 -6.707 -5.141 1.00 0.00 H new ATOM 0 HA TYR A 23 13.732 -5.161 -7.174 1.00 0.00 H new ATOM 0 HB2 TYR A 23 12.394 -5.565 -4.496 1.00 0.00 H new ATOM 0 HB3 TYR A 23 11.673 -5.567 -6.093 1.00 0.00 H new ATOM 0 HD1 TYR A 23 13.349 -7.459 -7.596 1.00 0.00 H new ATOM 0 HD2 TYR A 23 11.991 -7.674 -3.561 1.00 0.00 H new ATOM 0 HE1 TYR A 23 13.518 -9.907 -7.670 1.00 0.00 H new ATOM 0 HE2 TYR A 23 12.162 -10.122 -3.633 1.00 0.00 H new ATOM 0 HH TYR A 23 12.677 -11.907 -4.833 1.00 0.00 H new ATOM 331 N LYS A 24 13.494 -2.791 -6.504 1.00 0.00 N ATOM 332 CA LYS A 24 13.475 -1.372 -6.172 1.00 0.00 C ATOM 333 C LYS A 24 12.243 -0.691 -6.760 1.00 0.00 C ATOM 334 O LYS A 24 11.534 -1.273 -7.580 1.00 0.00 O ATOM 335 CB LYS A 24 14.744 -0.689 -6.690 1.00 0.00 C ATOM 336 CG LYS A 24 16.011 -1.148 -5.989 1.00 0.00 C ATOM 337 CD LYS A 24 16.254 -0.368 -4.709 1.00 0.00 C ATOM 338 CE LYS A 24 17.608 -0.700 -4.102 1.00 0.00 C ATOM 339 NZ LYS A 24 17.690 -0.295 -2.671 1.00 0.00 N ATOM 0 H LYS A 24 13.252 -3.000 -7.473 1.00 0.00 H new ATOM 0 HA LYS A 24 13.436 -1.279 -5.087 1.00 0.00 H new ATOM 0 HB2 LYS A 24 14.840 -0.882 -7.759 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.642 0.389 -6.568 1.00 0.00 H new ATOM 0 HG2 LYS A 24 15.936 -2.211 -5.760 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.863 -1.025 -6.658 1.00 0.00 H new ATOM 0 HD2 LYS A 24 16.200 0.701 -4.917 1.00 0.00 H new ATOM 0 HD3 LYS A 24 15.467 -0.593 -3.990 1.00 0.00 H new ATOM 0 HE2 LYS A 24 17.791 -1.771 -4.187 1.00 0.00 H new ATOM 0 HE3 LYS A 24 18.392 -0.197 -4.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 18.628 -0.539 -2.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 17.541 0.731 -2.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 16.958 -0.794 -2.126 1.00 0.00 H new ATOM 353 N MET A 25 11.996 0.544 -6.337 1.00 0.00 N ATOM 354 CA MET A 25 10.851 1.304 -6.824 1.00 0.00 C ATOM 355 C MET A 25 11.169 2.795 -6.872 1.00 0.00 C ATOM 356 O MET A 25 11.765 3.357 -5.953 1.00 0.00 O ATOM 357 CB MET A 25 9.632 1.059 -5.932 1.00 0.00 C ATOM 358 CG MET A 25 9.725 1.739 -4.576 1.00 0.00 C ATOM 359 SD MET A 25 8.203 1.592 -3.620 1.00 0.00 S ATOM 360 CE MET A 25 8.650 2.486 -2.134 1.00 0.00 C ATOM 0 H MET A 25 12.573 1.040 -5.658 1.00 0.00 H new ATOM 0 HA MET A 25 10.626 0.966 -7.835 1.00 0.00 H new ATOM 0 HB2 MET A 25 8.739 1.413 -6.446 1.00 0.00 H new ATOM 0 HB3 MET A 25 9.510 -0.014 -5.784 1.00 0.00 H new ATOM 0 HG2 MET A 25 10.548 1.302 -4.011 1.00 0.00 H new ATOM 0 HG3 MET A 25 9.960 2.794 -4.718 1.00 0.00 H new ATOM 0 HE1 MET A 25 7.760 2.944 -1.703 1.00 0.00 H new ATOM 0 HE2 MET A 25 9.089 1.797 -1.413 1.00 0.00 H new ATOM 0 HE3 MET A 25 9.374 3.262 -2.380 1.00 0.00 H new ATOM 370 N PRO A 26 10.763 3.453 -7.969 1.00 0.00 N ATOM 371 CA PRO A 26 10.994 4.887 -8.162 1.00 0.00 C ATOM 372 C PRO A 26 10.153 5.742 -7.219 1.00 0.00 C ATOM 373 O PRO A 26 9.136 5.288 -6.696 1.00 0.00 O ATOM 374 CB PRO A 26 10.572 5.121 -9.615 1.00 0.00 C ATOM 375 CG PRO A 26 9.595 4.035 -9.906 1.00 0.00 C ATOM 376 CD PRO A 26 10.047 2.846 -9.103 1.00 0.00 C ATOM 0 HA PRO A 26 12.027 5.165 -7.953 1.00 0.00 H new ATOM 0 HB2 PRO A 26 10.120 6.105 -9.742 1.00 0.00 H new ATOM 0 HB3 PRO A 26 11.428 5.074 -10.288 1.00 0.00 H new ATOM 0 HG2 PRO A 26 8.585 4.334 -9.626 1.00 0.00 H new ATOM 0 HG3 PRO A 26 9.576 3.802 -10.971 1.00 0.00 H new ATOM 0 HD2 PRO A 26 9.203 2.242 -8.769 1.00 0.00 H new ATOM 0 HD3 PRO A 26 10.696 2.192 -9.685 1.00 0.00 H new ATOM 384 N ARG A 27 10.585 6.981 -7.008 1.00 0.00 N ATOM 385 CA ARG A 27 9.873 7.898 -6.127 1.00 0.00 C ATOM 386 C ARG A 27 8.714 8.566 -6.861 1.00 0.00 C ATOM 387 O ARG A 27 8.921 9.341 -7.796 1.00 0.00 O ATOM 388 CB ARG A 27 10.828 8.963 -5.584 1.00 0.00 C ATOM 389 CG ARG A 27 11.969 8.393 -4.758 1.00 0.00 C ATOM 390 CD ARG A 27 13.195 8.119 -5.615 1.00 0.00 C ATOM 391 NE ARG A 27 13.646 9.315 -6.322 1.00 0.00 N ATOM 392 CZ ARG A 27 14.400 10.257 -5.766 1.00 0.00 C ATOM 393 NH1 ARG A 27 14.785 10.143 -4.503 1.00 0.00 N ATOM 394 NH2 ARG A 27 14.770 11.316 -6.475 1.00 0.00 N ATOM 0 H ARG A 27 11.424 7.373 -7.435 1.00 0.00 H new ATOM 0 HA ARG A 27 9.470 7.322 -5.294 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.242 9.528 -6.419 1.00 0.00 H new ATOM 0 HB3 ARG A 27 10.264 9.667 -4.972 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.228 9.092 -3.963 1.00 0.00 H new ATOM 0 HG3 ARG A 27 11.646 7.469 -4.278 1.00 0.00 H new ATOM 0 HD2 ARG A 27 14.002 7.744 -4.985 1.00 0.00 H new ATOM 0 HD3 ARG A 27 12.965 7.336 -6.337 1.00 0.00 H new ATOM 0 HE ARG A 27 13.367 9.433 -7.296 1.00 0.00 H new ATOM 0 HH11 ARG A 27 14.502 9.330 -3.955 1.00 0.00 H new ATOM 0 HH12 ARG A 27 15.364 10.868 -4.079 1.00 0.00 H new ATOM 0 HH21 ARG A 27 14.475 11.407 -7.447 1.00 0.00 H new ATOM 0 HH22 ARG A 27 15.349 12.039 -6.048 1.00 0.00 H new ATOM 408 N LEU A 28 7.494 8.261 -6.432 1.00 0.00 N ATOM 409 CA LEU A 28 6.301 8.831 -7.048 1.00 0.00 C ATOM 410 C LEU A 28 6.380 10.354 -7.081 1.00 0.00 C ATOM 411 O LEU A 28 6.901 10.979 -6.156 1.00 0.00 O ATOM 412 CB LEU A 28 5.050 8.391 -6.286 1.00 0.00 C ATOM 413 CG LEU A 28 4.597 9.309 -5.151 1.00 0.00 C ATOM 414 CD1 LEU A 28 3.903 10.543 -5.707 1.00 0.00 C ATOM 415 CD2 LEU A 28 3.677 8.563 -4.196 1.00 0.00 C ATOM 0 H LEU A 28 7.305 7.622 -5.660 1.00 0.00 H new ATOM 0 HA LEU A 28 6.242 8.466 -8.073 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.230 8.296 -6.998 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.231 7.399 -5.873 1.00 0.00 H new ATOM 0 HG LEU A 28 5.479 9.631 -4.597 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.588 11.185 -4.884 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.593 11.090 -6.350 1.00 0.00 H new ATOM 0 HD13 LEU A 28 3.031 10.240 -6.286 1.00 0.00 H new ATOM 0 HD21 LEU A 28 3.365 9.232 -3.394 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.799 8.211 -4.737 1.00 0.00 H new ATOM 0 HD23 LEU A 28 4.207 7.711 -3.771 1.00 0.00 H new ATOM 427 N ILE A 29 5.859 10.945 -8.151 1.00 0.00 N ATOM 428 CA ILE A 29 5.868 12.395 -8.302 1.00 0.00 C ATOM 429 C ILE A 29 4.481 12.981 -8.063 1.00 0.00 C ATOM 430 O ILE A 29 3.472 12.292 -8.205 1.00 0.00 O ATOM 431 CB ILE A 29 6.355 12.812 -9.703 1.00 0.00 C ATOM 432 CG1 ILE A 29 7.748 12.240 -9.973 1.00 0.00 C ATOM 433 CG2 ILE A 29 6.365 14.328 -9.830 1.00 0.00 C ATOM 434 CD1 ILE A 29 8.024 11.990 -11.439 1.00 0.00 C ATOM 0 H ILE A 29 5.426 10.443 -8.926 1.00 0.00 H new ATOM 0 HA ILE A 29 6.559 12.786 -7.555 1.00 0.00 H new ATOM 0 HB ILE A 29 5.667 12.409 -10.446 1.00 0.00 H new ATOM 0 HG12 ILE A 29 8.497 12.929 -9.583 1.00 0.00 H new ATOM 0 HG13 ILE A 29 7.860 11.304 -9.426 1.00 0.00 H new ATOM 0 HG21 ILE A 29 6.711 14.607 -10.825 1.00 0.00 H new ATOM 0 HG22 ILE A 29 5.357 14.713 -9.675 1.00 0.00 H new ATOM 0 HG23 ILE A 29 7.034 14.751 -9.081 1.00 0.00 H new ATOM 0 HD11 ILE A 29 9.029 11.585 -11.556 1.00 0.00 H new ATOM 0 HD12 ILE A 29 7.298 11.277 -11.830 1.00 0.00 H new ATOM 0 HD13 ILE A 29 7.944 12.928 -11.989 1.00 0.00 H new ATOM 446 N ALA A 30 4.439 14.259 -7.701 1.00 0.00 N ATOM 447 CA ALA A 30 3.176 14.940 -7.446 1.00 0.00 C ATOM 448 C ALA A 30 3.199 16.363 -7.993 1.00 0.00 C ATOM 449 O ALA A 30 4.124 17.129 -7.723 1.00 0.00 O ATOM 450 CB ALA A 30 2.874 14.951 -5.954 1.00 0.00 C ATOM 0 H ALA A 30 5.266 14.844 -7.578 1.00 0.00 H new ATOM 0 HA ALA A 30 2.387 14.393 -7.962 1.00 0.00 H new ATOM 0 HB1 ALA A 30 1.928 15.463 -5.778 1.00 0.00 H new ATOM 0 HB2 ALA A 30 2.806 13.926 -5.589 1.00 0.00 H new ATOM 0 HB3 ALA A 30 3.672 15.472 -5.425 1.00 0.00 H new ATOM 456 N LYS A 31 2.175 16.712 -8.765 1.00 0.00 N ATOM 457 CA LYS A 31 2.076 18.043 -9.350 1.00 0.00 C ATOM 458 C LYS A 31 1.023 18.878 -8.630 1.00 0.00 C ATOM 459 O LYS A 31 -0.070 18.395 -8.333 1.00 0.00 O ATOM 460 CB LYS A 31 1.733 17.944 -10.839 1.00 0.00 C ATOM 461 CG LYS A 31 1.472 19.290 -11.493 1.00 0.00 C ATOM 462 CD LYS A 31 1.622 19.213 -13.003 1.00 0.00 C ATOM 463 CE LYS A 31 3.049 19.512 -13.437 1.00 0.00 C ATOM 464 NZ LYS A 31 3.103 20.077 -14.814 1.00 0.00 N ATOM 0 H LYS A 31 1.401 16.090 -9.000 1.00 0.00 H new ATOM 0 HA LYS A 31 3.042 18.534 -9.237 1.00 0.00 H new ATOM 0 HB2 LYS A 31 2.552 17.449 -11.360 1.00 0.00 H new ATOM 0 HB3 LYS A 31 0.852 17.314 -10.959 1.00 0.00 H new ATOM 0 HG2 LYS A 31 0.467 19.629 -11.243 1.00 0.00 H new ATOM 0 HG3 LYS A 31 2.166 20.030 -11.095 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.336 18.219 -13.348 1.00 0.00 H new ATOM 0 HD3 LYS A 31 0.941 19.922 -13.474 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.501 20.215 -12.738 1.00 0.00 H new ATOM 0 HE3 LYS A 31 3.640 18.597 -13.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 4.092 20.267 -15.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.694 19.396 -15.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.560 20.963 -14.847 1.00 0.00 H new ATOM 478 N VAL A 32 1.357 20.134 -8.352 1.00 0.00 N ATOM 479 CA VAL A 32 0.439 21.037 -7.669 1.00 0.00 C ATOM 480 C VAL A 32 0.453 22.422 -8.306 1.00 0.00 C ATOM 481 O VAL A 32 1.514 22.963 -8.615 1.00 0.00 O ATOM 482 CB VAL A 32 0.789 21.169 -6.175 1.00 0.00 C ATOM 483 CG1 VAL A 32 -0.285 21.958 -5.442 1.00 0.00 C ATOM 484 CG2 VAL A 32 0.973 19.795 -5.548 1.00 0.00 C ATOM 0 H VAL A 32 2.258 20.550 -8.590 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.558 20.606 -7.765 1.00 0.00 H new ATOM 0 HB VAL A 32 1.729 21.713 -6.087 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -0.020 22.041 -4.388 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.364 22.955 -5.876 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -1.242 21.445 -5.536 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.220 19.907 -4.492 1.00 0.00 H new ATOM 0 HG22 VAL A 32 0.050 19.224 -5.646 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.781 19.269 -6.056 1.00 0.00 H new ATOM 494 N GLU A 33 -0.733 22.990 -8.501 1.00 0.00 N ATOM 495 CA GLU A 33 -0.856 24.313 -9.102 1.00 0.00 C ATOM 496 C GLU A 33 -1.894 25.152 -8.362 1.00 0.00 C ATOM 497 O GLU A 33 -2.952 24.655 -7.979 1.00 0.00 O ATOM 498 CB GLU A 33 -1.241 24.192 -10.579 1.00 0.00 C ATOM 499 CG GLU A 33 -2.305 23.141 -10.846 1.00 0.00 C ATOM 500 CD GLU A 33 -3.144 23.458 -12.069 1.00 0.00 C ATOM 501 OE1 GLU A 33 -2.611 24.092 -13.005 1.00 0.00 O ATOM 502 OE2 GLU A 33 -4.331 23.074 -12.090 1.00 0.00 O ATOM 0 H GLU A 33 -1.621 22.555 -8.252 1.00 0.00 H new ATOM 0 HA GLU A 33 0.111 24.811 -9.025 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.600 25.159 -10.933 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -0.350 23.951 -11.159 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.827 22.171 -10.980 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.955 23.058 -9.975 1.00 0.00 H new ATOM 509 N GLY A 34 -1.581 26.430 -8.165 1.00 0.00 N ATOM 510 CA GLY A 34 -2.494 27.318 -7.471 1.00 0.00 C ATOM 511 C GLY A 34 -2.577 27.021 -5.987 1.00 0.00 C ATOM 512 O GLY A 34 -2.295 25.905 -5.552 1.00 0.00 O ATOM 0 H GLY A 34 -0.712 26.865 -8.474 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -2.172 28.349 -7.614 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.487 27.230 -7.912 1.00 0.00 H new ATOM 516 N LYS A 35 -2.964 28.024 -5.205 1.00 0.00 N ATOM 517 CA LYS A 35 -3.083 27.866 -3.761 1.00 0.00 C ATOM 518 C LYS A 35 -4.465 28.296 -3.279 1.00 0.00 C ATOM 519 O LYS A 35 -4.770 29.486 -3.217 1.00 0.00 O ATOM 520 CB LYS A 35 -2.005 28.686 -3.047 1.00 0.00 C ATOM 521 CG LYS A 35 -1.963 28.459 -1.546 1.00 0.00 C ATOM 522 CD LYS A 35 -2.792 29.493 -0.802 1.00 0.00 C ATOM 523 CE LYS A 35 -2.110 30.852 -0.792 1.00 0.00 C ATOM 524 NZ LYS A 35 -3.096 31.967 -0.748 1.00 0.00 N ATOM 0 H LYS A 35 -3.200 28.955 -5.548 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.946 26.811 -3.523 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -1.032 28.438 -3.471 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -2.177 29.745 -3.241 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -2.335 27.460 -1.318 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -0.930 28.501 -1.199 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -3.772 29.580 -1.270 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -2.957 29.160 0.223 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -1.447 30.919 0.071 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -1.488 30.953 -1.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -2.592 32.876 -0.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -3.713 31.918 -1.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -3.673 31.886 0.113 1.00 0.00 H new ATOM 538 N GLY A 36 -5.298 27.317 -2.936 1.00 0.00 N ATOM 539 CA GLY A 36 -6.637 27.615 -2.463 1.00 0.00 C ATOM 540 C GLY A 36 -7.598 27.921 -3.595 1.00 0.00 C ATOM 541 O GLY A 36 -8.811 27.790 -3.440 1.00 0.00 O ATOM 0 H GLY A 36 -5.069 26.324 -2.977 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.013 26.767 -1.890 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.598 28.467 -1.784 1.00 0.00 H new ATOM 545 N ASN A 37 -7.054 28.331 -4.736 1.00 0.00 N ATOM 546 CA ASN A 37 -7.872 28.658 -5.898 1.00 0.00 C ATOM 547 C ASN A 37 -7.978 27.465 -6.842 1.00 0.00 C ATOM 548 O ASN A 37 -7.988 27.624 -8.062 1.00 0.00 O ATOM 549 CB ASN A 37 -7.282 29.859 -6.641 1.00 0.00 C ATOM 550 CG ASN A 37 -7.529 31.167 -5.914 1.00 0.00 C ATOM 551 OD1 ASN A 37 -7.027 31.381 -4.811 1.00 0.00 O ATOM 552 ND2 ASN A 37 -8.307 32.049 -6.532 1.00 0.00 N ATOM 0 H ASN A 37 -6.051 28.445 -4.881 1.00 0.00 H new ATOM 0 HA ASN A 37 -8.872 28.911 -5.547 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -6.209 29.714 -6.767 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -7.716 29.914 -7.639 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -8.510 32.947 -6.092 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -8.702 31.828 -7.446 1.00 0.00 H new ATOM 559 N GLY A 38 -8.059 26.268 -6.268 1.00 0.00 N ATOM 560 CA GLY A 38 -8.165 25.065 -7.073 1.00 0.00 C ATOM 561 C GLY A 38 -6.904 24.225 -7.028 1.00 0.00 C ATOM 562 O GLY A 38 -6.549 23.573 -8.010 1.00 0.00 O ATOM 0 H GLY A 38 -8.053 26.110 -5.260 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.007 24.469 -6.722 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -8.378 25.340 -8.106 1.00 0.00 H new ATOM 566 N ILE A 39 -6.224 24.241 -5.886 1.00 0.00 N ATOM 567 CA ILE A 39 -4.996 23.475 -5.718 1.00 0.00 C ATOM 568 C ILE A 39 -5.286 21.980 -5.636 1.00 0.00 C ATOM 569 O ILE A 39 -6.246 21.557 -4.992 1.00 0.00 O ATOM 570 CB ILE A 39 -4.231 23.908 -4.453 1.00 0.00 C ATOM 571 CG1 ILE A 39 -2.939 23.101 -4.311 1.00 0.00 C ATOM 572 CG2 ILE A 39 -5.107 23.737 -3.220 1.00 0.00 C ATOM 573 CD1 ILE A 39 -1.974 23.680 -3.299 1.00 0.00 C ATOM 0 H ILE A 39 -6.503 24.776 -5.064 1.00 0.00 H new ATOM 0 HA ILE A 39 -4.378 23.675 -6.593 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.970 24.962 -4.546 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.188 22.080 -4.021 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.446 23.046 -5.281 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.553 24.047 -2.334 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -6.002 24.351 -3.321 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -5.395 22.690 -3.120 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -1.081 23.057 -3.250 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.696 24.691 -3.598 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.449 23.710 -2.319 1.00 0.00 H new ATOM 585 N LYS A 40 -4.449 21.184 -6.293 1.00 0.00 N ATOM 586 CA LYS A 40 -4.613 19.735 -6.293 1.00 0.00 C ATOM 587 C LYS A 40 -3.261 19.035 -6.395 1.00 0.00 C ATOM 588 O LYS A 40 -2.246 19.662 -6.701 1.00 0.00 O ATOM 589 CB LYS A 40 -5.511 19.303 -7.454 1.00 0.00 C ATOM 590 CG LYS A 40 -5.030 19.791 -8.810 1.00 0.00 C ATOM 591 CD LYS A 40 -5.776 19.109 -9.945 1.00 0.00 C ATOM 592 CE LYS A 40 -5.636 19.882 -11.247 1.00 0.00 C ATOM 593 NZ LYS A 40 -5.797 19.000 -12.436 1.00 0.00 N ATOM 0 H LYS A 40 -3.650 21.518 -6.832 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.082 19.447 -5.352 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -5.572 18.215 -7.470 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -6.520 19.676 -7.280 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -5.168 20.870 -8.879 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -3.962 19.599 -8.909 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -5.392 18.097 -10.078 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -6.831 19.018 -9.686 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -6.382 20.676 -11.280 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -4.658 20.362 -11.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -5.695 19.565 -13.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -5.069 18.257 -12.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -6.740 18.561 -12.418 1.00 0.00 H new ATOM 607 N THR A 41 -3.254 17.731 -6.137 1.00 0.00 N ATOM 608 CA THR A 41 -2.028 16.946 -6.200 1.00 0.00 C ATOM 609 C THR A 41 -2.154 15.810 -7.208 1.00 0.00 C ATOM 610 O THR A 41 -2.713 14.756 -6.905 1.00 0.00 O ATOM 611 CB THR A 41 -1.667 16.358 -4.823 1.00 0.00 C ATOM 612 OG1 THR A 41 -1.566 17.406 -3.853 1.00 0.00 O ATOM 613 CG2 THR A 41 -0.353 15.593 -4.889 1.00 0.00 C ATOM 0 H THR A 41 -4.084 17.196 -5.882 1.00 0.00 H new ATOM 0 HA THR A 41 -1.235 17.623 -6.517 1.00 0.00 H new ATOM 0 HB THR A 41 -2.458 15.667 -4.529 1.00 0.00 H new ATOM 0 HG1 THR A 41 -2.463 17.661 -3.552 1.00 0.00 H new ATOM 0 HG21 THR A 41 -0.119 15.187 -3.905 1.00 0.00 H new ATOM 0 HG22 THR A 41 -0.443 14.777 -5.606 1.00 0.00 H new ATOM 0 HG23 THR A 41 0.445 16.266 -5.203 1.00 0.00 H new ATOM 621 N VAL A 42 -1.629 16.030 -8.409 1.00 0.00 N ATOM 622 CA VAL A 42 -1.680 15.023 -9.463 1.00 0.00 C ATOM 623 C VAL A 42 -0.490 14.074 -9.375 1.00 0.00 C ATOM 624 O VAL A 42 0.662 14.497 -9.476 1.00 0.00 O ATOM 625 CB VAL A 42 -1.704 15.672 -10.859 1.00 0.00 C ATOM 626 CG1 VAL A 42 -2.147 14.665 -11.909 1.00 0.00 C ATOM 627 CG2 VAL A 42 -2.611 16.894 -10.863 1.00 0.00 C ATOM 0 H VAL A 42 -1.163 16.897 -8.677 1.00 0.00 H new ATOM 0 HA VAL A 42 -2.601 14.459 -9.317 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.694 15.997 -11.107 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -2.158 15.142 -12.889 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -1.453 13.824 -11.922 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.148 14.306 -11.669 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.616 17.340 -11.858 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.624 16.596 -10.594 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.243 17.622 -10.140 1.00 0.00 H new ATOM 637 N ILE A 43 -0.776 12.791 -9.188 1.00 0.00 N ATOM 638 CA ILE A 43 0.271 11.781 -9.088 1.00 0.00 C ATOM 639 C ILE A 43 0.726 11.324 -10.470 1.00 0.00 C ATOM 640 O ILE A 43 0.411 10.216 -10.904 1.00 0.00 O ATOM 641 CB ILE A 43 -0.202 10.556 -8.284 1.00 0.00 C ATOM 642 CG1 ILE A 43 -0.822 10.999 -6.957 1.00 0.00 C ATOM 643 CG2 ILE A 43 0.957 9.602 -8.041 1.00 0.00 C ATOM 644 CD1 ILE A 43 -1.745 9.967 -6.348 1.00 0.00 C ATOM 0 H ILE A 43 -1.724 12.425 -9.103 1.00 0.00 H new ATOM 0 HA ILE A 43 1.108 12.245 -8.567 1.00 0.00 H new ATOM 0 HB ILE A 43 -0.963 10.032 -8.862 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -0.024 11.224 -6.249 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.377 11.923 -7.115 1.00 0.00 H new ATOM 0 HG21 ILE A 43 0.606 8.741 -7.471 1.00 0.00 H new ATOM 0 HG22 ILE A 43 1.358 9.266 -8.997 1.00 0.00 H new ATOM 0 HG23 ILE A 43 1.739 10.114 -7.480 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.148 10.348 -5.410 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -2.564 9.759 -7.037 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -1.189 9.049 -6.158 1.00 0.00 H new ATOM 656 N VAL A 44 1.472 12.184 -11.156 1.00 0.00 N ATOM 657 CA VAL A 44 1.974 11.867 -12.488 1.00 0.00 C ATOM 658 C VAL A 44 2.547 10.456 -12.538 1.00 0.00 C ATOM 659 O VAL A 44 2.063 9.604 -13.282 1.00 0.00 O ATOM 660 CB VAL A 44 3.059 12.867 -12.931 1.00 0.00 C ATOM 661 CG1 VAL A 44 3.605 12.490 -14.300 1.00 0.00 C ATOM 662 CG2 VAL A 44 2.506 14.284 -12.940 1.00 0.00 C ATOM 0 H VAL A 44 1.742 13.105 -10.812 1.00 0.00 H new ATOM 0 HA VAL A 44 1.127 11.936 -13.170 1.00 0.00 H new ATOM 0 HB VAL A 44 3.880 12.827 -12.215 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.370 13.207 -14.597 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.041 11.492 -14.256 1.00 0.00 H new ATOM 0 HG13 VAL A 44 2.796 12.500 -15.030 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.286 14.977 -13.255 1.00 0.00 H new ATOM 0 HG22 VAL A 44 1.667 14.343 -13.633 1.00 0.00 H new ATOM 0 HG23 VAL A 44 2.168 14.549 -11.938 1.00 0.00 H new ATOM 672 N ASN A 45 3.583 10.215 -11.740 1.00 0.00 N ATOM 673 CA ASN A 45 4.223 8.906 -11.693 1.00 0.00 C ATOM 674 C ASN A 45 3.380 7.916 -10.896 1.00 0.00 C ATOM 675 O ASN A 45 3.893 7.195 -10.041 1.00 0.00 O ATOM 676 CB ASN A 45 5.618 9.019 -11.074 1.00 0.00 C ATOM 677 CG ASN A 45 6.579 7.980 -11.618 1.00 0.00 C ATOM 678 OD1 ASN A 45 6.653 7.760 -12.827 1.00 0.00 O ATOM 679 ND2 ASN A 45 7.319 7.334 -10.725 1.00 0.00 N ATOM 0 H ASN A 45 3.997 10.909 -11.118 1.00 0.00 H new ATOM 0 HA ASN A 45 4.315 8.538 -12.715 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.018 10.015 -11.266 1.00 0.00 H new ATOM 0 HB3 ASN A 45 5.542 8.909 -9.992 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.982 6.622 -11.031 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.224 7.549 -9.733 1.00 0.00 H new ATOM 686 N MET A 46 2.083 7.886 -11.184 1.00 0.00 N ATOM 687 CA MET A 46 1.168 6.983 -10.495 1.00 0.00 C ATOM 688 C MET A 46 1.191 5.597 -11.131 1.00 0.00 C ATOM 689 O MET A 46 1.391 4.593 -10.447 1.00 0.00 O ATOM 690 CB MET A 46 -0.255 7.546 -10.521 1.00 0.00 C ATOM 691 CG MET A 46 -1.323 6.511 -10.208 1.00 0.00 C ATOM 692 SD MET A 46 -0.858 5.423 -8.847 1.00 0.00 S ATOM 693 CE MET A 46 -1.268 6.450 -7.438 1.00 0.00 C ATOM 0 H MET A 46 1.642 8.476 -11.889 1.00 0.00 H new ATOM 0 HA MET A 46 1.496 6.894 -9.459 1.00 0.00 H new ATOM 0 HB2 MET A 46 -0.328 8.361 -9.801 1.00 0.00 H new ATOM 0 HB3 MET A 46 -0.451 7.972 -11.505 1.00 0.00 H new ATOM 0 HG2 MET A 46 -2.255 7.020 -9.960 1.00 0.00 H new ATOM 0 HG3 MET A 46 -1.515 5.912 -11.098 1.00 0.00 H new ATOM 0 HE1 MET A 46 -0.354 6.730 -6.913 1.00 0.00 H new ATOM 0 HE2 MET A 46 -1.780 7.350 -7.780 1.00 0.00 H new ATOM 0 HE3 MET A 46 -1.920 5.897 -6.762 1.00 0.00 H new ATOM 703 N VAL A 47 0.985 5.549 -12.443 1.00 0.00 N ATOM 704 CA VAL A 47 0.983 4.286 -13.171 1.00 0.00 C ATOM 705 C VAL A 47 2.364 3.640 -13.154 1.00 0.00 C ATOM 706 O VAL A 47 2.489 2.423 -13.015 1.00 0.00 O ATOM 707 CB VAL A 47 0.537 4.481 -14.632 1.00 0.00 C ATOM 708 CG1 VAL A 47 0.527 3.151 -15.370 1.00 0.00 C ATOM 709 CG2 VAL A 47 -0.833 5.140 -14.687 1.00 0.00 C ATOM 0 H VAL A 47 0.817 6.371 -13.024 1.00 0.00 H new ATOM 0 HA VAL A 47 0.273 3.631 -12.667 1.00 0.00 H new ATOM 0 HB VAL A 47 1.252 5.138 -15.127 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.209 3.309 -16.401 1.00 0.00 H new ATOM 0 HG12 VAL A 47 1.529 2.722 -15.361 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.165 2.467 -14.878 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -1.133 5.270 -15.727 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -1.561 4.510 -14.176 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.789 6.113 -14.198 1.00 0.00 H new ATOM 719 N ASP A 48 3.397 4.462 -13.298 1.00 0.00 N ATOM 720 CA ASP A 48 4.770 3.972 -13.297 1.00 0.00 C ATOM 721 C ASP A 48 5.056 3.156 -12.040 1.00 0.00 C ATOM 722 O ASP A 48 5.298 1.951 -12.111 1.00 0.00 O ATOM 723 CB ASP A 48 5.752 5.140 -13.396 1.00 0.00 C ATOM 724 CG ASP A 48 5.777 5.760 -14.780 1.00 0.00 C ATOM 725 OD1 ASP A 48 4.740 6.312 -15.202 1.00 0.00 O ATOM 726 OD2 ASP A 48 6.835 5.691 -15.441 1.00 0.00 O ATOM 0 H ASP A 48 3.310 5.471 -13.417 1.00 0.00 H new ATOM 0 HA ASP A 48 4.898 3.325 -14.165 1.00 0.00 H new ATOM 0 HB2 ASP A 48 5.481 5.902 -12.665 1.00 0.00 H new ATOM 0 HB3 ASP A 48 6.753 4.792 -13.139 1.00 0.00 H new ATOM 731 N VAL A 49 5.027 3.822 -10.890 1.00 0.00 N ATOM 732 CA VAL A 49 5.282 3.159 -9.617 1.00 0.00 C ATOM 733 C VAL A 49 4.470 1.875 -9.492 1.00 0.00 C ATOM 734 O VAL A 49 4.995 0.830 -9.110 1.00 0.00 O ATOM 735 CB VAL A 49 4.951 4.081 -8.428 1.00 0.00 C ATOM 736 CG1 VAL A 49 5.895 5.273 -8.397 1.00 0.00 C ATOM 737 CG2 VAL A 49 3.502 4.538 -8.497 1.00 0.00 C ATOM 0 H VAL A 49 4.830 4.820 -10.814 1.00 0.00 H new ATOM 0 HA VAL A 49 6.344 2.916 -9.595 1.00 0.00 H new ATOM 0 HB VAL A 49 5.087 3.518 -7.505 1.00 0.00 H new ATOM 0 HG11 VAL A 49 5.646 5.913 -7.550 1.00 0.00 H new ATOM 0 HG12 VAL A 49 6.922 4.921 -8.296 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.795 5.840 -9.322 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.285 5.188 -7.650 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.337 5.084 -9.426 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.845 3.669 -8.465 1.00 0.00 H new ATOM 747 N ALA A 50 3.184 1.961 -9.818 1.00 0.00 N ATOM 748 CA ALA A 50 2.299 0.806 -9.746 1.00 0.00 C ATOM 749 C ALA A 50 2.838 -0.352 -10.578 1.00 0.00 C ATOM 750 O ALA A 50 3.157 -1.416 -10.048 1.00 0.00 O ATOM 751 CB ALA A 50 0.899 1.184 -10.208 1.00 0.00 C ATOM 0 H ALA A 50 2.733 2.819 -10.135 1.00 0.00 H new ATOM 0 HA ALA A 50 2.251 0.481 -8.707 1.00 0.00 H new ATOM 0 HB1 ALA A 50 0.248 0.311 -10.149 1.00 0.00 H new ATOM 0 HB2 ALA A 50 0.506 1.974 -9.568 1.00 0.00 H new ATOM 0 HB3 ALA A 50 0.939 1.538 -11.238 1.00 0.00 H new ATOM 757 N LYS A 51 2.936 -0.139 -11.886 1.00 0.00 N ATOM 758 CA LYS A 51 3.437 -1.164 -12.794 1.00 0.00 C ATOM 759 C LYS A 51 4.604 -1.922 -12.168 1.00 0.00 C ATOM 760 O LYS A 51 4.699 -3.143 -12.286 1.00 0.00 O ATOM 761 CB LYS A 51 3.876 -0.533 -14.117 1.00 0.00 C ATOM 762 CG LYS A 51 2.749 -0.391 -15.126 1.00 0.00 C ATOM 763 CD LYS A 51 2.965 0.806 -16.037 1.00 0.00 C ATOM 764 CE LYS A 51 3.811 0.441 -17.246 1.00 0.00 C ATOM 765 NZ LYS A 51 3.080 -0.456 -18.184 1.00 0.00 N ATOM 0 H LYS A 51 2.675 0.736 -12.341 1.00 0.00 H new ATOM 0 HA LYS A 51 2.629 -1.870 -12.986 1.00 0.00 H new ATOM 0 HB2 LYS A 51 4.300 0.451 -13.918 1.00 0.00 H new ATOM 0 HB3 LYS A 51 4.669 -1.140 -14.554 1.00 0.00 H new ATOM 0 HG2 LYS A 51 2.680 -1.298 -15.726 1.00 0.00 H new ATOM 0 HG3 LYS A 51 1.800 -0.283 -14.601 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.001 1.190 -16.369 1.00 0.00 H new ATOM 0 HD3 LYS A 51 3.452 1.606 -15.479 1.00 0.00 H new ATOM 0 HE2 LYS A 51 4.108 1.350 -17.770 1.00 0.00 H new ATOM 0 HE3 LYS A 51 4.726 -0.049 -16.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 3.515 -0.400 -19.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 3.129 -1.435 -17.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 2.085 -0.160 -18.243 1.00 0.00 H new ATOM 779 N ALA A 52 5.490 -1.189 -11.501 1.00 0.00 N ATOM 780 CA ALA A 52 6.648 -1.792 -10.854 1.00 0.00 C ATOM 781 C ALA A 52 6.223 -2.852 -9.844 1.00 0.00 C ATOM 782 O ALA A 52 6.834 -3.918 -9.752 1.00 0.00 O ATOM 783 CB ALA A 52 7.490 -0.722 -10.175 1.00 0.00 C ATOM 0 H ALA A 52 5.427 -0.176 -11.395 1.00 0.00 H new ATOM 0 HA ALA A 52 7.249 -2.279 -11.622 1.00 0.00 H new ATOM 0 HB1 ALA A 52 8.352 -1.187 -9.696 1.00 0.00 H new ATOM 0 HB2 ALA A 52 7.833 -0.002 -10.919 1.00 0.00 H new ATOM 0 HB3 ALA A 52 6.890 -0.209 -9.423 1.00 0.00 H new ATOM 789 N LEU A 53 5.172 -2.555 -9.088 1.00 0.00 N ATOM 790 CA LEU A 53 4.664 -3.483 -8.084 1.00 0.00 C ATOM 791 C LEU A 53 3.726 -4.508 -8.714 1.00 0.00 C ATOM 792 O LEU A 53 3.046 -5.255 -8.012 1.00 0.00 O ATOM 793 CB LEU A 53 3.934 -2.719 -6.977 1.00 0.00 C ATOM 794 CG LEU A 53 4.628 -1.458 -6.463 1.00 0.00 C ATOM 795 CD1 LEU A 53 3.613 -0.499 -5.860 1.00 0.00 C ATOM 796 CD2 LEU A 53 5.698 -1.816 -5.442 1.00 0.00 C ATOM 0 H LEU A 53 4.655 -1.678 -9.151 1.00 0.00 H new ATOM 0 HA LEU A 53 5.513 -4.013 -7.652 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.946 -2.442 -7.345 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.783 -3.395 -6.135 1.00 0.00 H new ATOM 0 HG LEU A 53 5.110 -0.963 -7.306 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.125 0.393 -5.499 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.883 -0.217 -6.619 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.102 -0.985 -5.029 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.181 -0.906 -5.087 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.239 -2.335 -4.600 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.441 -2.464 -5.906 1.00 0.00 H new ATOM 808 N ASN A 54 3.697 -4.538 -10.042 1.00 0.00 N ATOM 809 CA ASN A 54 2.844 -5.472 -10.767 1.00 0.00 C ATOM 810 C ASN A 54 1.383 -5.302 -10.361 1.00 0.00 C ATOM 811 O ASN A 54 0.588 -6.237 -10.459 1.00 0.00 O ATOM 812 CB ASN A 54 3.293 -6.912 -10.508 1.00 0.00 C ATOM 813 CG ASN A 54 4.722 -7.160 -10.950 1.00 0.00 C ATOM 814 OD1 ASN A 54 5.092 -6.864 -12.086 1.00 0.00 O ATOM 815 ND2 ASN A 54 5.532 -7.707 -10.052 1.00 0.00 N ATOM 0 H ASN A 54 4.254 -3.926 -10.638 1.00 0.00 H new ATOM 0 HA ASN A 54 2.934 -5.256 -11.832 1.00 0.00 H new ATOM 0 HB2 ASN A 54 3.201 -7.133 -9.445 1.00 0.00 H new ATOM 0 HB3 ASN A 54 2.629 -7.597 -11.034 1.00 0.00 H new ATOM 0 HD21 ASN A 54 6.505 -7.898 -10.292 1.00 0.00 H new ATOM 0 HD22 ASN A 54 5.182 -7.936 -9.122 1.00 0.00 H new ATOM 822 N ARG A 55 1.037 -4.102 -9.907 1.00 0.00 N ATOM 823 CA ARG A 55 -0.328 -3.809 -9.486 1.00 0.00 C ATOM 824 C ARG A 55 -0.816 -2.498 -10.096 1.00 0.00 C ATOM 825 O ARG A 55 -0.036 -1.587 -10.376 1.00 0.00 O ATOM 826 CB ARG A 55 -0.409 -3.735 -7.960 1.00 0.00 C ATOM 827 CG ARG A 55 -0.230 -5.080 -7.275 1.00 0.00 C ATOM 828 CD ARG A 55 -0.154 -4.929 -5.763 1.00 0.00 C ATOM 829 NE ARG A 55 0.615 -6.005 -5.144 1.00 0.00 N ATOM 830 CZ ARG A 55 0.215 -7.271 -5.112 1.00 0.00 C ATOM 831 NH1 ARG A 55 -0.941 -7.618 -5.662 1.00 0.00 N ATOM 832 NH2 ARG A 55 0.971 -8.193 -4.530 1.00 0.00 N ATOM 0 H ARG A 55 1.683 -3.317 -9.821 1.00 0.00 H new ATOM 0 HA ARG A 55 -0.971 -4.615 -9.839 1.00 0.00 H new ATOM 0 HB2 ARG A 55 0.355 -3.047 -7.597 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -1.375 -3.318 -7.676 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -1.061 -5.736 -7.535 1.00 0.00 H new ATOM 0 HG3 ARG A 55 0.679 -5.558 -7.640 1.00 0.00 H new ATOM 0 HD2 ARG A 55 0.302 -3.970 -5.517 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -1.162 -4.919 -5.348 1.00 0.00 H new ATOM 0 HE ARG A 55 1.509 -5.771 -4.712 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -1.525 -6.912 -6.111 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -1.246 -8.591 -5.636 1.00 0.00 H new ATOM 0 HH21 ARG A 55 1.861 -7.930 -4.106 1.00 0.00 H new ATOM 0 HH22 ARG A 55 0.662 -9.165 -4.506 1.00 0.00 H new ATOM 846 N PRO A 56 -2.137 -2.400 -10.308 1.00 0.00 N ATOM 847 CA PRO A 56 -2.758 -1.205 -10.887 1.00 0.00 C ATOM 848 C PRO A 56 -2.723 -0.014 -9.936 1.00 0.00 C ATOM 849 O PRO A 56 -2.795 -0.162 -8.716 1.00 0.00 O ATOM 850 CB PRO A 56 -4.202 -1.644 -11.141 1.00 0.00 C ATOM 851 CG PRO A 56 -4.443 -2.741 -10.162 1.00 0.00 C ATOM 852 CD PRO A 56 -3.125 -3.447 -9.999 1.00 0.00 C ATOM 0 HA PRO A 56 -2.236 -0.868 -11.783 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -4.899 -0.819 -10.991 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -4.336 -1.991 -12.165 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -4.794 -2.344 -9.209 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -5.210 -3.425 -10.524 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -2.998 -3.833 -8.988 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -3.037 -4.296 -10.678 1.00 0.00 H new ATOM 860 N PRO A 57 -2.610 1.196 -10.504 1.00 0.00 N ATOM 861 CA PRO A 57 -2.563 2.436 -9.724 1.00 0.00 C ATOM 862 C PRO A 57 -3.903 2.760 -9.071 1.00 0.00 C ATOM 863 O PRO A 57 -4.015 3.713 -8.299 1.00 0.00 O ATOM 864 CB PRO A 57 -2.206 3.498 -10.767 1.00 0.00 C ATOM 865 CG PRO A 57 -2.688 2.936 -12.060 1.00 0.00 C ATOM 866 CD PRO A 57 -2.519 1.446 -11.952 1.00 0.00 C ATOM 0 HA PRO A 57 -1.852 2.373 -8.900 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.689 4.450 -10.544 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.132 3.683 -10.792 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -3.731 3.199 -12.235 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -2.114 3.334 -12.897 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.295 0.913 -12.501 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -1.561 1.120 -12.357 1.00 0.00 H new ATOM 874 N THR A 58 -4.918 1.960 -9.383 1.00 0.00 N ATOM 875 CA THR A 58 -6.249 2.162 -8.827 1.00 0.00 C ATOM 876 C THR A 58 -6.293 1.779 -7.352 1.00 0.00 C ATOM 877 O THR A 58 -7.046 2.362 -6.571 1.00 0.00 O ATOM 878 CB THR A 58 -7.307 1.343 -9.591 1.00 0.00 C ATOM 879 OG1 THR A 58 -6.860 -0.008 -9.749 1.00 0.00 O ATOM 880 CG2 THR A 58 -7.584 1.955 -10.956 1.00 0.00 C ATOM 0 H THR A 58 -4.843 1.166 -10.018 1.00 0.00 H new ATOM 0 HA THR A 58 -6.477 3.223 -8.930 1.00 0.00 H new ATOM 0 HB THR A 58 -8.231 1.354 -9.012 1.00 0.00 H new ATOM 0 HG1 THR A 58 -7.539 -0.522 -10.234 1.00 0.00 H new ATOM 0 HG21 THR A 58 -8.334 1.359 -11.476 1.00 0.00 H new ATOM 0 HG22 THR A 58 -7.952 2.973 -10.830 1.00 0.00 H new ATOM 0 HG23 THR A 58 -6.664 1.972 -11.541 1.00 0.00 H new ATOM 888 N TYR A 59 -5.483 0.796 -6.977 1.00 0.00 N ATOM 889 CA TYR A 59 -5.431 0.333 -5.595 1.00 0.00 C ATOM 890 C TYR A 59 -4.877 1.419 -4.678 1.00 0.00 C ATOM 891 O TYR A 59 -5.500 1.813 -3.692 1.00 0.00 O ATOM 892 CB TYR A 59 -4.571 -0.927 -5.489 1.00 0.00 C ATOM 893 CG TYR A 59 -5.331 -2.204 -5.768 1.00 0.00 C ATOM 894 CD1 TYR A 59 -6.594 -2.416 -5.229 1.00 0.00 C ATOM 895 CD2 TYR A 59 -4.787 -3.199 -6.571 1.00 0.00 C ATOM 896 CE1 TYR A 59 -7.292 -3.581 -5.480 1.00 0.00 C ATOM 897 CE2 TYR A 59 -5.478 -4.367 -6.829 1.00 0.00 C ATOM 898 CZ TYR A 59 -6.730 -4.553 -6.281 1.00 0.00 C ATOM 899 OH TYR A 59 -7.423 -5.715 -6.535 1.00 0.00 O ATOM 0 H TYR A 59 -4.853 0.304 -7.611 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.447 0.098 -5.278 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -3.739 -0.849 -6.189 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.142 -0.981 -4.489 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.038 -1.656 -4.603 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -3.807 -3.057 -7.001 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.272 -3.730 -5.052 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -5.041 -5.130 -7.456 1.00 0.00 H new ATOM 0 HH TYR A 59 -6.888 -6.294 -7.117 1.00 0.00 H new ATOM 909 N PRO A 60 -3.676 1.916 -5.010 1.00 0.00 N ATOM 910 CA PRO A 60 -3.010 2.964 -4.231 1.00 0.00 C ATOM 911 C PRO A 60 -3.712 4.313 -4.354 1.00 0.00 C ATOM 912 O PRO A 60 -4.005 4.966 -3.352 1.00 0.00 O ATOM 913 CB PRO A 60 -1.611 3.031 -4.848 1.00 0.00 C ATOM 914 CG PRO A 60 -1.787 2.529 -6.240 1.00 0.00 C ATOM 915 CD PRO A 60 -2.876 1.494 -6.172 1.00 0.00 C ATOM 0 HA PRO A 60 -3.010 2.740 -3.164 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -1.223 4.050 -4.840 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -0.903 2.416 -4.292 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -2.061 3.340 -6.916 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -0.861 2.097 -6.619 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -3.471 1.477 -7.085 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -2.470 0.492 -6.037 1.00 0.00 H new ATOM 923 N THR A 61 -3.979 4.725 -5.590 1.00 0.00 N ATOM 924 CA THR A 61 -4.645 5.996 -5.844 1.00 0.00 C ATOM 925 C THR A 61 -5.804 6.212 -4.877 1.00 0.00 C ATOM 926 O THR A 61 -5.913 7.265 -4.248 1.00 0.00 O ATOM 927 CB THR A 61 -5.176 6.073 -7.288 1.00 0.00 C ATOM 928 OG1 THR A 61 -4.082 6.160 -8.208 1.00 0.00 O ATOM 929 CG2 THR A 61 -6.091 7.274 -7.465 1.00 0.00 C ATOM 0 H THR A 61 -3.744 4.197 -6.430 1.00 0.00 H new ATOM 0 HA THR A 61 -3.900 6.778 -5.696 1.00 0.00 H new ATOM 0 HB THR A 61 -5.749 5.168 -7.490 1.00 0.00 H new ATOM 0 HG1 THR A 61 -3.909 5.276 -8.595 1.00 0.00 H new ATOM 0 HG21 THR A 61 -6.453 7.307 -8.492 1.00 0.00 H new ATOM 0 HG22 THR A 61 -6.938 7.190 -6.784 1.00 0.00 H new ATOM 0 HG23 THR A 61 -5.539 8.188 -7.245 1.00 0.00 H new ATOM 937 N LYS A 62 -6.668 5.209 -4.763 1.00 0.00 N ATOM 938 CA LYS A 62 -7.818 5.289 -3.870 1.00 0.00 C ATOM 939 C LYS A 62 -7.373 5.372 -2.414 1.00 0.00 C ATOM 940 O LYS A 62 -8.001 6.051 -1.601 1.00 0.00 O ATOM 941 CB LYS A 62 -8.727 4.073 -4.068 1.00 0.00 C ATOM 942 CG LYS A 62 -10.041 4.167 -3.311 1.00 0.00 C ATOM 943 CD LYS A 62 -10.963 5.209 -3.922 1.00 0.00 C ATOM 944 CE LYS A 62 -12.406 5.000 -3.488 1.00 0.00 C ATOM 945 NZ LYS A 62 -13.356 5.784 -4.324 1.00 0.00 N ATOM 0 H LYS A 62 -6.594 4.331 -5.278 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.373 6.195 -4.113 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.937 3.956 -5.131 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.196 3.177 -3.748 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.535 3.195 -3.316 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.844 4.420 -2.269 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.634 6.205 -3.627 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.898 5.161 -5.009 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.655 3.941 -3.552 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.517 5.291 -2.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -14.328 5.614 -3.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -13.135 6.797 -4.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.269 5.489 -5.318 1.00 0.00 H new ATOM 959 N TYR A 63 -6.286 4.680 -2.092 1.00 0.00 N ATOM 960 CA TYR A 63 -5.757 4.675 -0.733 1.00 0.00 C ATOM 961 C TYR A 63 -5.412 6.090 -0.278 1.00 0.00 C ATOM 962 O TYR A 63 -5.699 6.477 0.855 1.00 0.00 O ATOM 963 CB TYR A 63 -4.517 3.784 -0.649 1.00 0.00 C ATOM 964 CG TYR A 63 -4.094 3.466 0.767 1.00 0.00 C ATOM 965 CD1 TYR A 63 -4.936 2.766 1.623 1.00 0.00 C ATOM 966 CD2 TYR A 63 -2.855 3.866 1.250 1.00 0.00 C ATOM 967 CE1 TYR A 63 -4.554 2.474 2.919 1.00 0.00 C ATOM 968 CE2 TYR A 63 -2.464 3.577 2.543 1.00 0.00 C ATOM 969 CZ TYR A 63 -3.318 2.881 3.374 1.00 0.00 C ATOM 970 OH TYR A 63 -2.933 2.593 4.663 1.00 0.00 O ATOM 0 H TYR A 63 -5.754 4.115 -2.754 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.527 4.277 -0.072 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -4.713 2.852 -1.178 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -3.692 4.275 -1.164 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.905 2.445 1.270 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -2.185 4.413 0.603 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.220 1.930 3.572 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -1.496 3.894 2.901 1.00 0.00 H new ATOM 0 HH TYR A 63 -2.034 2.949 4.823 1.00 0.00 H new ATOM 980 N PHE A 64 -4.795 6.857 -1.170 1.00 0.00 N ATOM 981 CA PHE A 64 -4.409 8.229 -0.862 1.00 0.00 C ATOM 982 C PHE A 64 -5.630 9.068 -0.498 1.00 0.00 C ATOM 983 O PHE A 64 -5.596 9.858 0.444 1.00 0.00 O ATOM 984 CB PHE A 64 -3.682 8.857 -2.053 1.00 0.00 C ATOM 985 CG PHE A 64 -2.311 8.289 -2.285 1.00 0.00 C ATOM 986 CD1 PHE A 64 -1.439 8.094 -1.226 1.00 0.00 C ATOM 987 CD2 PHE A 64 -1.894 7.950 -3.562 1.00 0.00 C ATOM 988 CE1 PHE A 64 -0.177 7.572 -1.437 1.00 0.00 C ATOM 989 CE2 PHE A 64 -0.633 7.428 -3.779 1.00 0.00 C ATOM 990 CZ PHE A 64 0.227 7.238 -2.715 1.00 0.00 C ATOM 0 H PHE A 64 -4.551 6.552 -2.112 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.736 8.207 -0.005 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.283 8.714 -2.951 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.599 9.932 -1.892 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.749 8.353 -0.224 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.562 8.095 -4.398 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.493 7.425 -0.603 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.320 7.169 -4.780 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.213 6.829 -2.882 1.00 0.00 H new ATOM 1000 N GLY A 65 -6.710 8.891 -1.254 1.00 0.00 N ATOM 1001 CA GLY A 65 -7.927 9.638 -0.996 1.00 0.00 C ATOM 1002 C GLY A 65 -8.582 9.246 0.313 1.00 0.00 C ATOM 1003 O GLY A 65 -8.594 10.024 1.267 1.00 0.00 O ATOM 0 H GLY A 65 -6.763 8.244 -2.040 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -7.699 10.704 -0.979 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -8.630 9.475 -1.813 1.00 0.00 H new ATOM 1007 N CYS A 66 -9.131 8.037 0.359 1.00 0.00 N ATOM 1008 CA CYS A 66 -9.794 7.543 1.561 1.00 0.00 C ATOM 1009 C CYS A 66 -9.047 7.986 2.815 1.00 0.00 C ATOM 1010 O CYS A 66 -9.661 8.362 3.813 1.00 0.00 O ATOM 1011 CB CYS A 66 -9.893 6.017 1.523 1.00 0.00 C ATOM 1012 SG CYS A 66 -8.307 5.170 1.718 1.00 0.00 S ATOM 0 H CYS A 66 -9.130 7.381 -0.422 1.00 0.00 H new ATOM 0 HA CYS A 66 -10.799 7.964 1.591 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -10.568 5.688 2.313 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -10.340 5.716 0.575 1.00 0.00 H new ATOM 0 HG CYS A 66 -7.361 5.895 1.199 1.00 0.00 H new ATOM 1018 N GLU A 67 -7.720 7.936 2.755 1.00 0.00 N ATOM 1019 CA GLU A 67 -6.890 8.331 3.888 1.00 0.00 C ATOM 1020 C GLU A 67 -6.948 9.840 4.106 1.00 0.00 C ATOM 1021 O GLU A 67 -7.067 10.311 5.237 1.00 0.00 O ATOM 1022 CB GLU A 67 -5.442 7.891 3.664 1.00 0.00 C ATOM 1023 CG GLU A 67 -5.254 6.384 3.676 1.00 0.00 C ATOM 1024 CD GLU A 67 -5.443 5.783 5.056 1.00 0.00 C ATOM 1025 OE1 GLU A 67 -6.598 5.726 5.526 1.00 0.00 O ATOM 1026 OE2 GLU A 67 -4.434 5.370 5.665 1.00 0.00 O ATOM 0 H GLU A 67 -7.197 7.627 1.936 1.00 0.00 H new ATOM 0 HA GLU A 67 -7.278 7.839 4.780 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -5.096 8.284 2.708 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.813 8.333 4.437 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.963 5.928 2.985 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.255 6.143 3.313 1.00 0.00 H new ATOM 1033 N LEU A 68 -6.863 10.593 3.014 1.00 0.00 N ATOM 1034 CA LEU A 68 -6.904 12.049 3.084 1.00 0.00 C ATOM 1035 C LEU A 68 -8.328 12.542 3.325 1.00 0.00 C ATOM 1036 O LEU A 68 -8.541 13.689 3.715 1.00 0.00 O ATOM 1037 CB LEU A 68 -6.353 12.657 1.794 1.00 0.00 C ATOM 1038 CG LEU A 68 -4.890 12.345 1.476 1.00 0.00 C ATOM 1039 CD1 LEU A 68 -4.633 12.456 -0.019 1.00 0.00 C ATOM 1040 CD2 LEU A 68 -3.966 13.276 2.248 1.00 0.00 C ATOM 0 H LEU A 68 -6.765 10.219 2.070 1.00 0.00 H new ATOM 0 HA LEU A 68 -6.282 12.366 3.921 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.966 12.311 0.962 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.469 13.739 1.848 1.00 0.00 H new ATOM 0 HG LEU A 68 -4.682 11.321 1.785 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.587 12.231 -0.226 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.269 11.748 -0.551 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.859 13.469 -0.353 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.929 13.040 2.009 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -4.176 14.309 1.971 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.131 13.147 3.318 1.00 0.00 H new ATOM 1052 N GLY A 69 -9.300 11.665 3.091 1.00 0.00 N ATOM 1053 CA GLY A 69 -10.691 12.029 3.290 1.00 0.00 C ATOM 1054 C GLY A 69 -11.198 12.982 2.226 1.00 0.00 C ATOM 1055 O GLY A 69 -12.060 13.819 2.492 1.00 0.00 O ATOM 0 H GLY A 69 -9.149 10.710 2.767 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -11.303 11.127 3.288 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -10.806 12.490 4.271 1.00 0.00 H new ATOM 1059 N ALA A 70 -10.661 12.856 1.016 1.00 0.00 N ATOM 1060 CA ALA A 70 -11.065 13.713 -0.091 1.00 0.00 C ATOM 1061 C ALA A 70 -11.504 12.885 -1.294 1.00 0.00 C ATOM 1062 O ALA A 70 -11.579 11.658 -1.220 1.00 0.00 O ATOM 1063 CB ALA A 70 -9.928 14.647 -0.478 1.00 0.00 C ATOM 0 H ALA A 70 -9.946 12.169 0.778 1.00 0.00 H new ATOM 0 HA ALA A 70 -11.916 14.310 0.236 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -10.244 15.281 -1.306 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -9.663 15.270 0.376 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -9.062 14.059 -0.781 1.00 0.00 H new ATOM 1069 N GLN A 71 -11.792 13.562 -2.401 1.00 0.00 N ATOM 1070 CA GLN A 71 -12.225 12.888 -3.619 1.00 0.00 C ATOM 1071 C GLN A 71 -11.059 12.710 -4.586 1.00 0.00 C ATOM 1072 O GLN A 71 -10.022 13.360 -4.452 1.00 0.00 O ATOM 1073 CB GLN A 71 -13.347 13.678 -4.294 1.00 0.00 C ATOM 1074 CG GLN A 71 -14.737 13.289 -3.817 1.00 0.00 C ATOM 1075 CD GLN A 71 -15.782 14.335 -4.151 1.00 0.00 C ATOM 1076 OE1 GLN A 71 -15.694 15.012 -5.176 1.00 0.00 O ATOM 1077 NE2 GLN A 71 -16.780 14.472 -3.286 1.00 0.00 N ATOM 0 H GLN A 71 -11.733 14.577 -2.479 1.00 0.00 H new ATOM 0 HA GLN A 71 -12.600 11.902 -3.345 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -13.193 14.741 -4.110 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -13.287 13.529 -5.372 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -15.020 12.340 -4.271 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -14.716 13.133 -2.738 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -16.813 13.890 -2.449 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -17.513 15.160 -3.458 1.00 0.00 H new ATOM 1086 N THR A 72 -11.235 11.824 -5.561 1.00 0.00 N ATOM 1087 CA THR A 72 -10.198 11.559 -6.550 1.00 0.00 C ATOM 1088 C THR A 72 -10.793 11.409 -7.945 1.00 0.00 C ATOM 1089 O THR A 72 -11.998 11.204 -8.096 1.00 0.00 O ATOM 1090 CB THR A 72 -9.404 10.285 -6.203 1.00 0.00 C ATOM 1091 OG1 THR A 72 -10.284 9.157 -6.153 1.00 0.00 O ATOM 1092 CG2 THR A 72 -8.690 10.438 -4.868 1.00 0.00 C ATOM 0 H THR A 72 -12.087 11.277 -5.687 1.00 0.00 H new ATOM 0 HA THR A 72 -9.523 12.415 -6.537 1.00 0.00 H new ATOM 0 HB THR A 72 -8.656 10.127 -6.980 1.00 0.00 H new ATOM 0 HG1 THR A 72 -9.807 8.386 -5.781 1.00 0.00 H new ATOM 0 HG21 THR A 72 -8.136 9.526 -4.645 1.00 0.00 H new ATOM 0 HG22 THR A 72 -7.998 11.279 -4.920 1.00 0.00 H new ATOM 0 HG23 THR A 72 -9.423 10.619 -4.082 1.00 0.00 H new ATOM 1100 N GLN A 73 -9.942 11.511 -8.961 1.00 0.00 N ATOM 1101 CA GLN A 73 -10.386 11.386 -10.344 1.00 0.00 C ATOM 1102 C GLN A 73 -9.690 10.219 -11.036 1.00 0.00 C ATOM 1103 O GLN A 73 -8.468 10.085 -10.971 1.00 0.00 O ATOM 1104 CB GLN A 73 -10.114 12.683 -11.108 1.00 0.00 C ATOM 1105 CG GLN A 73 -10.640 12.671 -12.534 1.00 0.00 C ATOM 1106 CD GLN A 73 -10.674 14.054 -13.155 1.00 0.00 C ATOM 1107 OE1 GLN A 73 -11.308 14.968 -12.628 1.00 0.00 O ATOM 1108 NE2 GLN A 73 -9.991 14.214 -14.283 1.00 0.00 N ATOM 0 H GLN A 73 -8.942 11.680 -8.852 1.00 0.00 H new ATOM 0 HA GLN A 73 -11.459 11.194 -10.339 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.568 13.514 -10.569 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.039 12.865 -11.127 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.014 12.019 -13.143 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -11.644 12.248 -12.543 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.479 13.429 -14.685 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -9.978 15.122 -14.747 1.00 0.00 H new ATOM 1117 N PHE A 74 -10.476 9.376 -11.698 1.00 0.00 N ATOM 1118 CA PHE A 74 -9.936 8.219 -12.402 1.00 0.00 C ATOM 1119 C PHE A 74 -10.159 8.344 -13.906 1.00 0.00 C ATOM 1120 O PHE A 74 -11.295 8.437 -14.370 1.00 0.00 O ATOM 1121 CB PHE A 74 -10.582 6.933 -11.883 1.00 0.00 C ATOM 1122 CG PHE A 74 -9.999 6.449 -10.587 1.00 0.00 C ATOM 1123 CD1 PHE A 74 -9.846 7.313 -9.515 1.00 0.00 C ATOM 1124 CD2 PHE A 74 -9.605 5.129 -10.440 1.00 0.00 C ATOM 1125 CE1 PHE A 74 -9.308 6.870 -8.321 1.00 0.00 C ATOM 1126 CE2 PHE A 74 -9.067 4.680 -9.248 1.00 0.00 C ATOM 1127 CZ PHE A 74 -8.920 5.551 -8.187 1.00 0.00 C ATOM 0 H PHE A 74 -11.489 9.473 -11.761 1.00 0.00 H new ATOM 0 HA PHE A 74 -8.863 8.179 -12.215 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -11.651 7.101 -11.751 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -10.473 6.152 -12.635 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -10.151 8.345 -9.613 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -9.719 4.443 -11.266 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -9.191 7.554 -7.494 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -8.762 3.649 -9.147 1.00 0.00 H new ATOM 0 HZ PHE A 74 -8.503 5.202 -7.254 1.00 0.00 H new ATOM 1137 N ASP A 75 -9.066 8.345 -14.662 1.00 0.00 N ATOM 1138 CA ASP A 75 -9.141 8.458 -16.114 1.00 0.00 C ATOM 1139 C ASP A 75 -8.265 7.405 -16.786 1.00 0.00 C ATOM 1140 O ASP A 75 -7.138 7.688 -17.192 1.00 0.00 O ATOM 1141 CB ASP A 75 -8.713 9.856 -16.561 1.00 0.00 C ATOM 1142 CG ASP A 75 -9.413 10.297 -17.831 1.00 0.00 C ATOM 1143 OD1 ASP A 75 -9.321 9.569 -18.842 1.00 0.00 O ATOM 1144 OD2 ASP A 75 -10.051 11.371 -17.816 1.00 0.00 O ATOM 0 H ASP A 75 -8.118 8.269 -14.293 1.00 0.00 H new ATOM 0 HA ASP A 75 -10.175 8.290 -16.414 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -8.926 10.570 -15.765 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -7.635 9.869 -16.720 1.00 0.00 H new ATOM 1149 N VAL A 76 -8.791 6.190 -16.900 1.00 0.00 N ATOM 1150 CA VAL A 76 -8.057 5.094 -17.523 1.00 0.00 C ATOM 1151 C VAL A 76 -7.649 5.447 -18.949 1.00 0.00 C ATOM 1152 O VAL A 76 -6.576 5.062 -19.413 1.00 0.00 O ATOM 1153 CB VAL A 76 -8.893 3.800 -17.545 1.00 0.00 C ATOM 1154 CG1 VAL A 76 -8.139 2.690 -18.261 1.00 0.00 C ATOM 1155 CG2 VAL A 76 -9.261 3.380 -16.130 1.00 0.00 C ATOM 0 H VAL A 76 -9.723 5.939 -16.569 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.162 4.930 -16.922 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.815 3.992 -18.093 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -8.745 1.784 -18.267 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.931 2.994 -19.287 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.200 2.495 -17.743 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -9.851 2.464 -16.164 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -8.352 3.205 -15.555 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -9.844 4.170 -15.656 1.00 0.00 H new ATOM 1165 N LYS A 77 -8.513 6.183 -19.640 1.00 0.00 N ATOM 1166 CA LYS A 77 -8.243 6.591 -21.014 1.00 0.00 C ATOM 1167 C LYS A 77 -6.860 7.223 -21.132 1.00 0.00 C ATOM 1168 O LYS A 77 -6.072 6.857 -22.003 1.00 0.00 O ATOM 1169 CB LYS A 77 -9.309 7.579 -21.493 1.00 0.00 C ATOM 1170 CG LYS A 77 -9.239 7.874 -22.981 1.00 0.00 C ATOM 1171 CD LYS A 77 -10.356 8.808 -23.417 1.00 0.00 C ATOM 1172 CE LYS A 77 -10.373 8.990 -24.927 1.00 0.00 C ATOM 1173 NZ LYS A 77 -9.287 9.898 -25.389 1.00 0.00 N ATOM 0 H LYS A 77 -9.406 6.509 -19.271 1.00 0.00 H new ATOM 0 HA LYS A 77 -8.272 5.701 -21.643 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -10.295 7.180 -21.256 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -9.202 8.512 -20.940 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -8.275 8.323 -23.219 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -9.304 6.941 -23.541 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -11.315 8.409 -23.087 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -10.231 9.777 -22.934 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -10.265 8.019 -25.411 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -11.338 9.393 -25.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -9.333 9.996 -26.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -9.404 10.832 -24.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -8.364 9.501 -25.119 1.00 0.00 H new ATOM 1187 N ASN A 78 -6.571 8.174 -20.249 1.00 0.00 N ATOM 1188 CA ASN A 78 -5.282 8.856 -20.254 1.00 0.00 C ATOM 1189 C ASN A 78 -4.412 8.385 -19.092 1.00 0.00 C ATOM 1190 O ASN A 78 -3.333 8.926 -18.852 1.00 0.00 O ATOM 1191 CB ASN A 78 -5.483 10.370 -20.174 1.00 0.00 C ATOM 1192 CG ASN A 78 -5.924 10.966 -21.497 1.00 0.00 C ATOM 1193 OD1 ASN A 78 -5.104 11.227 -22.377 1.00 0.00 O ATOM 1194 ND2 ASN A 78 -7.226 11.184 -21.642 1.00 0.00 N ATOM 0 H ASN A 78 -7.212 8.490 -19.521 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.774 8.612 -21.187 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -6.228 10.595 -19.411 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -4.552 10.841 -19.859 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -7.583 11.583 -22.510 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -7.869 10.952 -20.885 1.00 0.00 H new ATOM 1201 N ASP A 79 -4.890 7.373 -18.376 1.00 0.00 N ATOM 1202 CA ASP A 79 -4.155 6.827 -17.240 1.00 0.00 C ATOM 1203 C ASP A 79 -3.703 7.940 -16.300 1.00 0.00 C ATOM 1204 O ASP A 79 -2.645 7.848 -15.678 1.00 0.00 O ATOM 1205 CB ASP A 79 -2.944 6.028 -17.725 1.00 0.00 C ATOM 1206 CG ASP A 79 -3.248 5.213 -18.967 1.00 0.00 C ATOM 1207 OD1 ASP A 79 -4.246 4.464 -18.955 1.00 0.00 O ATOM 1208 OD2 ASP A 79 -2.486 5.325 -19.950 1.00 0.00 O ATOM 0 H ASP A 79 -5.782 6.914 -18.562 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.823 6.162 -16.692 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -2.122 6.712 -17.935 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -2.610 5.362 -16.930 1.00 0.00 H new ATOM 1213 N ARG A 80 -4.512 8.990 -16.202 1.00 0.00 N ATOM 1214 CA ARG A 80 -4.194 10.121 -15.340 1.00 0.00 C ATOM 1215 C ARG A 80 -5.011 10.070 -14.052 1.00 0.00 C ATOM 1216 O ARG A 80 -6.239 9.988 -14.087 1.00 0.00 O ATOM 1217 CB ARG A 80 -4.458 11.438 -16.072 1.00 0.00 C ATOM 1218 CG ARG A 80 -5.878 11.569 -16.598 1.00 0.00 C ATOM 1219 CD ARG A 80 -6.166 12.983 -17.078 1.00 0.00 C ATOM 1220 NE ARG A 80 -7.465 13.082 -17.738 1.00 0.00 N ATOM 1221 CZ ARG A 80 -7.804 14.080 -18.547 1.00 0.00 C ATOM 1222 NH1 ARG A 80 -6.943 15.057 -18.796 1.00 0.00 N ATOM 1223 NH2 ARG A 80 -9.005 14.100 -19.111 1.00 0.00 N ATOM 0 H ARG A 80 -5.392 9.080 -16.709 1.00 0.00 H new ATOM 0 HA ARG A 80 -3.137 10.062 -15.082 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -4.252 12.267 -15.395 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -3.761 11.526 -16.906 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -6.030 10.867 -17.418 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -6.584 11.299 -15.813 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -6.137 13.667 -16.230 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -5.384 13.298 -17.768 1.00 0.00 H new ATOM 0 HE ARG A 80 -8.149 12.345 -17.569 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -6.018 15.044 -18.366 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -7.206 15.822 -19.417 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -9.669 13.349 -18.924 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -9.264 14.867 -19.732 1.00 0.00 H new ATOM 1237 N TYR A 81 -4.322 10.119 -12.918 1.00 0.00 N ATOM 1238 CA TYR A 81 -4.983 10.075 -11.619 1.00 0.00 C ATOM 1239 C TYR A 81 -4.721 11.355 -10.831 1.00 0.00 C ATOM 1240 O TYR A 81 -3.572 11.754 -10.639 1.00 0.00 O ATOM 1241 CB TYR A 81 -4.504 8.863 -10.819 1.00 0.00 C ATOM 1242 CG TYR A 81 -4.787 7.540 -11.496 1.00 0.00 C ATOM 1243 CD1 TYR A 81 -4.073 7.146 -12.620 1.00 0.00 C ATOM 1244 CD2 TYR A 81 -5.770 6.687 -11.011 1.00 0.00 C ATOM 1245 CE1 TYR A 81 -4.329 5.939 -13.242 1.00 0.00 C ATOM 1246 CE2 TYR A 81 -6.032 5.477 -11.625 1.00 0.00 C ATOM 1247 CZ TYR A 81 -5.309 5.108 -12.740 1.00 0.00 C ATOM 1248 OH TYR A 81 -5.568 3.905 -13.356 1.00 0.00 O ATOM 0 H TYR A 81 -3.305 10.189 -12.872 1.00 0.00 H new ATOM 0 HA TYR A 81 -6.056 9.987 -11.789 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -3.431 8.952 -10.648 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -4.984 8.871 -9.841 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -3.304 7.794 -13.015 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -6.339 6.974 -10.139 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -3.765 5.648 -14.116 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -6.798 4.824 -11.234 1.00 0.00 H new ATOM 0 HH TYR A 81 -4.973 3.798 -14.128 1.00 0.00 H new ATOM 1258 N ILE A 82 -5.795 11.992 -10.376 1.00 0.00 N ATOM 1259 CA ILE A 82 -5.681 13.225 -9.607 1.00 0.00 C ATOM 1260 C ILE A 82 -6.228 13.045 -8.195 1.00 0.00 C ATOM 1261 O ILE A 82 -7.061 12.173 -7.947 1.00 0.00 O ATOM 1262 CB ILE A 82 -6.429 14.386 -10.290 1.00 0.00 C ATOM 1263 CG1 ILE A 82 -6.003 14.504 -11.755 1.00 0.00 C ATOM 1264 CG2 ILE A 82 -6.171 15.690 -9.551 1.00 0.00 C ATOM 1265 CD1 ILE A 82 -7.066 15.106 -12.647 1.00 0.00 C ATOM 0 H ILE A 82 -6.753 11.675 -10.526 1.00 0.00 H new ATOM 0 HA ILE A 82 -4.619 13.467 -9.555 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.499 14.179 -10.258 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.102 15.114 -11.815 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.743 13.514 -12.130 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -6.706 16.501 -10.046 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -6.519 15.600 -8.522 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -5.102 15.905 -9.555 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -6.695 15.159 -13.671 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -7.961 14.484 -12.617 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -7.309 16.109 -12.297 1.00 0.00 H new ATOM 1277 N VAL A 83 -5.755 13.876 -7.272 1.00 0.00 N ATOM 1278 CA VAL A 83 -6.198 13.811 -5.885 1.00 0.00 C ATOM 1279 C VAL A 83 -6.583 15.191 -5.365 1.00 0.00 C ATOM 1280 O VAL A 83 -5.732 16.064 -5.201 1.00 0.00 O ATOM 1281 CB VAL A 83 -5.106 13.218 -4.974 1.00 0.00 C ATOM 1282 CG1 VAL A 83 -5.592 13.144 -3.535 1.00 0.00 C ATOM 1283 CG2 VAL A 83 -4.683 11.845 -5.474 1.00 0.00 C ATOM 0 H VAL A 83 -5.064 14.603 -7.460 1.00 0.00 H new ATOM 0 HA VAL A 83 -7.073 13.161 -5.863 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.236 13.874 -5.005 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.807 12.723 -2.907 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.840 14.145 -3.183 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -6.478 12.511 -3.482 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.911 11.441 -4.819 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.544 11.177 -5.475 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.290 11.932 -6.487 1.00 0.00 H new ATOM 1293 N ASN A 84 -7.873 15.381 -5.108 1.00 0.00 N ATOM 1294 CA ASN A 84 -8.373 16.657 -4.606 1.00 0.00 C ATOM 1295 C ASN A 84 -7.717 17.012 -3.276 1.00 0.00 C ATOM 1296 O ASN A 84 -7.858 16.290 -2.290 1.00 0.00 O ATOM 1297 CB ASN A 84 -9.893 16.603 -4.440 1.00 0.00 C ATOM 1298 CG ASN A 84 -10.623 16.700 -5.766 1.00 0.00 C ATOM 1299 OD1 ASN A 84 -11.465 15.713 -6.051 1.00 0.00 O flip ATOM 1300 ND2 ASN A 84 -10.433 17.651 -6.524 1.00 0.00 N flip ATOM 0 H ASN A 84 -8.591 14.669 -5.239 1.00 0.00 H new ATOM 0 HA ASN A 84 -8.121 17.429 -5.333 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -10.169 15.673 -3.944 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -10.214 17.418 -3.791 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -9.777 18.387 -6.264 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -10.932 17.703 -7.412 1.00 0.00 H new ATOM 1307 N GLY A 85 -7.000 18.132 -3.256 1.00 0.00 N ATOM 1308 CA GLY A 85 -6.333 18.565 -2.042 1.00 0.00 C ATOM 1309 C GLY A 85 -4.844 18.770 -2.240 1.00 0.00 C ATOM 1310 O GLY A 85 -4.215 18.075 -3.037 1.00 0.00 O ATOM 0 H GLY A 85 -6.869 18.747 -4.059 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.782 19.496 -1.697 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -6.494 17.824 -1.259 1.00 0.00 H new ATOM 1314 N SER A 86 -4.279 19.729 -1.513 1.00 0.00 N ATOM 1315 CA SER A 86 -2.856 20.029 -1.616 1.00 0.00 C ATOM 1316 C SER A 86 -2.035 19.068 -0.761 1.00 0.00 C ATOM 1317 O SER A 86 -2.171 19.037 0.462 1.00 0.00 O ATOM 1318 CB SER A 86 -2.584 21.471 -1.186 1.00 0.00 C ATOM 1319 OG SER A 86 -2.699 21.615 0.219 1.00 0.00 O ATOM 0 H SER A 86 -4.785 20.311 -0.846 1.00 0.00 H new ATOM 0 HA SER A 86 -2.559 19.906 -2.658 1.00 0.00 H new ATOM 0 HB2 SER A 86 -1.584 21.766 -1.504 1.00 0.00 H new ATOM 0 HB3 SER A 86 -3.287 22.140 -1.682 1.00 0.00 H new ATOM 0 HG SER A 86 -2.592 20.740 0.647 1.00 0.00 H new ATOM 1325 N HIS A 87 -1.183 18.284 -1.415 1.00 0.00 N ATOM 1326 CA HIS A 87 -0.339 17.322 -0.716 1.00 0.00 C ATOM 1327 C HIS A 87 1.005 17.166 -1.420 1.00 0.00 C ATOM 1328 O HIS A 87 1.068 17.079 -2.645 1.00 0.00 O ATOM 1329 CB HIS A 87 -1.041 15.966 -0.626 1.00 0.00 C ATOM 1330 CG HIS A 87 -2.530 16.070 -0.496 1.00 0.00 C ATOM 1331 ND1 HIS A 87 -3.169 16.252 0.712 1.00 0.00 N ATOM 1332 CD2 HIS A 87 -3.506 16.018 -1.432 1.00 0.00 C ATOM 1333 CE1 HIS A 87 -4.473 16.306 0.514 1.00 0.00 C ATOM 1334 NE2 HIS A 87 -4.705 16.166 -0.779 1.00 0.00 N ATOM 0 H HIS A 87 -1.059 18.296 -2.427 1.00 0.00 H new ATOM 0 HA HIS A 87 -0.160 17.698 0.291 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -0.802 15.383 -1.515 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -0.647 15.418 0.230 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -2.706 16.332 1.617 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -3.368 15.885 -2.495 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -5.223 16.442 1.279 1.00 0.00 H new ATOM 1342 N GLU A 88 2.078 17.132 -0.635 1.00 0.00 N ATOM 1343 CA GLU A 88 3.421 16.989 -1.185 1.00 0.00 C ATOM 1344 C GLU A 88 3.788 15.517 -1.347 1.00 0.00 C ATOM 1345 O GLU A 88 3.315 14.662 -0.599 1.00 0.00 O ATOM 1346 CB GLU A 88 4.442 17.684 -0.282 1.00 0.00 C ATOM 1347 CG GLU A 88 4.613 17.016 1.072 1.00 0.00 C ATOM 1348 CD GLU A 88 5.224 17.941 2.106 1.00 0.00 C ATOM 1349 OE1 GLU A 88 6.312 18.492 1.841 1.00 0.00 O ATOM 1350 OE2 GLU A 88 4.612 18.113 3.181 1.00 0.00 O ATOM 0 H GLU A 88 2.043 17.201 0.382 1.00 0.00 H new ATOM 0 HA GLU A 88 3.436 17.460 -2.168 1.00 0.00 H new ATOM 0 HB2 GLU A 88 5.406 17.708 -0.790 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.135 18.719 -0.131 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.642 16.670 1.428 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.244 16.134 0.961 1.00 0.00 H new ATOM 1357 N ALA A 89 4.635 15.229 -2.331 1.00 0.00 N ATOM 1358 CA ALA A 89 5.067 13.861 -2.591 1.00 0.00 C ATOM 1359 C ALA A 89 5.497 13.167 -1.303 1.00 0.00 C ATOM 1360 O ALA A 89 5.040 12.067 -0.998 1.00 0.00 O ATOM 1361 CB ALA A 89 6.202 13.851 -3.603 1.00 0.00 C ATOM 0 H ALA A 89 5.035 15.925 -2.961 1.00 0.00 H new ATOM 0 HA ALA A 89 4.222 13.311 -3.004 1.00 0.00 H new ATOM 0 HB1 ALA A 89 6.515 12.824 -3.788 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.862 14.300 -4.536 1.00 0.00 H new ATOM 0 HB3 ALA A 89 7.044 14.422 -3.211 1.00 0.00 H new ATOM 1367 N ASN A 90 6.380 13.818 -0.552 1.00 0.00 N ATOM 1368 CA ASN A 90 6.873 13.261 0.703 1.00 0.00 C ATOM 1369 C ASN A 90 5.723 12.717 1.546 1.00 0.00 C ATOM 1370 O ASN A 90 5.828 11.645 2.141 1.00 0.00 O ATOM 1371 CB ASN A 90 7.638 14.326 1.491 1.00 0.00 C ATOM 1372 CG ASN A 90 7.722 14.002 2.970 1.00 0.00 C ATOM 1373 OD1 ASN A 90 8.585 13.237 3.401 1.00 0.00 O ATOM 1374 ND2 ASN A 90 6.822 14.584 3.755 1.00 0.00 N ATOM 0 H ASN A 90 6.768 14.731 -0.790 1.00 0.00 H new ATOM 0 HA ASN A 90 7.548 12.438 0.467 1.00 0.00 H new ATOM 0 HB2 ASN A 90 8.645 14.421 1.085 1.00 0.00 H new ATOM 0 HB3 ASN A 90 7.149 15.292 1.361 1.00 0.00 H new ATOM 0 HD21 ASN A 90 6.828 14.404 4.759 1.00 0.00 H new ATOM 0 HD22 ASN A 90 6.125 15.211 3.354 1.00 0.00 H new ATOM 1381 N LYS A 91 4.625 13.464 1.591 1.00 0.00 N ATOM 1382 CA LYS A 91 3.454 13.058 2.358 1.00 0.00 C ATOM 1383 C LYS A 91 2.840 11.786 1.782 1.00 0.00 C ATOM 1384 O LYS A 91 2.482 10.867 2.521 1.00 0.00 O ATOM 1385 CB LYS A 91 2.412 14.179 2.370 1.00 0.00 C ATOM 1386 CG LYS A 91 1.062 13.749 2.917 1.00 0.00 C ATOM 1387 CD LYS A 91 1.050 13.745 4.436 1.00 0.00 C ATOM 1388 CE LYS A 91 -0.361 13.592 4.983 1.00 0.00 C ATOM 1389 NZ LYS A 91 -1.089 14.891 5.010 1.00 0.00 N ATOM 0 H LYS A 91 4.522 14.355 1.105 1.00 0.00 H new ATOM 0 HA LYS A 91 3.773 12.856 3.380 1.00 0.00 H new ATOM 0 HB2 LYS A 91 2.790 15.008 2.968 1.00 0.00 H new ATOM 0 HB3 LYS A 91 2.281 14.553 1.354 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.288 14.422 2.548 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.820 12.752 2.548 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.674 12.930 4.803 1.00 0.00 H new ATOM 0 HD3 LYS A 91 1.486 14.673 4.807 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -0.913 12.879 4.370 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.317 13.179 5.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -2.046 14.745 5.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -0.576 15.564 5.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -1.153 15.273 4.045 1.00 0.00 H new ATOM 1403 N LEU A 92 2.723 11.737 0.460 1.00 0.00 N ATOM 1404 CA LEU A 92 2.154 10.576 -0.216 1.00 0.00 C ATOM 1405 C LEU A 92 3.044 9.351 -0.035 1.00 0.00 C ATOM 1406 O LEU A 92 2.625 8.348 0.541 1.00 0.00 O ATOM 1407 CB LEU A 92 1.967 10.869 -1.706 1.00 0.00 C ATOM 1408 CG LEU A 92 0.935 11.942 -2.054 1.00 0.00 C ATOM 1409 CD1 LEU A 92 1.077 12.367 -3.507 1.00 0.00 C ATOM 1410 CD2 LEU A 92 -0.474 11.436 -1.779 1.00 0.00 C ATOM 0 H LEU A 92 3.015 12.488 -0.166 1.00 0.00 H new ATOM 0 HA LEU A 92 1.182 10.366 0.231 1.00 0.00 H new ATOM 0 HB2 LEU A 92 2.929 11.171 -2.120 1.00 0.00 H new ATOM 0 HB3 LEU A 92 1.681 9.943 -2.205 1.00 0.00 H new ATOM 0 HG LEU A 92 1.116 12.812 -1.423 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.334 13.131 -3.737 1.00 0.00 H new ATOM 0 HD12 LEU A 92 2.076 12.770 -3.672 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.922 11.504 -4.155 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.195 12.213 -2.032 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.667 10.550 -2.384 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -0.570 11.182 -0.723 1.00 0.00 H new ATOM 1422 N GLN A 93 4.275 9.441 -0.530 1.00 0.00 N ATOM 1423 CA GLN A 93 5.224 8.340 -0.421 1.00 0.00 C ATOM 1424 C GLN A 93 5.192 7.729 0.977 1.00 0.00 C ATOM 1425 O GLN A 93 5.304 6.514 1.136 1.00 0.00 O ATOM 1426 CB GLN A 93 6.638 8.823 -0.746 1.00 0.00 C ATOM 1427 CG GLN A 93 6.998 8.704 -2.219 1.00 0.00 C ATOM 1428 CD GLN A 93 7.655 7.379 -2.553 1.00 0.00 C ATOM 1429 OE1 GLN A 93 8.857 7.317 -2.812 1.00 0.00 O ATOM 1430 NE2 GLN A 93 6.868 6.310 -2.549 1.00 0.00 N ATOM 0 H GLN A 93 4.638 10.265 -1.010 1.00 0.00 H new ATOM 0 HA GLN A 93 4.935 7.573 -1.140 1.00 0.00 H new ATOM 0 HB2 GLN A 93 6.737 9.864 -0.439 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.354 8.248 -0.158 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.096 8.820 -2.820 1.00 0.00 H new ATOM 0 HG3 GLN A 93 7.670 9.518 -2.492 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.877 6.407 -2.329 1.00 0.00 H new ATOM 0 HE22 GLN A 93 7.254 5.391 -2.766 1.00 0.00 H new ATOM 1439 N ASP A 94 5.039 8.580 1.985 1.00 0.00 N ATOM 1440 CA ASP A 94 4.991 8.125 3.369 1.00 0.00 C ATOM 1441 C ASP A 94 3.741 7.289 3.624 1.00 0.00 C ATOM 1442 O ASP A 94 3.816 6.197 4.187 1.00 0.00 O ATOM 1443 CB ASP A 94 5.023 9.320 4.323 1.00 0.00 C ATOM 1444 CG ASP A 94 5.033 8.898 5.780 1.00 0.00 C ATOM 1445 OD1 ASP A 94 4.484 7.820 6.089 1.00 0.00 O ATOM 1446 OD2 ASP A 94 5.590 9.646 6.610 1.00 0.00 O ATOM 0 H ASP A 94 4.946 9.589 1.869 1.00 0.00 H new ATOM 0 HA ASP A 94 5.866 7.501 3.550 1.00 0.00 H new ATOM 0 HB2 ASP A 94 5.907 9.923 4.116 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.155 9.953 4.137 1.00 0.00 H new ATOM 1451 N MET A 95 2.592 7.809 3.205 1.00 0.00 N ATOM 1452 CA MET A 95 1.325 7.110 3.388 1.00 0.00 C ATOM 1453 C MET A 95 1.293 5.821 2.572 1.00 0.00 C ATOM 1454 O MET A 95 1.052 4.740 3.110 1.00 0.00 O ATOM 1455 CB MET A 95 0.157 8.012 2.984 1.00 0.00 C ATOM 1456 CG MET A 95 0.007 9.242 3.865 1.00 0.00 C ATOM 1457 SD MET A 95 -0.879 10.580 3.044 1.00 0.00 S ATOM 1458 CE MET A 95 -2.545 9.922 3.025 1.00 0.00 C ATOM 0 H MET A 95 2.512 8.712 2.737 1.00 0.00 H new ATOM 0 HA MET A 95 1.229 6.854 4.443 1.00 0.00 H new ATOM 0 HB2 MET A 95 0.294 8.330 1.950 1.00 0.00 H new ATOM 0 HB3 MET A 95 -0.767 7.435 3.020 1.00 0.00 H new ATOM 0 HG2 MET A 95 -0.522 8.968 4.778 1.00 0.00 H new ATOM 0 HG3 MET A 95 0.995 9.594 4.162 1.00 0.00 H new ATOM 0 HE1 MET A 95 -2.890 9.834 1.995 1.00 0.00 H new ATOM 0 HE2 MET A 95 -2.553 8.939 3.496 1.00 0.00 H new ATOM 0 HE3 MET A 95 -3.207 10.592 3.573 1.00 0.00 H new ATOM 1468 N LEU A 96 1.537 5.944 1.272 1.00 0.00 N ATOM 1469 CA LEU A 96 1.536 4.788 0.381 1.00 0.00 C ATOM 1470 C LEU A 96 2.115 3.562 1.079 1.00 0.00 C ATOM 1471 O LEU A 96 1.533 2.478 1.036 1.00 0.00 O ATOM 1472 CB LEU A 96 2.337 5.095 -0.885 1.00 0.00 C ATOM 1473 CG LEU A 96 2.134 4.134 -2.057 1.00 0.00 C ATOM 1474 CD1 LEU A 96 0.652 3.939 -2.337 1.00 0.00 C ATOM 1475 CD2 LEU A 96 2.850 4.647 -3.298 1.00 0.00 C ATOM 0 H LEU A 96 1.738 6.832 0.811 1.00 0.00 H new ATOM 0 HA LEU A 96 0.503 4.572 0.107 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.081 6.101 -1.218 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.396 5.104 -0.628 1.00 0.00 H new ATOM 0 HG LEU A 96 2.562 3.168 -1.788 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.527 3.252 -3.174 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.166 3.526 -1.453 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.199 4.899 -2.585 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.695 3.950 -4.122 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.452 5.625 -3.570 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.917 4.734 -3.093 1.00 0.00 H new ATOM 1487 N ASP A 97 3.263 3.741 1.723 1.00 0.00 N ATOM 1488 CA ASP A 97 3.920 2.651 2.434 1.00 0.00 C ATOM 1489 C ASP A 97 2.892 1.697 3.035 1.00 0.00 C ATOM 1490 O ASP A 97 2.894 0.502 2.744 1.00 0.00 O ATOM 1491 CB ASP A 97 4.826 3.203 3.535 1.00 0.00 C ATOM 1492 CG ASP A 97 5.496 2.106 4.339 1.00 0.00 C ATOM 1493 OD1 ASP A 97 6.351 1.394 3.772 1.00 0.00 O ATOM 1494 OD2 ASP A 97 5.164 1.959 5.534 1.00 0.00 O ATOM 0 H ASP A 97 3.758 4.632 1.767 1.00 0.00 H new ATOM 0 HA ASP A 97 4.528 2.098 1.718 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.590 3.839 3.088 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.238 3.832 4.204 1.00 0.00 H new ATOM 1499 N GLY A 98 2.014 2.235 3.877 1.00 0.00 N ATOM 1500 CA GLY A 98 0.994 1.417 4.507 1.00 0.00 C ATOM 1501 C GLY A 98 0.394 0.402 3.554 1.00 0.00 C ATOM 1502 O GLY A 98 0.336 -0.789 3.861 1.00 0.00 O ATOM 0 H GLY A 98 1.991 3.222 4.134 1.00 0.00 H new ATOM 0 HA2 GLY A 98 1.427 0.897 5.362 1.00 0.00 H new ATOM 0 HA3 GLY A 98 0.203 2.061 4.892 1.00 0.00 H new ATOM 1506 N PHE A 99 -0.054 0.873 2.395 1.00 0.00 N ATOM 1507 CA PHE A 99 -0.654 -0.002 1.396 1.00 0.00 C ATOM 1508 C PHE A 99 0.300 -1.131 1.017 1.00 0.00 C ATOM 1509 O PHE A 99 -0.007 -2.308 1.208 1.00 0.00 O ATOM 1510 CB PHE A 99 -1.036 0.799 0.149 1.00 0.00 C ATOM 1511 CG PHE A 99 -1.376 -0.061 -1.035 1.00 0.00 C ATOM 1512 CD1 PHE A 99 -2.610 -0.685 -1.122 1.00 0.00 C ATOM 1513 CD2 PHE A 99 -0.463 -0.244 -2.060 1.00 0.00 C ATOM 1514 CE1 PHE A 99 -2.927 -1.477 -2.210 1.00 0.00 C ATOM 1515 CE2 PHE A 99 -0.774 -1.034 -3.151 1.00 0.00 C ATOM 1516 CZ PHE A 99 -2.007 -1.652 -3.225 1.00 0.00 C ATOM 0 H PHE A 99 -0.013 1.856 2.125 1.00 0.00 H new ATOM 0 HA PHE A 99 -1.554 -0.441 1.827 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -1.890 1.435 0.383 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.210 1.459 -0.116 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -3.333 -0.551 -0.331 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.503 0.236 -2.006 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -3.892 -1.958 -2.266 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -0.054 -1.168 -3.945 1.00 0.00 H new ATOM 0 HZ PHE A 99 -2.251 -2.271 -4.075 1.00 0.00 H new ATOM 1526 N ILE A 100 1.457 -0.763 0.477 1.00 0.00 N ATOM 1527 CA ILE A 100 2.457 -1.743 0.072 1.00 0.00 C ATOM 1528 C ILE A 100 2.920 -2.579 1.260 1.00 0.00 C ATOM 1529 O ILE A 100 3.446 -3.680 1.092 1.00 0.00 O ATOM 1530 CB ILE A 100 3.680 -1.066 -0.573 1.00 0.00 C ATOM 1531 CG1 ILE A 100 3.237 -0.120 -1.691 1.00 0.00 C ATOM 1532 CG2 ILE A 100 4.644 -2.114 -1.110 1.00 0.00 C ATOM 1533 CD1 ILE A 100 4.324 0.828 -2.147 1.00 0.00 C ATOM 0 H ILE A 100 1.725 0.207 0.310 1.00 0.00 H new ATOM 0 HA ILE A 100 1.982 -2.393 -0.663 1.00 0.00 H new ATOM 0 HB ILE A 100 4.196 -0.481 0.189 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.900 -0.710 -2.543 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.381 0.460 -1.347 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.503 -1.620 -1.563 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.981 -2.751 -0.292 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.139 -2.723 -1.860 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.939 1.468 -2.941 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.645 1.444 -1.307 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.172 0.255 -2.522 1.00 0.00 H new ATOM 1545 N LYS A 101 2.720 -2.051 2.462 1.00 0.00 N ATOM 1546 CA LYS A 101 3.114 -2.749 3.681 1.00 0.00 C ATOM 1547 C LYS A 101 2.372 -4.075 3.811 1.00 0.00 C ATOM 1548 O LYS A 101 2.877 -5.024 4.413 1.00 0.00 O ATOM 1549 CB LYS A 101 2.837 -1.874 4.906 1.00 0.00 C ATOM 1550 CG LYS A 101 3.802 -2.113 6.054 1.00 0.00 C ATOM 1551 CD LYS A 101 4.124 -0.823 6.789 1.00 0.00 C ATOM 1552 CE LYS A 101 3.196 -0.610 7.975 1.00 0.00 C ATOM 1553 NZ LYS A 101 1.953 0.111 7.584 1.00 0.00 N ATOM 0 H LYS A 101 2.287 -1.141 2.619 1.00 0.00 H new ATOM 0 HA LYS A 101 4.183 -2.955 3.624 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.887 -0.826 4.612 1.00 0.00 H new ATOM 0 HB3 LYS A 101 1.820 -2.059 5.252 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.370 -2.831 6.750 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.722 -2.554 5.671 1.00 0.00 H new ATOM 0 HD2 LYS A 101 5.158 -0.848 7.134 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.038 0.019 6.103 1.00 0.00 H new ATOM 0 HE2 LYS A 101 2.935 -1.575 8.410 1.00 0.00 H new ATOM 0 HE3 LYS A 101 3.717 -0.043 8.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 1.363 0.267 8.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 2.202 1.028 7.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 1.425 -0.457 6.891 1.00 0.00 H new ATOM 1567 N LYS A 102 1.173 -4.136 3.243 1.00 0.00 N ATOM 1568 CA LYS A 102 0.362 -5.347 3.293 1.00 0.00 C ATOM 1569 C LYS A 102 -0.170 -5.703 1.909 1.00 0.00 C ATOM 1570 O LYS A 102 0.039 -6.813 1.419 1.00 0.00 O ATOM 1571 CB LYS A 102 -0.803 -5.166 4.269 1.00 0.00 C ATOM 1572 CG LYS A 102 -1.717 -4.006 3.915 1.00 0.00 C ATOM 1573 CD LYS A 102 -2.594 -3.609 5.091 1.00 0.00 C ATOM 1574 CE LYS A 102 -1.777 -2.979 6.208 1.00 0.00 C ATOM 1575 NZ LYS A 102 -2.640 -2.283 7.202 1.00 0.00 N ATOM 0 H LYS A 102 0.740 -3.360 2.742 1.00 0.00 H new ATOM 0 HA LYS A 102 0.995 -6.164 3.640 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.389 -6.085 4.296 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -0.405 -5.012 5.272 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.117 -3.151 3.602 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -2.345 -4.282 3.068 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -3.357 -2.906 4.756 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -3.115 -4.488 5.471 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -1.194 -3.750 6.711 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -1.067 -2.269 5.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -2.045 -1.867 7.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -3.178 -1.530 6.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -3.300 -2.965 7.627 1.00 0.00 H new ATOM 1589 N PHE A 103 -0.859 -4.754 1.283 1.00 0.00 N ATOM 1590 CA PHE A 103 -1.421 -4.968 -0.045 1.00 0.00 C ATOM 1591 C PHE A 103 -0.371 -5.534 -0.996 1.00 0.00 C ATOM 1592 O PHE A 103 -0.701 -6.104 -2.036 1.00 0.00 O ATOM 1593 CB PHE A 103 -1.977 -3.656 -0.604 1.00 0.00 C ATOM 1594 CG PHE A 103 -3.206 -3.172 0.112 1.00 0.00 C ATOM 1595 CD1 PHE A 103 -3.102 -2.516 1.327 1.00 0.00 C ATOM 1596 CD2 PHE A 103 -4.464 -3.374 -0.431 1.00 0.00 C ATOM 1597 CE1 PHE A 103 -4.232 -2.070 1.988 1.00 0.00 C ATOM 1598 CE2 PHE A 103 -5.597 -2.931 0.225 1.00 0.00 C ATOM 1599 CZ PHE A 103 -5.481 -2.277 1.436 1.00 0.00 C ATOM 0 H PHE A 103 -1.041 -3.830 1.674 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.232 -5.691 0.044 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -1.205 -2.889 -0.544 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -2.211 -3.790 -1.660 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -2.128 -2.351 1.763 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -4.561 -3.884 -1.378 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.138 -1.560 2.935 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -6.572 -3.096 -0.209 1.00 0.00 H new ATOM 0 HZ PHE A 103 -6.365 -1.928 1.950 1.00 0.00 H new ATOM 1609 N VAL A 104 0.897 -5.372 -0.631 1.00 0.00 N ATOM 1610 CA VAL A 104 1.997 -5.867 -1.450 1.00 0.00 C ATOM 1611 C VAL A 104 2.861 -6.854 -0.673 1.00 0.00 C ATOM 1612 O VAL A 104 2.865 -8.052 -0.959 1.00 0.00 O ATOM 1613 CB VAL A 104 2.884 -4.713 -1.956 1.00 0.00 C ATOM 1614 CG1 VAL A 104 4.188 -5.252 -2.524 1.00 0.00 C ATOM 1615 CG2 VAL A 104 2.141 -3.887 -2.995 1.00 0.00 C ATOM 0 H VAL A 104 1.188 -4.902 0.226 1.00 0.00 H new ATOM 0 HA VAL A 104 1.551 -6.375 -2.305 1.00 0.00 H new ATOM 0 HB VAL A 104 3.123 -4.065 -1.113 1.00 0.00 H new ATOM 0 HG11 VAL A 104 4.802 -4.423 -2.876 1.00 0.00 H new ATOM 0 HG12 VAL A 104 4.725 -5.797 -1.748 1.00 0.00 H new ATOM 0 HG13 VAL A 104 3.973 -5.923 -3.355 1.00 0.00 H new ATOM 0 HG21 VAL A 104 2.782 -3.076 -3.342 1.00 0.00 H new ATOM 0 HG22 VAL A 104 1.870 -4.522 -3.839 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.237 -3.470 -2.550 1.00 0.00 H new ATOM 1625 N LEU A 105 3.591 -6.344 0.313 1.00 0.00 N ATOM 1626 CA LEU A 105 4.459 -7.180 1.134 1.00 0.00 C ATOM 1627 C LEU A 105 3.686 -8.358 1.719 1.00 0.00 C ATOM 1628 O LEU A 105 2.458 -8.405 1.648 1.00 0.00 O ATOM 1629 CB LEU A 105 5.080 -6.353 2.261 1.00 0.00 C ATOM 1630 CG LEU A 105 5.955 -5.177 1.827 1.00 0.00 C ATOM 1631 CD1 LEU A 105 6.174 -4.218 2.987 1.00 0.00 C ATOM 1632 CD2 LEU A 105 7.287 -5.675 1.286 1.00 0.00 C ATOM 0 H LEU A 105 3.599 -5.355 0.563 1.00 0.00 H new ATOM 0 HA LEU A 105 5.253 -7.570 0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 105 4.276 -5.969 2.889 1.00 0.00 H new ATOM 0 HB3 LEU A 105 5.681 -7.017 2.883 1.00 0.00 H new ATOM 0 HG LEU A 105 5.440 -4.640 1.031 1.00 0.00 H new ATOM 0 HD11 LEU A 105 6.799 -3.387 2.659 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.212 -3.836 3.329 1.00 0.00 H new ATOM 0 HD13 LEU A 105 6.668 -4.743 3.805 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.897 -4.824 0.982 1.00 0.00 H new ATOM 0 HD22 LEU A 105 7.808 -6.236 2.062 1.00 0.00 H new ATOM 0 HD23 LEU A 105 7.112 -6.322 0.426 1.00 0.00 H new ATOM 1644 N CYS A 106 4.414 -9.307 2.298 1.00 0.00 N ATOM 1645 CA CYS A 106 3.798 -10.485 2.897 1.00 0.00 C ATOM 1646 C CYS A 106 3.903 -10.439 4.419 1.00 0.00 C ATOM 1647 O CYS A 106 4.957 -10.149 4.985 1.00 0.00 O ATOM 1648 CB CYS A 106 4.461 -11.758 2.367 1.00 0.00 C ATOM 1649 SG CYS A 106 3.449 -13.260 2.565 1.00 0.00 S ATOM 0 H CYS A 106 5.432 -9.283 2.365 1.00 0.00 H new ATOM 0 HA CYS A 106 2.743 -10.492 2.623 1.00 0.00 H new ATOM 0 HB2 CYS A 106 4.689 -11.623 1.310 1.00 0.00 H new ATOM 0 HB3 CYS A 106 5.411 -11.902 2.882 1.00 0.00 H new ATOM 1654 N PRO A 107 2.784 -10.732 5.098 1.00 0.00 N ATOM 1655 CA PRO A 107 2.724 -10.732 6.562 1.00 0.00 C ATOM 1656 C PRO A 107 3.514 -11.884 7.175 1.00 0.00 C ATOM 1657 O PRO A 107 3.482 -12.094 8.387 1.00 0.00 O ATOM 1658 CB PRO A 107 1.230 -10.893 6.856 1.00 0.00 C ATOM 1659 CG PRO A 107 0.679 -11.579 5.654 1.00 0.00 C ATOM 1660 CD PRO A 107 1.491 -11.087 4.488 1.00 0.00 C ATOM 0 HA PRO A 107 3.162 -9.829 6.987 1.00 0.00 H new ATOM 0 HB2 PRO A 107 1.065 -11.482 7.758 1.00 0.00 H new ATOM 0 HB3 PRO A 107 0.751 -9.927 7.014 1.00 0.00 H new ATOM 0 HG2 PRO A 107 0.755 -12.662 5.753 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -0.377 -11.345 5.521 1.00 0.00 H new ATOM 0 HD2 PRO A 107 1.605 -11.856 3.724 1.00 0.00 H new ATOM 0 HD3 PRO A 107 1.024 -10.227 4.007 1.00 0.00 H new ATOM 1668 N GLU A 108 4.223 -12.625 6.329 1.00 0.00 N ATOM 1669 CA GLU A 108 5.021 -13.755 6.789 1.00 0.00 C ATOM 1670 C GLU A 108 6.453 -13.657 6.271 1.00 0.00 C ATOM 1671 O GLU A 108 7.412 -13.782 7.034 1.00 0.00 O ATOM 1672 CB GLU A 108 4.392 -15.073 6.331 1.00 0.00 C ATOM 1673 CG GLU A 108 3.095 -15.410 7.049 1.00 0.00 C ATOM 1674 CD GLU A 108 3.250 -15.424 8.557 1.00 0.00 C ATOM 1675 OE1 GLU A 108 4.098 -16.193 9.058 1.00 0.00 O ATOM 1676 OE2 GLU A 108 2.525 -14.669 9.236 1.00 0.00 O ATOM 0 H GLU A 108 4.261 -12.463 5.323 1.00 0.00 H new ATOM 0 HA GLU A 108 5.044 -13.730 7.878 1.00 0.00 H new ATOM 0 HB2 GLU A 108 4.201 -15.022 5.259 1.00 0.00 H new ATOM 0 HB3 GLU A 108 5.106 -15.881 6.490 1.00 0.00 H new ATOM 0 HG2 GLU A 108 2.332 -14.683 6.773 1.00 0.00 H new ATOM 0 HG3 GLU A 108 2.742 -16.386 6.715 1.00 0.00 H new ATOM 1683 N CYS A 109 6.591 -13.432 4.969 1.00 0.00 N ATOM 1684 CA CYS A 109 7.905 -13.317 4.347 1.00 0.00 C ATOM 1685 C CYS A 109 8.127 -11.909 3.802 1.00 0.00 C ATOM 1686 O CYS A 109 9.027 -11.681 2.994 1.00 0.00 O ATOM 1687 CB CYS A 109 8.050 -14.341 3.220 1.00 0.00 C ATOM 1688 SG CYS A 109 6.871 -14.111 1.850 1.00 0.00 S ATOM 0 H CYS A 109 5.808 -13.326 4.323 1.00 0.00 H new ATOM 0 HA CYS A 109 8.659 -13.516 5.109 1.00 0.00 H new ATOM 0 HB2 CYS A 109 9.064 -14.289 2.825 1.00 0.00 H new ATOM 0 HB3 CYS A 109 7.920 -15.341 3.633 1.00 0.00 H new ATOM 1693 N GLU A 110 7.301 -10.969 4.250 1.00 0.00 N ATOM 1694 CA GLU A 110 7.407 -9.584 3.807 1.00 0.00 C ATOM 1695 C GLU A 110 7.845 -9.513 2.346 1.00 0.00 C ATOM 1696 O GLU A 110 8.545 -8.585 1.942 1.00 0.00 O ATOM 1697 CB GLU A 110 8.399 -8.819 4.685 1.00 0.00 C ATOM 1698 CG GLU A 110 7.818 -8.383 6.020 1.00 0.00 C ATOM 1699 CD GLU A 110 7.989 -9.433 7.101 1.00 0.00 C ATOM 1700 OE1 GLU A 110 9.137 -9.642 7.548 1.00 0.00 O ATOM 1701 OE2 GLU A 110 6.977 -10.046 7.499 1.00 0.00 O ATOM 0 H GLU A 110 6.551 -11.141 4.919 1.00 0.00 H new ATOM 0 HA GLU A 110 6.423 -9.124 3.897 1.00 0.00 H new ATOM 0 HB2 GLU A 110 9.271 -9.447 4.865 1.00 0.00 H new ATOM 0 HB3 GLU A 110 8.746 -7.939 4.144 1.00 0.00 H new ATOM 0 HG2 GLU A 110 8.300 -7.458 6.337 1.00 0.00 H new ATOM 0 HG3 GLU A 110 6.758 -8.163 5.896 1.00 0.00 H new ATOM 1708 N ASN A 111 7.427 -10.500 1.561 1.00 0.00 N ATOM 1709 CA ASN A 111 7.776 -10.550 0.145 1.00 0.00 C ATOM 1710 C ASN A 111 6.940 -9.557 -0.657 1.00 0.00 C ATOM 1711 O ASN A 111 5.710 -9.550 -0.594 1.00 0.00 O ATOM 1712 CB ASN A 111 7.572 -11.964 -0.401 1.00 0.00 C ATOM 1713 CG ASN A 111 7.925 -12.072 -1.872 1.00 0.00 C ATOM 1714 OD1 ASN A 111 7.047 -12.056 -2.735 1.00 0.00 O ATOM 1715 ND2 ASN A 111 9.216 -12.183 -2.164 1.00 0.00 N ATOM 0 H ASN A 111 6.847 -11.276 1.880 1.00 0.00 H new ATOM 0 HA ASN A 111 8.826 -10.277 0.045 1.00 0.00 H new ATOM 0 HB2 ASN A 111 8.184 -12.663 0.169 1.00 0.00 H new ATOM 0 HB3 ASN A 111 6.533 -12.260 -0.257 1.00 0.00 H new ATOM 0 HD21 ASN A 111 9.514 -12.259 -3.136 1.00 0.00 H new ATOM 0 HD22 ASN A 111 9.909 -12.192 -1.416 1.00 0.00 H new ATOM 1722 N PRO A 112 7.622 -8.699 -1.430 1.00 0.00 N ATOM 1723 CA PRO A 112 6.963 -7.686 -2.260 1.00 0.00 C ATOM 1724 C PRO A 112 6.211 -8.301 -3.436 1.00 0.00 C ATOM 1725 O PRO A 112 5.542 -7.597 -4.192 1.00 0.00 O ATOM 1726 CB PRO A 112 8.126 -6.825 -2.760 1.00 0.00 C ATOM 1727 CG PRO A 112 9.310 -7.729 -2.720 1.00 0.00 C ATOM 1728 CD PRO A 112 9.088 -8.651 -1.553 1.00 0.00 C ATOM 0 HA PRO A 112 6.211 -7.128 -1.702 1.00 0.00 H new ATOM 0 HB2 PRO A 112 7.942 -6.458 -3.770 1.00 0.00 H new ATOM 0 HB3 PRO A 112 8.273 -5.951 -2.125 1.00 0.00 H new ATOM 0 HG2 PRO A 112 9.403 -8.291 -3.649 1.00 0.00 H new ATOM 0 HG3 PRO A 112 10.232 -7.160 -2.598 1.00 0.00 H new ATOM 0 HD2 PRO A 112 9.508 -9.640 -1.737 1.00 0.00 H new ATOM 0 HD3 PRO A 112 9.555 -8.270 -0.645 1.00 0.00 H new ATOM 1736 N GLU A 113 6.326 -9.617 -3.583 1.00 0.00 N ATOM 1737 CA GLU A 113 5.657 -10.325 -4.668 1.00 0.00 C ATOM 1738 C GLU A 113 4.605 -11.286 -4.123 1.00 0.00 C ATOM 1739 O GLU A 113 4.912 -12.422 -3.761 1.00 0.00 O ATOM 1740 CB GLU A 113 6.677 -11.093 -5.512 1.00 0.00 C ATOM 1741 CG GLU A 113 7.836 -10.237 -5.994 1.00 0.00 C ATOM 1742 CD GLU A 113 7.562 -9.588 -7.337 1.00 0.00 C ATOM 1743 OE1 GLU A 113 6.832 -10.192 -8.151 1.00 0.00 O ATOM 1744 OE2 GLU A 113 8.078 -8.476 -7.574 1.00 0.00 O ATOM 0 H GLU A 113 6.876 -10.214 -2.965 1.00 0.00 H new ATOM 0 HA GLU A 113 5.159 -9.587 -5.296 1.00 0.00 H new ATOM 0 HB2 GLU A 113 7.069 -11.924 -4.926 1.00 0.00 H new ATOM 0 HB3 GLU A 113 6.171 -11.524 -6.376 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.043 -9.462 -5.256 1.00 0.00 H new ATOM 0 HG3 GLU A 113 8.732 -10.853 -6.068 1.00 0.00 H new ATOM 1751 N THR A 114 3.360 -10.822 -4.068 1.00 0.00 N ATOM 1752 CA THR A 114 2.262 -11.638 -3.566 1.00 0.00 C ATOM 1753 C THR A 114 1.081 -11.624 -4.531 1.00 0.00 C ATOM 1754 O THR A 114 1.129 -10.976 -5.576 1.00 0.00 O ATOM 1755 CB THR A 114 1.786 -11.152 -2.184 1.00 0.00 C ATOM 1756 OG1 THR A 114 1.325 -9.799 -2.273 1.00 0.00 O ATOM 1757 CG2 THR A 114 2.910 -11.244 -1.162 1.00 0.00 C ATOM 0 H THR A 114 3.087 -9.885 -4.365 1.00 0.00 H new ATOM 0 HA THR A 114 2.641 -12.656 -3.474 1.00 0.00 H new ATOM 0 HB THR A 114 0.967 -11.794 -1.859 1.00 0.00 H new ATOM 0 HG1 THR A 114 1.994 -9.199 -1.882 1.00 0.00 H new ATOM 0 HG21 THR A 114 2.551 -10.896 -0.194 1.00 0.00 H new ATOM 0 HG22 THR A 114 3.239 -12.279 -1.076 1.00 0.00 H new ATOM 0 HG23 THR A 114 3.746 -10.623 -1.484 1.00 0.00 H new ATOM 1765 N ASP A 115 0.023 -12.343 -4.173 1.00 0.00 N ATOM 1766 CA ASP A 115 -1.172 -12.412 -5.006 1.00 0.00 C ATOM 1767 C ASP A 115 -2.413 -12.018 -4.211 1.00 0.00 C ATOM 1768 O ASP A 115 -2.451 -12.161 -2.988 1.00 0.00 O ATOM 1769 CB ASP A 115 -1.342 -13.821 -5.576 1.00 0.00 C ATOM 1770 CG ASP A 115 -0.584 -14.016 -6.875 1.00 0.00 C ATOM 1771 OD1 ASP A 115 -0.776 -13.200 -7.802 1.00 0.00 O ATOM 1772 OD2 ASP A 115 0.200 -14.983 -6.964 1.00 0.00 O ATOM 0 H ASP A 115 -0.032 -12.886 -3.312 1.00 0.00 H new ATOM 0 HA ASP A 115 -1.052 -11.708 -5.829 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -0.996 -14.550 -4.844 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -2.401 -14.016 -5.744 1.00 0.00 H new ATOM 1777 N LEU A 116 -3.426 -11.521 -4.913 1.00 0.00 N ATOM 1778 CA LEU A 116 -4.669 -11.105 -4.272 1.00 0.00 C ATOM 1779 C LEU A 116 -5.868 -11.799 -4.910 1.00 0.00 C ATOM 1780 O LEU A 116 -5.845 -12.142 -6.092 1.00 0.00 O ATOM 1781 CB LEU A 116 -4.832 -9.588 -4.369 1.00 0.00 C ATOM 1782 CG LEU A 116 -3.754 -8.751 -3.680 1.00 0.00 C ATOM 1783 CD1 LEU A 116 -3.798 -7.313 -4.172 1.00 0.00 C ATOM 1784 CD2 LEU A 116 -3.922 -8.805 -2.168 1.00 0.00 C ATOM 0 H LEU A 116 -3.411 -11.396 -5.925 1.00 0.00 H new ATOM 0 HA LEU A 116 -4.622 -11.393 -3.222 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -4.859 -9.312 -5.423 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.799 -9.319 -3.944 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.780 -9.170 -3.933 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -3.024 -6.733 -3.670 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -3.628 -7.291 -5.248 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -4.775 -6.882 -3.951 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -3.146 -8.204 -1.694 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.902 -8.412 -1.897 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -3.838 -9.838 -1.829 1.00 0.00 H new ATOM 1796 N HIS A 117 -6.917 -12.002 -4.119 1.00 0.00 N ATOM 1797 CA HIS A 117 -8.128 -12.653 -4.607 1.00 0.00 C ATOM 1798 C HIS A 117 -9.363 -11.817 -4.281 1.00 0.00 C ATOM 1799 O HIS A 117 -9.449 -11.208 -3.215 1.00 0.00 O ATOM 1800 CB HIS A 117 -8.265 -14.047 -3.995 1.00 0.00 C ATOM 1801 CG HIS A 117 -7.278 -15.037 -4.532 1.00 0.00 C ATOM 1802 ND1 HIS A 117 -7.371 -15.583 -5.795 1.00 0.00 N ATOM 1803 CD2 HIS A 117 -6.171 -15.577 -3.971 1.00 0.00 C ATOM 1804 CE1 HIS A 117 -6.365 -16.418 -5.986 1.00 0.00 C ATOM 1805 NE2 HIS A 117 -5.622 -16.432 -4.895 1.00 0.00 N ATOM 0 H HIS A 117 -6.953 -11.725 -3.138 1.00 0.00 H new ATOM 0 HA HIS A 117 -8.050 -12.747 -5.690 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -8.142 -13.974 -2.914 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -9.274 -14.417 -4.177 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -5.790 -15.373 -2.981 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -6.182 -16.992 -6.883 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -4.777 -16.988 -4.760 1.00 0.00 H new ATOM 1813 N VAL A 118 -10.316 -11.793 -5.207 1.00 0.00 N ATOM 1814 CA VAL A 118 -11.546 -11.033 -5.018 1.00 0.00 C ATOM 1815 C VAL A 118 -12.770 -11.937 -5.110 1.00 0.00 C ATOM 1816 O VAL A 118 -12.786 -12.902 -5.874 1.00 0.00 O ATOM 1817 CB VAL A 118 -11.675 -9.906 -6.059 1.00 0.00 C ATOM 1818 CG1 VAL A 118 -12.077 -10.472 -7.413 1.00 0.00 C ATOM 1819 CG2 VAL A 118 -12.675 -8.860 -5.591 1.00 0.00 C ATOM 0 H VAL A 118 -10.260 -12.291 -6.095 1.00 0.00 H new ATOM 0 HA VAL A 118 -11.496 -10.593 -4.022 1.00 0.00 H new ATOM 0 HB VAL A 118 -10.704 -9.424 -6.168 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -12.163 -9.660 -8.136 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -11.320 -11.180 -7.751 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -13.036 -10.982 -7.324 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -12.753 -8.071 -6.339 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -13.650 -9.326 -5.451 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -12.339 -8.432 -4.646 1.00 0.00 H new ATOM 1829 N ASN A 119 -13.795 -11.618 -4.327 1.00 0.00 N ATOM 1830 CA ASN A 119 -15.025 -12.401 -4.320 1.00 0.00 C ATOM 1831 C ASN A 119 -16.249 -11.492 -4.270 1.00 0.00 C ATOM 1832 O ASN A 119 -16.556 -10.878 -3.248 1.00 0.00 O ATOM 1833 CB ASN A 119 -15.038 -13.358 -3.126 1.00 0.00 C ATOM 1834 CG ASN A 119 -15.863 -14.603 -3.391 1.00 0.00 C ATOM 1835 OD1 ASN A 119 -16.909 -14.542 -4.038 1.00 0.00 O ATOM 1836 ND2 ASN A 119 -15.395 -15.741 -2.891 1.00 0.00 N ATOM 0 H ASN A 119 -13.798 -10.822 -3.689 1.00 0.00 H new ATOM 0 HA ASN A 119 -15.062 -12.980 -5.243 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -14.015 -13.648 -2.885 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -15.437 -12.840 -2.253 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -15.907 -16.611 -3.037 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -14.524 -15.745 -2.361 1.00 0.00 H new ATOM 1843 N PRO A 120 -16.967 -11.404 -5.400 1.00 0.00 N ATOM 1844 CA PRO A 120 -18.170 -10.573 -5.511 1.00 0.00 C ATOM 1845 C PRO A 120 -19.335 -11.128 -4.698 1.00 0.00 C ATOM 1846 O PRO A 120 -20.173 -10.376 -4.201 1.00 0.00 O ATOM 1847 CB PRO A 120 -18.493 -10.615 -7.006 1.00 0.00 C ATOM 1848 CG PRO A 120 -17.893 -11.890 -7.488 1.00 0.00 C ATOM 1849 CD PRO A 120 -16.660 -12.108 -6.656 1.00 0.00 C ATOM 0 HA PRO A 120 -18.008 -9.567 -5.124 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -19.569 -10.594 -7.179 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.069 -9.756 -7.527 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -18.592 -12.718 -7.374 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -17.643 -11.828 -8.547 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.472 -13.168 -6.487 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -15.772 -11.700 -7.139 1.00 0.00 H new ATOM 1857 N LYS A 121 -19.381 -12.450 -4.566 1.00 0.00 N ATOM 1858 CA LYS A 121 -20.443 -13.107 -3.813 1.00 0.00 C ATOM 1859 C LYS A 121 -20.265 -12.882 -2.314 1.00 0.00 C ATOM 1860 O LYS A 121 -21.150 -12.346 -1.647 1.00 0.00 O ATOM 1861 CB LYS A 121 -20.458 -14.607 -4.116 1.00 0.00 C ATOM 1862 CG LYS A 121 -21.420 -15.394 -3.243 1.00 0.00 C ATOM 1863 CD LYS A 121 -22.865 -15.024 -3.533 1.00 0.00 C ATOM 1864 CE LYS A 121 -23.468 -15.924 -4.601 1.00 0.00 C ATOM 1865 NZ LYS A 121 -23.291 -15.359 -5.967 1.00 0.00 N ATOM 0 H LYS A 121 -18.695 -13.087 -4.971 1.00 0.00 H new ATOM 0 HA LYS A 121 -21.395 -12.672 -4.118 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -20.726 -14.755 -5.162 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -19.452 -15.006 -3.985 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -21.276 -16.461 -3.411 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -21.198 -15.204 -2.193 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -23.452 -15.100 -2.618 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -22.917 -13.985 -3.859 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -23.002 -16.908 -4.552 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -24.530 -16.064 -4.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -24.053 -15.703 -6.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -23.325 -14.321 -5.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -22.372 -15.659 -6.350 1.00 0.00 H new ATOM 1879 N LYS A 122 -19.115 -13.294 -1.791 1.00 0.00 N ATOM 1880 CA LYS A 122 -18.819 -13.136 -0.372 1.00 0.00 C ATOM 1881 C LYS A 122 -18.502 -11.681 -0.042 1.00 0.00 C ATOM 1882 O LYS A 122 -18.444 -11.300 1.127 1.00 0.00 O ATOM 1883 CB LYS A 122 -17.642 -14.029 0.027 1.00 0.00 C ATOM 1884 CG LYS A 122 -18.032 -15.477 0.267 1.00 0.00 C ATOM 1885 CD LYS A 122 -18.424 -15.717 1.715 1.00 0.00 C ATOM 1886 CE LYS A 122 -18.662 -17.194 1.991 1.00 0.00 C ATOM 1887 NZ LYS A 122 -17.394 -17.975 1.962 1.00 0.00 N ATOM 0 H LYS A 122 -18.372 -13.740 -2.329 1.00 0.00 H new ATOM 0 HA LYS A 122 -19.702 -13.435 0.194 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -16.885 -13.990 -0.757 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -17.184 -13.630 0.932 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -18.864 -15.743 -0.385 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -17.199 -16.128 0.002 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -17.638 -15.345 2.372 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -19.327 -15.152 1.947 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -19.137 -17.309 2.965 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -19.353 -17.595 1.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -17.566 -18.931 2.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -17.050 -18.041 0.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -16.679 -17.499 2.549 1.00 0.00 H new ATOM 1901 N GLN A 123 -18.300 -10.874 -1.078 1.00 0.00 N ATOM 1902 CA GLN A 123 -17.990 -9.461 -0.896 1.00 0.00 C ATOM 1903 C GLN A 123 -16.820 -9.279 0.066 1.00 0.00 C ATOM 1904 O GLN A 123 -16.881 -8.465 0.988 1.00 0.00 O ATOM 1905 CB GLN A 123 -19.216 -8.711 -0.374 1.00 0.00 C ATOM 1906 CG GLN A 123 -20.175 -8.275 -1.470 1.00 0.00 C ATOM 1907 CD GLN A 123 -19.726 -7.007 -2.169 1.00 0.00 C ATOM 1908 OE1 GLN A 123 -19.115 -7.160 -3.338 1.00 0.00 O flip ATOM 1909 NE2 GLN A 123 -19.926 -5.902 -1.664 1.00 0.00 N flip ATOM 0 H GLN A 123 -18.345 -11.174 -2.052 1.00 0.00 H new ATOM 0 HA GLN A 123 -17.707 -9.050 -1.865 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -19.749 -9.349 0.331 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -18.885 -7.832 0.179 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -20.270 -9.075 -2.204 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -21.164 -8.117 -1.040 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -20.400 -5.831 -0.763 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -19.618 -5.058 -2.146 1.00 0.00 H new ATOM 1918 N THR A 124 -15.756 -10.045 -0.153 1.00 0.00 N ATOM 1919 CA THR A 124 -14.573 -9.970 0.695 1.00 0.00 C ATOM 1920 C THR A 124 -13.296 -10.064 -0.132 1.00 0.00 C ATOM 1921 O THR A 124 -13.291 -10.642 -1.219 1.00 0.00 O ATOM 1922 CB THR A 124 -14.569 -11.090 1.753 1.00 0.00 C ATOM 1923 OG1 THR A 124 -14.893 -12.343 1.141 1.00 0.00 O ATOM 1924 CG2 THR A 124 -15.565 -10.789 2.863 1.00 0.00 C ATOM 0 H THR A 124 -15.689 -10.725 -0.911 1.00 0.00 H new ATOM 0 HA THR A 124 -14.606 -9.004 1.198 1.00 0.00 H new ATOM 0 HB THR A 124 -13.571 -11.146 2.187 1.00 0.00 H new ATOM 0 HG1 THR A 124 -14.887 -13.050 1.820 1.00 0.00 H new ATOM 0 HG21 THR A 124 -15.545 -11.593 3.598 1.00 0.00 H new ATOM 0 HG22 THR A 124 -15.298 -9.849 3.346 1.00 0.00 H new ATOM 0 HG23 THR A 124 -16.567 -10.709 2.441 1.00 0.00 H new ATOM 1932 N ILE A 125 -12.216 -9.491 0.389 1.00 0.00 N ATOM 1933 CA ILE A 125 -10.932 -9.513 -0.302 1.00 0.00 C ATOM 1934 C ILE A 125 -9.970 -10.496 0.355 1.00 0.00 C ATOM 1935 O ILE A 125 -10.025 -10.721 1.563 1.00 0.00 O ATOM 1936 CB ILE A 125 -10.284 -8.116 -0.327 1.00 0.00 C ATOM 1937 CG1 ILE A 125 -11.214 -7.109 -1.006 1.00 0.00 C ATOM 1938 CG2 ILE A 125 -8.940 -8.169 -1.040 1.00 0.00 C ATOM 1939 CD1 ILE A 125 -10.838 -5.668 -0.746 1.00 0.00 C ATOM 0 H ILE A 125 -12.204 -9.006 1.286 1.00 0.00 H new ATOM 0 HA ILE A 125 -11.129 -9.832 -1.325 1.00 0.00 H new ATOM 0 HB ILE A 125 -10.117 -7.791 0.700 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -11.208 -7.289 -2.081 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -12.234 -7.278 -0.660 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -8.494 -7.175 -1.050 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -8.278 -8.859 -0.517 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -9.085 -8.512 -2.064 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -11.541 -5.011 -1.258 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -10.872 -5.471 0.325 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -9.830 -5.482 -1.118 1.00 0.00 H new ATOM 1951 N GLY A 126 -9.087 -11.080 -0.450 1.00 0.00 N ATOM 1952 CA GLY A 126 -8.124 -12.031 0.072 1.00 0.00 C ATOM 1953 C GLY A 126 -6.736 -11.825 -0.502 1.00 0.00 C ATOM 1954 O GLY A 126 -6.569 -11.134 -1.506 1.00 0.00 O ATOM 0 H GLY A 126 -9.022 -10.911 -1.454 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -8.082 -11.942 1.158 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -8.460 -13.044 -0.152 1.00 0.00 H new ATOM 1958 N ASN A 127 -5.737 -12.424 0.138 1.00 0.00 N ATOM 1959 CA ASN A 127 -4.356 -12.300 -0.313 1.00 0.00 C ATOM 1960 C ASN A 127 -3.583 -13.591 -0.060 1.00 0.00 C ATOM 1961 O ASN A 127 -3.615 -14.139 1.042 1.00 0.00 O ATOM 1962 CB ASN A 127 -3.668 -11.133 0.397 1.00 0.00 C ATOM 1963 CG ASN A 127 -3.871 -11.169 1.899 1.00 0.00 C ATOM 1964 OD1 ASN A 127 -4.641 -11.980 2.413 1.00 0.00 O ATOM 1965 ND2 ASN A 127 -3.179 -10.287 2.611 1.00 0.00 N ATOM 0 H ASN A 127 -5.858 -13.000 0.971 1.00 0.00 H new ATOM 0 HA ASN A 127 -4.367 -12.108 -1.386 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -2.601 -11.156 0.177 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -4.055 -10.193 0.003 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -3.275 -10.264 3.626 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -2.552 -9.633 2.143 1.00 0.00 H new ATOM 1972 N SER A 128 -2.890 -14.071 -1.087 1.00 0.00 N ATOM 1973 CA SER A 128 -2.111 -15.299 -0.977 1.00 0.00 C ATOM 1974 C SER A 128 -0.687 -15.085 -1.481 1.00 0.00 C ATOM 1975 O SER A 128 -0.455 -14.326 -2.422 1.00 0.00 O ATOM 1976 CB SER A 128 -2.780 -16.425 -1.768 1.00 0.00 C ATOM 1977 OG SER A 128 -1.923 -17.547 -1.881 1.00 0.00 O ATOM 0 H SER A 128 -2.852 -13.628 -2.005 1.00 0.00 H new ATOM 0 HA SER A 128 -2.068 -15.580 0.075 1.00 0.00 H new ATOM 0 HB2 SER A 128 -3.707 -16.719 -1.275 1.00 0.00 H new ATOM 0 HB3 SER A 128 -3.048 -16.066 -2.762 1.00 0.00 H new ATOM 0 HG SER A 128 -2.374 -18.253 -2.389 1.00 0.00 H new ATOM 1983 N CYS A 129 0.266 -15.761 -0.847 1.00 0.00 N ATOM 1984 CA CYS A 129 1.668 -15.648 -1.228 1.00 0.00 C ATOM 1985 C CYS A 129 2.224 -16.999 -1.667 1.00 0.00 C ATOM 1986 O CYS A 129 1.662 -18.047 -1.349 1.00 0.00 O ATOM 1987 CB CYS A 129 2.493 -15.099 -0.062 1.00 0.00 C ATOM 1988 SG CYS A 129 4.275 -15.457 -0.178 1.00 0.00 S ATOM 0 H CYS A 129 0.092 -16.393 -0.066 1.00 0.00 H new ATOM 0 HA CYS A 129 1.735 -14.957 -2.069 1.00 0.00 H new ATOM 0 HB2 CYS A 129 2.353 -14.019 -0.009 1.00 0.00 H new ATOM 0 HB3 CYS A 129 2.109 -15.517 0.869 1.00 0.00 H new ATOM 1993 N LYS A 130 3.332 -16.967 -2.400 1.00 0.00 N ATOM 1994 CA LYS A 130 3.966 -18.188 -2.883 1.00 0.00 C ATOM 1995 C LYS A 130 5.321 -18.398 -2.214 1.00 0.00 C ATOM 1996 O LYS A 130 5.695 -19.524 -1.888 1.00 0.00 O ATOM 1997 CB LYS A 130 4.139 -18.132 -4.402 1.00 0.00 C ATOM 1998 CG LYS A 130 4.993 -19.257 -4.960 1.00 0.00 C ATOM 1999 CD LYS A 130 4.157 -20.486 -5.279 1.00 0.00 C ATOM 2000 CE LYS A 130 5.033 -21.691 -5.587 1.00 0.00 C ATOM 2001 NZ LYS A 130 4.296 -22.972 -5.407 1.00 0.00 N ATOM 0 H LYS A 130 3.810 -16.108 -2.673 1.00 0.00 H new ATOM 0 HA LYS A 130 3.320 -19.028 -2.628 1.00 0.00 H new ATOM 0 HB2 LYS A 130 3.156 -18.166 -4.872 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.589 -17.177 -4.673 1.00 0.00 H new ATOM 0 HG2 LYS A 130 5.500 -18.917 -5.863 1.00 0.00 H new ATOM 0 HG3 LYS A 130 5.767 -19.519 -4.239 1.00 0.00 H new ATOM 0 HD2 LYS A 130 3.506 -20.714 -4.435 1.00 0.00 H new ATOM 0 HD3 LYS A 130 3.511 -20.277 -6.132 1.00 0.00 H new ATOM 0 HE2 LYS A 130 5.398 -21.623 -6.612 1.00 0.00 H new ATOM 0 HE3 LYS A 130 5.907 -21.680 -4.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 4.927 -23.769 -5.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 3.970 -23.049 -4.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 3.476 -22.993 -6.046 1.00 0.00 H new ATOM 2015 N ALA A 131 6.052 -17.306 -2.012 1.00 0.00 N ATOM 2016 CA ALA A 131 7.363 -17.371 -1.379 1.00 0.00 C ATOM 2017 C ALA A 131 7.339 -18.287 -0.160 1.00 0.00 C ATOM 2018 O ALA A 131 8.142 -19.215 -0.052 1.00 0.00 O ATOM 2019 CB ALA A 131 7.828 -15.977 -0.984 1.00 0.00 C ATOM 0 H ALA A 131 5.758 -16.366 -2.278 1.00 0.00 H new ATOM 0 HA ALA A 131 8.067 -17.787 -2.100 1.00 0.00 H new ATOM 0 HB1 ALA A 131 8.809 -16.041 -0.512 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.893 -15.350 -1.873 1.00 0.00 H new ATOM 0 HB3 ALA A 131 7.116 -15.541 -0.283 1.00 0.00 H new ATOM 2025 N CYS A 132 6.415 -18.022 0.757 1.00 0.00 N ATOM 2026 CA CYS A 132 6.287 -18.821 1.969 1.00 0.00 C ATOM 2027 C CYS A 132 5.054 -19.717 1.902 1.00 0.00 C ATOM 2028 O CYS A 132 5.097 -20.881 2.298 1.00 0.00 O ATOM 2029 CB CYS A 132 6.205 -17.913 3.198 1.00 0.00 C ATOM 2030 SG CYS A 132 4.681 -16.920 3.288 1.00 0.00 S ATOM 0 H CYS A 132 5.743 -17.258 0.683 1.00 0.00 H new ATOM 0 HA CYS A 132 7.171 -19.454 2.052 1.00 0.00 H new ATOM 0 HB2 CYS A 132 6.280 -18.527 4.096 1.00 0.00 H new ATOM 0 HB3 CYS A 132 7.064 -17.242 3.199 1.00 0.00 H new ATOM 2035 N GLY A 133 3.954 -19.165 1.398 1.00 0.00 N ATOM 2036 CA GLY A 133 2.724 -19.928 1.288 1.00 0.00 C ATOM 2037 C GLY A 133 1.655 -19.444 2.247 1.00 0.00 C ATOM 2038 O GLY A 133 0.950 -20.248 2.858 1.00 0.00 O ATOM 0 H GLY A 133 3.893 -18.203 1.064 1.00 0.00 H new ATOM 0 HA2 GLY A 133 2.349 -19.862 0.267 1.00 0.00 H new ATOM 0 HA3 GLY A 133 2.934 -20.980 1.483 1.00 0.00 H new ATOM 2042 N TYR A 134 1.534 -18.128 2.382 1.00 0.00 N ATOM 2043 CA TYR A 134 0.546 -17.539 3.277 1.00 0.00 C ATOM 2044 C TYR A 134 -0.771 -17.291 2.547 1.00 0.00 C ATOM 2045 O TYR A 134 -0.798 -16.661 1.490 1.00 0.00 O ATOM 2046 CB TYR A 134 1.073 -16.227 3.861 1.00 0.00 C ATOM 2047 CG TYR A 134 -0.006 -15.354 4.459 1.00 0.00 C ATOM 2048 CD1 TYR A 134 -0.888 -14.651 3.648 1.00 0.00 C ATOM 2049 CD2 TYR A 134 -0.144 -15.232 5.836 1.00 0.00 C ATOM 2050 CE1 TYR A 134 -1.875 -13.851 4.190 1.00 0.00 C ATOM 2051 CE2 TYR A 134 -1.129 -14.435 6.388 1.00 0.00 C ATOM 2052 CZ TYR A 134 -1.991 -13.746 5.561 1.00 0.00 C ATOM 2053 OH TYR A 134 -2.974 -12.952 6.105 1.00 0.00 O ATOM 0 H TYR A 134 2.108 -17.449 1.883 1.00 0.00 H new ATOM 0 HA TYR A 134 0.364 -18.243 4.089 1.00 0.00 H new ATOM 0 HB2 TYR A 134 1.813 -16.452 4.629 1.00 0.00 H new ATOM 0 HB3 TYR A 134 1.586 -15.670 3.077 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -0.800 -14.731 2.575 1.00 0.00 H new ATOM 0 HD2 TYR A 134 0.530 -15.769 6.486 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -2.552 -13.311 3.545 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -1.223 -14.352 7.461 1.00 0.00 H new ATOM 0 HH TYR A 134 -2.920 -12.988 7.083 1.00 0.00 H new ATOM 2063 N ARG A 135 -1.861 -17.791 3.120 1.00 0.00 N ATOM 2064 CA ARG A 135 -3.181 -17.625 2.525 1.00 0.00 C ATOM 2065 C ARG A 135 -4.201 -17.194 3.576 1.00 0.00 C ATOM 2066 O ARG A 135 -4.414 -17.887 4.570 1.00 0.00 O ATOM 2067 CB ARG A 135 -3.634 -18.928 1.865 1.00 0.00 C ATOM 2068 CG ARG A 135 -3.097 -19.115 0.455 1.00 0.00 C ATOM 2069 CD ARG A 135 -1.720 -19.760 0.465 1.00 0.00 C ATOM 2070 NE ARG A 135 -1.758 -21.125 0.984 1.00 0.00 N ATOM 2071 CZ ARG A 135 -2.272 -22.152 0.316 1.00 0.00 C ATOM 2072 NH1 ARG A 135 -2.787 -21.969 -0.892 1.00 0.00 N ATOM 2073 NH2 ARG A 135 -2.270 -23.364 0.856 1.00 0.00 N ATOM 0 H ARG A 135 -1.856 -18.314 3.996 1.00 0.00 H new ATOM 0 HA ARG A 135 -3.114 -16.845 1.766 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -3.314 -19.768 2.481 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -4.723 -18.951 1.836 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -3.786 -19.735 -0.119 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -3.044 -18.149 -0.047 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -1.316 -19.768 -0.547 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -1.043 -19.160 1.073 1.00 0.00 H new ATOM 0 HE ARG A 135 -1.368 -21.299 1.910 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -2.789 -21.039 -1.310 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -3.181 -22.759 -1.403 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -1.874 -23.508 1.785 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -2.665 -24.152 0.342 1.00 0.00 H new ATOM 2087 N GLY A 136 -4.827 -16.044 3.348 1.00 0.00 N ATOM 2088 CA GLY A 136 -5.816 -15.540 4.284 1.00 0.00 C ATOM 2089 C GLY A 136 -6.750 -14.527 3.651 1.00 0.00 C ATOM 2090 O GLY A 136 -6.800 -14.399 2.428 1.00 0.00 O ATOM 0 H GLY A 136 -4.668 -15.452 2.533 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -6.400 -16.373 4.675 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -5.308 -15.081 5.132 1.00 0.00 H new ATOM 2094 N MET A 137 -7.493 -13.808 4.485 1.00 0.00 N ATOM 2095 CA MET A 137 -8.431 -12.802 3.999 1.00 0.00 C ATOM 2096 C MET A 137 -8.065 -11.418 4.526 1.00 0.00 C ATOM 2097 O MET A 137 -7.985 -11.205 5.736 1.00 0.00 O ATOM 2098 CB MET A 137 -9.858 -13.159 4.419 1.00 0.00 C ATOM 2099 CG MET A 137 -10.065 -13.162 5.925 1.00 0.00 C ATOM 2100 SD MET A 137 -11.462 -14.184 6.432 1.00 0.00 S ATOM 2101 CE MET A 137 -10.614 -15.654 7.007 1.00 0.00 C ATOM 0 H MET A 137 -7.464 -13.903 5.500 1.00 0.00 H new ATOM 0 HA MET A 137 -8.374 -12.784 2.911 1.00 0.00 H new ATOM 0 HB2 MET A 137 -10.550 -12.448 3.967 1.00 0.00 H new ATOM 0 HB3 MET A 137 -10.109 -14.143 4.024 1.00 0.00 H new ATOM 0 HG2 MET A 137 -9.159 -13.524 6.412 1.00 0.00 H new ATOM 0 HG3 MET A 137 -10.224 -12.140 6.268 1.00 0.00 H new ATOM 0 HE1 MET A 137 -11.345 -16.384 7.355 1.00 0.00 H new ATOM 0 HE2 MET A 137 -10.034 -16.083 6.190 1.00 0.00 H new ATOM 0 HE3 MET A 137 -9.946 -15.391 7.827 1.00 0.00 H new ATOM 2111 N LEU A 138 -7.843 -10.482 3.610 1.00 0.00 N ATOM 2112 CA LEU A 138 -7.484 -9.117 3.983 1.00 0.00 C ATOM 2113 C LEU A 138 -8.636 -8.432 4.711 1.00 0.00 C ATOM 2114 O LEU A 138 -9.802 -8.616 4.362 1.00 0.00 O ATOM 2115 CB LEU A 138 -7.100 -8.313 2.740 1.00 0.00 C ATOM 2116 CG LEU A 138 -5.615 -8.306 2.377 1.00 0.00 C ATOM 2117 CD1 LEU A 138 -5.406 -7.702 0.997 1.00 0.00 C ATOM 2118 CD2 LEU A 138 -4.814 -7.544 3.422 1.00 0.00 C ATOM 0 H LEU A 138 -7.905 -10.642 2.605 1.00 0.00 H new ATOM 0 HA LEU A 138 -6.629 -9.162 4.657 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -7.659 -8.706 1.891 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -7.423 -7.282 2.885 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.260 -9.337 2.357 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -4.343 -7.705 0.756 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -5.948 -8.290 0.257 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -5.777 -6.677 0.988 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.759 -7.549 3.147 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -5.170 -6.515 3.474 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -4.938 -8.021 4.394 1.00 0.00 H new ATOM 2130 N ASP A 139 -8.300 -7.639 5.723 1.00 0.00 N ATOM 2131 CA ASP A 139 -9.306 -6.922 6.498 1.00 0.00 C ATOM 2132 C ASP A 139 -9.594 -5.556 5.884 1.00 0.00 C ATOM 2133 O ASP A 139 -10.059 -4.641 6.566 1.00 0.00 O ATOM 2134 CB ASP A 139 -8.842 -6.756 7.946 1.00 0.00 C ATOM 2135 CG ASP A 139 -10.001 -6.638 8.916 1.00 0.00 C ATOM 2136 OD1 ASP A 139 -10.743 -7.629 9.078 1.00 0.00 O ATOM 2137 OD2 ASP A 139 -10.165 -5.555 9.514 1.00 0.00 O ATOM 0 H ASP A 139 -7.340 -7.477 6.025 1.00 0.00 H new ATOM 0 HA ASP A 139 -10.225 -7.508 6.484 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -8.223 -7.608 8.226 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -8.215 -5.868 8.024 1.00 0.00 H new ATOM 2142 N THR A 140 -9.314 -5.423 4.591 1.00 0.00 N ATOM 2143 CA THR A 140 -9.541 -4.168 3.885 1.00 0.00 C ATOM 2144 C THR A 140 -10.820 -3.491 4.363 1.00 0.00 C ATOM 2145 O THR A 140 -11.881 -4.115 4.418 1.00 0.00 O ATOM 2146 CB THR A 140 -9.627 -4.388 2.363 1.00 0.00 C ATOM 2147 OG1 THR A 140 -8.800 -5.491 1.979 1.00 0.00 O ATOM 2148 CG2 THR A 140 -9.196 -3.138 1.610 1.00 0.00 C ATOM 0 H THR A 140 -8.930 -6.169 4.012 1.00 0.00 H new ATOM 0 HA THR A 140 -8.690 -3.524 4.104 1.00 0.00 H new ATOM 0 HB THR A 140 -10.664 -4.607 2.109 1.00 0.00 H new ATOM 0 HG1 THR A 140 -8.735 -5.526 1.002 1.00 0.00 H new ATOM 0 HG21 THR A 140 -9.265 -3.318 0.537 1.00 0.00 H new ATOM 0 HG22 THR A 140 -9.847 -2.307 1.882 1.00 0.00 H new ATOM 0 HG23 THR A 140 -8.167 -2.893 1.871 1.00 0.00 H new ATOM 2156 N HIS A 141 -10.714 -2.212 4.709 1.00 0.00 N ATOM 2157 CA HIS A 141 -11.865 -1.450 5.181 1.00 0.00 C ATOM 2158 C HIS A 141 -12.916 -1.316 4.084 1.00 0.00 C ATOM 2159 O HIS A 141 -12.605 -1.422 2.897 1.00 0.00 O ATOM 2160 CB HIS A 141 -11.425 -0.064 5.655 1.00 0.00 C ATOM 2161 CG HIS A 141 -10.687 0.719 4.614 1.00 0.00 C ATOM 2162 ND1 HIS A 141 -10.437 2.070 4.725 1.00 0.00 N ATOM 2163 CD2 HIS A 141 -10.140 0.332 3.438 1.00 0.00 C ATOM 2164 CE1 HIS A 141 -9.771 2.481 3.661 1.00 0.00 C ATOM 2165 NE2 HIS A 141 -9.578 1.446 2.864 1.00 0.00 N ATOM 0 H HIS A 141 -9.844 -1.682 4.671 1.00 0.00 H new ATOM 0 HA HIS A 141 -12.308 -1.989 6.019 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -12.304 0.500 5.967 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -10.789 -0.174 6.533 1.00 0.00 H new ATOM 0 HD1 HIS A 141 -10.722 2.660 5.507 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -10.145 -0.667 3.027 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -9.440 3.492 3.474 1.00 0.00 H new ATOM 2173 N HIS A 142 -14.160 -1.081 4.488 1.00 0.00 N ATOM 2174 CA HIS A 142 -15.257 -0.933 3.538 1.00 0.00 C ATOM 2175 C HIS A 142 -14.973 0.197 2.553 1.00 0.00 C ATOM 2176 O HIS A 142 -15.312 0.106 1.373 1.00 0.00 O ATOM 2177 CB HIS A 142 -16.567 -0.663 4.278 1.00 0.00 C ATOM 2178 CG HIS A 142 -16.444 0.368 5.358 1.00 0.00 C ATOM 2179 ND1 HIS A 142 -16.284 1.710 5.287 1.00 0.00 N flip ATOM 2180 CD2 HIS A 142 -16.478 0.059 6.701 1.00 0.00 C flip ATOM 2181 CE1 HIS A 142 -16.226 2.182 6.575 1.00 0.00 C flip ATOM 2182 NE2 HIS A 142 -16.347 1.166 7.410 1.00 0.00 N flip ATOM 0 H HIS A 142 -14.434 -0.989 5.466 1.00 0.00 H new ATOM 0 HA HIS A 142 -15.350 -1.864 2.979 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -17.320 -0.337 3.560 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -16.926 -1.594 4.716 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -16.594 -0.934 7.110 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -16.102 3.216 6.859 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -16.340 1.226 8.428 1.00 0.00 H new ATOM 2190 N LYS A 143 -14.351 1.263 3.045 1.00 0.00 N ATOM 2191 CA LYS A 143 -14.020 2.411 2.210 1.00 0.00 C ATOM 2192 C LYS A 143 -13.431 1.962 0.876 1.00 0.00 C ATOM 2193 O LYS A 143 -14.010 2.205 -0.183 1.00 0.00 O ATOM 2194 CB LYS A 143 -13.031 3.327 2.934 1.00 0.00 C ATOM 2195 CG LYS A 143 -13.700 4.412 3.760 1.00 0.00 C ATOM 2196 CD LYS A 143 -13.909 5.681 2.950 1.00 0.00 C ATOM 2197 CE LYS A 143 -15.194 5.620 2.139 1.00 0.00 C ATOM 2198 NZ LYS A 143 -16.371 5.287 2.990 1.00 0.00 N ATOM 0 H LYS A 143 -14.066 1.356 4.020 1.00 0.00 H new ATOM 0 HA LYS A 143 -14.939 2.963 2.014 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -12.400 2.723 3.586 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -12.376 3.794 2.199 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -14.661 4.051 4.127 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -13.088 4.634 4.634 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -13.941 6.540 3.620 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -13.062 5.830 2.281 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -15.360 6.579 1.649 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -15.092 4.873 1.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -17.224 5.726 2.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -16.495 4.255 3.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -16.216 5.647 3.953 1.00 0.00 H new ATOM 2212 N LEU A 144 -12.278 1.305 0.936 1.00 0.00 N ATOM 2213 CA LEU A 144 -11.611 0.820 -0.267 1.00 0.00 C ATOM 2214 C LEU A 144 -12.203 -0.511 -0.720 1.00 0.00 C ATOM 2215 O LEU A 144 -12.584 -0.669 -1.880 1.00 0.00 O ATOM 2216 CB LEU A 144 -10.110 0.664 -0.014 1.00 0.00 C ATOM 2217 CG LEU A 144 -9.276 0.183 -1.202 1.00 0.00 C ATOM 2218 CD1 LEU A 144 -9.207 1.258 -2.276 1.00 0.00 C ATOM 2219 CD2 LEU A 144 -7.877 -0.209 -0.748 1.00 0.00 C ATOM 0 H LEU A 144 -11.786 1.096 1.805 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.766 1.553 -1.059 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -9.716 1.625 0.316 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.971 -0.037 0.809 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.759 -0.697 -1.627 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -8.609 0.898 -3.113 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -10.214 1.491 -2.622 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -8.748 2.156 -1.863 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -7.298 -0.549 -1.607 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.386 0.653 -0.297 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -7.944 -1.013 -0.015 1.00 0.00 H new ATOM 2231 N CYS A 145 -12.279 -1.463 0.203 1.00 0.00 N ATOM 2232 CA CYS A 145 -12.826 -2.780 -0.100 1.00 0.00 C ATOM 2233 C CYS A 145 -13.997 -2.672 -1.072 1.00 0.00 C ATOM 2234 O CYS A 145 -14.009 -3.315 -2.122 1.00 0.00 O ATOM 2235 CB CYS A 145 -13.277 -3.476 1.185 1.00 0.00 C ATOM 2236 SG CYS A 145 -14.016 -5.105 0.922 1.00 0.00 S ATOM 0 H CYS A 145 -11.969 -1.347 1.168 1.00 0.00 H new ATOM 0 HA CYS A 145 -12.041 -3.373 -0.569 1.00 0.00 H new ATOM 0 HB2 CYS A 145 -12.419 -3.581 1.849 1.00 0.00 H new ATOM 0 HB3 CYS A 145 -13.999 -2.839 1.696 1.00 0.00 H new ATOM 0 HG CYS A 145 -14.363 -5.614 2.067 1.00 0.00 H new ATOM 2242 N THR A 146 -14.983 -1.854 -0.714 1.00 0.00 N ATOM 2243 CA THR A 146 -16.160 -1.664 -1.552 1.00 0.00 C ATOM 2244 C THR A 146 -15.765 -1.330 -2.986 1.00 0.00 C ATOM 2245 O THR A 146 -16.230 -1.966 -3.932 1.00 0.00 O ATOM 2246 CB THR A 146 -17.062 -0.541 -1.006 1.00 0.00 C ATOM 2247 OG1 THR A 146 -17.365 -0.783 0.373 1.00 0.00 O ATOM 2248 CG2 THR A 146 -18.354 -0.449 -1.804 1.00 0.00 C ATOM 0 H THR A 146 -14.989 -1.313 0.151 1.00 0.00 H new ATOM 0 HA THR A 146 -16.713 -2.603 -1.539 1.00 0.00 H new ATOM 0 HB THR A 146 -16.526 0.403 -1.100 1.00 0.00 H new ATOM 0 HG1 THR A 146 -16.738 -0.285 0.938 1.00 0.00 H new ATOM 0 HG21 THR A 146 -18.975 0.351 -1.400 1.00 0.00 H new ATOM 0 HG22 THR A 146 -18.123 -0.237 -2.848 1.00 0.00 H new ATOM 0 HG23 THR A 146 -18.892 -1.395 -1.736 1.00 0.00 H new ATOM 2256 N PHE A 147 -14.904 -0.330 -3.141 1.00 0.00 N ATOM 2257 CA PHE A 147 -14.447 0.089 -4.461 1.00 0.00 C ATOM 2258 C PHE A 147 -13.814 -1.079 -5.212 1.00 0.00 C ATOM 2259 O PHE A 147 -14.213 -1.400 -6.331 1.00 0.00 O ATOM 2260 CB PHE A 147 -13.442 1.236 -4.336 1.00 0.00 C ATOM 2261 CG PHE A 147 -12.526 1.361 -5.520 1.00 0.00 C ATOM 2262 CD1 PHE A 147 -11.379 0.590 -5.609 1.00 0.00 C ATOM 2263 CD2 PHE A 147 -12.813 2.251 -6.543 1.00 0.00 C ATOM 2264 CE1 PHE A 147 -10.534 0.703 -6.698 1.00 0.00 C ATOM 2265 CE2 PHE A 147 -11.972 2.368 -7.633 1.00 0.00 C ATOM 2266 CZ PHE A 147 -10.831 1.594 -7.710 1.00 0.00 C ATOM 0 H PHE A 147 -14.508 0.206 -2.368 1.00 0.00 H new ATOM 0 HA PHE A 147 -15.313 0.435 -5.026 1.00 0.00 H new ATOM 0 HB2 PHE A 147 -13.985 2.172 -4.206 1.00 0.00 H new ATOM 0 HB3 PHE A 147 -12.843 1.088 -3.437 1.00 0.00 H new ATOM 0 HD1 PHE A 147 -11.142 -0.107 -4.819 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -13.704 2.860 -6.488 1.00 0.00 H new ATOM 0 HE1 PHE A 147 -9.643 0.095 -6.757 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -12.207 3.064 -8.424 1.00 0.00 H new ATOM 0 HZ PHE A 147 -10.172 1.685 -8.561 1.00 0.00 H new ATOM 2276 N ILE A 148 -12.823 -1.708 -4.588 1.00 0.00 N ATOM 2277 CA ILE A 148 -12.135 -2.839 -5.197 1.00 0.00 C ATOM 2278 C ILE A 148 -13.128 -3.840 -5.778 1.00 0.00 C ATOM 2279 O ILE A 148 -13.038 -4.212 -6.948 1.00 0.00 O ATOM 2280 CB ILE A 148 -11.231 -3.561 -4.180 1.00 0.00 C ATOM 2281 CG1 ILE A 148 -10.162 -2.606 -3.646 1.00 0.00 C ATOM 2282 CG2 ILE A 148 -10.587 -4.783 -4.818 1.00 0.00 C ATOM 2283 CD1 ILE A 148 -9.252 -3.233 -2.613 1.00 0.00 C ATOM 0 H ILE A 148 -12.479 -1.453 -3.662 1.00 0.00 H new ATOM 0 HA ILE A 148 -11.517 -2.437 -6.000 1.00 0.00 H new ATOM 0 HB ILE A 148 -11.845 -3.893 -3.343 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -9.558 -2.247 -4.480 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -10.650 -1.736 -3.208 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -9.951 -5.283 -4.087 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -11.364 -5.470 -5.153 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -9.984 -4.473 -5.671 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -8.519 -2.498 -2.279 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -9.844 -3.567 -1.761 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -8.736 -4.086 -3.053 1.00 0.00 H new ATOM 2295 N LEU A 149 -14.076 -4.270 -4.953 1.00 0.00 N ATOM 2296 CA LEU A 149 -15.089 -5.227 -5.385 1.00 0.00 C ATOM 2297 C LEU A 149 -15.832 -4.715 -6.615 1.00 0.00 C ATOM 2298 O LEU A 149 -15.935 -5.411 -7.626 1.00 0.00 O ATOM 2299 CB LEU A 149 -16.081 -5.496 -4.251 1.00 0.00 C ATOM 2300 CG LEU A 149 -15.567 -6.365 -3.102 1.00 0.00 C ATOM 2301 CD1 LEU A 149 -16.504 -6.277 -1.907 1.00 0.00 C ATOM 2302 CD2 LEU A 149 -15.411 -7.809 -3.555 1.00 0.00 C ATOM 0 H LEU A 149 -14.165 -3.972 -3.982 1.00 0.00 H new ATOM 0 HA LEU A 149 -14.586 -6.158 -5.648 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -16.401 -4.538 -3.841 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -16.965 -5.973 -4.674 1.00 0.00 H new ATOM 0 HG LEU A 149 -14.588 -5.993 -2.799 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -16.123 -6.901 -1.099 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -16.566 -5.243 -1.568 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -17.496 -6.624 -2.196 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -15.044 -8.413 -2.725 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -16.376 -8.193 -3.885 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -14.700 -7.857 -4.380 1.00 0.00 H new ATOM 2314 N LYS A 150 -16.347 -3.494 -6.523 1.00 0.00 N ATOM 2315 CA LYS A 150 -17.078 -2.886 -7.629 1.00 0.00 C ATOM 2316 C LYS A 150 -16.379 -3.157 -8.957 1.00 0.00 C ATOM 2317 O LYS A 150 -17.007 -3.583 -9.925 1.00 0.00 O ATOM 2318 CB LYS A 150 -17.213 -1.378 -7.409 1.00 0.00 C ATOM 2319 CG LYS A 150 -18.162 -1.010 -6.281 1.00 0.00 C ATOM 2320 CD LYS A 150 -18.900 0.286 -6.573 1.00 0.00 C ATOM 2321 CE LYS A 150 -18.005 1.497 -6.358 1.00 0.00 C ATOM 2322 NZ LYS A 150 -18.633 2.748 -6.867 1.00 0.00 N ATOM 0 H LYS A 150 -16.272 -2.905 -5.693 1.00 0.00 H new ATOM 0 HA LYS A 150 -18.072 -3.332 -7.665 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -16.229 -0.961 -7.195 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -17.562 -0.915 -8.332 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -18.882 -1.815 -6.133 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -17.602 -0.909 -5.351 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -19.261 0.277 -7.602 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -19.776 0.360 -5.929 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -17.790 1.605 -5.295 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -17.052 1.338 -6.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -17.992 3.550 -6.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -18.816 2.655 -7.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -19.530 2.914 -6.368 1.00 0.00 H new ATOM 2336 N ASN A 151 -15.074 -2.907 -8.995 1.00 0.00 N ATOM 2337 CA ASN A 151 -14.289 -3.125 -10.205 1.00 0.00 C ATOM 2338 C ASN A 151 -13.114 -4.059 -9.930 1.00 0.00 C ATOM 2339 O ASN A 151 -12.106 -3.671 -9.340 1.00 0.00 O ATOM 2340 CB ASN A 151 -13.777 -1.791 -10.753 1.00 0.00 C ATOM 2341 CG ASN A 151 -13.191 -0.907 -9.669 1.00 0.00 C ATOM 2342 OD1 ASN A 151 -14.057 -0.217 -8.936 1.00 0.00 O flip ATOM 2343 ND2 ASN A 151 -11.975 -0.846 -9.492 1.00 0.00 N flip ATOM 0 H ASN A 151 -14.538 -2.554 -8.202 1.00 0.00 H new ATOM 0 HA ASN A 151 -14.935 -3.592 -10.948 1.00 0.00 H new ATOM 0 HB2 ASN A 151 -13.019 -1.981 -11.513 1.00 0.00 H new ATOM 0 HB3 ASN A 151 -14.596 -1.265 -11.244 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -11.346 -1.394 -10.079 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -11.596 -0.248 -8.758 1.00 0.00 H new ATOM 2350 N PRO A 152 -13.245 -5.319 -10.369 1.00 0.00 N ATOM 2351 CA PRO A 152 -12.204 -6.335 -10.184 1.00 0.00 C ATOM 2352 C PRO A 152 -10.970 -6.062 -11.037 1.00 0.00 C ATOM 2353 O PRO A 152 -10.977 -5.213 -11.928 1.00 0.00 O ATOM 2354 CB PRO A 152 -12.888 -7.629 -10.630 1.00 0.00 C ATOM 2355 CG PRO A 152 -13.950 -7.190 -11.578 1.00 0.00 C ATOM 2356 CD PRO A 152 -14.420 -5.851 -11.081 1.00 0.00 C ATOM 0 HA PRO A 152 -11.839 -6.363 -9.157 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -12.181 -8.304 -11.113 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -13.312 -8.165 -9.781 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -13.560 -7.115 -12.593 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -14.771 -7.907 -11.604 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -14.721 -5.201 -11.902 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -15.281 -5.948 -10.419 1.00 0.00 H new ATOM 2364 N PRO A 153 -9.884 -6.799 -10.760 1.00 0.00 N ATOM 2365 CA PRO A 153 -8.622 -6.656 -11.492 1.00 0.00 C ATOM 2366 C PRO A 153 -8.723 -7.165 -12.926 1.00 0.00 C ATOM 2367 O PRO A 153 -9.407 -8.151 -13.197 1.00 0.00 O ATOM 2368 CB PRO A 153 -7.645 -7.515 -10.687 1.00 0.00 C ATOM 2369 CG PRO A 153 -8.502 -8.523 -10.002 1.00 0.00 C ATOM 2370 CD PRO A 153 -9.804 -7.830 -9.711 1.00 0.00 C ATOM 0 HA PRO A 153 -8.319 -5.613 -11.582 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -6.912 -7.994 -11.336 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -7.089 -6.914 -9.968 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -8.658 -9.397 -10.634 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -8.033 -8.874 -9.083 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -10.646 -8.520 -9.761 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -9.811 -7.390 -8.714 1.00 0.00 H new ATOM 2378 N GLU A 154 -8.037 -6.486 -13.840 1.00 0.00 N ATOM 2379 CA GLU A 154 -8.051 -6.871 -15.246 1.00 0.00 C ATOM 2380 C GLU A 154 -7.210 -8.123 -15.476 1.00 0.00 C ATOM 2381 O GLU A 154 -6.258 -8.387 -14.743 1.00 0.00 O ATOM 2382 CB GLU A 154 -7.528 -5.726 -16.117 1.00 0.00 C ATOM 2383 CG GLU A 154 -7.618 -6.004 -17.608 1.00 0.00 C ATOM 2384 CD GLU A 154 -7.551 -4.740 -18.442 1.00 0.00 C ATOM 2385 OE1 GLU A 154 -6.432 -4.235 -18.667 1.00 0.00 O ATOM 2386 OE2 GLU A 154 -8.620 -4.256 -18.871 1.00 0.00 O ATOM 0 H GLU A 154 -7.465 -5.667 -13.632 1.00 0.00 H new ATOM 0 HA GLU A 154 -9.082 -7.090 -15.525 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -8.092 -4.821 -15.890 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -6.489 -5.527 -15.855 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -6.806 -6.670 -17.899 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -8.551 -6.526 -17.821 1.00 0.00 H new ATOM 2393 N ASN A 155 -7.570 -8.891 -16.499 1.00 0.00 N ATOM 2394 CA ASN A 155 -6.850 -10.117 -16.825 1.00 0.00 C ATOM 2395 C ASN A 155 -5.560 -9.806 -17.578 1.00 0.00 C ATOM 2396 O ASN A 155 -5.587 -9.234 -18.667 1.00 0.00 O ATOM 2397 CB ASN A 155 -7.732 -11.043 -17.664 1.00 0.00 C ATOM 2398 CG ASN A 155 -8.889 -11.618 -16.868 1.00 0.00 C ATOM 2399 OD1 ASN A 155 -9.314 -11.042 -15.867 1.00 0.00 O ATOM 2400 ND2 ASN A 155 -9.403 -12.759 -17.312 1.00 0.00 N ATOM 0 H ASN A 155 -8.356 -8.686 -17.116 1.00 0.00 H new ATOM 0 HA ASN A 155 -6.594 -10.618 -15.891 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -8.122 -10.492 -18.520 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -7.126 -11.858 -18.059 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -10.183 -13.193 -16.818 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -9.018 -13.201 -18.147 1.00 0.00 H new ATOM 2407 N SER A 156 -4.431 -10.188 -16.989 1.00 0.00 N ATOM 2408 CA SER A 156 -3.130 -9.947 -17.601 1.00 0.00 C ATOM 2409 C SER A 156 -3.187 -10.180 -19.108 1.00 0.00 C ATOM 2410 O SER A 156 -2.809 -9.314 -19.896 1.00 0.00 O ATOM 2411 CB SER A 156 -2.071 -10.856 -16.974 1.00 0.00 C ATOM 2412 OG SER A 156 -2.460 -12.217 -17.044 1.00 0.00 O ATOM 0 H SER A 156 -4.391 -10.666 -16.089 1.00 0.00 H new ATOM 0 HA SER A 156 -2.859 -8.907 -17.421 1.00 0.00 H new ATOM 0 HB2 SER A 156 -1.120 -10.720 -17.488 1.00 0.00 H new ATOM 0 HB3 SER A 156 -1.914 -10.573 -15.933 1.00 0.00 H new ATOM 0 HG SER A 156 -1.766 -12.777 -16.638 1.00 0.00 H new ATOM 2418 N ASP A 157 -3.663 -11.357 -19.500 1.00 0.00 N ATOM 2419 CA ASP A 157 -3.772 -11.705 -20.912 1.00 0.00 C ATOM 2420 C ASP A 157 -4.513 -13.027 -21.090 1.00 0.00 C ATOM 2421 O ASP A 157 -4.564 -13.820 -20.151 1.00 0.00 O ATOM 2422 CB ASP A 157 -2.383 -11.797 -21.546 1.00 0.00 C ATOM 2423 CG ASP A 157 -2.362 -12.691 -22.769 1.00 0.00 C ATOM 2424 OD1 ASP A 157 -2.963 -12.308 -23.794 1.00 0.00 O ATOM 2425 OD2 ASP A 157 -1.745 -13.775 -22.702 1.00 0.00 O ATOM 0 H ASP A 157 -3.979 -12.086 -18.860 1.00 0.00 H new ATOM 0 HA ASP A 157 -4.340 -10.920 -21.411 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -2.047 -10.798 -21.824 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.675 -12.178 -20.809 1.00 0.00 H new TER 2430 ASP A 157 HETATM 2431 ZN ZN A 301 4.922 -15.083 2.096 1.00 0.00 ZN