USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 889 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 79 SER OG : rot 157:sc= -2.33! USER MOD Set 1.2: A 100 TYR OH : rot -111:sc= -0.709 USER MOD Set 2.1: A 25 SER OG : rot -51:sc= 1.05 USER MOD Set 2.2: A 27 ASN : amide:sc= 0.815 K(o=1.9,f=-3.7!) USER MOD Set 3.1: A 16 HIS :FLIP no HD1:sc= -0.362 F(o=-1.5,f=-0.36) USER MOD Set 3.2: A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -121:sc= 0.108 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 70:sc= -3.87! USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -0.519 X(o=-0.52,f=-0.24) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 MET CE :methyl 162:sc= -4.27! (180deg=-4.9!) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 MET CE :methyl -155:sc= -0.0666 (180deg=-0.885) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 SER OG : rot 72:sc= 0.00247 USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.0373 USER MOD Single : A 34 TYR OH : rot -30:sc= -3.77! USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 70:sc= -1.85 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 171:sc= 1.1 USER MOD Single : A 51 ASN : amide:sc= -0.083 X(o=-0.083,f=-0.14) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot -52:sc= 0.202 USER MOD Single : A 65 MET CE :methyl -133:sc= 0 (180deg=-0.881) USER MOD Single : A 67 MET CE :methyl -153:sc= -0.233 (180deg=-1.62!) USER MOD Single : A 70 ASN : amide:sc= 0.0857 X(o=0.086,f=-0.32) USER MOD Single : A 80 MET CE :methyl -113:sc= -0.263 (180deg=-2.94!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -0.348 K(o=-0.35,f=-2.8) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.189 USER MOD Single : A 101 THR OG1 : rot 70:sc= 1.2 USER MOD Single : A 105 SER OG : rot -64:sc= 1.13 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ -130:sc= 0 (180deg=-0.451) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.915 6.390 19.595 1.00 0.00 N ATOM 2 CA GLY A 1 -7.346 6.451 19.353 1.00 0.00 C ATOM 3 C GLY A 1 -7.690 5.922 17.959 1.00 0.00 C ATOM 4 O GLY A 1 -6.799 5.572 17.187 1.00 0.00 O ATOM 0 H1 GLY A 1 -5.729 5.796 20.428 1.00 0.00 H new ATOM 0 H2 GLY A 1 -5.440 5.981 18.765 1.00 0.00 H new ATOM 0 H3 GLY A 1 -5.550 7.349 19.765 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.871 5.866 20.108 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.691 7.480 19.451 1.00 0.00 H new ATOM 8 N SER A 2 -8.985 5.881 17.680 1.00 0.00 N ATOM 9 CA SER A 2 -9.458 5.401 16.393 1.00 0.00 C ATOM 10 C SER A 2 -10.980 5.527 16.314 1.00 0.00 C ATOM 11 O SER A 2 -11.655 5.597 17.340 1.00 0.00 O ATOM 12 CB SER A 2 -9.033 3.950 16.156 1.00 0.00 C ATOM 13 OG SER A 2 -9.509 3.081 17.180 1.00 0.00 O ATOM 0 H SER A 2 -9.721 6.172 18.323 1.00 0.00 H new ATOM 0 HA SER A 2 -9.008 6.015 15.613 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.412 3.614 15.191 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.945 3.894 16.109 1.00 0.00 H new ATOM 0 HG SER A 2 -9.219 2.164 16.992 1.00 0.00 H new ATOM 19 N SER A 3 -11.477 5.553 15.086 1.00 0.00 N ATOM 20 CA SER A 3 -12.908 5.670 14.860 1.00 0.00 C ATOM 21 C SER A 3 -13.301 4.911 13.591 1.00 0.00 C ATOM 22 O SER A 3 -14.018 3.914 13.657 1.00 0.00 O ATOM 23 CB SER A 3 -13.331 7.137 14.754 1.00 0.00 C ATOM 24 OG SER A 3 -14.272 7.495 15.762 1.00 0.00 O ATOM 0 H SER A 3 -10.914 5.495 14.237 1.00 0.00 H new ATOM 0 HA SER A 3 -13.426 5.232 15.713 1.00 0.00 H new ATOM 0 HB2 SER A 3 -12.451 7.775 14.836 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.766 7.319 13.771 1.00 0.00 H new ATOM 0 HG SER A 3 -14.516 8.439 15.662 1.00 0.00 H new ATOM 30 N GLY A 4 -12.814 5.413 12.466 1.00 0.00 N ATOM 31 CA GLY A 4 -13.106 4.795 11.183 1.00 0.00 C ATOM 32 C GLY A 4 -11.963 3.878 10.744 1.00 0.00 C ATOM 33 O GLY A 4 -10.943 3.782 11.424 1.00 0.00 O ATOM 0 H GLY A 4 -12.219 6.240 12.416 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.030 4.222 11.253 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.266 5.568 10.431 1.00 0.00 H new ATOM 37 N SER A 5 -12.171 3.228 9.608 1.00 0.00 N ATOM 38 CA SER A 5 -11.170 2.323 9.070 1.00 0.00 C ATOM 39 C SER A 5 -10.551 1.496 10.199 1.00 0.00 C ATOM 40 O SER A 5 -9.337 1.301 10.236 1.00 0.00 O ATOM 41 CB SER A 5 -10.083 3.089 8.316 1.00 0.00 C ATOM 42 OG SER A 5 -10.397 3.242 6.934 1.00 0.00 O ATOM 0 H SER A 5 -13.018 3.310 9.046 1.00 0.00 H new ATOM 0 HA SER A 5 -11.660 1.653 8.364 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.952 4.072 8.769 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.134 2.563 8.416 1.00 0.00 H new ATOM 0 HG SER A 5 -11.146 3.866 6.836 1.00 0.00 H new ATOM 48 N SER A 6 -11.414 1.032 11.091 1.00 0.00 N ATOM 49 CA SER A 6 -10.967 0.230 12.218 1.00 0.00 C ATOM 50 C SER A 6 -10.492 -1.140 11.730 1.00 0.00 C ATOM 51 O SER A 6 -11.073 -2.164 12.084 1.00 0.00 O ATOM 52 CB SER A 6 -12.081 0.068 13.254 1.00 0.00 C ATOM 53 OG SER A 6 -11.566 -0.037 14.579 1.00 0.00 O ATOM 0 H SER A 6 -12.420 1.196 11.056 1.00 0.00 H new ATOM 0 HA SER A 6 -10.135 0.746 12.697 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.758 0.920 13.195 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.666 -0.821 13.021 1.00 0.00 H new ATOM 0 HG SER A 6 -12.308 -0.138 15.211 1.00 0.00 H new ATOM 59 N GLY A 7 -9.440 -1.114 10.924 1.00 0.00 N ATOM 60 CA GLY A 7 -8.881 -2.341 10.384 1.00 0.00 C ATOM 61 C GLY A 7 -7.809 -2.039 9.335 1.00 0.00 C ATOM 62 O GLY A 7 -6.853 -2.799 9.183 1.00 0.00 O ATOM 0 H GLY A 7 -8.961 -0.262 10.632 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -8.449 -2.934 11.190 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.674 -2.940 9.937 1.00 0.00 H new ATOM 66 N LEU A 8 -8.003 -0.929 8.639 1.00 0.00 N ATOM 67 CA LEU A 8 -7.065 -0.518 7.608 1.00 0.00 C ATOM 68 C LEU A 8 -5.840 0.123 8.266 1.00 0.00 C ATOM 69 O LEU A 8 -4.767 0.175 7.668 1.00 0.00 O ATOM 70 CB LEU A 8 -7.755 0.385 6.584 1.00 0.00 C ATOM 71 CG LEU A 8 -8.825 -0.282 5.716 1.00 0.00 C ATOM 72 CD1 LEU A 8 -9.662 0.765 4.978 1.00 0.00 C ATOM 73 CD2 LEU A 8 -8.199 -1.296 4.757 1.00 0.00 C ATOM 0 H LEU A 8 -8.796 -0.301 8.769 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.712 -1.384 7.048 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.214 1.219 7.115 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.993 0.806 5.928 1.00 0.00 H new ATOM 0 HG LEU A 8 -9.501 -0.833 6.369 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -10.415 0.265 4.368 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -10.154 1.414 5.702 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -9.014 1.363 4.337 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -8.981 -1.755 4.152 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -7.487 -0.789 4.106 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -7.683 -2.067 5.329 1.00 0.00 H new ATOM 85 N HIS A 9 -6.043 0.594 9.487 1.00 0.00 N ATOM 86 CA HIS A 9 -4.969 1.228 10.232 1.00 0.00 C ATOM 87 C HIS A 9 -3.992 0.163 10.732 1.00 0.00 C ATOM 88 O HIS A 9 -2.778 0.329 10.624 1.00 0.00 O ATOM 89 CB HIS A 9 -5.530 2.095 11.362 1.00 0.00 C ATOM 90 CG HIS A 9 -5.605 3.566 11.028 1.00 0.00 C ATOM 91 ND1 HIS A 9 -6.602 4.394 11.513 1.00 0.00 N ATOM 92 CD2 HIS A 9 -4.798 4.347 10.254 1.00 0.00 C ATOM 93 CE1 HIS A 9 -6.395 5.616 11.044 1.00 0.00 C ATOM 94 NE2 HIS A 9 -5.277 5.585 10.264 1.00 0.00 N ATOM 0 H HIS A 9 -6.935 0.549 9.979 1.00 0.00 H new ATOM 0 HA HIS A 9 -4.415 1.900 9.577 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -6.528 1.740 11.618 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -4.909 1.965 12.248 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -3.918 4.015 9.723 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -7.005 6.484 11.244 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -4.875 6.382 9.770 1.00 0.00 H new ATOM 102 N ARG A 10 -4.557 -0.908 11.269 1.00 0.00 N ATOM 103 CA ARG A 10 -3.751 -2.001 11.786 1.00 0.00 C ATOM 104 C ARG A 10 -3.039 -2.723 10.640 1.00 0.00 C ATOM 105 O ARG A 10 -1.997 -3.344 10.845 1.00 0.00 O ATOM 106 CB ARG A 10 -4.611 -3.005 12.555 1.00 0.00 C ATOM 107 CG ARG A 10 -5.351 -3.941 11.597 1.00 0.00 C ATOM 108 CD ARG A 10 -4.687 -5.319 11.555 1.00 0.00 C ATOM 109 NE ARG A 10 -5.651 -6.359 11.978 1.00 0.00 N ATOM 110 CZ ARG A 10 -5.894 -6.682 13.256 1.00 0.00 C ATOM 111 NH1 ARG A 10 -5.245 -6.049 14.242 1.00 0.00 N ATOM 112 NH2 ARG A 10 -6.786 -7.639 13.546 1.00 0.00 N ATOM 0 H ARG A 10 -5.564 -1.042 11.357 1.00 0.00 H new ATOM 0 HA ARG A 10 -3.014 -1.576 12.467 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.982 -3.589 13.226 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -5.331 -2.472 13.176 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.389 -4.043 11.912 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.363 -3.508 10.597 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.332 -5.530 10.546 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -3.815 -5.332 12.209 1.00 0.00 H new ATOM 0 HE ARG A 10 -6.162 -6.861 11.252 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -4.566 -5.321 14.020 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -5.430 -6.295 15.214 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -7.279 -8.121 12.795 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -6.972 -7.886 14.518 1.00 0.00 H new ATOM 126 N ILE A 11 -3.629 -2.617 9.458 1.00 0.00 N ATOM 127 CA ILE A 11 -3.064 -3.253 8.280 1.00 0.00 C ATOM 128 C ILE A 11 -1.910 -2.399 7.750 1.00 0.00 C ATOM 129 O ILE A 11 -0.838 -2.920 7.446 1.00 0.00 O ATOM 130 CB ILE A 11 -4.155 -3.524 7.243 1.00 0.00 C ATOM 131 CG1 ILE A 11 -5.143 -4.577 7.748 1.00 0.00 C ATOM 132 CG2 ILE A 11 -3.546 -3.911 5.894 1.00 0.00 C ATOM 133 CD1 ILE A 11 -6.418 -4.584 6.903 1.00 0.00 C ATOM 0 H ILE A 11 -4.492 -2.100 9.291 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.649 -4.228 8.535 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.717 -2.602 7.091 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -4.677 -5.562 7.717 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.394 -4.375 8.789 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.344 -4.098 5.175 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -2.915 -3.099 5.533 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -2.945 -4.812 6.012 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.103 -5.342 7.284 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -6.895 -3.605 6.955 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -6.167 -4.810 5.867 1.00 0.00 H new ATOM 145 N VAL A 12 -2.169 -1.103 7.655 1.00 0.00 N ATOM 146 CA VAL A 12 -1.165 -0.173 7.167 1.00 0.00 C ATOM 147 C VAL A 12 0.058 -0.222 8.085 1.00 0.00 C ATOM 148 O VAL A 12 1.187 -0.357 7.614 1.00 0.00 O ATOM 149 CB VAL A 12 -1.766 1.229 7.046 1.00 0.00 C ATOM 150 CG1 VAL A 12 -0.713 2.238 6.583 1.00 0.00 C ATOM 151 CG2 VAL A 12 -2.974 1.228 6.107 1.00 0.00 C ATOM 0 H VAL A 12 -3.060 -0.675 7.908 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.834 -0.458 6.168 1.00 0.00 H new ATOM 0 HB VAL A 12 -2.110 1.533 8.035 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -1.166 3.226 6.505 1.00 0.00 H new ATOM 0 HG12 VAL A 12 0.103 2.269 7.304 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -0.326 1.939 5.609 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -3.382 2.236 6.039 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -2.665 0.894 5.117 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -3.737 0.553 6.496 1.00 0.00 H new ATOM 161 N ASP A 13 -0.207 -0.110 9.378 1.00 0.00 N ATOM 162 CA ASP A 13 0.858 -0.139 10.366 1.00 0.00 C ATOM 163 C ASP A 13 1.778 -1.328 10.081 1.00 0.00 C ATOM 164 O ASP A 13 3.001 -1.194 10.117 1.00 0.00 O ATOM 165 CB ASP A 13 0.295 -0.305 11.778 1.00 0.00 C ATOM 166 CG ASP A 13 -0.129 0.996 12.462 1.00 0.00 C ATOM 167 OD1 ASP A 13 0.715 1.917 12.503 1.00 0.00 O ATOM 168 OD2 ASP A 13 -1.288 1.041 12.928 1.00 0.00 O ATOM 0 H ASP A 13 -1.144 0.001 9.765 1.00 0.00 H new ATOM 0 HA ASP A 13 1.402 0.803 10.304 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.566 -0.972 11.734 1.00 0.00 H new ATOM 0 HB3 ASP A 13 1.046 -0.795 12.397 1.00 0.00 H new ATOM 173 N LYS A 14 1.156 -2.465 9.805 1.00 0.00 N ATOM 174 CA LYS A 14 1.904 -3.676 9.515 1.00 0.00 C ATOM 175 C LYS A 14 2.711 -3.477 8.231 1.00 0.00 C ATOM 176 O LYS A 14 3.911 -3.745 8.200 1.00 0.00 O ATOM 177 CB LYS A 14 0.968 -4.886 9.472 1.00 0.00 C ATOM 178 CG LYS A 14 1.448 -5.985 10.423 1.00 0.00 C ATOM 179 CD LYS A 14 0.277 -6.582 11.206 1.00 0.00 C ATOM 180 CE LYS A 14 0.765 -7.271 12.481 1.00 0.00 C ATOM 181 NZ LYS A 14 -0.356 -7.462 13.429 1.00 0.00 N ATOM 0 H LYS A 14 0.142 -2.573 9.776 1.00 0.00 H new ATOM 0 HA LYS A 14 2.619 -3.883 10.312 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -0.042 -4.579 9.745 1.00 0.00 H new ATOM 0 HB3 LYS A 14 0.918 -5.276 8.455 1.00 0.00 H new ATOM 0 HG2 LYS A 14 1.948 -6.770 9.855 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.183 -5.576 11.116 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.433 -5.795 11.462 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.255 -7.300 10.581 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.208 -8.236 12.233 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.546 -6.672 12.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.007 -7.931 14.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -0.761 -6.537 13.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -1.089 -8.052 12.986 1.00 0.00 H new ATOM 195 N MET A 15 2.020 -3.008 7.202 1.00 0.00 N ATOM 196 CA MET A 15 2.658 -2.770 5.919 1.00 0.00 C ATOM 197 C MET A 15 3.767 -1.723 6.044 1.00 0.00 C ATOM 198 O MET A 15 4.644 -1.637 5.185 1.00 0.00 O ATOM 199 CB MET A 15 1.613 -2.288 4.911 1.00 0.00 C ATOM 200 CG MET A 15 0.461 -3.288 4.795 1.00 0.00 C ATOM 201 SD MET A 15 -1.028 -2.449 4.279 1.00 0.00 S ATOM 202 CE MET A 15 -0.697 -2.277 2.533 1.00 0.00 C ATOM 0 H MET A 15 1.025 -2.787 7.231 1.00 0.00 H new ATOM 0 HA MET A 15 3.103 -3.704 5.577 1.00 0.00 H new ATOM 0 HB2 MET A 15 1.226 -1.317 5.219 1.00 0.00 H new ATOM 0 HB3 MET A 15 2.080 -2.151 3.936 1.00 0.00 H new ATOM 0 HG2 MET A 15 0.716 -4.067 4.077 1.00 0.00 H new ATOM 0 HG3 MET A 15 0.297 -3.779 5.754 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.628 -2.072 2.005 1.00 0.00 H new ATOM 0 HE2 MET A 15 -0.001 -1.453 2.374 1.00 0.00 H new ATOM 0 HE3 MET A 15 -0.259 -3.200 2.153 1.00 0.00 H new ATOM 212 N HIS A 16 3.692 -0.954 7.120 1.00 0.00 N ATOM 213 CA HIS A 16 4.679 0.084 7.368 1.00 0.00 C ATOM 214 C HIS A 16 6.001 -0.557 7.795 1.00 0.00 C ATOM 215 O HIS A 16 7.029 0.116 7.861 1.00 0.00 O ATOM 216 CB HIS A 16 4.156 1.098 8.387 1.00 0.00 C ATOM 217 CG HIS A 16 3.649 2.381 7.771 1.00 0.00 C ATOM 218 ND1 HIS A 16 2.515 3.099 8.016 1.00 0.00 N flip ATOM 219 CD2 HIS A 16 4.336 3.060 6.780 1.00 0.00 C flip ATOM 220 CE1 HIS A 16 2.511 4.160 7.219 1.00 0.00 C flip ATOM 221 NE2 HIS A 16 3.639 4.137 6.451 1.00 0.00 N flip ATOM 0 H HIS A 16 2.964 -1.029 7.830 1.00 0.00 H new ATOM 0 HA HIS A 16 4.865 0.641 6.450 1.00 0.00 H new ATOM 0 HB2 HIS A 16 3.351 0.639 8.961 1.00 0.00 H new ATOM 0 HB3 HIS A 16 4.954 1.335 9.091 1.00 0.00 H new ATOM 0 HD2 HIS A 16 5.280 2.762 6.348 1.00 0.00 H new ATOM 0 HE1 HIS A 16 1.742 4.917 7.184 1.00 0.00 H new ATOM 0 HE2 HIS A 16 3.899 4.828 5.747 1.00 0.00 H new ATOM 229 N ASP A 17 5.932 -1.851 8.073 1.00 0.00 N ATOM 230 CA ASP A 17 7.111 -2.591 8.491 1.00 0.00 C ATOM 231 C ASP A 17 7.658 -3.385 7.303 1.00 0.00 C ATOM 232 O ASP A 17 6.965 -3.568 6.303 1.00 0.00 O ATOM 233 CB ASP A 17 6.772 -3.581 9.607 1.00 0.00 C ATOM 234 CG ASP A 17 7.954 -3.992 10.487 1.00 0.00 C ATOM 235 OD1 ASP A 17 8.269 -3.214 11.413 1.00 0.00 O ATOM 236 OD2 ASP A 17 8.515 -5.075 10.215 1.00 0.00 O ATOM 0 H ASP A 17 5.078 -2.406 8.017 1.00 0.00 H new ATOM 0 HA ASP A 17 7.847 -1.875 8.856 1.00 0.00 H new ATOM 0 HB2 ASP A 17 6.002 -3.141 10.241 1.00 0.00 H new ATOM 0 HB3 ASP A 17 6.343 -4.477 9.159 1.00 0.00 H new ATOM 241 N THR A 18 8.895 -3.835 7.452 1.00 0.00 N ATOM 242 CA THR A 18 9.542 -4.606 6.404 1.00 0.00 C ATOM 243 C THR A 18 9.773 -6.046 6.866 1.00 0.00 C ATOM 244 O THR A 18 9.758 -6.971 6.056 1.00 0.00 O ATOM 245 CB THR A 18 10.831 -3.880 6.011 1.00 0.00 C ATOM 246 OG1 THR A 18 11.284 -4.579 4.855 1.00 0.00 O ATOM 247 CG2 THR A 18 11.952 -4.082 7.033 1.00 0.00 C ATOM 0 H THR A 18 9.466 -3.681 8.283 1.00 0.00 H new ATOM 0 HA THR A 18 8.910 -4.679 5.519 1.00 0.00 H new ATOM 0 HB THR A 18 10.629 -2.815 5.901 1.00 0.00 H new ATOM 0 HG1 THR A 18 12.116 -4.173 4.532 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.843 -3.546 6.706 1.00 0.00 H new ATOM 0 HG22 THR A 18 11.634 -3.699 8.003 1.00 0.00 H new ATOM 0 HG23 THR A 18 12.179 -5.145 7.119 1.00 0.00 H new ATOM 255 N SER A 19 9.980 -6.190 8.167 1.00 0.00 N ATOM 256 CA SER A 19 10.214 -7.502 8.746 1.00 0.00 C ATOM 257 C SER A 19 9.017 -8.415 8.473 1.00 0.00 C ATOM 258 O SER A 19 9.126 -9.378 7.715 1.00 0.00 O ATOM 259 CB SER A 19 10.472 -7.402 10.251 1.00 0.00 C ATOM 260 OG SER A 19 11.786 -7.832 10.597 1.00 0.00 O ATOM 0 H SER A 19 9.991 -5.420 8.836 1.00 0.00 H new ATOM 0 HA SER A 19 11.102 -7.928 8.280 1.00 0.00 H new ATOM 0 HB2 SER A 19 10.331 -6.371 10.575 1.00 0.00 H new ATOM 0 HB3 SER A 19 9.740 -8.007 10.785 1.00 0.00 H new ATOM 0 HG SER A 19 11.912 -7.751 11.565 1.00 0.00 H new ATOM 266 N THR A 20 7.901 -8.081 9.105 1.00 0.00 N ATOM 267 CA THR A 20 6.685 -8.859 8.939 1.00 0.00 C ATOM 268 C THR A 20 5.734 -8.161 7.965 1.00 0.00 C ATOM 269 O THR A 20 4.853 -8.797 7.389 1.00 0.00 O ATOM 270 CB THR A 20 6.077 -9.087 10.325 1.00 0.00 C ATOM 271 OG1 THR A 20 5.473 -7.837 10.648 1.00 0.00 O ATOM 272 CG2 THR A 20 7.142 -9.277 11.407 1.00 0.00 C ATOM 0 H THR A 20 7.814 -7.282 9.733 1.00 0.00 H new ATOM 0 HA THR A 20 6.895 -9.833 8.496 1.00 0.00 H new ATOM 0 HB THR A 20 5.427 -9.962 10.298 1.00 0.00 H new ATOM 0 HG1 THR A 20 5.053 -7.895 11.531 1.00 0.00 H new ATOM 0 HG21 THR A 20 6.658 -9.435 12.371 1.00 0.00 H new ATOM 0 HG22 THR A 20 7.757 -10.143 11.164 1.00 0.00 H new ATOM 0 HG23 THR A 20 7.771 -8.388 11.459 1.00 0.00 H new ATOM 280 N GLY A 21 5.945 -6.862 7.812 1.00 0.00 N ATOM 281 CA GLY A 21 5.117 -6.070 6.917 1.00 0.00 C ATOM 282 C GLY A 21 5.427 -6.392 5.454 1.00 0.00 C ATOM 283 O GLY A 21 5.864 -7.497 5.137 1.00 0.00 O ATOM 0 H GLY A 21 6.677 -6.338 8.292 1.00 0.00 H new ATOM 0 HA2 GLY A 21 4.064 -6.266 7.121 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.286 -5.009 7.103 1.00 0.00 H new ATOM 287 N ILE A 22 5.190 -5.405 4.602 1.00 0.00 N ATOM 288 CA ILE A 22 5.439 -5.569 3.180 1.00 0.00 C ATOM 289 C ILE A 22 6.912 -5.278 2.887 1.00 0.00 C ATOM 290 O ILE A 22 7.599 -4.658 3.698 1.00 0.00 O ATOM 291 CB ILE A 22 4.469 -4.713 2.364 1.00 0.00 C ATOM 292 CG1 ILE A 22 4.065 -5.423 1.070 1.00 0.00 C ATOM 293 CG2 ILE A 22 5.054 -3.325 2.097 1.00 0.00 C ATOM 294 CD1 ILE A 22 2.897 -6.381 1.312 1.00 0.00 C ATOM 0 H ILE A 22 4.828 -4.489 4.869 1.00 0.00 H new ATOM 0 HA ILE A 22 5.251 -6.599 2.877 1.00 0.00 H new ATOM 0 HB ILE A 22 3.561 -4.573 2.951 1.00 0.00 H new ATOM 0 HG12 ILE A 22 3.785 -4.685 0.318 1.00 0.00 H new ATOM 0 HG13 ILE A 22 4.917 -5.975 0.673 1.00 0.00 H new ATOM 0 HG21 ILE A 22 4.344 -2.737 1.515 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.249 -2.824 3.045 1.00 0.00 H new ATOM 0 HG23 ILE A 22 5.986 -3.424 1.540 1.00 0.00 H new ATOM 0 HD11 ILE A 22 2.630 -6.872 0.377 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.189 -7.132 2.046 1.00 0.00 H new ATOM 0 HD13 ILE A 22 2.039 -5.822 1.686 1.00 0.00 H new ATOM 306 N ARG A 23 7.355 -5.739 1.726 1.00 0.00 N ATOM 307 CA ARG A 23 8.734 -5.535 1.317 1.00 0.00 C ATOM 308 C ARG A 23 8.789 -5.023 -0.124 1.00 0.00 C ATOM 309 O ARG A 23 8.886 -5.811 -1.063 1.00 0.00 O ATOM 310 CB ARG A 23 9.536 -6.834 1.421 1.00 0.00 C ATOM 311 CG ARG A 23 9.580 -7.338 2.865 1.00 0.00 C ATOM 312 CD ARG A 23 10.877 -8.101 3.140 1.00 0.00 C ATOM 313 NE ARG A 23 10.728 -9.515 2.731 1.00 0.00 N ATOM 314 CZ ARG A 23 11.756 -10.325 2.440 1.00 0.00 C ATOM 315 NH1 ARG A 23 13.012 -9.866 2.512 1.00 0.00 N ATOM 316 NH2 ARG A 23 11.527 -11.595 2.078 1.00 0.00 N ATOM 0 H ARG A 23 6.783 -6.253 1.056 1.00 0.00 H new ATOM 0 HA ARG A 23 9.174 -4.795 1.986 1.00 0.00 H new ATOM 0 HB2 ARG A 23 9.088 -7.594 0.780 1.00 0.00 H new ATOM 0 HB3 ARG A 23 10.551 -6.669 1.059 1.00 0.00 H new ATOM 0 HG2 ARG A 23 9.497 -6.495 3.551 1.00 0.00 H new ATOM 0 HG3 ARG A 23 8.725 -7.987 3.054 1.00 0.00 H new ATOM 0 HD2 ARG A 23 11.702 -7.641 2.595 1.00 0.00 H new ATOM 0 HD3 ARG A 23 11.124 -8.044 4.200 1.00 0.00 H new ATOM 0 HE ARG A 23 9.785 -9.897 2.666 1.00 0.00 H new ATOM 0 HH11 ARG A 23 13.187 -8.900 2.788 1.00 0.00 H new ATOM 0 HH12 ARG A 23 13.794 -10.483 2.291 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.571 -11.945 2.024 1.00 0.00 H new ATOM 0 HH22 ARG A 23 12.309 -12.211 1.857 1.00 0.00 H new ATOM 330 N PRO A 24 8.725 -3.671 -0.256 1.00 0.00 N ATOM 331 CA PRO A 24 8.767 -3.044 -1.566 1.00 0.00 C ATOM 332 C PRO A 24 10.185 -3.067 -2.139 1.00 0.00 C ATOM 333 O PRO A 24 11.014 -2.227 -1.789 1.00 0.00 O ATOM 334 CB PRO A 24 8.238 -1.636 -1.346 1.00 0.00 C ATOM 335 CG PRO A 24 8.357 -1.375 0.147 1.00 0.00 C ATOM 336 CD PRO A 24 8.610 -2.707 0.835 1.00 0.00 C ATOM 0 HA PRO A 24 8.162 -3.571 -2.304 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.815 -0.908 -1.917 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.203 -1.552 -1.676 1.00 0.00 H new ATOM 0 HG2 PRO A 24 9.172 -0.680 0.349 1.00 0.00 H new ATOM 0 HG3 PRO A 24 7.445 -0.916 0.528 1.00 0.00 H new ATOM 0 HD2 PRO A 24 9.520 -2.677 1.434 1.00 0.00 H new ATOM 0 HD3 PRO A 24 7.793 -2.966 1.508 1.00 0.00 H new ATOM 344 N SER A 25 10.422 -4.037 -3.010 1.00 0.00 N ATOM 345 CA SER A 25 11.726 -4.180 -3.635 1.00 0.00 C ATOM 346 C SER A 25 11.753 -3.426 -4.967 1.00 0.00 C ATOM 347 O SER A 25 10.707 -3.178 -5.565 1.00 0.00 O ATOM 348 CB SER A 25 12.074 -5.654 -3.852 1.00 0.00 C ATOM 349 OG SER A 25 11.685 -6.109 -5.145 1.00 0.00 O ATOM 0 H SER A 25 9.733 -4.732 -3.298 1.00 0.00 H new ATOM 0 HA SER A 25 12.474 -3.753 -2.968 1.00 0.00 H new ATOM 0 HB2 SER A 25 13.147 -5.796 -3.725 1.00 0.00 H new ATOM 0 HB3 SER A 25 11.581 -6.259 -3.091 1.00 0.00 H new ATOM 0 HG SER A 25 10.746 -5.879 -5.304 1.00 0.00 H new ATOM 355 N PRO A 26 12.992 -3.075 -5.403 1.00 0.00 N ATOM 356 CA PRO A 26 13.170 -2.355 -6.652 1.00 0.00 C ATOM 357 C PRO A 26 12.973 -3.283 -7.853 1.00 0.00 C ATOM 358 O PRO A 26 13.894 -3.486 -8.642 1.00 0.00 O ATOM 359 CB PRO A 26 14.571 -1.772 -6.575 1.00 0.00 C ATOM 360 CG PRO A 26 15.295 -2.568 -5.501 1.00 0.00 C ATOM 361 CD PRO A 26 14.253 -3.352 -4.720 1.00 0.00 C ATOM 0 HA PRO A 26 12.432 -1.565 -6.790 1.00 0.00 H new ATOM 0 HB2 PRO A 26 15.082 -1.855 -7.534 1.00 0.00 H new ATOM 0 HB3 PRO A 26 14.540 -0.712 -6.322 1.00 0.00 H new ATOM 0 HG2 PRO A 26 16.022 -3.243 -5.952 1.00 0.00 H new ATOM 0 HG3 PRO A 26 15.847 -1.901 -4.838 1.00 0.00 H new ATOM 0 HD2 PRO A 26 14.478 -4.419 -4.720 1.00 0.00 H new ATOM 0 HD3 PRO A 26 14.217 -3.034 -3.678 1.00 0.00 H new ATOM 369 N ASN A 27 11.767 -3.822 -7.952 1.00 0.00 N ATOM 370 CA ASN A 27 11.438 -4.724 -9.043 1.00 0.00 C ATOM 371 C ASN A 27 11.366 -3.932 -10.350 1.00 0.00 C ATOM 372 O ASN A 27 10.437 -3.153 -10.557 1.00 0.00 O ATOM 373 CB ASN A 27 10.078 -5.389 -8.817 1.00 0.00 C ATOM 374 CG ASN A 27 10.132 -6.361 -7.637 1.00 0.00 C ATOM 375 OD1 ASN A 27 9.599 -6.111 -6.568 1.00 0.00 O ATOM 376 ND2 ASN A 27 10.804 -7.480 -7.889 1.00 0.00 N ATOM 0 H ASN A 27 11.006 -3.652 -7.295 1.00 0.00 H new ATOM 0 HA ASN A 27 12.211 -5.491 -9.091 1.00 0.00 H new ATOM 0 HB2 ASN A 27 9.323 -4.626 -8.630 1.00 0.00 H new ATOM 0 HB3 ASN A 27 9.776 -5.922 -9.718 1.00 0.00 H new ATOM 0 HD21 ASN A 27 10.898 -8.193 -7.165 1.00 0.00 H new ATOM 0 HD22 ASN A 27 11.226 -7.626 -8.806 1.00 0.00 H new ATOM 383 N MET A 28 12.359 -4.159 -11.197 1.00 0.00 N ATOM 384 CA MET A 28 12.420 -3.477 -12.478 1.00 0.00 C ATOM 385 C MET A 28 11.055 -3.486 -13.170 1.00 0.00 C ATOM 386 O MET A 28 10.352 -4.495 -13.149 1.00 0.00 O ATOM 387 CB MET A 28 13.452 -4.164 -13.375 1.00 0.00 C ATOM 388 CG MET A 28 14.142 -3.152 -14.292 1.00 0.00 C ATOM 389 SD MET A 28 14.942 -4.000 -15.644 1.00 0.00 S ATOM 390 CE MET A 28 13.810 -3.611 -16.967 1.00 0.00 C ATOM 0 H MET A 28 13.128 -4.806 -11.021 1.00 0.00 H new ATOM 0 HA MET A 28 12.711 -2.441 -12.303 1.00 0.00 H new ATOM 0 HB2 MET A 28 14.196 -4.668 -12.759 1.00 0.00 H new ATOM 0 HB3 MET A 28 12.963 -4.931 -13.976 1.00 0.00 H new ATOM 0 HG2 MET A 28 13.411 -2.442 -14.679 1.00 0.00 H new ATOM 0 HG3 MET A 28 14.876 -2.578 -13.727 1.00 0.00 H new ATOM 0 HE1 MET A 28 13.879 -4.375 -17.741 1.00 0.00 H new ATOM 0 HE2 MET A 28 12.792 -3.580 -16.578 1.00 0.00 H new ATOM 0 HE3 MET A 28 14.066 -2.640 -17.391 1.00 0.00 H new ATOM 400 N GLU A 29 10.722 -2.351 -13.767 1.00 0.00 N ATOM 401 CA GLU A 29 9.454 -2.216 -14.464 1.00 0.00 C ATOM 402 C GLU A 29 9.604 -1.277 -15.662 1.00 0.00 C ATOM 403 O GLU A 29 9.676 -0.060 -15.496 1.00 0.00 O ATOM 404 CB GLU A 29 8.357 -1.725 -13.517 1.00 0.00 C ATOM 405 CG GLU A 29 7.130 -2.637 -13.580 1.00 0.00 C ATOM 406 CD GLU A 29 7.411 -3.982 -12.907 1.00 0.00 C ATOM 407 OE1 GLU A 29 7.189 -4.060 -11.679 1.00 0.00 O ATOM 408 OE2 GLU A 29 7.841 -4.902 -13.636 1.00 0.00 O ATOM 0 H GLU A 29 11.308 -1.516 -13.782 1.00 0.00 H new ATOM 0 HA GLU A 29 9.158 -3.198 -14.832 1.00 0.00 H new ATOM 0 HB2 GLU A 29 8.739 -1.694 -12.497 1.00 0.00 H new ATOM 0 HB3 GLU A 29 8.072 -0.707 -13.782 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.286 -2.151 -13.091 1.00 0.00 H new ATOM 0 HG3 GLU A 29 6.846 -2.799 -14.620 1.00 0.00 H new ATOM 415 N GLN A 30 9.648 -1.877 -16.842 1.00 0.00 N ATOM 416 CA GLN A 30 9.788 -1.110 -18.068 1.00 0.00 C ATOM 417 C GLN A 30 10.921 -0.091 -17.929 1.00 0.00 C ATOM 418 O GLN A 30 10.743 1.086 -18.238 1.00 0.00 O ATOM 419 CB GLN A 30 8.473 -0.420 -18.437 1.00 0.00 C ATOM 420 CG GLN A 30 8.474 0.013 -19.904 1.00 0.00 C ATOM 421 CD GLN A 30 7.690 -0.977 -20.769 1.00 0.00 C ATOM 422 OE1 GLN A 30 8.244 -1.853 -21.412 1.00 0.00 O ATOM 423 NE2 GLN A 30 6.373 -0.789 -20.748 1.00 0.00 N ATOM 0 H GLN A 30 9.589 -2.887 -16.975 1.00 0.00 H new ATOM 0 HA GLN A 30 10.039 -1.797 -18.876 1.00 0.00 H new ATOM 0 HB2 GLN A 30 7.639 -1.098 -18.255 1.00 0.00 H new ATOM 0 HB3 GLN A 30 8.323 0.450 -17.797 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.035 1.007 -19.994 1.00 0.00 H new ATOM 0 HG3 GLN A 30 9.500 0.084 -20.265 1.00 0.00 H new ATOM 0 HE21 GLN A 30 5.974 -0.036 -20.188 1.00 0.00 H new ATOM 0 HE22 GLN A 30 5.762 -1.398 -21.292 1.00 0.00 H new ATOM 432 N GLY A 31 12.061 -0.581 -17.464 1.00 0.00 N ATOM 433 CA GLY A 31 13.223 0.272 -17.280 1.00 0.00 C ATOM 434 C GLY A 31 12.863 1.522 -16.473 1.00 0.00 C ATOM 435 O GLY A 31 12.341 2.491 -17.022 1.00 0.00 O ATOM 0 H GLY A 31 12.205 -1.558 -17.209 1.00 0.00 H new ATOM 0 HA2 GLY A 31 14.008 -0.283 -16.767 1.00 0.00 H new ATOM 0 HA3 GLY A 31 13.622 0.564 -18.251 1.00 0.00 H new ATOM 439 N SER A 32 13.158 1.459 -15.183 1.00 0.00 N ATOM 440 CA SER A 32 12.873 2.573 -14.295 1.00 0.00 C ATOM 441 C SER A 32 13.111 2.158 -12.842 1.00 0.00 C ATOM 442 O SER A 32 13.512 2.977 -12.016 1.00 0.00 O ATOM 443 CB SER A 32 11.437 3.068 -14.477 1.00 0.00 C ATOM 444 OG SER A 32 11.391 4.418 -14.932 1.00 0.00 O ATOM 0 H SER A 32 13.592 0.654 -14.731 1.00 0.00 H new ATOM 0 HA SER A 32 13.546 3.392 -14.547 1.00 0.00 H new ATOM 0 HB2 SER A 32 10.920 2.427 -15.191 1.00 0.00 H new ATOM 0 HB3 SER A 32 10.903 2.986 -13.531 1.00 0.00 H new ATOM 0 HG SER A 32 11.673 4.457 -15.870 1.00 0.00 H new ATOM 450 N THR A 33 12.855 0.886 -12.573 1.00 0.00 N ATOM 451 CA THR A 33 13.037 0.353 -11.234 1.00 0.00 C ATOM 452 C THR A 33 12.395 1.279 -10.199 1.00 0.00 C ATOM 453 O THR A 33 12.994 2.273 -9.794 1.00 0.00 O ATOM 454 CB THR A 33 14.535 0.138 -11.010 1.00 0.00 C ATOM 455 OG1 THR A 33 14.941 -0.661 -12.118 1.00 0.00 O ATOM 456 CG2 THR A 33 14.825 -0.741 -9.791 1.00 0.00 C ATOM 0 H THR A 33 12.523 0.209 -13.260 1.00 0.00 H new ATOM 0 HA THR A 33 12.535 -0.608 -11.120 1.00 0.00 H new ATOM 0 HB THR A 33 15.025 1.104 -10.886 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.901 -0.847 -12.053 1.00 0.00 H new ATOM 0 HG21 THR A 33 15.902 -0.862 -9.678 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.417 -0.270 -8.897 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.363 -1.719 -9.929 1.00 0.00 H new ATOM 464 N TYR A 34 11.183 0.919 -9.801 1.00 0.00 N ATOM 465 CA TYR A 34 10.453 1.705 -8.822 1.00 0.00 C ATOM 466 C TYR A 34 10.874 1.335 -7.398 1.00 0.00 C ATOM 467 O TYR A 34 10.736 0.185 -6.985 1.00 0.00 O ATOM 468 CB TYR A 34 8.977 1.351 -9.012 1.00 0.00 C ATOM 469 CG TYR A 34 8.343 1.976 -10.257 1.00 0.00 C ATOM 470 CD1 TYR A 34 8.795 1.625 -11.512 1.00 0.00 C ATOM 471 CD2 TYR A 34 7.319 2.892 -10.123 1.00 0.00 C ATOM 472 CE1 TYR A 34 8.198 2.214 -12.683 1.00 0.00 C ATOM 473 CE2 TYR A 34 6.722 3.480 -11.294 1.00 0.00 C ATOM 474 CZ TYR A 34 7.191 3.112 -12.516 1.00 0.00 C ATOM 475 OH TYR A 34 6.627 3.668 -13.622 1.00 0.00 O ATOM 0 H TYR A 34 10.689 0.093 -10.139 1.00 0.00 H new ATOM 0 HA TYR A 34 10.649 2.768 -8.961 1.00 0.00 H new ATOM 0 HB2 TYR A 34 8.879 0.267 -9.072 1.00 0.00 H new ATOM 0 HB3 TYR A 34 8.420 1.674 -8.132 1.00 0.00 H new ATOM 0 HD1 TYR A 34 9.596 0.909 -11.617 1.00 0.00 H new ATOM 0 HD2 TYR A 34 6.966 3.168 -9.140 1.00 0.00 H new ATOM 0 HE1 TYR A 34 8.543 1.948 -13.671 1.00 0.00 H new ATOM 0 HE2 TYR A 34 5.920 4.197 -11.204 1.00 0.00 H new ATOM 0 HH TYR A 34 7.294 3.722 -14.337 1.00 0.00 H new ATOM 485 N LYS A 35 11.379 2.332 -6.687 1.00 0.00 N ATOM 486 CA LYS A 35 11.821 2.126 -5.318 1.00 0.00 C ATOM 487 C LYS A 35 10.648 2.366 -4.366 1.00 0.00 C ATOM 488 O LYS A 35 9.866 3.296 -4.561 1.00 0.00 O ATOM 489 CB LYS A 35 13.046 2.991 -5.015 1.00 0.00 C ATOM 490 CG LYS A 35 14.341 2.237 -5.326 1.00 0.00 C ATOM 491 CD LYS A 35 15.363 2.414 -4.201 1.00 0.00 C ATOM 492 CE LYS A 35 16.061 1.091 -3.881 1.00 0.00 C ATOM 493 NZ LYS A 35 15.985 0.803 -2.431 1.00 0.00 N ATOM 0 H LYS A 35 11.492 3.285 -7.033 1.00 0.00 H new ATOM 0 HA LYS A 35 12.144 1.095 -5.173 1.00 0.00 H new ATOM 0 HB2 LYS A 35 13.004 3.907 -5.605 1.00 0.00 H new ATOM 0 HB3 LYS A 35 13.036 3.287 -3.966 1.00 0.00 H new ATOM 0 HG2 LYS A 35 14.125 1.177 -5.462 1.00 0.00 H new ATOM 0 HG3 LYS A 35 14.761 2.600 -6.264 1.00 0.00 H new ATOM 0 HD2 LYS A 35 16.104 3.159 -4.492 1.00 0.00 H new ATOM 0 HD3 LYS A 35 14.865 2.792 -3.308 1.00 0.00 H new ATOM 0 HE2 LYS A 35 15.595 0.282 -4.444 1.00 0.00 H new ATOM 0 HE3 LYS A 35 17.104 1.138 -4.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 16.463 -0.098 -2.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 16.450 1.567 -1.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 14.988 0.738 -2.142 1.00 0.00 H new ATOM 507 N LYS A 36 10.562 1.513 -3.357 1.00 0.00 N ATOM 508 CA LYS A 36 9.497 1.621 -2.374 1.00 0.00 C ATOM 509 C LYS A 36 8.158 1.305 -3.043 1.00 0.00 C ATOM 510 O LYS A 36 7.184 2.036 -2.865 1.00 0.00 O ATOM 511 CB LYS A 36 9.536 2.989 -1.690 1.00 0.00 C ATOM 512 CG LYS A 36 10.398 2.946 -0.427 1.00 0.00 C ATOM 513 CD LYS A 36 10.193 4.204 0.420 1.00 0.00 C ATOM 514 CE LYS A 36 11.299 5.228 0.156 1.00 0.00 C ATOM 515 NZ LYS A 36 12.422 5.034 1.101 1.00 0.00 N ATOM 0 H LYS A 36 11.212 0.743 -3.198 1.00 0.00 H new ATOM 0 HA LYS A 36 9.637 0.889 -1.578 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.933 3.733 -2.380 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.523 3.300 -1.433 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.146 2.063 0.160 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.449 2.856 -0.702 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.222 4.645 0.194 1.00 0.00 H new ATOM 0 HD3 LYS A 36 10.183 3.938 1.477 1.00 0.00 H new ATOM 0 HE2 LYS A 36 11.657 5.129 -0.869 1.00 0.00 H new ATOM 0 HE3 LYS A 36 10.900 6.237 0.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 13.164 5.737 0.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 12.079 5.151 2.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 12.813 4.077 0.984 1.00 0.00 H new ATOM 529 N THR A 37 8.151 0.217 -3.798 1.00 0.00 N ATOM 530 CA THR A 37 6.948 -0.204 -4.494 1.00 0.00 C ATOM 531 C THR A 37 6.834 -1.730 -4.489 1.00 0.00 C ATOM 532 O THR A 37 7.789 -2.428 -4.824 1.00 0.00 O ATOM 533 CB THR A 37 6.980 0.397 -5.901 1.00 0.00 C ATOM 534 OG1 THR A 37 8.353 0.325 -6.278 1.00 0.00 O ATOM 535 CG2 THR A 37 6.671 1.896 -5.904 1.00 0.00 C ATOM 0 H THR A 37 8.960 -0.386 -3.943 1.00 0.00 H new ATOM 0 HA THR A 37 6.053 0.159 -3.989 1.00 0.00 H new ATOM 0 HB THR A 37 6.262 -0.123 -6.535 1.00 0.00 H new ATOM 0 HG1 THR A 37 8.604 -0.611 -6.424 1.00 0.00 H new ATOM 0 HG21 THR A 37 6.707 2.273 -6.926 1.00 0.00 H new ATOM 0 HG22 THR A 37 5.677 2.063 -5.490 1.00 0.00 H new ATOM 0 HG23 THR A 37 7.409 2.421 -5.298 1.00 0.00 H new ATOM 543 N PHE A 38 5.658 -2.202 -4.104 1.00 0.00 N ATOM 544 CA PHE A 38 5.407 -3.632 -4.050 1.00 0.00 C ATOM 545 C PHE A 38 4.322 -4.037 -5.051 1.00 0.00 C ATOM 546 O PHE A 38 3.292 -3.374 -5.157 1.00 0.00 O ATOM 547 CB PHE A 38 4.921 -3.948 -2.634 1.00 0.00 C ATOM 548 CG PHE A 38 3.659 -3.186 -2.225 1.00 0.00 C ATOM 549 CD1 PHE A 38 2.434 -3.652 -2.590 1.00 0.00 C ATOM 550 CD2 PHE A 38 3.761 -2.043 -1.496 1.00 0.00 C ATOM 551 CE1 PHE A 38 1.263 -2.945 -2.210 1.00 0.00 C ATOM 552 CE2 PHE A 38 2.590 -1.335 -1.116 1.00 0.00 C ATOM 553 CZ PHE A 38 1.366 -1.801 -1.481 1.00 0.00 C ATOM 0 H PHE A 38 4.868 -1.620 -3.826 1.00 0.00 H new ATOM 0 HA PHE A 38 6.316 -4.179 -4.300 1.00 0.00 H new ATOM 0 HB2 PHE A 38 4.728 -5.018 -2.557 1.00 0.00 H new ATOM 0 HB3 PHE A 38 5.718 -3.717 -1.927 1.00 0.00 H new ATOM 0 HD1 PHE A 38 2.352 -4.560 -3.169 1.00 0.00 H new ATOM 0 HD2 PHE A 38 4.733 -1.673 -1.206 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.291 -3.315 -2.500 1.00 0.00 H new ATOM 0 HE2 PHE A 38 2.672 -0.427 -0.537 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.475 -1.263 -1.192 1.00 0.00 H new ATOM 563 N LEU A 39 4.592 -5.124 -5.760 1.00 0.00 N ATOM 564 CA LEU A 39 3.652 -5.624 -6.748 1.00 0.00 C ATOM 565 C LEU A 39 2.291 -5.846 -6.085 1.00 0.00 C ATOM 566 O LEU A 39 2.220 -6.226 -4.917 1.00 0.00 O ATOM 567 CB LEU A 39 4.211 -6.871 -7.436 1.00 0.00 C ATOM 568 CG LEU A 39 5.667 -6.785 -7.899 1.00 0.00 C ATOM 569 CD1 LEU A 39 6.090 -8.068 -8.618 1.00 0.00 C ATOM 570 CD2 LEU A 39 5.895 -5.543 -8.763 1.00 0.00 C ATOM 0 H LEU A 39 5.448 -5.672 -5.669 1.00 0.00 H new ATOM 0 HA LEU A 39 3.505 -4.889 -7.540 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.118 -7.713 -6.750 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.588 -7.094 -8.302 1.00 0.00 H new ATOM 0 HG LEU A 39 6.300 -6.685 -7.018 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.129 -7.981 -8.937 1.00 0.00 H new ATOM 0 HD12 LEU A 39 5.988 -8.915 -7.940 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.455 -8.223 -9.490 1.00 0.00 H new ATOM 0 HD21 LEU A 39 6.938 -5.506 -9.079 1.00 0.00 H new ATOM 0 HD22 LEU A 39 5.251 -5.588 -9.641 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.659 -4.649 -8.185 1.00 0.00 H new ATOM 582 N GLY A 40 1.244 -5.599 -6.859 1.00 0.00 N ATOM 583 CA GLY A 40 -0.111 -5.767 -6.362 1.00 0.00 C ATOM 584 C GLY A 40 -0.345 -7.201 -5.881 1.00 0.00 C ATOM 585 O GLY A 40 -1.086 -7.426 -4.926 1.00 0.00 O ATOM 0 H GLY A 40 1.307 -5.284 -7.827 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.291 -5.071 -5.543 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -0.824 -5.523 -7.150 1.00 0.00 H new ATOM 589 N SER A 41 0.302 -8.133 -6.566 1.00 0.00 N ATOM 590 CA SER A 41 0.173 -9.539 -6.222 1.00 0.00 C ATOM 591 C SER A 41 0.933 -9.832 -4.926 1.00 0.00 C ATOM 592 O SER A 41 0.574 -10.745 -4.185 1.00 0.00 O ATOM 593 CB SER A 41 0.688 -10.432 -7.352 1.00 0.00 C ATOM 594 OG SER A 41 -0.152 -11.564 -7.562 1.00 0.00 O ATOM 0 H SER A 41 0.917 -7.942 -7.357 1.00 0.00 H new ATOM 0 HA SER A 41 -0.884 -9.759 -6.074 1.00 0.00 H new ATOM 0 HB2 SER A 41 0.751 -9.852 -8.273 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.698 -10.768 -7.117 1.00 0.00 H new ATOM 0 HG SER A 41 0.209 -12.108 -8.292 1.00 0.00 H new ATOM 600 N SER A 42 1.968 -9.039 -4.693 1.00 0.00 N ATOM 601 CA SER A 42 2.782 -9.202 -3.500 1.00 0.00 C ATOM 602 C SER A 42 1.984 -8.786 -2.262 1.00 0.00 C ATOM 603 O SER A 42 1.881 -9.548 -1.302 1.00 0.00 O ATOM 604 CB SER A 42 4.072 -8.386 -3.598 1.00 0.00 C ATOM 605 OG SER A 42 5.225 -9.220 -3.691 1.00 0.00 O ATOM 0 H SER A 42 2.262 -8.282 -5.310 1.00 0.00 H new ATOM 0 HA SER A 42 3.055 -10.254 -3.413 1.00 0.00 H new ATOM 0 HB2 SER A 42 4.024 -7.735 -4.471 1.00 0.00 H new ATOM 0 HB3 SER A 42 4.160 -7.741 -2.724 1.00 0.00 H new ATOM 0 HG SER A 42 6.028 -8.662 -3.754 1.00 0.00 H new ATOM 611 N LEU A 43 1.440 -7.580 -2.325 1.00 0.00 N ATOM 612 CA LEU A 43 0.655 -7.054 -1.222 1.00 0.00 C ATOM 613 C LEU A 43 -0.604 -7.907 -1.046 1.00 0.00 C ATOM 614 O LEU A 43 -0.826 -8.479 0.020 1.00 0.00 O ATOM 615 CB LEU A 43 0.365 -5.566 -1.431 1.00 0.00 C ATOM 616 CG LEU A 43 -0.802 -4.991 -0.626 1.00 0.00 C ATOM 617 CD1 LEU A 43 -2.076 -4.937 -1.471 1.00 0.00 C ATOM 618 CD2 LEU A 43 -1.008 -5.769 0.674 1.00 0.00 C ATOM 0 H LEU A 43 1.528 -6.952 -3.124 1.00 0.00 H new ATOM 0 HA LEU A 43 1.217 -7.117 -0.290 1.00 0.00 H new ATOM 0 HB2 LEU A 43 1.264 -5.002 -1.183 1.00 0.00 H new ATOM 0 HB3 LEU A 43 0.167 -5.400 -2.490 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.555 -3.966 -0.350 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.890 -4.525 -0.875 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.908 -4.305 -2.343 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.339 -5.943 -1.798 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.843 -5.339 1.227 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.224 -6.812 0.443 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -0.104 -5.711 1.280 1.00 0.00 H new ATOM 630 N VAL A 44 -1.394 -7.964 -2.107 1.00 0.00 N ATOM 631 CA VAL A 44 -2.624 -8.737 -2.083 1.00 0.00 C ATOM 632 C VAL A 44 -2.388 -10.040 -1.316 1.00 0.00 C ATOM 633 O VAL A 44 -3.096 -10.335 -0.355 1.00 0.00 O ATOM 634 CB VAL A 44 -3.127 -8.966 -3.510 1.00 0.00 C ATOM 635 CG1 VAL A 44 -4.273 -9.979 -3.532 1.00 0.00 C ATOM 636 CG2 VAL A 44 -3.547 -7.647 -4.162 1.00 0.00 C ATOM 0 H VAL A 44 -1.207 -7.488 -2.989 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.408 -8.190 -1.560 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.304 -9.380 -4.093 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -4.612 -10.123 -4.558 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.926 -10.930 -3.127 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -5.099 -9.607 -2.926 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -3.900 -7.838 -5.175 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.347 -7.191 -3.579 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -2.693 -6.970 -4.197 1.00 0.00 H new ATOM 646 N ASP A 45 -1.391 -10.784 -1.771 1.00 0.00 N ATOM 647 CA ASP A 45 -1.053 -12.049 -1.140 1.00 0.00 C ATOM 648 C ASP A 45 -0.685 -11.800 0.324 1.00 0.00 C ATOM 649 O ASP A 45 -1.138 -12.521 1.212 1.00 0.00 O ATOM 650 CB ASP A 45 0.149 -12.702 -1.825 1.00 0.00 C ATOM 651 CG ASP A 45 0.243 -14.220 -1.656 1.00 0.00 C ATOM 652 OD1 ASP A 45 -0.514 -14.745 -0.811 1.00 0.00 O ATOM 653 OD2 ASP A 45 1.069 -14.821 -2.376 1.00 0.00 O ATOM 0 H ASP A 45 -0.806 -10.536 -2.569 1.00 0.00 H new ATOM 0 HA ASP A 45 -1.917 -12.709 -1.222 1.00 0.00 H new ATOM 0 HB2 ASP A 45 0.111 -12.472 -2.890 1.00 0.00 H new ATOM 0 HB3 ASP A 45 1.061 -12.251 -1.434 1.00 0.00 H new ATOM 658 N TRP A 46 0.132 -10.778 0.531 1.00 0.00 N ATOM 659 CA TRP A 46 0.566 -10.426 1.872 1.00 0.00 C ATOM 660 C TRP A 46 -0.680 -10.275 2.747 1.00 0.00 C ATOM 661 O TRP A 46 -0.830 -10.975 3.747 1.00 0.00 O ATOM 662 CB TRP A 46 1.440 -9.171 1.854 1.00 0.00 C ATOM 663 CG TRP A 46 1.829 -8.663 3.244 1.00 0.00 C ATOM 664 CD1 TRP A 46 2.922 -8.967 3.957 1.00 0.00 C ATOM 665 CD2 TRP A 46 1.079 -7.742 4.064 1.00 0.00 C ATOM 666 NE1 TRP A 46 2.930 -8.314 5.173 1.00 0.00 N ATOM 667 CE2 TRP A 46 1.774 -7.545 5.239 1.00 0.00 C ATOM 668 CE3 TRP A 46 -0.147 -7.098 3.821 1.00 0.00 C ATOM 669 CZ2 TRP A 46 1.324 -6.704 6.264 1.00 0.00 C ATOM 670 CZ3 TRP A 46 -0.583 -6.261 4.855 1.00 0.00 C ATOM 671 CH2 TRP A 46 0.106 -6.051 6.044 1.00 0.00 C ATOM 0 H TRP A 46 0.505 -10.182 -0.208 1.00 0.00 H new ATOM 0 HA TRP A 46 1.194 -11.211 2.293 1.00 0.00 H new ATOM 0 HB2 TRP A 46 2.348 -9.381 1.288 1.00 0.00 H new ATOM 0 HB3 TRP A 46 0.910 -8.379 1.324 1.00 0.00 H new ATOM 0 HD1 TRP A 46 3.699 -9.638 3.622 1.00 0.00 H new ATOM 0 HE1 TRP A 46 3.651 -8.383 5.891 1.00 0.00 H new ATOM 0 HE3 TRP A 46 -0.708 -7.238 2.909 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 1.887 -6.567 7.176 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -1.520 -5.742 4.719 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -0.297 -5.387 6.794 1.00 0.00 H new ATOM 682 N LEU A 47 -1.542 -9.355 2.339 1.00 0.00 N ATOM 683 CA LEU A 47 -2.770 -9.103 3.074 1.00 0.00 C ATOM 684 C LEU A 47 -3.363 -10.434 3.541 1.00 0.00 C ATOM 685 O LEU A 47 -3.796 -10.557 4.686 1.00 0.00 O ATOM 686 CB LEU A 47 -3.734 -8.262 2.234 1.00 0.00 C ATOM 687 CG LEU A 47 -3.574 -6.744 2.348 1.00 0.00 C ATOM 688 CD1 LEU A 47 -4.114 -6.041 1.101 1.00 0.00 C ATOM 689 CD2 LEU A 47 -4.225 -6.220 3.630 1.00 0.00 C ATOM 0 H LEU A 47 -1.414 -8.775 1.509 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.564 -8.514 3.968 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.613 -8.543 1.188 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.754 -8.522 2.518 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.510 -6.515 2.410 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.988 -4.964 1.208 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.567 -6.385 0.224 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -5.172 -6.273 0.982 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.097 -5.139 3.687 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.288 -6.460 3.623 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.754 -6.687 4.495 1.00 0.00 H new ATOM 701 N ILE A 48 -3.363 -11.397 2.631 1.00 0.00 N ATOM 702 CA ILE A 48 -3.895 -12.714 2.936 1.00 0.00 C ATOM 703 C ILE A 48 -3.064 -13.349 4.053 1.00 0.00 C ATOM 704 O ILE A 48 -3.587 -13.651 5.125 1.00 0.00 O ATOM 705 CB ILE A 48 -3.974 -13.566 1.667 1.00 0.00 C ATOM 706 CG1 ILE A 48 -4.757 -12.844 0.569 1.00 0.00 C ATOM 707 CG2 ILE A 48 -4.555 -14.949 1.971 1.00 0.00 C ATOM 708 CD1 ILE A 48 -4.469 -13.456 -0.803 1.00 0.00 C ATOM 0 H ILE A 48 -3.003 -11.291 1.682 1.00 0.00 H new ATOM 0 HA ILE A 48 -4.918 -12.636 3.305 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.961 -13.717 1.293 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.825 -12.903 0.780 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -4.491 -11.787 0.563 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.600 -15.534 1.053 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -3.920 -15.459 2.696 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.559 -14.840 2.382 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -5.038 -12.924 -1.565 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.404 -13.374 -1.022 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.759 -14.507 -0.801 1.00 0.00 H new ATOM 720 N SER A 49 -1.785 -13.534 3.763 1.00 0.00 N ATOM 721 CA SER A 49 -0.877 -14.127 4.730 1.00 0.00 C ATOM 722 C SER A 49 -0.949 -13.364 6.053 1.00 0.00 C ATOM 723 O SER A 49 -0.690 -13.928 7.115 1.00 0.00 O ATOM 724 CB SER A 49 0.559 -14.140 4.202 1.00 0.00 C ATOM 725 OG SER A 49 1.498 -14.491 5.215 1.00 0.00 O ATOM 0 H SER A 49 -1.356 -13.284 2.872 1.00 0.00 H new ATOM 0 HA SER A 49 -1.183 -15.160 4.897 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.635 -14.848 3.376 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.807 -13.157 3.803 1.00 0.00 H new ATOM 0 HG SER A 49 2.402 -14.489 4.837 1.00 0.00 H new ATOM 731 N SER A 50 -1.303 -12.091 5.947 1.00 0.00 N ATOM 732 CA SER A 50 -1.412 -11.244 7.123 1.00 0.00 C ATOM 733 C SER A 50 -2.683 -11.591 7.901 1.00 0.00 C ATOM 734 O SER A 50 -2.838 -11.190 9.054 1.00 0.00 O ATOM 735 CB SER A 50 -1.415 -9.764 6.736 1.00 0.00 C ATOM 736 OG SER A 50 -0.146 -9.338 6.246 1.00 0.00 O ATOM 0 H SER A 50 -1.518 -11.626 5.065 1.00 0.00 H new ATOM 0 HA SER A 50 -0.544 -11.425 7.757 1.00 0.00 H new ATOM 0 HB2 SER A 50 -2.175 -9.590 5.974 1.00 0.00 H new ATOM 0 HB3 SER A 50 -1.689 -9.163 7.603 1.00 0.00 H new ATOM 0 HG SER A 50 -0.224 -8.433 5.879 1.00 0.00 H new ATOM 742 N ASN A 51 -3.559 -12.334 7.241 1.00 0.00 N ATOM 743 CA ASN A 51 -4.811 -12.740 7.857 1.00 0.00 C ATOM 744 C ASN A 51 -5.819 -11.593 7.758 1.00 0.00 C ATOM 745 O ASN A 51 -6.796 -11.554 8.503 1.00 0.00 O ATOM 746 CB ASN A 51 -4.615 -13.070 9.338 1.00 0.00 C ATOM 747 CG ASN A 51 -5.722 -13.995 9.845 1.00 0.00 C ATOM 748 OD1 ASN A 51 -6.646 -13.585 10.528 1.00 0.00 O ATOM 749 ND2 ASN A 51 -5.580 -15.264 9.473 1.00 0.00 N ATOM 0 H ASN A 51 -3.427 -12.666 6.286 1.00 0.00 H new ATOM 0 HA ASN A 51 -5.172 -13.626 7.335 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -3.645 -13.545 9.483 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -4.610 -12.149 9.922 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -6.268 -15.960 9.760 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -4.783 -15.541 8.901 1.00 0.00 H new ATOM 756 N PHE A 52 -5.545 -10.686 6.831 1.00 0.00 N ATOM 757 CA PHE A 52 -6.416 -9.541 6.625 1.00 0.00 C ATOM 758 C PHE A 52 -7.392 -9.794 5.474 1.00 0.00 C ATOM 759 O PHE A 52 -8.366 -9.061 5.308 1.00 0.00 O ATOM 760 CB PHE A 52 -5.518 -8.355 6.264 1.00 0.00 C ATOM 761 CG PHE A 52 -4.566 -7.933 7.385 1.00 0.00 C ATOM 762 CD1 PHE A 52 -4.934 -8.087 8.685 1.00 0.00 C ATOM 763 CD2 PHE A 52 -3.351 -7.403 7.081 1.00 0.00 C ATOM 764 CE1 PHE A 52 -4.050 -7.695 9.725 1.00 0.00 C ATOM 765 CE2 PHE A 52 -2.467 -7.010 8.121 1.00 0.00 C ATOM 766 CZ PHE A 52 -2.836 -7.165 9.421 1.00 0.00 C ATOM 0 H PHE A 52 -4.733 -10.721 6.215 1.00 0.00 H new ATOM 0 HA PHE A 52 -6.999 -9.351 7.526 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -4.933 -8.611 5.381 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -6.146 -7.505 5.995 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -5.899 -8.508 8.927 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -3.058 -7.281 6.049 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.342 -7.818 10.757 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -1.502 -6.588 7.880 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.164 -6.867 10.212 1.00 0.00 H new ATOM 776 N ALA A 53 -7.097 -10.835 4.709 1.00 0.00 N ATOM 777 CA ALA A 53 -7.937 -11.194 3.579 1.00 0.00 C ATOM 778 C ALA A 53 -8.129 -12.712 3.554 1.00 0.00 C ATOM 779 O ALA A 53 -7.309 -13.454 4.093 1.00 0.00 O ATOM 780 CB ALA A 53 -7.310 -10.664 2.288 1.00 0.00 C ATOM 0 H ALA A 53 -6.289 -11.441 4.849 1.00 0.00 H new ATOM 0 HA ALA A 53 -8.923 -10.739 3.673 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -7.940 -10.933 1.440 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -7.222 -9.579 2.345 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -6.320 -11.102 2.158 1.00 0.00 H new ATOM 786 N ALA A 54 -9.216 -13.129 2.921 1.00 0.00 N ATOM 787 CA ALA A 54 -9.525 -14.545 2.819 1.00 0.00 C ATOM 788 C ALA A 54 -8.919 -15.103 1.529 1.00 0.00 C ATOM 789 O ALA A 54 -8.345 -16.191 1.529 1.00 0.00 O ATOM 790 CB ALA A 54 -11.041 -14.742 2.883 1.00 0.00 C ATOM 0 H ALA A 54 -9.893 -12.511 2.474 1.00 0.00 H new ATOM 0 HA ALA A 54 -9.089 -15.094 3.653 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -11.273 -15.804 2.806 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -11.419 -14.355 3.830 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.513 -14.207 2.059 1.00 0.00 H new ATOM 796 N SER A 55 -9.067 -14.333 0.462 1.00 0.00 N ATOM 797 CA SER A 55 -8.541 -14.736 -0.831 1.00 0.00 C ATOM 798 C SER A 55 -7.983 -13.520 -1.572 1.00 0.00 C ATOM 799 O SER A 55 -8.290 -12.381 -1.223 1.00 0.00 O ATOM 800 CB SER A 55 -9.618 -15.423 -1.674 1.00 0.00 C ATOM 801 OG SER A 55 -10.615 -14.506 -2.116 1.00 0.00 O ATOM 0 H SER A 55 -9.544 -13.431 0.466 1.00 0.00 H new ATOM 0 HA SER A 55 -7.736 -15.452 -0.664 1.00 0.00 H new ATOM 0 HB2 SER A 55 -9.154 -15.898 -2.538 1.00 0.00 H new ATOM 0 HB3 SER A 55 -10.087 -16.214 -1.089 1.00 0.00 H new ATOM 0 HG SER A 55 -11.283 -14.982 -2.652 1.00 0.00 H new ATOM 807 N ARG A 56 -7.174 -13.802 -2.583 1.00 0.00 N ATOM 808 CA ARG A 56 -6.570 -12.745 -3.376 1.00 0.00 C ATOM 809 C ARG A 56 -7.571 -11.608 -3.594 1.00 0.00 C ATOM 810 O ARG A 56 -7.189 -10.439 -3.630 1.00 0.00 O ATOM 811 CB ARG A 56 -6.106 -13.273 -4.735 1.00 0.00 C ATOM 812 CG ARG A 56 -4.580 -13.374 -4.791 1.00 0.00 C ATOM 813 CD ARG A 56 -4.133 -14.827 -4.965 1.00 0.00 C ATOM 814 NE ARG A 56 -3.683 -15.377 -3.667 1.00 0.00 N ATOM 815 CZ ARG A 56 -3.471 -16.680 -3.436 1.00 0.00 C ATOM 816 NH1 ARG A 56 -3.668 -17.574 -4.414 1.00 0.00 N ATOM 817 NH2 ARG A 56 -3.064 -17.089 -2.227 1.00 0.00 N ATOM 0 H ARG A 56 -6.923 -14.748 -2.871 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.704 -12.373 -2.828 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -6.546 -14.253 -4.918 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -6.460 -12.612 -5.526 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -4.202 -12.772 -5.617 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -4.151 -12.965 -3.876 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -4.956 -15.425 -5.357 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -3.324 -14.882 -5.693 1.00 0.00 H new ATOM 0 HE ARG A 56 -3.524 -14.723 -2.900 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -3.979 -17.263 -5.334 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -3.507 -18.566 -4.238 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -2.915 -16.409 -1.482 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -2.903 -18.081 -2.052 1.00 0.00 H new ATOM 831 N LEU A 57 -8.832 -11.990 -3.733 1.00 0.00 N ATOM 832 CA LEU A 57 -9.889 -11.017 -3.946 1.00 0.00 C ATOM 833 C LEU A 57 -9.958 -10.073 -2.743 1.00 0.00 C ATOM 834 O LEU A 57 -9.675 -8.883 -2.867 1.00 0.00 O ATOM 835 CB LEU A 57 -11.213 -11.722 -4.251 1.00 0.00 C ATOM 836 CG LEU A 57 -12.108 -11.047 -5.292 1.00 0.00 C ATOM 837 CD1 LEU A 57 -12.889 -9.886 -4.673 1.00 0.00 C ATOM 838 CD2 LEU A 57 -11.295 -10.604 -6.510 1.00 0.00 C ATOM 0 H LEU A 57 -9.145 -12.960 -3.702 1.00 0.00 H new ATOM 0 HA LEU A 57 -9.672 -10.404 -4.821 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -10.993 -12.734 -4.591 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -11.776 -11.814 -3.322 1.00 0.00 H new ATOM 0 HG LEU A 57 -12.838 -11.778 -5.640 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -13.517 -9.423 -5.434 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -13.516 -10.260 -3.863 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -12.191 -9.147 -4.280 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -11.955 -10.127 -7.234 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -10.528 -9.896 -6.197 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -10.822 -11.473 -6.967 1.00 0.00 H new ATOM 850 N GLU A 58 -10.336 -10.641 -1.607 1.00 0.00 N ATOM 851 CA GLU A 58 -10.445 -9.866 -0.383 1.00 0.00 C ATOM 852 C GLU A 58 -9.256 -8.913 -0.250 1.00 0.00 C ATOM 853 O GLU A 58 -9.429 -7.739 0.076 1.00 0.00 O ATOM 854 CB GLU A 58 -10.554 -10.781 0.838 1.00 0.00 C ATOM 855 CG GLU A 58 -11.924 -11.460 0.894 1.00 0.00 C ATOM 856 CD GLU A 58 -13.031 -10.500 0.454 1.00 0.00 C ATOM 857 OE1 GLU A 58 -13.559 -9.797 1.343 1.00 0.00 O ATOM 858 OE2 GLU A 58 -13.323 -10.490 -0.761 1.00 0.00 O ATOM 0 H GLU A 58 -10.571 -11.629 -1.509 1.00 0.00 H new ATOM 0 HA GLU A 58 -11.357 -9.272 -0.433 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.770 -11.538 0.801 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -10.394 -10.201 1.747 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -11.924 -12.340 0.251 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -12.121 -11.807 1.908 1.00 0.00 H new ATOM 865 N ALA A 59 -8.074 -9.453 -0.510 1.00 0.00 N ATOM 866 CA ALA A 59 -6.856 -8.665 -0.423 1.00 0.00 C ATOM 867 C ALA A 59 -6.924 -7.517 -1.432 1.00 0.00 C ATOM 868 O ALA A 59 -6.597 -6.377 -1.103 1.00 0.00 O ATOM 869 CB ALA A 59 -5.645 -9.571 -0.651 1.00 0.00 C ATOM 0 H ALA A 59 -7.934 -10.426 -0.781 1.00 0.00 H new ATOM 0 HA ALA A 59 -6.752 -8.226 0.569 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.731 -8.980 -0.586 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -5.627 -10.352 0.109 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -5.713 -10.027 -1.639 1.00 0.00 H new ATOM 875 N VAL A 60 -7.350 -7.856 -2.639 1.00 0.00 N ATOM 876 CA VAL A 60 -7.465 -6.868 -3.698 1.00 0.00 C ATOM 877 C VAL A 60 -8.380 -5.733 -3.233 1.00 0.00 C ATOM 878 O VAL A 60 -8.132 -4.567 -3.537 1.00 0.00 O ATOM 879 CB VAL A 60 -7.948 -7.536 -4.987 1.00 0.00 C ATOM 880 CG1 VAL A 60 -8.430 -6.492 -5.997 1.00 0.00 C ATOM 881 CG2 VAL A 60 -6.855 -8.419 -5.590 1.00 0.00 C ATOM 0 H VAL A 60 -7.620 -8.802 -2.908 1.00 0.00 H new ATOM 0 HA VAL A 60 -6.492 -6.431 -3.920 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.794 -8.176 -4.737 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -8.768 -6.993 -6.904 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.255 -5.924 -5.567 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -7.611 -5.815 -6.240 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.225 -8.882 -6.505 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -5.980 -7.810 -5.819 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.580 -9.196 -4.876 1.00 0.00 H new ATOM 891 N THR A 61 -9.418 -6.114 -2.504 1.00 0.00 N ATOM 892 CA THR A 61 -10.372 -5.143 -1.994 1.00 0.00 C ATOM 893 C THR A 61 -9.761 -4.355 -0.834 1.00 0.00 C ATOM 894 O THR A 61 -9.963 -3.146 -0.725 1.00 0.00 O ATOM 895 CB THR A 61 -11.651 -5.890 -1.614 1.00 0.00 C ATOM 896 OG1 THR A 61 -12.693 -5.120 -2.209 1.00 0.00 O ATOM 897 CG2 THR A 61 -11.946 -5.822 -0.115 1.00 0.00 C ATOM 0 H THR A 61 -9.620 -7.082 -2.254 1.00 0.00 H new ATOM 0 HA THR A 61 -10.625 -4.402 -2.752 1.00 0.00 H new ATOM 0 HB THR A 61 -11.566 -6.933 -1.920 1.00 0.00 H new ATOM 0 HG1 THR A 61 -13.559 -5.535 -2.013 1.00 0.00 H new ATOM 0 HG21 THR A 61 -12.864 -6.368 0.100 1.00 0.00 H new ATOM 0 HG22 THR A 61 -11.120 -6.268 0.439 1.00 0.00 H new ATOM 0 HG23 THR A 61 -12.064 -4.781 0.186 1.00 0.00 H new ATOM 905 N LEU A 62 -9.026 -5.071 0.004 1.00 0.00 N ATOM 906 CA LEU A 62 -8.385 -4.454 1.153 1.00 0.00 C ATOM 907 C LEU A 62 -7.336 -3.451 0.668 1.00 0.00 C ATOM 908 O LEU A 62 -7.141 -2.404 1.283 1.00 0.00 O ATOM 909 CB LEU A 62 -7.825 -5.523 2.093 1.00 0.00 C ATOM 910 CG LEU A 62 -8.689 -5.867 3.307 1.00 0.00 C ATOM 911 CD1 LEU A 62 -9.193 -7.310 3.231 1.00 0.00 C ATOM 912 CD2 LEU A 62 -7.938 -5.591 4.611 1.00 0.00 C ATOM 0 H LEU A 62 -8.860 -6.073 -0.090 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.113 -3.896 1.741 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.662 -6.435 1.518 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.849 -5.191 2.448 1.00 0.00 H new ATOM 0 HG LEU A 62 -9.565 -5.219 3.296 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -9.805 -7.528 4.106 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -9.791 -7.439 2.329 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.343 -7.991 3.203 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -8.575 -5.844 5.458 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.032 -6.196 4.644 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.671 -4.535 4.661 1.00 0.00 H new ATOM 924 N ALA A 63 -6.687 -3.807 -0.431 1.00 0.00 N ATOM 925 CA ALA A 63 -5.663 -2.952 -1.006 1.00 0.00 C ATOM 926 C ALA A 63 -6.301 -1.642 -1.473 1.00 0.00 C ATOM 927 O ALA A 63 -5.919 -0.565 -1.018 1.00 0.00 O ATOM 928 CB ALA A 63 -4.956 -3.694 -2.143 1.00 0.00 C ATOM 0 H ALA A 63 -6.851 -4.676 -0.939 1.00 0.00 H new ATOM 0 HA ALA A 63 -4.908 -2.704 -0.260 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -4.188 -3.052 -2.574 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -4.494 -4.601 -1.754 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.682 -3.958 -2.912 1.00 0.00 H new ATOM 934 N SER A 64 -7.263 -1.778 -2.374 1.00 0.00 N ATOM 935 CA SER A 64 -7.958 -0.618 -2.907 1.00 0.00 C ATOM 936 C SER A 64 -8.480 0.251 -1.761 1.00 0.00 C ATOM 937 O SER A 64 -8.501 1.477 -1.867 1.00 0.00 O ATOM 938 CB SER A 64 -9.110 -1.039 -3.822 1.00 0.00 C ATOM 939 OG SER A 64 -10.314 -1.266 -3.094 1.00 0.00 O ATOM 0 H SER A 64 -7.578 -2.673 -2.748 1.00 0.00 H new ATOM 0 HA SER A 64 -7.251 -0.038 -3.501 1.00 0.00 H new ATOM 0 HB2 SER A 64 -9.279 -0.265 -4.571 1.00 0.00 H new ATOM 0 HB3 SER A 64 -8.834 -1.947 -4.358 1.00 0.00 H new ATOM 0 HG SER A 64 -10.139 -1.890 -2.359 1.00 0.00 H new ATOM 945 N MET A 65 -8.889 -0.417 -0.693 1.00 0.00 N ATOM 946 CA MET A 65 -9.411 0.279 0.471 1.00 0.00 C ATOM 947 C MET A 65 -8.334 1.157 1.112 1.00 0.00 C ATOM 948 O MET A 65 -8.618 2.266 1.562 1.00 0.00 O ATOM 949 CB MET A 65 -9.914 -0.741 1.494 1.00 0.00 C ATOM 950 CG MET A 65 -11.302 -1.260 1.113 1.00 0.00 C ATOM 951 SD MET A 65 -12.433 -1.036 2.476 1.00 0.00 S ATOM 952 CE MET A 65 -11.936 -2.397 3.518 1.00 0.00 C ATOM 0 H MET A 65 -8.870 -1.433 -0.609 1.00 0.00 H new ATOM 0 HA MET A 65 -10.233 0.919 0.150 1.00 0.00 H new ATOM 0 HB2 MET A 65 -9.214 -1.575 1.556 1.00 0.00 H new ATOM 0 HB3 MET A 65 -9.952 -0.282 2.482 1.00 0.00 H new ATOM 0 HG2 MET A 65 -11.669 -0.730 0.234 1.00 0.00 H new ATOM 0 HG3 MET A 65 -11.244 -2.316 0.847 1.00 0.00 H new ATOM 0 HE1 MET A 65 -12.820 -2.935 3.859 1.00 0.00 H new ATOM 0 HE2 MET A 65 -11.295 -3.073 2.952 1.00 0.00 H new ATOM 0 HE3 MET A 65 -11.389 -2.015 4.380 1.00 0.00 H new ATOM 962 N LEU A 66 -7.120 0.627 1.135 1.00 0.00 N ATOM 963 CA LEU A 66 -5.999 1.348 1.714 1.00 0.00 C ATOM 964 C LEU A 66 -5.669 2.558 0.837 1.00 0.00 C ATOM 965 O LEU A 66 -5.482 3.663 1.343 1.00 0.00 O ATOM 966 CB LEU A 66 -4.813 0.407 1.935 1.00 0.00 C ATOM 967 CG LEU A 66 -5.074 -0.799 2.839 1.00 0.00 C ATOM 968 CD1 LEU A 66 -4.162 -1.970 2.467 1.00 0.00 C ATOM 969 CD2 LEU A 66 -4.943 -0.417 4.315 1.00 0.00 C ATOM 0 H LEU A 66 -6.888 -0.294 0.762 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.261 1.730 2.701 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.478 0.042 0.964 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.991 0.984 2.360 1.00 0.00 H new ATOM 0 HG LEU A 66 -6.101 -1.128 2.682 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.368 -2.815 3.125 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.348 -2.262 1.433 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.120 -1.669 2.578 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.133 -1.293 4.936 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.936 -0.048 4.507 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.667 0.362 4.555 1.00 0.00 H new ATOM 981 N MET A 67 -5.607 2.307 -0.463 1.00 0.00 N ATOM 982 CA MET A 67 -5.303 3.362 -1.415 1.00 0.00 C ATOM 983 C MET A 67 -6.256 4.547 -1.244 1.00 0.00 C ATOM 984 O MET A 67 -5.854 5.699 -1.399 1.00 0.00 O ATOM 985 CB MET A 67 -5.419 2.814 -2.838 1.00 0.00 C ATOM 986 CG MET A 67 -4.125 2.121 -3.267 1.00 0.00 C ATOM 987 SD MET A 67 -3.840 2.382 -5.010 1.00 0.00 S ATOM 988 CE MET A 67 -5.490 2.113 -5.637 1.00 0.00 C ATOM 0 H MET A 67 -5.762 1.389 -0.879 1.00 0.00 H new ATOM 0 HA MET A 67 -4.286 3.709 -1.232 1.00 0.00 H new ATOM 0 HB2 MET A 67 -6.249 2.109 -2.893 1.00 0.00 H new ATOM 0 HB3 MET A 67 -5.646 3.627 -3.527 1.00 0.00 H new ATOM 0 HG2 MET A 67 -3.286 2.511 -2.691 1.00 0.00 H new ATOM 0 HG3 MET A 67 -4.188 1.053 -3.056 1.00 0.00 H new ATOM 0 HE1 MET A 67 -5.435 1.764 -6.668 1.00 0.00 H new ATOM 0 HE2 MET A 67 -5.993 1.363 -5.027 1.00 0.00 H new ATOM 0 HE3 MET A 67 -6.050 3.047 -5.599 1.00 0.00 H new ATOM 998 N GLU A 68 -7.501 4.223 -0.925 1.00 0.00 N ATOM 999 CA GLU A 68 -8.514 5.246 -0.732 1.00 0.00 C ATOM 1000 C GLU A 68 -8.214 6.058 0.530 1.00 0.00 C ATOM 1001 O GLU A 68 -8.250 7.287 0.504 1.00 0.00 O ATOM 1002 CB GLU A 68 -9.912 4.627 -0.666 1.00 0.00 C ATOM 1003 CG GLU A 68 -10.649 4.794 -1.996 1.00 0.00 C ATOM 1004 CD GLU A 68 -11.873 5.699 -1.835 1.00 0.00 C ATOM 1005 OE1 GLU A 68 -12.454 5.676 -0.729 1.00 0.00 O ATOM 1006 OE2 GLU A 68 -12.199 6.392 -2.823 1.00 0.00 O ATOM 0 H GLU A 68 -7.831 3.266 -0.796 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.491 5.920 -1.588 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -9.833 3.568 -0.420 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.485 5.098 0.133 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -9.974 5.218 -2.739 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.960 3.818 -2.368 1.00 0.00 H new ATOM 1013 N GLU A 69 -7.925 5.338 1.604 1.00 0.00 N ATOM 1014 CA GLU A 69 -7.619 5.977 2.873 1.00 0.00 C ATOM 1015 C GLU A 69 -6.372 6.853 2.739 1.00 0.00 C ATOM 1016 O GLU A 69 -6.072 7.651 3.625 1.00 0.00 O ATOM 1017 CB GLU A 69 -7.442 4.937 3.981 1.00 0.00 C ATOM 1018 CG GLU A 69 -8.795 4.505 4.549 1.00 0.00 C ATOM 1019 CD GLU A 69 -9.078 5.203 5.882 1.00 0.00 C ATOM 1020 OE1 GLU A 69 -8.161 5.197 6.731 1.00 0.00 O ATOM 1021 OE2 GLU A 69 -10.204 5.726 6.020 1.00 0.00 O ATOM 0 H GLU A 69 -7.896 4.319 1.622 1.00 0.00 H new ATOM 0 HA GLU A 69 -8.459 6.615 3.149 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.914 4.068 3.588 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.825 5.351 4.778 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.585 4.741 3.836 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -8.806 3.424 4.691 1.00 0.00 H new ATOM 1028 N ASN A 70 -5.679 6.674 1.623 1.00 0.00 N ATOM 1029 CA ASN A 70 -4.471 7.439 1.362 1.00 0.00 C ATOM 1030 C ASN A 70 -3.281 6.750 2.033 1.00 0.00 C ATOM 1031 O ASN A 70 -2.396 7.414 2.568 1.00 0.00 O ATOM 1032 CB ASN A 70 -4.581 8.854 1.932 1.00 0.00 C ATOM 1033 CG ASN A 70 -3.741 9.840 1.118 1.00 0.00 C ATOM 1034 OD1 ASN A 70 -4.242 10.598 0.304 1.00 0.00 O ATOM 1035 ND2 ASN A 70 -2.439 9.788 1.383 1.00 0.00 N ATOM 0 H ASN A 70 -5.931 6.011 0.890 1.00 0.00 H new ATOM 0 HA ASN A 70 -4.334 7.495 0.282 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -5.624 9.171 1.930 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -4.249 8.858 2.970 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -1.794 10.407 0.892 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -2.086 9.129 2.077 1.00 0.00 H new ATOM 1042 N PHE A 71 -3.300 5.426 1.982 1.00 0.00 N ATOM 1043 CA PHE A 71 -2.233 4.639 2.578 1.00 0.00 C ATOM 1044 C PHE A 71 -1.297 4.081 1.504 1.00 0.00 C ATOM 1045 O PHE A 71 -0.124 3.824 1.771 1.00 0.00 O ATOM 1046 CB PHE A 71 -2.895 3.474 3.316 1.00 0.00 C ATOM 1047 CG PHE A 71 -3.647 3.887 4.583 1.00 0.00 C ATOM 1048 CD1 PHE A 71 -3.064 4.732 5.475 1.00 0.00 C ATOM 1049 CD2 PHE A 71 -4.898 3.408 4.818 1.00 0.00 C ATOM 1050 CE1 PHE A 71 -3.762 5.116 6.651 1.00 0.00 C ATOM 1051 CE2 PHE A 71 -5.596 3.791 5.994 1.00 0.00 C ATOM 1052 CZ PHE A 71 -5.014 4.637 6.885 1.00 0.00 C ATOM 0 H PHE A 71 -4.037 4.878 1.537 1.00 0.00 H new ATOM 0 HA PHE A 71 -1.642 5.262 3.249 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -3.590 2.976 2.639 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -2.130 2.744 3.581 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.070 5.111 5.289 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -5.361 2.736 4.110 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -3.299 5.788 7.359 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -6.589 3.410 6.181 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.545 4.929 7.779 1.00 0.00 H new ATOM 1062 N LEU A 72 -1.851 3.911 0.313 1.00 0.00 N ATOM 1063 CA LEU A 72 -1.080 3.388 -0.803 1.00 0.00 C ATOM 1064 C LEU A 72 -1.569 4.032 -2.101 1.00 0.00 C ATOM 1065 O LEU A 72 -2.600 4.704 -2.115 1.00 0.00 O ATOM 1066 CB LEU A 72 -1.130 1.859 -0.818 1.00 0.00 C ATOM 1067 CG LEU A 72 -2.301 1.218 -0.069 1.00 0.00 C ATOM 1068 CD1 LEU A 72 -2.942 0.106 -0.902 1.00 0.00 C ATOM 1069 CD2 LEU A 72 -1.863 0.721 1.310 1.00 0.00 C ATOM 0 H LEU A 72 -2.824 4.126 0.096 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.027 3.649 -0.695 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.163 1.527 -1.856 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.201 1.481 -0.391 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.063 1.981 0.090 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.771 -0.333 -0.347 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -3.312 0.521 -1.839 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.200 -0.664 -1.114 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.713 0.270 1.821 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -1.073 -0.021 1.195 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.490 1.560 1.897 1.00 0.00 H new ATOM 1081 N ARG A 73 -0.806 3.806 -3.161 1.00 0.00 N ATOM 1082 CA ARG A 73 -1.149 4.356 -4.461 1.00 0.00 C ATOM 1083 C ARG A 73 -0.918 3.313 -5.556 1.00 0.00 C ATOM 1084 O ARG A 73 -0.112 2.399 -5.388 1.00 0.00 O ATOM 1085 CB ARG A 73 -0.316 5.602 -4.769 1.00 0.00 C ATOM 1086 CG ARG A 73 0.131 6.295 -3.480 1.00 0.00 C ATOM 1087 CD ARG A 73 0.232 7.808 -3.678 1.00 0.00 C ATOM 1088 NE ARG A 73 1.523 8.303 -3.150 1.00 0.00 N ATOM 1089 CZ ARG A 73 1.926 9.579 -3.225 1.00 0.00 C ATOM 1090 NH1 ARG A 73 1.142 10.496 -3.807 1.00 0.00 N ATOM 1091 NH2 ARG A 73 3.114 9.937 -2.718 1.00 0.00 N ATOM 0 H ARG A 73 0.049 3.249 -3.145 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.203 4.634 -4.436 1.00 0.00 H new ATOM 0 HB2 ARG A 73 0.558 5.323 -5.358 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -0.901 6.294 -5.374 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -0.577 6.076 -2.681 1.00 0.00 H new ATOM 0 HG3 ARG A 73 1.098 5.900 -3.167 1.00 0.00 H new ATOM 0 HD2 ARG A 73 0.146 8.051 -4.737 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -0.593 8.306 -3.169 1.00 0.00 H new ATOM 0 HE ARG A 73 2.145 7.631 -2.701 1.00 0.00 H new ATOM 0 HH11 ARG A 73 0.238 10.223 -4.193 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.449 11.467 -3.864 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.711 9.238 -2.275 1.00 0.00 H new ATOM 0 HH22 ARG A 73 3.421 10.908 -2.775 1.00 0.00 H new ATOM 1105 N PRO A 74 -1.659 3.489 -6.683 1.00 0.00 N ATOM 1106 CA PRO A 74 -1.543 2.574 -7.806 1.00 0.00 C ATOM 1107 C PRO A 74 -0.245 2.817 -8.579 1.00 0.00 C ATOM 1108 O PRO A 74 0.120 2.028 -9.450 1.00 0.00 O ATOM 1109 CB PRO A 74 -2.787 2.819 -8.643 1.00 0.00 C ATOM 1110 CG PRO A 74 -3.319 4.176 -8.213 1.00 0.00 C ATOM 1111 CD PRO A 74 -2.623 4.560 -6.918 1.00 0.00 C ATOM 0 HA PRO A 74 -1.488 1.531 -7.495 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -2.549 2.812 -9.707 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -3.529 2.038 -8.477 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -3.129 4.922 -8.984 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -4.399 4.135 -8.068 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.127 5.527 -7.007 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.334 4.641 -6.095 1.00 0.00 H new ATOM 1119 N VAL A 75 0.417 3.911 -8.233 1.00 0.00 N ATOM 1120 CA VAL A 75 1.666 4.268 -8.884 1.00 0.00 C ATOM 1121 C VAL A 75 1.424 4.437 -10.385 1.00 0.00 C ATOM 1122 O VAL A 75 0.397 4.003 -10.904 1.00 0.00 O ATOM 1123 CB VAL A 75 2.739 3.224 -8.565 1.00 0.00 C ATOM 1124 CG1 VAL A 75 3.850 3.241 -9.617 1.00 0.00 C ATOM 1125 CG2 VAL A 75 3.310 3.436 -7.161 1.00 0.00 C ATOM 0 H VAL A 75 0.112 4.562 -7.510 1.00 0.00 H new ATOM 0 HA VAL A 75 2.035 5.221 -8.505 1.00 0.00 H new ATOM 0 HB VAL A 75 2.268 2.241 -8.590 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.599 2.490 -9.367 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.427 3.019 -10.597 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.316 4.226 -9.638 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.070 2.681 -6.960 1.00 0.00 H new ATOM 0 HG22 VAL A 75 3.757 4.428 -7.096 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.510 3.350 -6.426 1.00 0.00 H new ATOM 1135 N GLY A 76 2.388 5.069 -11.040 1.00 0.00 N ATOM 1136 CA GLY A 76 2.292 5.300 -12.471 1.00 0.00 C ATOM 1137 C GLY A 76 2.140 3.981 -13.231 1.00 0.00 C ATOM 1138 O GLY A 76 1.738 2.971 -12.655 1.00 0.00 O ATOM 0 H GLY A 76 3.238 5.428 -10.606 1.00 0.00 H new ATOM 0 HA2 GLY A 76 1.440 5.946 -12.682 1.00 0.00 H new ATOM 0 HA3 GLY A 76 3.182 5.824 -12.819 1.00 0.00 H new ATOM 1142 N VAL A 77 2.471 4.033 -14.513 1.00 0.00 N ATOM 1143 CA VAL A 77 2.377 2.854 -15.358 1.00 0.00 C ATOM 1144 C VAL A 77 1.107 2.078 -15.004 1.00 0.00 C ATOM 1145 O VAL A 77 0.111 2.668 -14.585 1.00 0.00 O ATOM 1146 CB VAL A 77 3.648 2.013 -15.226 1.00 0.00 C ATOM 1147 CG1 VAL A 77 4.897 2.867 -15.448 1.00 0.00 C ATOM 1148 CG2 VAL A 77 3.700 1.308 -13.869 1.00 0.00 C ATOM 0 H VAL A 77 2.804 4.872 -14.987 1.00 0.00 H new ATOM 0 HA VAL A 77 2.301 3.141 -16.407 1.00 0.00 H new ATOM 0 HB VAL A 77 3.624 1.247 -16.001 1.00 0.00 H new ATOM 0 HG11 VAL A 77 5.786 2.244 -15.348 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.868 3.301 -16.447 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.928 3.665 -14.707 1.00 0.00 H new ATOM 0 HG21 VAL A 77 4.613 0.717 -13.801 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.689 2.052 -13.072 1.00 0.00 H new ATOM 0 HG23 VAL A 77 2.835 0.653 -13.766 1.00 0.00 H new ATOM 1158 N ARG A 78 1.182 0.768 -15.185 1.00 0.00 N ATOM 1159 CA ARG A 78 0.050 -0.094 -14.890 1.00 0.00 C ATOM 1160 C ARG A 78 -0.662 0.379 -13.622 1.00 0.00 C ATOM 1161 O ARG A 78 -0.041 0.975 -12.743 1.00 0.00 O ATOM 1162 CB ARG A 78 0.498 -1.546 -14.704 1.00 0.00 C ATOM 1163 CG ARG A 78 1.039 -2.125 -16.013 1.00 0.00 C ATOM 1164 CD ARG A 78 -0.062 -2.854 -16.786 1.00 0.00 C ATOM 1165 NE ARG A 78 0.351 -3.047 -18.194 1.00 0.00 N ATOM 1166 CZ ARG A 78 -0.473 -3.452 -19.169 1.00 0.00 C ATOM 1167 NH1 ARG A 78 -1.760 -3.709 -18.896 1.00 0.00 N ATOM 1168 NH2 ARG A 78 -0.011 -3.600 -20.419 1.00 0.00 N ATOM 0 H ARG A 78 2.009 0.282 -15.532 1.00 0.00 H new ATOM 0 HA ARG A 78 -0.636 -0.042 -15.736 1.00 0.00 H new ATOM 0 HB2 ARG A 78 1.268 -1.597 -13.934 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -0.342 -2.148 -14.356 1.00 0.00 H new ATOM 0 HG2 ARG A 78 1.450 -1.324 -16.627 1.00 0.00 H new ATOM 0 HG3 ARG A 78 1.856 -2.814 -15.800 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -0.265 -3.819 -16.322 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -0.988 -2.280 -16.745 1.00 0.00 H new ATOM 0 HE ARG A 78 1.324 -2.860 -18.437 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -2.112 -3.596 -17.945 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -2.387 -4.017 -19.639 1.00 0.00 H new ATOM 0 HH21 ARG A 78 0.968 -3.404 -20.627 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -0.639 -3.908 -21.162 1.00 0.00 H new ATOM 1182 N SER A 79 -1.955 0.096 -13.566 1.00 0.00 N ATOM 1183 CA SER A 79 -2.758 0.486 -12.420 1.00 0.00 C ATOM 1184 C SER A 79 -2.759 2.009 -12.276 1.00 0.00 C ATOM 1185 O SER A 79 -1.816 2.586 -11.737 1.00 0.00 O ATOM 1186 CB SER A 79 -2.241 -0.168 -11.137 1.00 0.00 C ATOM 1187 OG SER A 79 -2.665 0.533 -9.972 1.00 0.00 O ATOM 0 H SER A 79 -2.467 -0.399 -14.296 1.00 0.00 H new ATOM 0 HA SER A 79 -3.779 0.142 -12.585 1.00 0.00 H new ATOM 0 HB2 SER A 79 -2.593 -1.198 -11.088 1.00 0.00 H new ATOM 0 HB3 SER A 79 -1.152 -0.204 -11.162 1.00 0.00 H new ATOM 0 HG SER A 79 -2.655 -0.074 -9.203 1.00 0.00 H new ATOM 1193 N MET A 80 -3.829 2.617 -12.766 1.00 0.00 N ATOM 1194 CA MET A 80 -3.966 4.062 -12.698 1.00 0.00 C ATOM 1195 C MET A 80 -5.033 4.559 -13.676 1.00 0.00 C ATOM 1196 O MET A 80 -4.848 5.580 -14.336 1.00 0.00 O ATOM 1197 CB MET A 80 -2.624 4.718 -13.030 1.00 0.00 C ATOM 1198 CG MET A 80 -2.009 5.367 -11.788 1.00 0.00 C ATOM 1199 SD MET A 80 -2.703 6.993 -11.541 1.00 0.00 S ATOM 1200 CE MET A 80 -2.181 7.301 -9.862 1.00 0.00 C ATOM 0 H MET A 80 -4.610 2.135 -13.212 1.00 0.00 H new ATOM 0 HA MET A 80 -4.273 4.332 -11.687 1.00 0.00 H new ATOM 0 HB2 MET A 80 -1.939 3.971 -13.431 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.765 5.470 -13.806 1.00 0.00 H new ATOM 0 HG2 MET A 80 -2.197 4.746 -10.912 1.00 0.00 H new ATOM 0 HG3 MET A 80 -0.927 5.438 -11.903 1.00 0.00 H new ATOM 0 HE1 MET A 80 -3.054 7.333 -9.210 1.00 0.00 H new ATOM 0 HE2 MET A 80 -1.513 6.503 -9.536 1.00 0.00 H new ATOM 0 HE3 MET A 80 -1.657 8.255 -9.813 1.00 0.00 H new ATOM 1210 N GLY A 81 -6.126 3.813 -13.738 1.00 0.00 N ATOM 1211 CA GLY A 81 -7.222 4.164 -14.625 1.00 0.00 C ATOM 1212 C GLY A 81 -8.016 5.350 -14.072 1.00 0.00 C ATOM 1213 O GLY A 81 -7.478 6.446 -13.924 1.00 0.00 O ATOM 0 H GLY A 81 -6.276 2.967 -13.188 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.831 4.412 -15.612 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -7.883 3.306 -14.750 1.00 0.00 H new ATOM 1217 N ALA A 82 -9.282 5.090 -13.782 1.00 0.00 N ATOM 1218 CA ALA A 82 -10.155 6.122 -13.248 1.00 0.00 C ATOM 1219 C ALA A 82 -10.181 6.023 -11.722 1.00 0.00 C ATOM 1220 O ALA A 82 -11.251 5.963 -11.119 1.00 0.00 O ATOM 1221 CB ALA A 82 -11.548 5.982 -13.866 1.00 0.00 C ATOM 0 H ALA A 82 -9.725 4.180 -13.907 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.782 7.113 -13.507 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -12.203 6.756 -13.466 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -11.478 6.090 -14.948 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -11.956 5.001 -13.625 1.00 0.00 H new ATOM 1227 N ILE A 83 -8.990 6.008 -11.141 1.00 0.00 N ATOM 1228 CA ILE A 83 -8.863 5.917 -9.697 1.00 0.00 C ATOM 1229 C ILE A 83 -9.106 7.296 -9.080 1.00 0.00 C ATOM 1230 O ILE A 83 -8.488 8.279 -9.486 1.00 0.00 O ATOM 1231 CB ILE A 83 -7.516 5.301 -9.315 1.00 0.00 C ATOM 1232 CG1 ILE A 83 -7.474 3.812 -9.665 1.00 0.00 C ATOM 1233 CG2 ILE A 83 -7.196 5.553 -7.840 1.00 0.00 C ATOM 1234 CD1 ILE A 83 -6.354 3.515 -10.664 1.00 0.00 C ATOM 0 H ILE A 83 -8.104 6.057 -11.645 1.00 0.00 H new ATOM 0 HA ILE A 83 -9.620 5.247 -9.290 1.00 0.00 H new ATOM 0 HB ILE A 83 -6.738 5.791 -9.901 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -7.323 3.226 -8.759 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -8.432 3.507 -10.086 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -6.233 5.105 -7.595 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.154 6.626 -7.655 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.972 5.108 -7.218 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -6.346 2.450 -10.896 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -6.522 4.084 -11.578 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -5.395 3.799 -10.231 1.00 0.00 H new ATOM 1246 N ARG A 84 -10.008 7.324 -8.109 1.00 0.00 N ATOM 1247 CA ARG A 84 -10.340 8.566 -7.433 1.00 0.00 C ATOM 1248 C ARG A 84 -10.775 8.286 -5.993 1.00 0.00 C ATOM 1249 O ARG A 84 -11.624 7.430 -5.753 1.00 0.00 O ATOM 1250 CB ARG A 84 -11.462 9.308 -8.162 1.00 0.00 C ATOM 1251 CG ARG A 84 -11.006 9.763 -9.550 1.00 0.00 C ATOM 1252 CD ARG A 84 -9.948 10.863 -9.447 1.00 0.00 C ATOM 1253 NE ARG A 84 -9.831 11.575 -10.739 1.00 0.00 N ATOM 1254 CZ ARG A 84 -8.840 12.426 -11.040 1.00 0.00 C ATOM 1255 NH1 ARG A 84 -7.875 12.675 -10.145 1.00 0.00 N ATOM 1256 NH2 ARG A 84 -8.814 13.027 -12.238 1.00 0.00 N ATOM 0 H ARG A 84 -10.519 6.507 -7.775 1.00 0.00 H new ATOM 0 HA ARG A 84 -9.447 9.192 -7.432 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -12.332 8.658 -8.256 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -11.772 10.173 -7.575 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -10.600 8.914 -10.100 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -11.862 10.129 -10.116 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -10.217 11.565 -8.658 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -8.986 10.429 -9.173 1.00 0.00 H new ATOM 0 HE ARG A 84 -10.549 11.408 -11.444 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -7.894 12.217 -9.234 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -7.121 13.323 -10.375 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -9.548 12.837 -12.920 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -8.060 13.675 -12.467 1.00 0.00 H new ATOM 1270 N SER A 85 -10.173 9.025 -5.072 1.00 0.00 N ATOM 1271 CA SER A 85 -10.488 8.867 -3.662 1.00 0.00 C ATOM 1272 C SER A 85 -11.902 9.380 -3.381 1.00 0.00 C ATOM 1273 O SER A 85 -12.083 10.320 -2.609 1.00 0.00 O ATOM 1274 CB SER A 85 -9.473 9.603 -2.786 1.00 0.00 C ATOM 1275 OG SER A 85 -8.144 9.134 -2.999 1.00 0.00 O ATOM 0 H SER A 85 -9.469 9.735 -5.275 1.00 0.00 H new ATOM 0 HA SER A 85 -10.438 7.806 -3.417 1.00 0.00 H new ATOM 0 HB2 SER A 85 -9.519 10.671 -2.998 1.00 0.00 H new ATOM 0 HB3 SER A 85 -9.739 9.474 -1.737 1.00 0.00 H new ATOM 0 HG SER A 85 -7.526 9.630 -2.423 1.00 0.00 H new ATOM 1281 N GLY A 86 -12.868 8.740 -4.024 1.00 0.00 N ATOM 1282 CA GLY A 86 -14.260 9.119 -3.853 1.00 0.00 C ATOM 1283 C GLY A 86 -15.139 7.888 -3.621 1.00 0.00 C ATOM 1284 O GLY A 86 -15.878 7.824 -2.640 1.00 0.00 O ATOM 0 H GLY A 86 -12.714 7.961 -4.664 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -14.354 9.802 -3.008 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -14.606 9.656 -4.736 1.00 0.00 H new ATOM 1288 N ASP A 87 -15.030 6.941 -4.541 1.00 0.00 N ATOM 1289 CA ASP A 87 -15.806 5.716 -4.450 1.00 0.00 C ATOM 1290 C ASP A 87 -14.890 4.569 -4.017 1.00 0.00 C ATOM 1291 O ASP A 87 -13.816 4.378 -4.585 1.00 0.00 O ATOM 1292 CB ASP A 87 -16.415 5.348 -5.804 1.00 0.00 C ATOM 1293 CG ASP A 87 -16.778 6.538 -6.695 1.00 0.00 C ATOM 1294 OD1 ASP A 87 -17.036 7.618 -6.122 1.00 0.00 O ATOM 1295 OD2 ASP A 87 -16.789 6.340 -7.929 1.00 0.00 O ATOM 0 H ASP A 87 -14.416 6.997 -5.353 1.00 0.00 H new ATOM 0 HA ASP A 87 -16.605 5.876 -3.726 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -15.711 4.713 -6.341 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -17.313 4.755 -5.632 1.00 0.00 H new ATOM 1300 N LEU A 88 -15.349 3.835 -3.014 1.00 0.00 N ATOM 1301 CA LEU A 88 -14.586 2.712 -2.497 1.00 0.00 C ATOM 1302 C LEU A 88 -14.140 1.825 -3.662 1.00 0.00 C ATOM 1303 O LEU A 88 -12.948 1.721 -3.947 1.00 0.00 O ATOM 1304 CB LEU A 88 -15.386 1.966 -1.428 1.00 0.00 C ATOM 1305 CG LEU A 88 -14.587 1.457 -0.226 1.00 0.00 C ATOM 1306 CD1 LEU A 88 -15.469 1.372 1.022 1.00 0.00 C ATOM 1307 CD2 LEU A 88 -13.913 0.120 -0.543 1.00 0.00 C ATOM 0 H LEU A 88 -16.240 3.996 -2.545 1.00 0.00 H new ATOM 0 HA LEU A 88 -13.683 3.063 -1.998 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -16.172 2.627 -1.063 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -15.878 1.115 -1.899 1.00 0.00 H new ATOM 0 HG LEU A 88 -13.795 2.175 -0.013 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -14.877 1.008 1.862 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -15.863 2.361 1.257 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -16.296 0.687 0.837 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.352 -0.220 0.327 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -14.673 -0.619 -0.796 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -13.234 0.246 -1.386 1.00 0.00 H new ATOM 1319 N ALA A 89 -15.121 1.209 -4.304 1.00 0.00 N ATOM 1320 CA ALA A 89 -14.845 0.335 -5.431 1.00 0.00 C ATOM 1321 C ALA A 89 -13.701 -0.613 -5.068 1.00 0.00 C ATOM 1322 O ALA A 89 -13.273 -0.662 -3.915 1.00 0.00 O ATOM 1323 CB ALA A 89 -14.533 1.179 -6.668 1.00 0.00 C ATOM 0 H ALA A 89 -16.109 1.298 -4.065 1.00 0.00 H new ATOM 0 HA ALA A 89 -15.717 -0.276 -5.665 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -14.326 0.523 -7.513 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -15.389 1.813 -6.901 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.662 1.804 -6.472 1.00 0.00 H new ATOM 1329 N GLU A 90 -13.236 -1.341 -6.072 1.00 0.00 N ATOM 1330 CA GLU A 90 -12.149 -2.285 -5.873 1.00 0.00 C ATOM 1331 C GLU A 90 -11.035 -2.034 -6.892 1.00 0.00 C ATOM 1332 O GLU A 90 -10.323 -2.960 -7.278 1.00 0.00 O ATOM 1333 CB GLU A 90 -12.653 -3.727 -5.954 1.00 0.00 C ATOM 1334 CG GLU A 90 -12.976 -4.114 -7.398 1.00 0.00 C ATOM 1335 CD GLU A 90 -13.479 -5.557 -7.480 1.00 0.00 C ATOM 1336 OE1 GLU A 90 -12.672 -6.458 -7.164 1.00 0.00 O ATOM 1337 OE2 GLU A 90 -14.659 -5.726 -7.856 1.00 0.00 O ATOM 0 H GLU A 90 -13.592 -1.296 -7.027 1.00 0.00 H new ATOM 0 HA GLU A 90 -11.741 -2.134 -4.874 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -11.898 -4.403 -5.553 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -13.543 -3.840 -5.335 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -13.732 -3.438 -7.799 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -12.086 -4.000 -8.017 1.00 0.00 H new ATOM 1344 N GLN A 91 -10.921 -0.779 -7.299 1.00 0.00 N ATOM 1345 CA GLN A 91 -9.906 -0.395 -8.265 1.00 0.00 C ATOM 1346 C GLN A 91 -8.525 -0.856 -7.796 1.00 0.00 C ATOM 1347 O GLN A 91 -7.823 -0.120 -7.103 1.00 0.00 O ATOM 1348 CB GLN A 91 -9.926 1.115 -8.512 1.00 0.00 C ATOM 1349 CG GLN A 91 -10.264 1.428 -9.971 1.00 0.00 C ATOM 1350 CD GLN A 91 -9.125 1.004 -10.900 1.00 0.00 C ATOM 1351 OE1 GLN A 91 -8.027 0.686 -10.474 1.00 0.00 O ATOM 1352 NE2 GLN A 91 -9.447 1.016 -12.191 1.00 0.00 N ATOM 0 H GLN A 91 -11.515 -0.015 -6.977 1.00 0.00 H new ATOM 0 HA GLN A 91 -10.129 -0.887 -9.212 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -10.659 1.585 -7.856 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -8.955 1.541 -8.261 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -11.181 0.911 -10.255 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -10.452 2.496 -10.084 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -10.385 1.293 -12.480 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -8.756 0.748 -12.892 1.00 0.00 H new ATOM 1361 N PHE A 92 -8.175 -2.071 -8.192 1.00 0.00 N ATOM 1362 CA PHE A 92 -6.890 -2.638 -7.821 1.00 0.00 C ATOM 1363 C PHE A 92 -6.710 -4.032 -8.425 1.00 0.00 C ATOM 1364 O PHE A 92 -7.529 -4.921 -8.198 1.00 0.00 O ATOM 1365 CB PHE A 92 -6.875 -2.751 -6.295 1.00 0.00 C ATOM 1366 CG PHE A 92 -5.486 -2.995 -5.702 1.00 0.00 C ATOM 1367 CD1 PHE A 92 -4.892 -4.211 -5.839 1.00 0.00 C ATOM 1368 CD2 PHE A 92 -4.845 -1.996 -5.038 1.00 0.00 C ATOM 1369 CE1 PHE A 92 -3.603 -4.437 -5.289 1.00 0.00 C ATOM 1370 CE2 PHE A 92 -3.555 -2.223 -4.488 1.00 0.00 C ATOM 1371 CZ PHE A 92 -2.962 -3.438 -4.625 1.00 0.00 C ATOM 0 H PHE A 92 -8.759 -2.679 -8.766 1.00 0.00 H new ATOM 0 HA PHE A 92 -6.084 -2.005 -8.191 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -7.285 -1.835 -5.869 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.535 -3.565 -5.995 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -5.401 -5.004 -6.366 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.317 -1.031 -4.929 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.131 -5.402 -5.398 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.046 -1.430 -3.961 1.00 0.00 H new ATOM 0 HZ PHE A 92 -1.981 -3.610 -4.206 1.00 0.00 H new ATOM 1381 N LEU A 93 -5.634 -4.178 -9.184 1.00 0.00 N ATOM 1382 CA LEU A 93 -5.337 -5.449 -9.824 1.00 0.00 C ATOM 1383 C LEU A 93 -4.392 -6.255 -8.931 1.00 0.00 C ATOM 1384 O LEU A 93 -3.742 -5.699 -8.047 1.00 0.00 O ATOM 1385 CB LEU A 93 -4.802 -5.224 -11.240 1.00 0.00 C ATOM 1386 CG LEU A 93 -5.801 -4.661 -12.252 1.00 0.00 C ATOM 1387 CD1 LEU A 93 -6.794 -3.715 -11.575 1.00 0.00 C ATOM 1388 CD2 LEU A 93 -5.078 -3.992 -13.422 1.00 0.00 C ATOM 0 H LEU A 93 -4.957 -3.438 -9.370 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.246 -6.038 -9.942 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.952 -4.545 -11.182 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -4.426 -6.174 -11.620 1.00 0.00 H new ATOM 0 HG LEU A 93 -6.376 -5.491 -12.662 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -7.493 -3.329 -12.317 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -7.344 -4.256 -10.805 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -6.253 -2.885 -11.120 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -5.811 -3.600 -14.127 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -4.461 -3.175 -13.049 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -4.446 -4.724 -13.925 1.00 0.00 H new ATOM 1400 N ASP A 94 -4.347 -7.554 -9.192 1.00 0.00 N ATOM 1401 CA ASP A 94 -3.492 -8.442 -8.423 1.00 0.00 C ATOM 1402 C ASP A 94 -2.542 -9.176 -9.371 1.00 0.00 C ATOM 1403 O ASP A 94 -2.757 -10.344 -9.690 1.00 0.00 O ATOM 1404 CB ASP A 94 -4.319 -9.491 -7.677 1.00 0.00 C ATOM 1405 CG ASP A 94 -3.546 -10.742 -7.253 1.00 0.00 C ATOM 1406 OD1 ASP A 94 -2.864 -10.661 -6.209 1.00 0.00 O ATOM 1407 OD2 ASP A 94 -3.656 -11.751 -7.983 1.00 0.00 O ATOM 0 H ASP A 94 -4.889 -8.012 -9.925 1.00 0.00 H new ATOM 0 HA ASP A 94 -2.939 -7.839 -7.703 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -4.748 -9.029 -6.788 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -5.151 -9.794 -8.312 1.00 0.00 H new ATOM 1412 N ASP A 95 -1.510 -8.460 -9.795 1.00 0.00 N ATOM 1413 CA ASP A 95 -0.526 -9.029 -10.700 1.00 0.00 C ATOM 1414 C ASP A 95 0.868 -8.543 -10.300 1.00 0.00 C ATOM 1415 O ASP A 95 1.027 -7.865 -9.286 1.00 0.00 O ATOM 1416 CB ASP A 95 -0.785 -8.589 -12.142 1.00 0.00 C ATOM 1417 CG ASP A 95 -1.208 -9.710 -13.094 1.00 0.00 C ATOM 1418 OD1 ASP A 95 -0.969 -10.882 -12.732 1.00 0.00 O ATOM 1419 OD2 ASP A 95 -1.761 -9.368 -14.162 1.00 0.00 O ATOM 0 H ASP A 95 -1.334 -7.491 -9.528 1.00 0.00 H new ATOM 0 HA ASP A 95 -0.597 -10.115 -10.637 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.561 -7.824 -12.139 1.00 0.00 H new ATOM 0 HB3 ASP A 95 0.120 -8.124 -12.532 1.00 0.00 H new ATOM 1424 N SER A 96 1.844 -8.908 -11.119 1.00 0.00 N ATOM 1425 CA SER A 96 3.221 -8.518 -10.863 1.00 0.00 C ATOM 1426 C SER A 96 3.473 -7.109 -11.403 1.00 0.00 C ATOM 1427 O SER A 96 4.208 -6.330 -10.796 1.00 0.00 O ATOM 1428 CB SER A 96 4.200 -9.510 -11.492 1.00 0.00 C ATOM 1429 OG SER A 96 3.900 -10.856 -11.133 1.00 0.00 O ATOM 0 H SER A 96 1.709 -9.469 -11.960 1.00 0.00 H new ATOM 0 HA SER A 96 3.384 -8.523 -9.785 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.171 -9.409 -12.577 1.00 0.00 H new ATOM 0 HB3 SER A 96 5.215 -9.268 -11.176 1.00 0.00 H new ATOM 0 HG SER A 96 4.546 -11.459 -11.556 1.00 0.00 H new ATOM 1435 N THR A 97 2.850 -6.823 -12.537 1.00 0.00 N ATOM 1436 CA THR A 97 2.999 -5.521 -13.165 1.00 0.00 C ATOM 1437 C THR A 97 2.453 -4.423 -12.250 1.00 0.00 C ATOM 1438 O THR A 97 3.215 -3.612 -11.726 1.00 0.00 O ATOM 1439 CB THR A 97 2.309 -5.573 -14.530 1.00 0.00 C ATOM 1440 OG1 THR A 97 1.048 -6.178 -14.259 1.00 0.00 O ATOM 1441 CG2 THR A 97 2.990 -6.548 -15.493 1.00 0.00 C ATOM 0 H THR A 97 2.241 -7.471 -13.037 1.00 0.00 H new ATOM 0 HA THR A 97 4.049 -5.276 -13.324 1.00 0.00 H new ATOM 0 HB THR A 97 2.299 -4.576 -14.969 1.00 0.00 H new ATOM 0 HG1 THR A 97 0.534 -6.249 -15.090 1.00 0.00 H new ATOM 0 HG21 THR A 97 2.461 -6.547 -16.446 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.024 -6.241 -15.651 1.00 0.00 H new ATOM 0 HG23 THR A 97 2.971 -7.552 -15.069 1.00 0.00 H new ATOM 1449 N ALA A 98 1.138 -4.432 -12.087 1.00 0.00 N ATOM 1450 CA ALA A 98 0.482 -3.446 -11.245 1.00 0.00 C ATOM 1451 C ALA A 98 1.340 -3.189 -10.005 1.00 0.00 C ATOM 1452 O ALA A 98 1.372 -4.007 -9.087 1.00 0.00 O ATOM 1453 CB ALA A 98 -0.924 -3.933 -10.890 1.00 0.00 C ATOM 0 H ALA A 98 0.509 -5.106 -12.524 1.00 0.00 H new ATOM 0 HA ALA A 98 0.375 -2.499 -11.774 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -1.416 -3.194 -10.258 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -1.502 -4.073 -11.803 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -0.857 -4.880 -10.355 1.00 0.00 H new ATOM 1459 N LEU A 99 2.015 -2.049 -10.018 1.00 0.00 N ATOM 1460 CA LEU A 99 2.871 -1.673 -8.906 1.00 0.00 C ATOM 1461 C LEU A 99 2.127 -0.684 -8.006 1.00 0.00 C ATOM 1462 O LEU A 99 1.439 0.210 -8.496 1.00 0.00 O ATOM 1463 CB LEU A 99 4.215 -1.149 -9.417 1.00 0.00 C ATOM 1464 CG LEU A 99 5.415 -2.078 -9.223 1.00 0.00 C ATOM 1465 CD1 LEU A 99 6.693 -1.443 -9.775 1.00 0.00 C ATOM 1466 CD2 LEU A 99 5.563 -2.484 -7.756 1.00 0.00 C ATOM 0 H LEU A 99 1.986 -1.373 -10.781 1.00 0.00 H new ATOM 0 HA LEU A 99 3.106 -2.545 -8.295 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.117 -0.932 -10.481 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.428 -0.204 -8.917 1.00 0.00 H new ATOM 0 HG LEU A 99 5.237 -2.991 -9.792 1.00 0.00 H new ATOM 0 HD11 LEU A 99 7.531 -2.123 -9.625 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.571 -1.247 -10.840 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.888 -0.506 -9.254 1.00 0.00 H new ATOM 0 HD21 LEU A 99 6.423 -3.144 -7.646 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.709 -1.593 -7.145 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.662 -3.004 -7.430 1.00 0.00 H new ATOM 1478 N TYR A 100 2.290 -0.879 -6.706 1.00 0.00 N ATOM 1479 CA TYR A 100 1.642 -0.015 -5.733 1.00 0.00 C ATOM 1480 C TYR A 100 2.651 0.512 -4.710 1.00 0.00 C ATOM 1481 O TYR A 100 3.555 -0.211 -4.295 1.00 0.00 O ATOM 1482 CB TYR A 100 0.613 -0.889 -5.013 1.00 0.00 C ATOM 1483 CG TYR A 100 -0.613 -1.234 -5.861 1.00 0.00 C ATOM 1484 CD1 TYR A 100 -1.627 -0.311 -6.015 1.00 0.00 C ATOM 1485 CD2 TYR A 100 -0.704 -2.468 -6.472 1.00 0.00 C ATOM 1486 CE1 TYR A 100 -2.781 -0.636 -6.814 1.00 0.00 C ATOM 1487 CE2 TYR A 100 -1.857 -2.793 -7.270 1.00 0.00 C ATOM 1488 CZ TYR A 100 -2.839 -1.861 -7.402 1.00 0.00 C ATOM 1489 OH TYR A 100 -3.928 -2.168 -8.156 1.00 0.00 O ATOM 0 H TYR A 100 2.861 -1.622 -6.303 1.00 0.00 H new ATOM 0 HA TYR A 100 1.189 0.846 -6.225 1.00 0.00 H new ATOM 0 HB2 TYR A 100 1.095 -1.814 -4.697 1.00 0.00 H new ATOM 0 HB3 TYR A 100 0.284 -0.376 -4.109 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -1.556 0.655 -5.537 1.00 0.00 H new ATOM 0 HD2 TYR A 100 0.090 -3.190 -6.351 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -3.582 0.077 -6.943 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -1.941 -3.755 -7.753 1.00 0.00 H new ATOM 0 HH TYR A 100 -4.460 -2.852 -7.699 1.00 0.00 H new ATOM 1499 N THR A 101 2.461 1.768 -4.333 1.00 0.00 N ATOM 1500 CA THR A 101 3.343 2.400 -3.367 1.00 0.00 C ATOM 1501 C THR A 101 2.536 2.953 -2.190 1.00 0.00 C ATOM 1502 O THR A 101 1.306 2.935 -2.213 1.00 0.00 O ATOM 1503 CB THR A 101 4.158 3.468 -4.099 1.00 0.00 C ATOM 1504 OG1 THR A 101 5.151 3.856 -3.153 1.00 0.00 O ATOM 1505 CG2 THR A 101 3.359 4.749 -4.347 1.00 0.00 C ATOM 0 H THR A 101 1.709 2.365 -4.679 1.00 0.00 H new ATOM 0 HA THR A 101 4.037 1.679 -2.935 1.00 0.00 H new ATOM 0 HB THR A 101 4.506 3.068 -5.051 1.00 0.00 H new ATOM 0 HG1 THR A 101 5.789 3.123 -3.029 1.00 0.00 H new ATOM 0 HG21 THR A 101 3.985 5.473 -4.869 1.00 0.00 H new ATOM 0 HG22 THR A 101 2.484 4.520 -4.955 1.00 0.00 H new ATOM 0 HG23 THR A 101 3.038 5.168 -3.393 1.00 0.00 H new ATOM 1513 N PHE A 102 3.261 3.432 -1.190 1.00 0.00 N ATOM 1514 CA PHE A 102 2.628 3.988 -0.007 1.00 0.00 C ATOM 1515 C PHE A 102 2.355 5.484 -0.183 1.00 0.00 C ATOM 1516 O PHE A 102 3.252 6.244 -0.544 1.00 0.00 O ATOM 1517 CB PHE A 102 3.603 3.794 1.156 1.00 0.00 C ATOM 1518 CG PHE A 102 3.657 2.361 1.690 1.00 0.00 C ATOM 1519 CD1 PHE A 102 2.509 1.650 1.846 1.00 0.00 C ATOM 1520 CD2 PHE A 102 4.854 1.798 2.007 1.00 0.00 C ATOM 1521 CE1 PHE A 102 2.559 0.320 2.342 1.00 0.00 C ATOM 1522 CE2 PHE A 102 4.904 0.468 2.503 1.00 0.00 C ATOM 1523 CZ PHE A 102 3.755 -0.243 2.659 1.00 0.00 C ATOM 0 H PHE A 102 4.281 3.446 -1.175 1.00 0.00 H new ATOM 0 HA PHE A 102 1.675 3.490 0.173 1.00 0.00 H new ATOM 0 HB2 PHE A 102 4.601 4.088 0.833 1.00 0.00 H new ATOM 0 HB3 PHE A 102 3.321 4.463 1.969 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.559 2.096 1.593 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.766 2.362 1.882 1.00 0.00 H new ATOM 0 HE1 PHE A 102 1.647 -0.244 2.467 1.00 0.00 H new ATOM 0 HE2 PHE A 102 5.854 0.021 2.756 1.00 0.00 H new ATOM 0 HZ PHE A 102 3.793 -1.255 3.035 1.00 0.00 H new ATOM 1533 N ALA A 103 1.113 5.861 0.080 1.00 0.00 N ATOM 1534 CA ALA A 103 0.710 7.252 -0.045 1.00 0.00 C ATOM 1535 C ALA A 103 1.333 8.062 1.093 1.00 0.00 C ATOM 1536 O ALA A 103 2.037 7.513 1.939 1.00 0.00 O ATOM 1537 CB ALA A 103 -0.817 7.342 -0.057 1.00 0.00 C ATOM 0 H ALA A 103 0.372 5.228 0.379 1.00 0.00 H new ATOM 0 HA ALA A 103 1.068 7.673 -0.984 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.119 8.385 -0.151 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.208 6.774 -0.901 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.213 6.932 0.872 1.00 0.00 H new ATOM 1543 N GLU A 104 1.051 9.357 1.078 1.00 0.00 N ATOM 1544 CA GLU A 104 1.575 10.249 2.098 1.00 0.00 C ATOM 1545 C GLU A 104 0.428 10.898 2.876 1.00 0.00 C ATOM 1546 O GLU A 104 -0.295 11.735 2.338 1.00 0.00 O ATOM 1547 CB GLU A 104 2.489 11.310 1.482 1.00 0.00 C ATOM 1548 CG GLU A 104 1.865 11.905 0.218 1.00 0.00 C ATOM 1549 CD GLU A 104 2.698 13.076 -0.305 1.00 0.00 C ATOM 1550 OE1 GLU A 104 2.472 14.200 0.193 1.00 0.00 O ATOM 1551 OE2 GLU A 104 3.542 12.821 -1.192 1.00 0.00 O ATOM 0 H GLU A 104 0.466 9.809 0.375 1.00 0.00 H new ATOM 0 HA GLU A 104 2.173 9.661 2.794 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.674 12.102 2.208 1.00 0.00 H new ATOM 0 HB3 GLU A 104 3.455 10.867 1.241 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.789 11.136 -0.551 1.00 0.00 H new ATOM 0 HG3 GLU A 104 0.851 12.243 0.433 1.00 0.00 H new ATOM 1558 N SER A 105 0.297 10.487 4.128 1.00 0.00 N ATOM 1559 CA SER A 105 -0.749 11.018 4.985 1.00 0.00 C ATOM 1560 C SER A 105 -0.551 10.526 6.420 1.00 0.00 C ATOM 1561 O SER A 105 -1.444 9.906 6.997 1.00 0.00 O ATOM 1562 CB SER A 105 -2.135 10.618 4.474 1.00 0.00 C ATOM 1563 OG SER A 105 -3.155 10.882 5.433 1.00 0.00 O ATOM 0 H SER A 105 0.898 9.792 4.570 1.00 0.00 H new ATOM 0 HA SER A 105 -0.685 12.106 4.969 1.00 0.00 H new ATOM 0 HB2 SER A 105 -2.353 11.161 3.554 1.00 0.00 H new ATOM 0 HB3 SER A 105 -2.137 9.557 4.225 1.00 0.00 H new ATOM 0 HG SER A 105 -3.011 10.324 6.226 1.00 0.00 H new ATOM 1569 N TYR A 106 0.625 10.820 6.955 1.00 0.00 N ATOM 1570 CA TYR A 106 0.951 10.415 8.312 1.00 0.00 C ATOM 1571 C TYR A 106 2.316 10.964 8.734 1.00 0.00 C ATOM 1572 O TYR A 106 2.994 11.623 7.948 1.00 0.00 O ATOM 1573 CB TYR A 106 1.013 8.886 8.293 1.00 0.00 C ATOM 1574 CG TYR A 106 1.949 8.315 7.225 1.00 0.00 C ATOM 1575 CD1 TYR A 106 3.314 8.486 7.341 1.00 0.00 C ATOM 1576 CD2 TYR A 106 1.428 7.629 6.147 1.00 0.00 C ATOM 1577 CE1 TYR A 106 4.194 7.948 6.337 1.00 0.00 C ATOM 1578 CE2 TYR A 106 2.309 7.092 5.142 1.00 0.00 C ATOM 1579 CZ TYR A 106 3.648 7.278 5.287 1.00 0.00 C ATOM 1580 OH TYR A 106 4.480 6.770 4.338 1.00 0.00 O ATOM 0 H TYR A 106 1.363 11.333 6.474 1.00 0.00 H new ATOM 0 HA TYR A 106 0.209 10.794 9.015 1.00 0.00 H new ATOM 0 HB2 TYR A 106 1.337 8.533 9.272 1.00 0.00 H new ATOM 0 HB3 TYR A 106 0.009 8.494 8.129 1.00 0.00 H new ATOM 0 HD1 TYR A 106 3.721 9.023 8.185 1.00 0.00 H new ATOM 0 HD2 TYR A 106 0.360 7.495 6.057 1.00 0.00 H new ATOM 0 HE1 TYR A 106 5.264 8.074 6.416 1.00 0.00 H new ATOM 0 HE2 TYR A 106 1.915 6.554 4.293 1.00 0.00 H new ATOM 0 HH TYR A 106 3.952 6.316 3.649 1.00 0.00 H new ATOM 1590 N LYS A 107 2.677 10.671 9.975 1.00 0.00 N ATOM 1591 CA LYS A 107 3.948 11.127 10.511 1.00 0.00 C ATOM 1592 C LYS A 107 5.043 10.921 9.462 1.00 0.00 C ATOM 1593 O LYS A 107 5.564 9.816 9.312 1.00 0.00 O ATOM 1594 CB LYS A 107 4.242 10.444 11.849 1.00 0.00 C ATOM 1595 CG LYS A 107 3.556 11.179 13.002 1.00 0.00 C ATOM 1596 CD LYS A 107 4.579 11.921 13.865 1.00 0.00 C ATOM 1597 CE LYS A 107 3.901 12.597 15.058 1.00 0.00 C ATOM 1598 NZ LYS A 107 4.894 12.906 16.111 1.00 0.00 N ATOM 0 H LYS A 107 2.112 10.124 10.624 1.00 0.00 H new ATOM 0 HA LYS A 107 3.909 12.195 10.726 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.899 9.410 11.817 1.00 0.00 H new ATOM 0 HB3 LYS A 107 5.318 10.417 12.019 1.00 0.00 H new ATOM 0 HG2 LYS A 107 2.828 11.887 12.605 1.00 0.00 H new ATOM 0 HG3 LYS A 107 3.006 10.466 13.616 1.00 0.00 H new ATOM 0 HD2 LYS A 107 5.336 11.222 14.220 1.00 0.00 H new ATOM 0 HD3 LYS A 107 5.094 12.669 13.263 1.00 0.00 H new ATOM 0 HE2 LYS A 107 3.409 13.514 14.733 1.00 0.00 H new ATOM 0 HE3 LYS A 107 3.126 11.945 15.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 4.418 13.365 16.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 5.344 12.025 16.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 5.619 13.546 15.728 1.00 0.00 H new ATOM 1612 N LYS A 108 5.359 12.001 8.763 1.00 0.00 N ATOM 1613 CA LYS A 108 6.383 11.952 7.733 1.00 0.00 C ATOM 1614 C LYS A 108 6.695 13.374 7.262 1.00 0.00 C ATOM 1615 O LYS A 108 5.800 14.214 7.178 1.00 0.00 O ATOM 1616 CB LYS A 108 5.961 11.009 6.604 1.00 0.00 C ATOM 1617 CG LYS A 108 7.099 10.813 5.600 1.00 0.00 C ATOM 1618 CD LYS A 108 6.594 10.959 4.163 1.00 0.00 C ATOM 1619 CE LYS A 108 7.681 10.575 3.157 1.00 0.00 C ATOM 1620 NZ LYS A 108 7.487 11.300 1.882 1.00 0.00 N ATOM 0 H LYS A 108 4.924 12.915 8.889 1.00 0.00 H new ATOM 0 HA LYS A 108 7.308 11.539 8.134 1.00 0.00 H new ATOM 0 HB2 LYS A 108 5.669 10.045 7.020 1.00 0.00 H new ATOM 0 HB3 LYS A 108 5.087 11.414 6.094 1.00 0.00 H new ATOM 0 HG2 LYS A 108 7.885 11.544 5.789 1.00 0.00 H new ATOM 0 HG3 LYS A 108 7.542 9.826 5.735 1.00 0.00 H new ATOM 0 HD2 LYS A 108 5.718 10.327 4.016 1.00 0.00 H new ATOM 0 HD3 LYS A 108 6.278 11.987 3.988 1.00 0.00 H new ATOM 0 HE2 LYS A 108 8.663 10.807 3.568 1.00 0.00 H new ATOM 0 HE3 LYS A 108 7.656 9.500 2.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 7.519 10.626 1.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 6.564 11.779 1.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 8.242 12.006 1.766 1.00 0.00 H new ATOM 1634 N LYS A 109 7.966 13.600 6.968 1.00 0.00 N ATOM 1635 CA LYS A 109 8.408 14.906 6.508 1.00 0.00 C ATOM 1636 C LYS A 109 7.833 15.172 5.115 1.00 0.00 C ATOM 1637 O LYS A 109 7.145 14.323 4.551 1.00 0.00 O ATOM 1638 CB LYS A 109 9.933 15.010 6.574 1.00 0.00 C ATOM 1639 CG LYS A 109 10.594 13.875 5.789 1.00 0.00 C ATOM 1640 CD LYS A 109 12.000 14.270 5.333 1.00 0.00 C ATOM 1641 CE LYS A 109 11.941 15.215 4.131 1.00 0.00 C ATOM 1642 NZ LYS A 109 13.247 15.250 3.436 1.00 0.00 N ATOM 0 H LYS A 109 8.705 12.901 7.039 1.00 0.00 H new ATOM 0 HA LYS A 109 8.030 15.689 7.165 1.00 0.00 H new ATOM 0 HB2 LYS A 109 10.253 15.971 6.171 1.00 0.00 H new ATOM 0 HB3 LYS A 109 10.259 14.976 7.614 1.00 0.00 H new ATOM 0 HG2 LYS A 109 10.647 12.981 6.410 1.00 0.00 H new ATOM 0 HG3 LYS A 109 9.983 13.624 4.922 1.00 0.00 H new ATOM 0 HD2 LYS A 109 12.530 14.753 6.154 1.00 0.00 H new ATOM 0 HD3 LYS A 109 12.566 13.376 5.070 1.00 0.00 H new ATOM 0 HE2 LYS A 109 11.164 14.887 3.441 1.00 0.00 H new ATOM 0 HE3 LYS A 109 11.671 16.218 4.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 13.190 15.896 2.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 13.981 15.584 4.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 13.489 14.295 3.103 1.00 0.00 H new ATOM 1656 N VAL A 110 8.135 16.355 4.602 1.00 0.00 N ATOM 1657 CA VAL A 110 7.657 16.744 3.286 1.00 0.00 C ATOM 1658 C VAL A 110 6.202 16.301 3.125 1.00 0.00 C ATOM 1659 O VAL A 110 5.813 15.806 2.068 1.00 0.00 O ATOM 1660 CB VAL A 110 8.578 16.175 2.205 1.00 0.00 C ATOM 1661 CG1 VAL A 110 8.548 14.646 2.208 1.00 0.00 C ATOM 1662 CG2 VAL A 110 8.213 16.729 0.826 1.00 0.00 C ATOM 0 H VAL A 110 8.705 17.057 5.074 1.00 0.00 H new ATOM 0 HA VAL A 110 7.681 17.828 3.177 1.00 0.00 H new ATOM 0 HB VAL A 110 9.596 16.490 2.433 1.00 0.00 H new ATOM 0 HG11 VAL A 110 9.211 14.268 1.430 1.00 0.00 H new ATOM 0 HG12 VAL A 110 8.880 14.277 3.179 1.00 0.00 H new ATOM 0 HG13 VAL A 110 7.532 14.302 2.017 1.00 0.00 H new ATOM 0 HG21 VAL A 110 8.883 16.309 0.076 1.00 0.00 H new ATOM 0 HG22 VAL A 110 7.185 16.459 0.586 1.00 0.00 H new ATOM 0 HG23 VAL A 110 8.311 17.815 0.832 1.00 0.00 H new ATOM 1672 N SER A 111 5.437 16.494 4.190 1.00 0.00 N ATOM 1673 CA SER A 111 4.033 16.119 4.180 1.00 0.00 C ATOM 1674 C SER A 111 3.237 17.047 5.100 1.00 0.00 C ATOM 1675 O SER A 111 3.642 17.298 6.235 1.00 0.00 O ATOM 1676 CB SER A 111 3.848 14.662 4.607 1.00 0.00 C ATOM 1677 OG SER A 111 2.568 14.156 4.239 1.00 0.00 O ATOM 0 H SER A 111 5.763 16.905 5.065 1.00 0.00 H new ATOM 0 HA SER A 111 3.660 16.220 3.161 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.625 14.049 4.150 1.00 0.00 H new ATOM 0 HB3 SER A 111 3.973 14.582 5.687 1.00 0.00 H new ATOM 0 HG SER A 111 2.490 13.223 4.528 1.00 0.00 H new ATOM 1683 N SER A 112 2.121 17.532 4.577 1.00 0.00 N ATOM 1684 CA SER A 112 1.265 18.427 5.338 1.00 0.00 C ATOM 1685 C SER A 112 0.004 18.753 4.535 1.00 0.00 C ATOM 1686 O SER A 112 -0.060 18.485 3.337 1.00 0.00 O ATOM 1687 CB SER A 112 2.005 19.713 5.710 1.00 0.00 C ATOM 1688 OG SER A 112 2.013 20.653 4.639 1.00 0.00 O ATOM 0 H SER A 112 1.789 17.322 3.635 1.00 0.00 H new ATOM 0 HA SER A 112 0.980 17.924 6.262 1.00 0.00 H new ATOM 0 HB2 SER A 112 1.533 20.163 6.584 1.00 0.00 H new ATOM 0 HB3 SER A 112 3.031 19.473 5.990 1.00 0.00 H new ATOM 0 HG SER A 112 2.493 21.461 4.916 1.00 0.00 H new ATOM 1694 N LYS A 113 -0.968 19.328 5.229 1.00 0.00 N ATOM 1695 CA LYS A 113 -2.224 19.693 4.596 1.00 0.00 C ATOM 1696 C LYS A 113 -3.008 18.424 4.256 1.00 0.00 C ATOM 1697 O LYS A 113 -2.588 17.639 3.407 1.00 0.00 O ATOM 1698 CB LYS A 113 -1.971 20.601 3.390 1.00 0.00 C ATOM 1699 CG LYS A 113 -3.249 21.336 2.981 1.00 0.00 C ATOM 1700 CD LYS A 113 -3.151 22.828 3.307 1.00 0.00 C ATOM 1701 CE LYS A 113 -4.277 23.258 4.250 1.00 0.00 C ATOM 1702 NZ LYS A 113 -5.421 23.795 3.481 1.00 0.00 N ATOM 0 H LYS A 113 -0.911 19.550 6.223 1.00 0.00 H new ATOM 0 HA LYS A 113 -2.841 20.274 5.281 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -1.192 21.324 3.632 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -1.605 20.007 2.553 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -3.423 21.204 1.913 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -4.104 20.902 3.499 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -2.186 23.041 3.766 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -3.201 23.409 2.386 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -4.602 22.408 4.850 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -3.910 24.015 4.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -6.176 24.082 4.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -5.111 24.619 2.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -5.781 23.062 2.837 1.00 0.00 H new ATOM 1716 N GLU A 114 -4.132 18.262 4.937 1.00 0.00 N ATOM 1717 CA GLU A 114 -4.979 17.101 4.719 1.00 0.00 C ATOM 1718 C GLU A 114 -6.275 17.230 5.522 1.00 0.00 C ATOM 1719 O GLU A 114 -6.273 17.772 6.626 1.00 0.00 O ATOM 1720 CB GLU A 114 -4.240 15.809 5.074 1.00 0.00 C ATOM 1721 CG GLU A 114 -4.939 14.592 4.464 1.00 0.00 C ATOM 1722 CD GLU A 114 -4.458 14.344 3.033 1.00 0.00 C ATOM 1723 OE1 GLU A 114 -3.223 14.346 2.841 1.00 0.00 O ATOM 1724 OE2 GLU A 114 -5.336 14.159 2.163 1.00 0.00 O ATOM 0 H GLU A 114 -4.477 18.915 5.641 1.00 0.00 H new ATOM 0 HA GLU A 114 -5.234 17.056 3.660 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -3.213 15.862 4.712 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -4.191 15.700 6.157 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -4.743 13.711 5.075 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -6.018 14.748 4.467 1.00 0.00 H new ATOM 1731 N SER A 115 -7.349 16.723 4.936 1.00 0.00 N ATOM 1732 CA SER A 115 -8.649 16.775 5.583 1.00 0.00 C ATOM 1733 C SER A 115 -8.600 16.025 6.916 1.00 0.00 C ATOM 1734 O SER A 115 -7.645 15.301 7.190 1.00 0.00 O ATOM 1735 CB SER A 115 -9.737 16.186 4.683 1.00 0.00 C ATOM 1736 OG SER A 115 -9.418 14.865 4.255 1.00 0.00 O ATOM 0 H SER A 115 -7.346 16.274 4.020 1.00 0.00 H new ATOM 0 HA SER A 115 -8.896 17.820 5.769 1.00 0.00 H new ATOM 0 HB2 SER A 115 -10.685 16.174 5.221 1.00 0.00 H new ATOM 0 HB3 SER A 115 -9.873 16.827 3.812 1.00 0.00 H new ATOM 0 HG SER A 115 -10.138 14.523 3.684 1.00 0.00 H new ATOM 1742 N GLY A 116 -9.643 16.225 7.709 1.00 0.00 N ATOM 1743 CA GLY A 116 -9.731 15.577 9.007 1.00 0.00 C ATOM 1744 C GLY A 116 -11.128 15.742 9.609 1.00 0.00 C ATOM 1745 O GLY A 116 -11.569 16.862 9.864 1.00 0.00 O ATOM 0 H GLY A 116 -10.434 16.826 7.478 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.498 14.517 8.905 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.988 16.003 9.681 1.00 0.00 H new ATOM 1749 N PRO A 117 -11.802 14.581 9.824 1.00 0.00 N ATOM 1750 CA PRO A 117 -13.140 14.587 10.391 1.00 0.00 C ATOM 1751 C PRO A 117 -13.098 14.881 11.892 1.00 0.00 C ATOM 1752 O PRO A 117 -12.024 15.075 12.460 1.00 0.00 O ATOM 1753 CB PRO A 117 -13.709 13.214 10.071 1.00 0.00 C ATOM 1754 CG PRO A 117 -12.513 12.332 9.749 1.00 0.00 C ATOM 1755 CD PRO A 117 -11.311 13.237 9.534 1.00 0.00 C ATOM 0 HA PRO A 117 -13.770 15.372 9.973 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -14.271 12.817 10.917 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -14.397 13.263 9.227 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -12.324 11.633 10.564 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -12.707 11.737 8.857 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -10.488 12.965 10.194 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -10.938 13.164 8.513 1.00 0.00 H new ATOM 1763 N SER A 118 -14.279 14.904 12.492 1.00 0.00 N ATOM 1764 CA SER A 118 -14.391 15.171 13.915 1.00 0.00 C ATOM 1765 C SER A 118 -15.803 14.840 14.401 1.00 0.00 C ATOM 1766 O SER A 118 -16.686 14.543 13.597 1.00 0.00 O ATOM 1767 CB SER A 118 -14.049 16.629 14.231 1.00 0.00 C ATOM 1768 OG SER A 118 -13.198 16.744 15.368 1.00 0.00 O ATOM 0 H SER A 118 -15.167 14.742 12.018 1.00 0.00 H new ATOM 0 HA SER A 118 -13.676 14.537 14.439 1.00 0.00 H new ATOM 0 HB2 SER A 118 -13.563 17.083 13.367 1.00 0.00 H new ATOM 0 HB3 SER A 118 -14.969 17.187 14.409 1.00 0.00 H new ATOM 0 HG SER A 118 -13.002 17.689 15.535 1.00 0.00 H new ATOM 1774 N SER A 119 -15.973 14.902 15.713 1.00 0.00 N ATOM 1775 CA SER A 119 -17.264 14.612 16.315 1.00 0.00 C ATOM 1776 C SER A 119 -17.635 13.147 16.078 1.00 0.00 C ATOM 1777 O SER A 119 -17.179 12.536 15.112 1.00 0.00 O ATOM 1778 CB SER A 119 -18.351 15.532 15.757 1.00 0.00 C ATOM 1779 OG SER A 119 -18.555 16.678 16.579 1.00 0.00 O ATOM 0 H SER A 119 -15.239 15.149 16.377 1.00 0.00 H new ATOM 0 HA SER A 119 -17.189 14.792 17.387 1.00 0.00 H new ATOM 0 HB2 SER A 119 -18.075 15.851 14.752 1.00 0.00 H new ATOM 0 HB3 SER A 119 -19.285 14.978 15.670 1.00 0.00 H new ATOM 0 HG SER A 119 -19.255 17.241 16.188 1.00 0.00 H new ATOM 1785 N GLY A 120 -18.458 12.625 16.975 1.00 0.00 N ATOM 1786 CA GLY A 120 -18.895 11.243 16.876 1.00 0.00 C ATOM 1787 C GLY A 120 -17.738 10.281 17.148 1.00 0.00 C ATOM 1788 O GLY A 120 -16.611 10.711 17.386 1.00 0.00 O ATOM 0 H GLY A 120 -18.834 13.135 17.774 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -19.699 11.060 17.588 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -19.301 11.057 15.882 1.00 0.00 H new TER 1792 GLY A 120