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 148:sc= -0.498 USER MOD Set 1.2: A 100 TYR OH : rot 120:sc= -2.25 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (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 -140:sc=-0.00117 USER MOD Single : A 6 SER OG : rot -77:sc= 0.262 USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 148:sc= 0 (180deg=-1.01) USER MOD Single : A 15 MET CE :methyl -151:sc= -4.54! (180deg=-5.45!) USER MOD Single : A 16 HIS :FLIP no HE2:sc= -6.72! C(o=-7.6!,f=-6.7!) 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= 0.0266 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -0.461 K(o=-0.46,f=-4.5!) USER MOD Single : A 28 MET CE :methyl 161:sc= -0.173 (180deg=-0.386) USER MOD Single : A 30 GLN : amide:sc= -0.0589 X(o=-0.059,f=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 167:sc= -0.245 (180deg=-0.449) USER MOD Single : A 37 THR OG1 : rot 120:sc= -0.164 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 159:sc= 0.739 USER MOD Single : A 51 ASN : amide:sc= -0.114 X(o=-0.11,f=-0.41) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.266 USER MOD Single : A 64 SER OG : rot -50:sc= 0.611 USER MOD Single : A 65 MET CE :methyl -111:sc=-0.00512 (180deg=-0.669) USER MOD Single : A 67 MET CE :methyl -171:sc= -0.571 (180deg=-0.844) USER MOD Single : A 70 ASN : amide:sc= -0.182 K(o=-0.18,f=-1.5!) USER MOD Single : A 80 MET CE :methyl 161:sc= -2.59 (180deg=-3.59!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -0.673 X(o=-0.67,f=-0.56) USER MOD Single : A 96 SER OG : rot 66:sc= 0.463 USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.147 USER MOD Single : A 101 THR OG1 : rot 92:sc= 0.683 USER MOD Single : A 105 SER OG : rot 180:sc= -0.355 USER MOD Single : A 106 TYR OH : rot -126:sc= 1.24 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 150: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 -12.168 8.707 13.671 1.00 0.00 N ATOM 2 CA GLY A 1 -11.978 9.090 12.283 1.00 0.00 C ATOM 3 C GLY A 1 -13.128 8.582 11.411 1.00 0.00 C ATOM 4 O GLY A 1 -12.907 7.835 10.459 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.375 9.064 14.241 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.058 9.113 14.024 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.207 7.670 13.743 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -11.912 10.175 12.207 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.034 8.687 11.917 1.00 0.00 H new ATOM 8 N SER A 2 -14.331 9.007 11.768 1.00 0.00 N ATOM 9 CA SER A 2 -15.516 8.604 11.030 1.00 0.00 C ATOM 10 C SER A 2 -15.678 7.084 11.089 1.00 0.00 C ATOM 11 O SER A 2 -14.767 6.375 11.513 1.00 0.00 O ATOM 12 CB SER A 2 -15.446 9.074 9.575 1.00 0.00 C ATOM 13 OG SER A 2 -16.088 10.333 9.389 1.00 0.00 O ATOM 0 H SER A 2 -14.511 9.626 12.558 1.00 0.00 H new ATOM 0 HA SER A 2 -16.383 9.074 11.494 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.403 9.150 9.268 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.914 8.330 8.931 1.00 0.00 H new ATOM 0 HG SER A 2 -16.020 10.599 8.448 1.00 0.00 H new ATOM 19 N SER A 3 -16.845 6.628 10.659 1.00 0.00 N ATOM 20 CA SER A 3 -17.139 5.205 10.658 1.00 0.00 C ATOM 21 C SER A 3 -16.493 4.539 9.442 1.00 0.00 C ATOM 22 O SER A 3 -15.962 5.219 8.565 1.00 0.00 O ATOM 23 CB SER A 3 -18.648 4.954 10.662 1.00 0.00 C ATOM 24 OG SER A 3 -19.228 5.208 11.939 1.00 0.00 O ATOM 0 H SER A 3 -17.599 7.219 10.309 1.00 0.00 H new ATOM 0 HA SER A 3 -16.724 4.769 11.567 1.00 0.00 H new ATOM 0 HB2 SER A 3 -19.123 5.590 9.915 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.845 3.921 10.373 1.00 0.00 H new ATOM 0 HG SER A 3 -20.192 5.038 11.900 1.00 0.00 H new ATOM 30 N GLY A 4 -16.560 3.216 9.427 1.00 0.00 N ATOM 31 CA GLY A 4 -15.988 2.449 8.333 1.00 0.00 C ATOM 32 C GLY A 4 -14.501 2.180 8.571 1.00 0.00 C ATOM 33 O GLY A 4 -14.143 1.285 9.335 1.00 0.00 O ATOM 0 H GLY A 4 -17.002 2.655 10.155 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.520 1.503 8.230 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.118 2.992 7.397 1.00 0.00 H new ATOM 37 N SER A 5 -13.674 2.970 7.901 1.00 0.00 N ATOM 38 CA SER A 5 -12.234 2.827 8.030 1.00 0.00 C ATOM 39 C SER A 5 -11.835 2.856 9.506 1.00 0.00 C ATOM 40 O SER A 5 -12.422 3.592 10.298 1.00 0.00 O ATOM 41 CB SER A 5 -11.501 3.928 7.261 1.00 0.00 C ATOM 42 OG SER A 5 -11.437 5.144 8.001 1.00 0.00 O ATOM 0 H SER A 5 -13.974 3.711 7.267 1.00 0.00 H new ATOM 0 HA SER A 5 -11.946 1.867 7.601 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.491 3.594 7.024 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.008 4.107 6.313 1.00 0.00 H new ATOM 0 HG SER A 5 -11.582 5.902 7.397 1.00 0.00 H new ATOM 48 N SER A 6 -10.840 2.044 9.834 1.00 0.00 N ATOM 49 CA SER A 6 -10.356 1.967 11.201 1.00 0.00 C ATOM 50 C SER A 6 -9.300 0.867 11.321 1.00 0.00 C ATOM 51 O SER A 6 -8.211 1.101 11.844 1.00 0.00 O ATOM 52 CB SER A 6 -11.505 1.709 12.178 1.00 0.00 C ATOM 53 OG SER A 6 -12.424 0.741 11.678 1.00 0.00 O ATOM 0 H SER A 6 -10.356 1.434 9.175 1.00 0.00 H new ATOM 0 HA SER A 6 -9.904 2.925 11.458 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.101 1.367 13.131 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.032 2.643 12.372 1.00 0.00 H new ATOM 0 HG SER A 6 -12.997 1.154 10.999 1.00 0.00 H new ATOM 59 N GLY A 7 -9.659 -0.310 10.829 1.00 0.00 N ATOM 60 CA GLY A 7 -8.755 -1.447 10.874 1.00 0.00 C ATOM 61 C GLY A 7 -7.558 -1.234 9.946 1.00 0.00 C ATOM 62 O GLY A 7 -6.432 -1.594 10.286 1.00 0.00 O ATOM 0 H GLY A 7 -10.563 -0.501 10.397 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -8.405 -1.598 11.895 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.289 -2.352 10.583 1.00 0.00 H new ATOM 66 N LEU A 8 -7.842 -0.649 8.791 1.00 0.00 N ATOM 67 CA LEU A 8 -6.803 -0.383 7.811 1.00 0.00 C ATOM 68 C LEU A 8 -5.575 0.192 8.520 1.00 0.00 C ATOM 69 O LEU A 8 -4.452 0.044 8.041 1.00 0.00 O ATOM 70 CB LEU A 8 -7.339 0.508 6.689 1.00 0.00 C ATOM 71 CG LEU A 8 -8.388 -0.125 5.773 1.00 0.00 C ATOM 72 CD1 LEU A 8 -9.125 0.943 4.963 1.00 0.00 C ATOM 73 CD2 LEU A 8 -7.760 -1.193 4.876 1.00 0.00 C ATOM 0 H LEU A 8 -8.777 -0.352 8.512 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.489 -1.308 7.328 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.770 1.403 7.137 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.498 0.832 6.076 1.00 0.00 H new ATOM 0 HG LEU A 8 -9.129 -0.624 6.397 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -9.865 0.466 4.320 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -9.625 1.634 5.642 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -8.411 1.491 4.349 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -8.527 -1.627 4.235 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.985 -0.739 4.258 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -7.319 -1.975 5.495 1.00 0.00 H new ATOM 85 N HIS A 9 -5.830 0.836 9.649 1.00 0.00 N ATOM 86 CA HIS A 9 -4.760 1.434 10.428 1.00 0.00 C ATOM 87 C HIS A 9 -3.823 0.338 10.939 1.00 0.00 C ATOM 88 O HIS A 9 -2.603 0.461 10.837 1.00 0.00 O ATOM 89 CB HIS A 9 -5.326 2.302 11.554 1.00 0.00 C ATOM 90 CG HIS A 9 -4.551 3.575 11.797 1.00 0.00 C ATOM 91 ND1 HIS A 9 -3.717 3.749 12.887 1.00 0.00 N ATOM 92 CD2 HIS A 9 -4.492 4.733 11.078 1.00 0.00 C ATOM 93 CE1 HIS A 9 -3.186 4.961 12.819 1.00 0.00 C ATOM 94 NE2 HIS A 9 -3.668 5.570 11.698 1.00 0.00 N ATOM 0 H HIS A 9 -6.763 0.957 10.043 1.00 0.00 H new ATOM 0 HA HIS A 9 -4.174 2.100 9.795 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -6.359 2.557 11.318 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -5.344 1.719 12.475 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -5.025 4.935 10.161 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -2.493 5.391 13.527 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -3.434 6.513 11.387 1.00 0.00 H new ATOM 102 N ARG A 10 -4.428 -0.710 11.478 1.00 0.00 N ATOM 103 CA ARG A 10 -3.663 -1.827 12.005 1.00 0.00 C ATOM 104 C ARG A 10 -2.930 -2.550 10.873 1.00 0.00 C ATOM 105 O ARG A 10 -1.928 -3.223 11.108 1.00 0.00 O ATOM 106 CB ARG A 10 -4.570 -2.821 12.733 1.00 0.00 C ATOM 107 CG ARG A 10 -5.252 -3.768 11.743 1.00 0.00 C ATOM 108 CD ARG A 10 -4.581 -5.143 11.748 1.00 0.00 C ATOM 109 NE ARG A 10 -5.513 -6.159 12.287 1.00 0.00 N ATOM 110 CZ ARG A 10 -5.126 -7.322 12.828 1.00 0.00 C ATOM 111 NH1 ARG A 10 -3.823 -7.623 12.906 1.00 0.00 N ATOM 112 NH2 ARG A 10 -6.042 -8.183 13.292 1.00 0.00 N ATOM 0 H ARG A 10 -5.440 -0.809 11.561 1.00 0.00 H new ATOM 0 HA ARG A 10 -2.938 -1.427 12.714 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.983 -3.398 13.448 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -5.325 -2.280 13.303 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.306 -3.873 12.002 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.211 -3.343 10.740 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.280 -5.414 10.736 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -3.674 -5.112 12.352 1.00 0.00 H new ATOM 0 HE ARG A 10 -6.513 -5.961 12.244 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -3.126 -6.967 12.554 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -3.528 -8.508 13.318 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -7.034 -7.953 13.233 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -5.747 -9.068 13.704 1.00 0.00 H new ATOM 126 N ILE A 11 -3.459 -2.386 9.670 1.00 0.00 N ATOM 127 CA ILE A 11 -2.868 -3.015 8.501 1.00 0.00 C ATOM 128 C ILE A 11 -1.672 -2.184 8.031 1.00 0.00 C ATOM 129 O ILE A 11 -0.608 -2.730 7.741 1.00 0.00 O ATOM 130 CB ILE A 11 -3.927 -3.236 7.418 1.00 0.00 C ATOM 131 CG1 ILE A 11 -5.203 -3.833 8.014 1.00 0.00 C ATOM 132 CG2 ILE A 11 -3.373 -4.090 6.276 1.00 0.00 C ATOM 133 CD1 ILE A 11 -6.205 -4.192 6.914 1.00 0.00 C ATOM 0 H ILE A 11 -4.290 -1.827 9.479 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.490 -4.006 8.751 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.192 -2.267 6.995 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -4.957 -4.724 8.592 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.655 -3.120 8.704 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.145 -4.232 5.520 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -2.515 -3.587 5.829 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.063 -5.060 6.664 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.103 -4.614 7.364 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -6.467 -3.295 6.354 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.759 -4.923 6.240 1.00 0.00 H new ATOM 145 N VAL A 12 -1.887 -0.878 7.969 1.00 0.00 N ATOM 146 CA VAL A 12 -0.840 0.033 7.539 1.00 0.00 C ATOM 147 C VAL A 12 0.392 -0.157 8.427 1.00 0.00 C ATOM 148 O VAL A 12 1.503 -0.323 7.926 1.00 0.00 O ATOM 149 CB VAL A 12 -1.363 1.470 7.542 1.00 0.00 C ATOM 150 CG1 VAL A 12 -0.226 2.468 7.315 1.00 0.00 C ATOM 151 CG2 VAL A 12 -2.469 1.653 6.501 1.00 0.00 C ATOM 0 H VAL A 12 -2.771 -0.429 8.209 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.539 -0.187 6.515 1.00 0.00 H new ATOM 0 HB VAL A 12 -1.791 1.668 8.524 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -0.625 3.482 7.322 1.00 0.00 H new ATOM 0 HG12 VAL A 12 0.513 2.364 8.109 1.00 0.00 H new ATOM 0 HG13 VAL A 12 0.245 2.270 6.352 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -2.823 2.684 6.524 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -2.077 1.426 5.510 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -3.296 0.980 6.727 1.00 0.00 H new ATOM 161 N ASP A 13 0.153 -0.126 9.730 1.00 0.00 N ATOM 162 CA ASP A 13 1.229 -0.292 10.692 1.00 0.00 C ATOM 163 C ASP A 13 2.033 -1.545 10.339 1.00 0.00 C ATOM 164 O ASP A 13 3.262 -1.506 10.297 1.00 0.00 O ATOM 165 CB ASP A 13 0.678 -0.467 12.109 1.00 0.00 C ATOM 166 CG ASP A 13 0.284 0.832 12.814 1.00 0.00 C ATOM 167 OD1 ASP A 13 1.104 1.774 12.769 1.00 0.00 O ATOM 168 OD2 ASP A 13 -0.829 0.854 13.383 1.00 0.00 O ATOM 0 H ASP A 13 -0.770 0.012 10.142 1.00 0.00 H new ATOM 0 HA ASP A 13 1.855 0.600 10.656 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.195 -1.118 12.065 1.00 0.00 H new ATOM 0 HB3 ASP A 13 1.427 -0.978 12.714 1.00 0.00 H new ATOM 173 N LYS A 14 1.308 -2.626 10.095 1.00 0.00 N ATOM 174 CA LYS A 14 1.939 -3.888 9.748 1.00 0.00 C ATOM 175 C LYS A 14 2.778 -3.702 8.482 1.00 0.00 C ATOM 176 O LYS A 14 3.935 -4.117 8.434 1.00 0.00 O ATOM 177 CB LYS A 14 0.891 -4.997 9.634 1.00 0.00 C ATOM 178 CG LYS A 14 1.233 -6.171 10.553 1.00 0.00 C ATOM 179 CD LYS A 14 -0.027 -6.736 11.212 1.00 0.00 C ATOM 180 CE LYS A 14 0.332 -7.671 12.369 1.00 0.00 C ATOM 181 NZ LYS A 14 -0.825 -8.522 12.726 1.00 0.00 N ATOM 0 H LYS A 14 0.289 -2.654 10.131 1.00 0.00 H new ATOM 0 HA LYS A 14 2.620 -4.204 10.538 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -0.091 -4.602 9.893 1.00 0.00 H new ATOM 0 HB3 LYS A 14 0.833 -5.343 8.602 1.00 0.00 H new ATOM 0 HG2 LYS A 14 1.730 -6.954 9.980 1.00 0.00 H new ATOM 0 HG3 LYS A 14 1.934 -5.844 11.321 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.647 -5.919 11.579 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.617 -7.277 10.472 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.179 -8.297 12.089 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.641 -7.086 13.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.486 -9.444 13.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -1.378 -8.059 13.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -1.425 -8.661 11.888 1.00 0.00 H new ATOM 195 N MET A 15 2.162 -3.078 7.489 1.00 0.00 N ATOM 196 CA MET A 15 2.838 -2.831 6.226 1.00 0.00 C ATOM 197 C MET A 15 4.043 -1.909 6.420 1.00 0.00 C ATOM 198 O MET A 15 5.024 -1.999 5.683 1.00 0.00 O ATOM 199 CB MET A 15 1.860 -2.193 5.239 1.00 0.00 C ATOM 200 CG MET A 15 0.604 -3.052 5.078 1.00 0.00 C ATOM 201 SD MET A 15 -0.795 -2.019 4.677 1.00 0.00 S ATOM 202 CE MET A 15 -0.598 -1.904 2.906 1.00 0.00 C ATOM 0 H MET A 15 1.202 -2.736 7.533 1.00 0.00 H new ATOM 0 HA MET A 15 3.193 -3.784 5.834 1.00 0.00 H new ATOM 0 HB2 MET A 15 1.582 -1.199 5.588 1.00 0.00 H new ATOM 0 HB3 MET A 15 2.345 -2.067 4.271 1.00 0.00 H new ATOM 0 HG2 MET A 15 0.758 -3.792 4.292 1.00 0.00 H new ATOM 0 HG3 MET A 15 0.409 -3.601 5.999 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.008 -0.957 2.555 1.00 0.00 H new ATOM 0 HE2 MET A 15 0.461 -1.957 2.653 1.00 0.00 H new ATOM 0 HE3 MET A 15 -1.127 -2.728 2.427 1.00 0.00 H new ATOM 212 N HIS A 16 3.931 -1.042 7.416 1.00 0.00 N ATOM 213 CA HIS A 16 4.999 -0.104 7.716 1.00 0.00 C ATOM 214 C HIS A 16 6.251 -0.872 8.143 1.00 0.00 C ATOM 215 O HIS A 16 7.361 -0.346 8.069 1.00 0.00 O ATOM 216 CB HIS A 16 4.546 0.919 8.760 1.00 0.00 C ATOM 217 CG HIS A 16 3.843 2.122 8.176 1.00 0.00 C ATOM 218 ND1 HIS A 16 2.865 2.210 7.230 1.00 0.00 N flip ATOM 219 CD2 HIS A 16 4.129 3.419 8.565 1.00 0.00 C flip ATOM 220 CE1 HIS A 16 2.569 3.491 7.051 1.00 0.00 C flip ATOM 221 NE2 HIS A 16 3.352 4.242 7.877 1.00 0.00 N flip ATOM 0 H HIS A 16 3.116 -0.970 8.026 1.00 0.00 H new ATOM 0 HA HIS A 16 5.251 0.464 6.821 1.00 0.00 H new ATOM 0 HB2 HIS A 16 3.878 0.429 9.468 1.00 0.00 H new ATOM 0 HB3 HIS A 16 5.415 1.257 9.324 1.00 0.00 H new ATOM 0 HD1 HIS A 16 2.434 1.424 6.743 1.00 0.00 H new ATOM 0 HD2 HIS A 16 4.861 3.710 9.304 1.00 0.00 H new ATOM 0 HE1 HIS A 16 1.830 3.876 6.364 1.00 0.00 H new ATOM 229 N ASP A 17 6.031 -2.103 8.581 1.00 0.00 N ATOM 230 CA ASP A 17 7.128 -2.948 9.020 1.00 0.00 C ATOM 231 C ASP A 17 7.764 -3.623 7.803 1.00 0.00 C ATOM 232 O ASP A 17 7.232 -3.547 6.697 1.00 0.00 O ATOM 233 CB ASP A 17 6.635 -4.045 9.965 1.00 0.00 C ATOM 234 CG ASP A 17 7.724 -4.710 10.809 1.00 0.00 C ATOM 235 OD1 ASP A 17 8.106 -4.096 11.829 1.00 0.00 O ATOM 236 OD2 ASP A 17 8.150 -5.817 10.415 1.00 0.00 O ATOM 0 H ASP A 17 5.109 -2.535 8.641 1.00 0.00 H new ATOM 0 HA ASP A 17 7.849 -2.320 9.543 1.00 0.00 H new ATOM 0 HB2 ASP A 17 5.888 -3.618 10.634 1.00 0.00 H new ATOM 0 HB3 ASP A 17 6.134 -4.813 9.376 1.00 0.00 H new ATOM 241 N THR A 18 8.895 -4.270 8.049 1.00 0.00 N ATOM 242 CA THR A 18 9.609 -4.958 6.987 1.00 0.00 C ATOM 243 C THR A 18 9.667 -6.460 7.270 1.00 0.00 C ATOM 244 O THR A 18 9.537 -7.274 6.357 1.00 0.00 O ATOM 245 CB THR A 18 10.989 -4.312 6.850 1.00 0.00 C ATOM 246 OG1 THR A 18 11.646 -5.103 5.862 1.00 0.00 O ATOM 247 CG2 THR A 18 11.848 -4.492 8.103 1.00 0.00 C ATOM 0 H THR A 18 9.334 -4.332 8.968 1.00 0.00 H new ATOM 0 HA THR A 18 9.091 -4.858 6.033 1.00 0.00 H new ATOM 0 HB THR A 18 10.872 -3.249 6.640 1.00 0.00 H new ATOM 0 HG1 THR A 18 12.548 -4.753 5.710 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.816 -4.015 7.952 1.00 0.00 H new ATOM 0 HG22 THR A 18 11.347 -4.035 8.956 1.00 0.00 H new ATOM 0 HG23 THR A 18 11.993 -5.555 8.295 1.00 0.00 H new ATOM 255 N SER A 19 9.862 -6.784 8.540 1.00 0.00 N ATOM 256 CA SER A 19 9.939 -8.174 8.955 1.00 0.00 C ATOM 257 C SER A 19 8.643 -8.901 8.592 1.00 0.00 C ATOM 258 O SER A 19 8.627 -9.733 7.686 1.00 0.00 O ATOM 259 CB SER A 19 10.207 -8.286 10.458 1.00 0.00 C ATOM 260 OG SER A 19 11.556 -8.652 10.733 1.00 0.00 O ATOM 0 H SER A 19 9.969 -6.107 9.295 1.00 0.00 H new ATOM 0 HA SER A 19 10.771 -8.642 8.429 1.00 0.00 H new ATOM 0 HB2 SER A 19 9.985 -7.333 10.938 1.00 0.00 H new ATOM 0 HB3 SER A 19 9.535 -9.026 10.892 1.00 0.00 H new ATOM 0 HG SER A 19 11.688 -8.711 11.702 1.00 0.00 H new ATOM 266 N THR A 20 7.587 -8.560 9.316 1.00 0.00 N ATOM 267 CA THR A 20 6.290 -9.170 9.081 1.00 0.00 C ATOM 268 C THR A 20 5.495 -8.356 8.058 1.00 0.00 C ATOM 269 O THR A 20 4.615 -8.889 7.384 1.00 0.00 O ATOM 270 CB THR A 20 5.581 -9.309 10.430 1.00 0.00 C ATOM 271 OG1 THR A 20 5.484 -7.971 10.910 1.00 0.00 O ATOM 272 CG2 THR A 20 6.445 -10.018 11.475 1.00 0.00 C ATOM 0 H THR A 20 7.604 -7.869 10.066 1.00 0.00 H new ATOM 0 HA THR A 20 6.394 -10.165 8.648 1.00 0.00 H new ATOM 0 HB THR A 20 4.649 -9.859 10.296 1.00 0.00 H new ATOM 0 HG1 THR A 20 5.035 -7.968 11.781 1.00 0.00 H new ATOM 0 HG21 THR A 20 5.895 -10.090 12.413 1.00 0.00 H new ATOM 0 HG22 THR A 20 6.695 -11.019 11.122 1.00 0.00 H new ATOM 0 HG23 THR A 20 7.362 -9.451 11.635 1.00 0.00 H new ATOM 280 N GLY A 21 5.835 -7.078 7.975 1.00 0.00 N ATOM 281 CA GLY A 21 5.164 -6.185 7.045 1.00 0.00 C ATOM 282 C GLY A 21 5.505 -6.543 5.597 1.00 0.00 C ATOM 283 O GLY A 21 6.156 -7.556 5.341 1.00 0.00 O ATOM 0 H GLY A 21 6.566 -6.640 8.536 1.00 0.00 H new ATOM 0 HA2 GLY A 21 4.086 -6.243 7.193 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.458 -5.155 7.248 1.00 0.00 H new ATOM 287 N ILE A 22 5.051 -5.693 4.688 1.00 0.00 N ATOM 288 CA ILE A 22 5.301 -5.908 3.273 1.00 0.00 C ATOM 289 C ILE A 22 6.784 -5.676 2.980 1.00 0.00 C ATOM 290 O ILE A 22 7.562 -5.386 3.888 1.00 0.00 O ATOM 291 CB ILE A 22 4.365 -5.042 2.427 1.00 0.00 C ATOM 292 CG1 ILE A 22 4.202 -5.623 1.021 1.00 0.00 C ATOM 293 CG2 ILE A 22 4.841 -3.589 2.395 1.00 0.00 C ATOM 294 CD1 ILE A 22 2.730 -5.647 0.605 1.00 0.00 C ATOM 0 H ILE A 22 4.512 -4.854 4.904 1.00 0.00 H new ATOM 0 HA ILE A 22 5.079 -6.940 3.000 1.00 0.00 H new ATOM 0 HB ILE A 22 3.380 -5.047 2.894 1.00 0.00 H new ATOM 0 HG12 ILE A 22 4.775 -5.029 0.309 1.00 0.00 H new ATOM 0 HG13 ILE A 22 4.608 -6.634 0.992 1.00 0.00 H new ATOM 0 HG21 ILE A 22 4.158 -2.996 1.787 1.00 0.00 H new ATOM 0 HG22 ILE A 22 4.863 -3.191 3.409 1.00 0.00 H new ATOM 0 HG23 ILE A 22 5.842 -3.543 1.966 1.00 0.00 H new ATOM 0 HD11 ILE A 22 2.642 -6.064 -0.398 1.00 0.00 H new ATOM 0 HD12 ILE A 22 2.164 -6.262 1.305 1.00 0.00 H new ATOM 0 HD13 ILE A 22 2.333 -4.632 0.611 1.00 0.00 H new ATOM 306 N ARG A 23 7.132 -5.814 1.709 1.00 0.00 N ATOM 307 CA ARG A 23 8.509 -5.623 1.285 1.00 0.00 C ATOM 308 C ARG A 23 8.558 -5.195 -0.183 1.00 0.00 C ATOM 309 O ARG A 23 8.550 -6.038 -1.079 1.00 0.00 O ATOM 310 CB ARG A 23 9.323 -6.907 1.463 1.00 0.00 C ATOM 311 CG ARG A 23 9.590 -7.186 2.943 1.00 0.00 C ATOM 312 CD ARG A 23 10.962 -7.833 3.140 1.00 0.00 C ATOM 313 NE ARG A 23 10.867 -9.295 2.933 1.00 0.00 N ATOM 314 CZ ARG A 23 11.920 -10.125 2.939 1.00 0.00 C ATOM 315 NH1 ARG A 23 13.153 -9.641 3.141 1.00 0.00 N ATOM 316 NH2 ARG A 23 11.739 -11.438 2.742 1.00 0.00 N ATOM 0 H ARG A 23 6.484 -6.056 0.959 1.00 0.00 H new ATOM 0 HA ARG A 23 8.943 -4.842 1.909 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.786 -7.747 1.022 1.00 0.00 H new ATOM 0 HB3 ARG A 23 10.269 -6.819 0.929 1.00 0.00 H new ATOM 0 HG2 ARG A 23 9.539 -6.255 3.507 1.00 0.00 H new ATOM 0 HG3 ARG A 23 8.814 -7.842 3.339 1.00 0.00 H new ATOM 0 HD2 ARG A 23 11.679 -7.404 2.440 1.00 0.00 H new ATOM 0 HD3 ARG A 23 11.331 -7.623 4.144 1.00 0.00 H new ATOM 0 HE ARG A 23 9.943 -9.697 2.776 1.00 0.00 H new ATOM 0 HH11 ARG A 23 13.290 -8.641 3.290 1.00 0.00 H new ATOM 0 HH12 ARG A 23 13.954 -10.272 3.146 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.800 -11.806 2.587 1.00 0.00 H new ATOM 0 HH22 ARG A 23 12.540 -12.070 2.747 1.00 0.00 H new ATOM 330 N PRO A 24 8.610 -3.852 -0.389 1.00 0.00 N ATOM 331 CA PRO A 24 8.660 -3.302 -1.733 1.00 0.00 C ATOM 332 C PRO A 24 10.049 -3.485 -2.348 1.00 0.00 C ATOM 333 O PRO A 24 10.192 -4.124 -3.389 1.00 0.00 O ATOM 334 CB PRO A 24 8.268 -1.842 -1.576 1.00 0.00 C ATOM 335 CG PRO A 24 8.463 -1.514 -0.105 1.00 0.00 C ATOM 336 CD PRO A 24 8.621 -2.825 0.649 1.00 0.00 C ATOM 0 HA PRO A 24 7.984 -3.810 -2.421 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.887 -1.202 -2.204 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.233 -1.681 -1.878 1.00 0.00 H new ATOM 0 HG2 PRO A 24 9.343 -0.886 0.033 1.00 0.00 H new ATOM 0 HG3 PRO A 24 7.610 -0.954 0.278 1.00 0.00 H new ATOM 0 HD2 PRO A 24 9.551 -2.846 1.217 1.00 0.00 H new ATOM 0 HD3 PRO A 24 7.809 -2.973 1.361 1.00 0.00 H new ATOM 344 N SER A 25 11.038 -2.911 -1.678 1.00 0.00 N ATOM 345 CA SER A 25 12.411 -3.003 -2.146 1.00 0.00 C ATOM 346 C SER A 25 12.479 -2.665 -3.637 1.00 0.00 C ATOM 347 O SER A 25 12.241 -3.525 -4.483 1.00 0.00 O ATOM 348 CB SER A 25 12.988 -4.397 -1.891 1.00 0.00 C ATOM 349 OG SER A 25 13.950 -4.392 -0.840 1.00 0.00 O ATOM 0 H SER A 25 10.916 -2.381 -0.815 1.00 0.00 H new ATOM 0 HA SER A 25 13.011 -2.284 -1.589 1.00 0.00 H new ATOM 0 HB2 SER A 25 12.180 -5.084 -1.639 1.00 0.00 H new ATOM 0 HB3 SER A 25 13.451 -4.771 -2.804 1.00 0.00 H new ATOM 0 HG SER A 25 14.293 -5.300 -0.707 1.00 0.00 H new ATOM 355 N PRO A 26 12.814 -1.377 -3.919 1.00 0.00 N ATOM 356 CA PRO A 26 12.916 -0.915 -5.293 1.00 0.00 C ATOM 357 C PRO A 26 14.199 -1.428 -5.950 1.00 0.00 C ATOM 358 O PRO A 26 15.006 -0.642 -6.443 1.00 0.00 O ATOM 359 CB PRO A 26 12.861 0.602 -5.203 1.00 0.00 C ATOM 360 CG PRO A 26 13.198 0.946 -3.761 1.00 0.00 C ATOM 361 CD PRO A 26 13.102 -0.331 -2.942 1.00 0.00 C ATOM 0 HA PRO A 26 12.112 -1.293 -5.925 1.00 0.00 H new ATOM 0 HB2 PRO A 26 13.572 1.060 -5.890 1.00 0.00 H new ATOM 0 HB3 PRO A 26 11.872 0.974 -5.473 1.00 0.00 H new ATOM 0 HG2 PRO A 26 14.201 1.368 -3.694 1.00 0.00 H new ATOM 0 HG3 PRO A 26 12.509 1.698 -3.377 1.00 0.00 H new ATOM 0 HD2 PRO A 26 14.032 -0.531 -2.410 1.00 0.00 H new ATOM 0 HD3 PRO A 26 12.314 -0.262 -2.192 1.00 0.00 H new ATOM 369 N ASN A 27 14.347 -2.745 -5.935 1.00 0.00 N ATOM 370 CA ASN A 27 15.518 -3.373 -6.524 1.00 0.00 C ATOM 371 C ASN A 27 15.335 -3.462 -8.040 1.00 0.00 C ATOM 372 O ASN A 27 15.369 -4.552 -8.610 1.00 0.00 O ATOM 373 CB ASN A 27 15.710 -4.793 -5.987 1.00 0.00 C ATOM 374 CG ASN A 27 14.484 -5.660 -6.279 1.00 0.00 C ATOM 375 OD1 ASN A 27 13.347 -5.244 -6.128 1.00 0.00 O ATOM 376 ND2 ASN A 27 14.777 -6.886 -6.703 1.00 0.00 N ATOM 0 H ASN A 27 13.676 -3.394 -5.524 1.00 0.00 H new ATOM 0 HA ASN A 27 16.389 -2.770 -6.268 1.00 0.00 H new ATOM 0 HB2 ASN A 27 16.593 -5.241 -6.442 1.00 0.00 H new ATOM 0 HB3 ASN A 27 15.888 -4.758 -4.912 1.00 0.00 H new ATOM 0 HD21 ASN A 27 14.028 -7.542 -6.924 1.00 0.00 H new ATOM 0 HD22 ASN A 27 15.751 -7.170 -6.808 1.00 0.00 H new ATOM 383 N MET A 28 15.146 -2.302 -8.650 1.00 0.00 N ATOM 384 CA MET A 28 14.959 -2.235 -10.090 1.00 0.00 C ATOM 385 C MET A 28 13.774 -3.098 -10.529 1.00 0.00 C ATOM 386 O MET A 28 13.300 -3.941 -9.769 1.00 0.00 O ATOM 387 CB MET A 28 16.230 -2.715 -10.793 1.00 0.00 C ATOM 388 CG MET A 28 16.743 -1.661 -11.777 1.00 0.00 C ATOM 389 SD MET A 28 18.058 -2.345 -12.772 1.00 0.00 S ATOM 390 CE MET A 28 17.423 -2.000 -14.404 1.00 0.00 C ATOM 0 H MET A 28 15.118 -1.400 -8.174 1.00 0.00 H new ATOM 0 HA MET A 28 14.752 -1.200 -10.363 1.00 0.00 H new ATOM 0 HB2 MET A 28 17.000 -2.932 -10.052 1.00 0.00 H new ATOM 0 HB3 MET A 28 16.027 -3.645 -11.324 1.00 0.00 H new ATOM 0 HG2 MET A 28 15.929 -1.323 -12.418 1.00 0.00 H new ATOM 0 HG3 MET A 28 17.104 -0.788 -11.233 1.00 0.00 H new ATOM 0 HE1 MET A 28 18.237 -2.045 -15.128 1.00 0.00 H new ATOM 0 HE2 MET A 28 16.665 -2.740 -14.663 1.00 0.00 H new ATOM 0 HE3 MET A 28 16.979 -1.005 -14.419 1.00 0.00 H new ATOM 400 N GLU A 29 13.331 -2.858 -11.754 1.00 0.00 N ATOM 401 CA GLU A 29 12.211 -3.603 -12.304 1.00 0.00 C ATOM 402 C GLU A 29 12.262 -3.588 -13.833 1.00 0.00 C ATOM 403 O GLU A 29 12.204 -4.638 -14.470 1.00 0.00 O ATOM 404 CB GLU A 29 10.879 -3.048 -11.794 1.00 0.00 C ATOM 405 CG GLU A 29 10.003 -4.164 -11.222 1.00 0.00 C ATOM 406 CD GLU A 29 10.473 -4.568 -9.824 1.00 0.00 C ATOM 407 OE1 GLU A 29 10.652 -3.648 -8.997 1.00 0.00 O ATOM 408 OE2 GLU A 29 10.642 -5.789 -9.613 1.00 0.00 O ATOM 0 H GLU A 29 13.727 -2.158 -12.381 1.00 0.00 H new ATOM 0 HA GLU A 29 12.288 -4.637 -11.968 1.00 0.00 H new ATOM 0 HB2 GLU A 29 11.064 -2.297 -11.026 1.00 0.00 H new ATOM 0 HB3 GLU A 29 10.353 -2.549 -12.608 1.00 0.00 H new ATOM 0 HG2 GLU A 29 8.966 -3.831 -11.179 1.00 0.00 H new ATOM 0 HG3 GLU A 29 10.033 -5.030 -11.884 1.00 0.00 H new ATOM 415 N GLN A 30 12.370 -2.385 -14.377 1.00 0.00 N ATOM 416 CA GLN A 30 12.429 -2.219 -15.820 1.00 0.00 C ATOM 417 C GLN A 30 13.114 -0.897 -16.174 1.00 0.00 C ATOM 418 O GLN A 30 12.483 0.007 -16.718 1.00 0.00 O ATOM 419 CB GLN A 30 11.032 -2.295 -16.439 1.00 0.00 C ATOM 420 CG GLN A 30 11.113 -2.420 -17.961 1.00 0.00 C ATOM 421 CD GLN A 30 11.239 -3.885 -18.385 1.00 0.00 C ATOM 422 OE1 GLN A 30 12.251 -4.322 -18.908 1.00 0.00 O ATOM 423 NE2 GLN A 30 10.157 -4.616 -18.132 1.00 0.00 N ATOM 0 H GLN A 30 12.418 -1.516 -13.845 1.00 0.00 H new ATOM 0 HA GLN A 30 13.019 -3.035 -16.236 1.00 0.00 H new ATOM 0 HB2 GLN A 30 10.494 -3.150 -16.028 1.00 0.00 H new ATOM 0 HB3 GLN A 30 10.464 -1.404 -16.173 1.00 0.00 H new ATOM 0 HG2 GLN A 30 10.223 -1.982 -18.413 1.00 0.00 H new ATOM 0 HG3 GLN A 30 11.969 -1.856 -18.331 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.343 -4.187 -17.692 1.00 0.00 H new ATOM 0 HE22 GLN A 30 10.141 -5.606 -18.378 1.00 0.00 H new ATOM 432 N GLY A 31 14.397 -0.827 -15.850 1.00 0.00 N ATOM 433 CA GLY A 31 15.175 0.369 -16.128 1.00 0.00 C ATOM 434 C GLY A 31 14.927 1.442 -15.065 1.00 0.00 C ATOM 435 O GLY A 31 15.872 1.971 -14.480 1.00 0.00 O ATOM 0 H GLY A 31 14.917 -1.579 -15.398 1.00 0.00 H new ATOM 0 HA2 GLY A 31 16.236 0.119 -16.157 1.00 0.00 H new ATOM 0 HA3 GLY A 31 14.912 0.758 -17.112 1.00 0.00 H new ATOM 439 N SER A 32 13.653 1.732 -14.848 1.00 0.00 N ATOM 440 CA SER A 32 13.270 2.732 -13.867 1.00 0.00 C ATOM 441 C SER A 32 13.331 2.135 -12.460 1.00 0.00 C ATOM 442 O SER A 32 12.967 0.978 -12.256 1.00 0.00 O ATOM 443 CB SER A 32 11.868 3.276 -14.153 1.00 0.00 C ATOM 444 OG SER A 32 11.857 4.697 -14.254 1.00 0.00 O ATOM 0 H SER A 32 12.873 1.292 -15.335 1.00 0.00 H new ATOM 0 HA SER A 32 13.973 3.563 -13.933 1.00 0.00 H new ATOM 0 HB2 SER A 32 11.494 2.844 -15.081 1.00 0.00 H new ATOM 0 HB3 SER A 32 11.189 2.964 -13.359 1.00 0.00 H new ATOM 0 HG SER A 32 10.945 5.005 -14.439 1.00 0.00 H new ATOM 450 N THR A 33 13.794 2.952 -11.525 1.00 0.00 N ATOM 451 CA THR A 33 13.907 2.519 -10.142 1.00 0.00 C ATOM 452 C THR A 33 12.835 3.192 -9.283 1.00 0.00 C ATOM 453 O THR A 33 13.103 4.193 -8.621 1.00 0.00 O ATOM 454 CB THR A 33 15.334 2.809 -9.672 1.00 0.00 C ATOM 455 OG1 THR A 33 16.112 1.770 -10.260 1.00 0.00 O ATOM 456 CG2 THR A 33 15.508 2.598 -8.166 1.00 0.00 C ATOM 0 H THR A 33 14.095 3.911 -11.698 1.00 0.00 H new ATOM 0 HA THR A 33 13.729 1.448 -10.046 1.00 0.00 H new ATOM 0 HB THR A 33 15.599 3.835 -9.928 1.00 0.00 H new ATOM 0 HG1 THR A 33 17.052 1.883 -10.008 1.00 0.00 H new ATOM 0 HG21 THR A 33 16.538 2.817 -7.885 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.835 3.263 -7.625 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.275 1.563 -7.914 1.00 0.00 H new ATOM 464 N TYR A 34 11.643 2.614 -9.321 1.00 0.00 N ATOM 465 CA TYR A 34 10.530 3.146 -8.554 1.00 0.00 C ATOM 466 C TYR A 34 10.942 3.418 -7.106 1.00 0.00 C ATOM 467 O TYR A 34 11.917 2.850 -6.617 1.00 0.00 O ATOM 468 CB TYR A 34 9.451 2.060 -8.569 1.00 0.00 C ATOM 469 CG TYR A 34 8.961 1.690 -9.970 1.00 0.00 C ATOM 470 CD1 TYR A 34 9.592 0.688 -10.679 1.00 0.00 C ATOM 471 CD2 TYR A 34 7.888 2.357 -10.525 1.00 0.00 C ATOM 472 CE1 TYR A 34 9.131 0.339 -11.998 1.00 0.00 C ATOM 473 CE2 TYR A 34 7.427 2.009 -11.844 1.00 0.00 C ATOM 474 CZ TYR A 34 8.071 1.017 -12.515 1.00 0.00 C ATOM 475 OH TYR A 34 7.635 0.688 -13.761 1.00 0.00 O ATOM 0 H TYR A 34 11.424 1.783 -9.871 1.00 0.00 H new ATOM 0 HA TYR A 34 10.184 4.087 -8.982 1.00 0.00 H new ATOM 0 HB2 TYR A 34 9.843 1.166 -8.084 1.00 0.00 H new ATOM 0 HB3 TYR A 34 8.602 2.398 -7.975 1.00 0.00 H new ATOM 0 HD1 TYR A 34 10.432 0.166 -10.245 1.00 0.00 H new ATOM 0 HD2 TYR A 34 7.394 3.140 -9.970 1.00 0.00 H new ATOM 0 HE1 TYR A 34 9.616 -0.443 -12.564 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.589 2.524 -12.290 1.00 0.00 H new ATOM 0 HH TYR A 34 6.871 1.253 -14.000 1.00 0.00 H new ATOM 485 N LYS A 35 10.177 4.287 -6.460 1.00 0.00 N ATOM 486 CA LYS A 35 10.451 4.641 -5.078 1.00 0.00 C ATOM 487 C LYS A 35 9.411 3.980 -4.171 1.00 0.00 C ATOM 488 O LYS A 35 8.250 4.387 -4.152 1.00 0.00 O ATOM 489 CB LYS A 35 10.527 6.161 -4.919 1.00 0.00 C ATOM 490 CG LYS A 35 11.558 6.761 -5.878 1.00 0.00 C ATOM 491 CD LYS A 35 11.039 8.060 -6.498 1.00 0.00 C ATOM 492 CE LYS A 35 11.657 8.294 -7.878 1.00 0.00 C ATOM 493 NZ LYS A 35 12.118 9.694 -8.008 1.00 0.00 N ATOM 0 H LYS A 35 9.368 4.756 -6.868 1.00 0.00 H new ATOM 0 HA LYS A 35 11.427 4.262 -4.774 1.00 0.00 H new ATOM 0 HB2 LYS A 35 9.548 6.600 -5.111 1.00 0.00 H new ATOM 0 HB3 LYS A 35 10.792 6.410 -3.892 1.00 0.00 H new ATOM 0 HG2 LYS A 35 12.488 6.955 -5.343 1.00 0.00 H new ATOM 0 HG3 LYS A 35 11.787 6.044 -6.666 1.00 0.00 H new ATOM 0 HD2 LYS A 35 9.953 8.018 -6.584 1.00 0.00 H new ATOM 0 HD3 LYS A 35 11.274 8.899 -5.843 1.00 0.00 H new ATOM 0 HE2 LYS A 35 12.495 7.613 -8.028 1.00 0.00 H new ATOM 0 HE3 LYS A 35 10.924 8.073 -8.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 12.535 9.836 -8.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 11.311 10.338 -7.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 12.833 9.893 -7.280 1.00 0.00 H new ATOM 507 N LYS A 36 9.865 2.971 -3.442 1.00 0.00 N ATOM 508 CA LYS A 36 8.988 2.249 -2.535 1.00 0.00 C ATOM 509 C LYS A 36 7.747 1.781 -3.297 1.00 0.00 C ATOM 510 O LYS A 36 6.747 2.495 -3.360 1.00 0.00 O ATOM 511 CB LYS A 36 8.669 3.103 -1.306 1.00 0.00 C ATOM 512 CG LYS A 36 9.921 3.329 -0.455 1.00 0.00 C ATOM 513 CD LYS A 36 10.120 4.816 -0.158 1.00 0.00 C ATOM 514 CE LYS A 36 10.885 5.504 -1.290 1.00 0.00 C ATOM 515 NZ LYS A 36 10.481 6.923 -1.402 1.00 0.00 N ATOM 0 H LYS A 36 10.828 2.636 -3.461 1.00 0.00 H new ATOM 0 HA LYS A 36 9.485 1.356 -2.155 1.00 0.00 H new ATOM 0 HB2 LYS A 36 8.261 4.063 -1.622 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.902 2.613 -0.707 1.00 0.00 H new ATOM 0 HG2 LYS A 36 9.834 2.776 0.480 1.00 0.00 H new ATOM 0 HG3 LYS A 36 10.795 2.938 -0.976 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.151 5.297 -0.025 1.00 0.00 H new ATOM 0 HD3 LYS A 36 10.666 4.934 0.778 1.00 0.00 H new ATOM 0 HE2 LYS A 36 11.957 5.439 -1.104 1.00 0.00 H new ATOM 0 HE3 LYS A 36 10.693 4.990 -2.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 11.153 7.428 -2.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.527 6.981 -1.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.478 7.359 -0.458 1.00 0.00 H new ATOM 529 N THR A 37 7.852 0.585 -3.857 1.00 0.00 N ATOM 530 CA THR A 37 6.750 0.013 -4.612 1.00 0.00 C ATOM 531 C THR A 37 6.743 -1.511 -4.473 1.00 0.00 C ATOM 532 O THR A 37 7.797 -2.144 -4.486 1.00 0.00 O ATOM 533 CB THR A 37 6.872 0.490 -6.061 1.00 0.00 C ATOM 534 OG1 THR A 37 8.268 0.409 -6.337 1.00 0.00 O ATOM 535 CG2 THR A 37 6.547 1.977 -6.217 1.00 0.00 C ATOM 0 H THR A 37 8.683 -0.004 -3.803 1.00 0.00 H new ATOM 0 HA THR A 37 5.788 0.348 -4.224 1.00 0.00 H new ATOM 0 HB THR A 37 6.205 -0.096 -6.693 1.00 0.00 H new ATOM 0 HG1 THR A 37 8.419 -0.208 -7.083 1.00 0.00 H new ATOM 0 HG21 THR A 37 6.649 2.264 -7.264 1.00 0.00 H new ATOM 0 HG22 THR A 37 5.525 2.162 -5.888 1.00 0.00 H new ATOM 0 HG23 THR A 37 7.236 2.566 -5.611 1.00 0.00 H new ATOM 543 N PHE A 38 5.542 -2.055 -4.343 1.00 0.00 N ATOM 544 CA PHE A 38 5.383 -3.493 -4.201 1.00 0.00 C ATOM 545 C PHE A 38 4.352 -4.031 -5.196 1.00 0.00 C ATOM 546 O PHE A 38 3.286 -3.442 -5.371 1.00 0.00 O ATOM 547 CB PHE A 38 4.882 -3.749 -2.779 1.00 0.00 C ATOM 548 CG PHE A 38 3.682 -2.890 -2.376 1.00 0.00 C ATOM 549 CD1 PHE A 38 2.421 -3.299 -2.682 1.00 0.00 C ATOM 550 CD2 PHE A 38 3.875 -1.719 -1.714 1.00 0.00 C ATOM 551 CE1 PHE A 38 1.307 -2.502 -2.309 1.00 0.00 C ATOM 552 CE2 PHE A 38 2.761 -0.922 -1.341 1.00 0.00 C ATOM 553 CZ PHE A 38 1.500 -1.330 -1.646 1.00 0.00 C ATOM 0 H PHE A 38 4.670 -1.526 -4.333 1.00 0.00 H new ATOM 0 HA PHE A 38 6.332 -3.993 -4.395 1.00 0.00 H new ATOM 0 HB2 PHE A 38 4.611 -4.800 -2.685 1.00 0.00 H new ATOM 0 HB3 PHE A 38 5.698 -3.566 -2.079 1.00 0.00 H new ATOM 0 HD1 PHE A 38 2.268 -4.229 -3.208 1.00 0.00 H new ATOM 0 HD2 PHE A 38 4.876 -1.395 -1.472 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.306 -2.826 -2.552 1.00 0.00 H new ATOM 0 HE2 PHE A 38 2.915 0.009 -0.815 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.652 -0.724 -1.362 1.00 0.00 H new ATOM 563 N LEU A 39 4.707 -5.143 -5.823 1.00 0.00 N ATOM 564 CA LEU A 39 3.826 -5.768 -6.795 1.00 0.00 C ATOM 565 C LEU A 39 2.418 -5.874 -6.207 1.00 0.00 C ATOM 566 O LEU A 39 2.256 -6.039 -4.999 1.00 0.00 O ATOM 567 CB LEU A 39 4.403 -7.107 -7.258 1.00 0.00 C ATOM 568 CG LEU A 39 5.840 -7.075 -7.780 1.00 0.00 C ATOM 569 CD1 LEU A 39 6.362 -8.489 -8.039 1.00 0.00 C ATOM 570 CD2 LEU A 39 5.953 -6.186 -9.021 1.00 0.00 C ATOM 0 H LEU A 39 5.593 -5.627 -5.677 1.00 0.00 H new ATOM 0 HA LEU A 39 3.751 -5.153 -7.692 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.356 -7.808 -6.424 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.761 -7.504 -8.044 1.00 0.00 H new ATOM 0 HG LEU A 39 6.473 -6.635 -7.009 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.386 -8.437 -8.409 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.341 -9.060 -7.111 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.732 -8.979 -8.781 1.00 0.00 H new ATOM 0 HD21 LEU A 39 6.985 -6.181 -9.372 1.00 0.00 H new ATOM 0 HD22 LEU A 39 5.305 -6.574 -9.807 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.650 -5.170 -8.769 1.00 0.00 H new ATOM 582 N GLY A 40 1.434 -5.775 -7.089 1.00 0.00 N ATOM 583 CA GLY A 40 0.044 -5.858 -6.673 1.00 0.00 C ATOM 584 C GLY A 40 -0.253 -7.211 -6.024 1.00 0.00 C ATOM 585 O GLY A 40 -1.166 -7.324 -5.206 1.00 0.00 O ATOM 0 H GLY A 40 1.572 -5.638 -8.090 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.177 -5.056 -5.969 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -0.607 -5.713 -7.535 1.00 0.00 H new ATOM 589 N SER A 41 0.533 -8.204 -6.412 1.00 0.00 N ATOM 590 CA SER A 41 0.365 -9.545 -5.878 1.00 0.00 C ATOM 591 C SER A 41 1.024 -9.646 -4.501 1.00 0.00 C ATOM 592 O SER A 41 0.497 -10.302 -3.603 1.00 0.00 O ATOM 593 CB SER A 41 0.953 -10.593 -6.825 1.00 0.00 C ATOM 594 OG SER A 41 0.405 -11.888 -6.596 1.00 0.00 O ATOM 0 H SER A 41 1.289 -8.107 -7.090 1.00 0.00 H new ATOM 0 HA SER A 41 -0.702 -9.742 -5.779 1.00 0.00 H new ATOM 0 HB2 SER A 41 0.763 -10.296 -7.857 1.00 0.00 H new ATOM 0 HB3 SER A 41 2.035 -10.630 -6.698 1.00 0.00 H new ATOM 0 HG SER A 41 0.805 -12.528 -7.221 1.00 0.00 H new ATOM 600 N SER A 42 2.166 -8.986 -4.376 1.00 0.00 N ATOM 601 CA SER A 42 2.901 -8.993 -3.123 1.00 0.00 C ATOM 602 C SER A 42 1.991 -8.543 -1.979 1.00 0.00 C ATOM 603 O SER A 42 1.999 -9.140 -0.903 1.00 0.00 O ATOM 604 CB SER A 42 4.136 -8.092 -3.204 1.00 0.00 C ATOM 605 OG SER A 42 5.159 -8.507 -2.303 1.00 0.00 O ATOM 0 H SER A 42 2.600 -8.443 -5.122 1.00 0.00 H new ATOM 0 HA SER A 42 3.239 -10.011 -2.931 1.00 0.00 H new ATOM 0 HB2 SER A 42 4.525 -8.100 -4.222 1.00 0.00 H new ATOM 0 HB3 SER A 42 3.850 -7.064 -2.980 1.00 0.00 H new ATOM 0 HG SER A 42 5.930 -7.908 -2.386 1.00 0.00 H new ATOM 611 N LEU A 43 1.227 -7.495 -2.250 1.00 0.00 N ATOM 612 CA LEU A 43 0.313 -6.959 -1.256 1.00 0.00 C ATOM 613 C LEU A 43 -0.809 -7.968 -1.005 1.00 0.00 C ATOM 614 O LEU A 43 -1.027 -8.390 0.130 1.00 0.00 O ATOM 615 CB LEU A 43 -0.188 -5.576 -1.679 1.00 0.00 C ATOM 616 CG LEU A 43 -1.326 -4.989 -0.842 1.00 0.00 C ATOM 617 CD1 LEU A 43 -1.094 -5.239 0.650 1.00 0.00 C ATOM 618 CD2 LEU A 43 -1.524 -3.504 -1.150 1.00 0.00 C ATOM 0 H LEU A 43 1.222 -7.003 -3.143 1.00 0.00 H new ATOM 0 HA LEU A 43 0.828 -6.810 -0.307 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.653 -4.883 -1.650 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.519 -5.633 -2.716 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.249 -5.500 -1.115 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -1.917 -4.812 1.223 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.041 -6.312 0.835 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.158 -4.772 0.956 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.339 -3.112 -0.542 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -0.607 -2.960 -0.923 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.767 -3.381 -2.205 1.00 0.00 H new ATOM 630 N VAL A 44 -1.492 -8.326 -2.082 1.00 0.00 N ATOM 631 CA VAL A 44 -2.586 -9.278 -1.992 1.00 0.00 C ATOM 632 C VAL A 44 -2.143 -10.481 -1.156 1.00 0.00 C ATOM 633 O VAL A 44 -2.687 -10.728 -0.081 1.00 0.00 O ATOM 634 CB VAL A 44 -3.058 -9.667 -3.395 1.00 0.00 C ATOM 635 CG1 VAL A 44 -4.112 -10.774 -3.332 1.00 0.00 C ATOM 636 CG2 VAL A 44 -3.588 -8.448 -4.153 1.00 0.00 C ATOM 0 H VAL A 44 -1.309 -7.974 -3.022 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.442 -8.829 -1.488 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.198 -10.054 -3.942 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -4.430 -11.031 -4.342 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.687 -11.654 -2.850 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -4.971 -10.426 -2.759 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -3.917 -8.752 -5.147 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.429 -8.018 -3.608 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -2.797 -7.704 -4.245 1.00 0.00 H new ATOM 646 N ASP A 45 -1.160 -11.197 -1.682 1.00 0.00 N ATOM 647 CA ASP A 45 -0.638 -12.368 -0.998 1.00 0.00 C ATOM 648 C ASP A 45 -0.348 -12.012 0.462 1.00 0.00 C ATOM 649 O ASP A 45 -0.700 -12.764 1.369 1.00 0.00 O ATOM 650 CB ASP A 45 0.668 -12.842 -1.638 1.00 0.00 C ATOM 651 CG ASP A 45 0.925 -14.348 -1.543 1.00 0.00 C ATOM 652 OD1 ASP A 45 1.254 -14.798 -0.424 1.00 0.00 O ATOM 653 OD2 ASP A 45 0.786 -15.014 -2.591 1.00 0.00 O ATOM 0 H ASP A 45 -0.711 -10.989 -2.574 1.00 0.00 H new ATOM 0 HA ASP A 45 -1.383 -13.161 -1.069 1.00 0.00 H new ATOM 0 HB2 ASP A 45 0.665 -12.555 -2.689 1.00 0.00 H new ATOM 0 HB3 ASP A 45 1.498 -12.316 -1.166 1.00 0.00 H new ATOM 658 N TRP A 46 0.291 -10.866 0.643 1.00 0.00 N ATOM 659 CA TRP A 46 0.633 -10.402 1.977 1.00 0.00 C ATOM 660 C TRP A 46 -0.657 -10.328 2.796 1.00 0.00 C ATOM 661 O TRP A 46 -0.839 -11.091 3.744 1.00 0.00 O ATOM 662 CB TRP A 46 1.381 -9.069 1.918 1.00 0.00 C ATOM 663 CG TRP A 46 1.820 -8.541 3.286 1.00 0.00 C ATOM 664 CD1 TRP A 46 2.945 -8.824 3.957 1.00 0.00 C ATOM 665 CD2 TRP A 46 1.091 -7.622 4.127 1.00 0.00 C ATOM 666 NE1 TRP A 46 2.994 -8.157 5.164 1.00 0.00 N ATOM 667 CE2 TRP A 46 1.831 -7.403 5.271 1.00 0.00 C ATOM 668 CE3 TRP A 46 -0.152 -6.997 3.928 1.00 0.00 C ATOM 669 CZ2 TRP A 46 1.412 -6.557 6.305 1.00 0.00 C ATOM 670 CZ3 TRP A 46 -0.557 -6.155 4.971 1.00 0.00 C ATOM 671 CH2 TRP A 46 0.176 -5.924 6.128 1.00 0.00 C ATOM 0 H TRP A 46 0.581 -10.245 -0.112 1.00 0.00 H new ATOM 0 HA TRP A 46 1.316 -11.098 2.465 1.00 0.00 H new ATOM 0 HB2 TRP A 46 2.261 -9.185 1.285 1.00 0.00 H new ATOM 0 HB3 TRP A 46 0.742 -8.326 1.441 1.00 0.00 H new ATOM 0 HD1 TRP A 46 3.716 -9.490 3.598 1.00 0.00 H new ATOM 0 HE1 TRP A 46 3.746 -8.208 5.852 1.00 0.00 H new ATOM 0 HE3 TRP A 46 -0.748 -7.154 3.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 2.010 -6.401 7.191 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -1.506 -5.650 4.869 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -0.206 -5.259 6.888 1.00 0.00 H new ATOM 682 N LEU A 47 -1.519 -9.403 2.401 1.00 0.00 N ATOM 683 CA LEU A 47 -2.787 -9.220 3.088 1.00 0.00 C ATOM 684 C LEU A 47 -3.336 -10.585 3.507 1.00 0.00 C ATOM 685 O LEU A 47 -3.783 -10.756 4.641 1.00 0.00 O ATOM 686 CB LEU A 47 -3.752 -8.408 2.222 1.00 0.00 C ATOM 687 CG LEU A 47 -3.600 -6.887 2.292 1.00 0.00 C ATOM 688 CD1 LEU A 47 -4.204 -6.218 1.056 1.00 0.00 C ATOM 689 CD2 LEU A 47 -4.193 -6.336 3.591 1.00 0.00 C ATOM 0 H LEU A 47 -1.365 -8.772 1.614 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.647 -8.639 4.000 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.626 -8.718 1.185 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.771 -8.665 2.510 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.536 -6.650 2.298 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.083 -5.137 1.131 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.696 -6.579 0.162 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -5.265 -6.460 0.993 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.072 -5.253 3.616 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.253 -6.584 3.641 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.677 -6.778 4.443 1.00 0.00 H new ATOM 701 N ILE A 48 -3.285 -11.521 2.571 1.00 0.00 N ATOM 702 CA ILE A 48 -3.772 -12.865 2.830 1.00 0.00 C ATOM 703 C ILE A 48 -2.940 -13.499 3.946 1.00 0.00 C ATOM 704 O ILE A 48 -3.484 -13.941 4.957 1.00 0.00 O ATOM 705 CB ILE A 48 -3.794 -13.685 1.538 1.00 0.00 C ATOM 706 CG1 ILE A 48 -4.650 -13.002 0.470 1.00 0.00 C ATOM 707 CG2 ILE A 48 -4.252 -15.120 1.808 1.00 0.00 C ATOM 708 CD1 ILE A 48 -4.371 -13.590 -0.915 1.00 0.00 C ATOM 0 H ILE A 48 -2.914 -11.375 1.632 1.00 0.00 H new ATOM 0 HA ILE A 48 -4.804 -12.835 3.180 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.777 -13.739 1.150 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.706 -13.121 0.714 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -4.444 -11.932 0.463 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.259 -15.682 0.874 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -3.567 -15.594 2.511 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.256 -15.108 2.231 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -4.992 -13.087 -1.656 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.320 -13.447 -1.166 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.602 -14.655 -0.911 1.00 0.00 H new ATOM 720 N SER A 49 -1.633 -13.522 3.726 1.00 0.00 N ATOM 721 CA SER A 49 -0.720 -14.095 4.701 1.00 0.00 C ATOM 722 C SER A 49 -0.880 -13.385 6.047 1.00 0.00 C ATOM 723 O SER A 49 -0.682 -13.991 7.099 1.00 0.00 O ATOM 724 CB SER A 49 0.729 -14.000 4.219 1.00 0.00 C ATOM 725 OG SER A 49 1.658 -14.225 5.276 1.00 0.00 O ATOM 0 H SER A 49 -1.185 -13.153 2.887 1.00 0.00 H new ATOM 0 HA SER A 49 -0.966 -15.150 4.823 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.897 -14.730 3.427 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.903 -13.015 3.786 1.00 0.00 H new ATOM 0 HG SER A 49 2.572 -14.158 4.928 1.00 0.00 H new ATOM 731 N SER A 50 -1.236 -12.111 5.970 1.00 0.00 N ATOM 732 CA SER A 50 -1.425 -11.313 7.169 1.00 0.00 C ATOM 733 C SER A 50 -2.714 -11.733 7.879 1.00 0.00 C ATOM 734 O SER A 50 -2.939 -11.366 9.032 1.00 0.00 O ATOM 735 CB SER A 50 -1.464 -9.820 6.837 1.00 0.00 C ATOM 736 OG SER A 50 -0.160 -9.286 6.626 1.00 0.00 O ATOM 0 H SER A 50 -1.399 -11.612 5.095 1.00 0.00 H new ATOM 0 HA SER A 50 -0.578 -11.488 7.833 1.00 0.00 H new ATOM 0 HB2 SER A 50 -2.069 -9.663 5.944 1.00 0.00 H new ATOM 0 HB3 SER A 50 -1.950 -9.280 7.650 1.00 0.00 H new ATOM 0 HG SER A 50 -0.225 -8.462 6.100 1.00 0.00 H new ATOM 742 N ASN A 51 -3.526 -12.495 7.162 1.00 0.00 N ATOM 743 CA ASN A 51 -4.786 -12.968 7.709 1.00 0.00 C ATOM 744 C ASN A 51 -5.833 -11.857 7.601 1.00 0.00 C ATOM 745 O ASN A 51 -6.854 -11.892 8.287 1.00 0.00 O ATOM 746 CB ASN A 51 -4.641 -13.338 9.186 1.00 0.00 C ATOM 747 CG ASN A 51 -5.735 -14.317 9.616 1.00 0.00 C ATOM 748 OD1 ASN A 51 -6.001 -15.315 8.967 1.00 0.00 O ATOM 749 ND2 ASN A 51 -6.352 -13.977 10.744 1.00 0.00 N ATOM 0 H ASN A 51 -3.336 -12.797 6.206 1.00 0.00 H new ATOM 0 HA ASN A 51 -5.089 -13.850 7.144 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -3.661 -13.783 9.358 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -4.694 -12.437 9.797 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -7.097 -14.566 11.115 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -6.080 -13.127 11.238 1.00 0.00 H new ATOM 756 N PHE A 52 -5.544 -10.897 6.734 1.00 0.00 N ATOM 757 CA PHE A 52 -6.448 -9.779 6.528 1.00 0.00 C ATOM 758 C PHE A 52 -7.480 -10.100 5.446 1.00 0.00 C ATOM 759 O PHE A 52 -8.570 -9.530 5.433 1.00 0.00 O ATOM 760 CB PHE A 52 -5.595 -8.594 6.067 1.00 0.00 C ATOM 761 CG PHE A 52 -4.687 -8.021 7.156 1.00 0.00 C ATOM 762 CD1 PHE A 52 -5.127 -7.949 8.441 1.00 0.00 C ATOM 763 CD2 PHE A 52 -3.439 -7.582 6.839 1.00 0.00 C ATOM 764 CE1 PHE A 52 -4.283 -7.416 9.451 1.00 0.00 C ATOM 765 CE2 PHE A 52 -2.596 -7.049 7.850 1.00 0.00 C ATOM 766 CZ PHE A 52 -3.036 -6.978 9.135 1.00 0.00 C ATOM 0 H PHE A 52 -4.697 -10.871 6.167 1.00 0.00 H new ATOM 0 HA PHE A 52 -6.985 -9.560 7.451 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -4.980 -8.908 5.224 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -6.253 -7.805 5.705 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -6.118 -8.297 8.693 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -3.089 -7.639 5.819 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.632 -7.359 10.471 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -1.605 -6.700 7.598 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.395 -6.574 9.904 1.00 0.00 H new ATOM 776 N ALA A 53 -7.101 -11.013 4.564 1.00 0.00 N ATOM 777 CA ALA A 53 -7.980 -11.418 3.480 1.00 0.00 C ATOM 778 C ALA A 53 -8.051 -12.946 3.429 1.00 0.00 C ATOM 779 O ALA A 53 -7.169 -13.629 3.948 1.00 0.00 O ATOM 780 CB ALA A 53 -7.483 -10.813 2.166 1.00 0.00 C ATOM 0 H ALA A 53 -6.196 -11.484 4.578 1.00 0.00 H new ATOM 0 HA ALA A 53 -8.991 -11.047 3.648 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -8.142 -11.117 1.353 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -7.480 -9.726 2.244 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -6.471 -11.165 1.963 1.00 0.00 H new ATOM 786 N ALA A 54 -9.108 -13.437 2.800 1.00 0.00 N ATOM 787 CA ALA A 54 -9.305 -14.871 2.675 1.00 0.00 C ATOM 788 C ALA A 54 -8.904 -15.315 1.267 1.00 0.00 C ATOM 789 O ALA A 54 -8.441 -16.439 1.074 1.00 0.00 O ATOM 790 CB ALA A 54 -10.758 -15.218 3.004 1.00 0.00 C ATOM 0 H ALA A 54 -9.837 -12.867 2.371 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.674 -15.408 3.383 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -10.905 -16.294 2.910 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.984 -14.909 4.024 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.422 -14.699 2.312 1.00 0.00 H new ATOM 796 N SER A 55 -9.096 -14.410 0.318 1.00 0.00 N ATOM 797 CA SER A 55 -8.760 -14.695 -1.067 1.00 0.00 C ATOM 798 C SER A 55 -8.218 -13.435 -1.744 1.00 0.00 C ATOM 799 O SER A 55 -8.481 -12.321 -1.292 1.00 0.00 O ATOM 800 CB SER A 55 -9.975 -15.227 -1.830 1.00 0.00 C ATOM 801 OG SER A 55 -9.601 -15.872 -3.044 1.00 0.00 O ATOM 0 H SER A 55 -9.480 -13.479 0.481 1.00 0.00 H new ATOM 0 HA SER A 55 -7.990 -15.466 -1.080 1.00 0.00 H new ATOM 0 HB2 SER A 55 -10.520 -15.929 -1.199 1.00 0.00 H new ATOM 0 HB3 SER A 55 -10.654 -14.403 -2.051 1.00 0.00 H new ATOM 0 HG SER A 55 -10.404 -16.199 -3.501 1.00 0.00 H new ATOM 807 N ARG A 56 -7.470 -13.652 -2.816 1.00 0.00 N ATOM 808 CA ARG A 56 -6.888 -12.547 -3.559 1.00 0.00 C ATOM 809 C ARG A 56 -7.873 -11.379 -3.631 1.00 0.00 C ATOM 810 O ARG A 56 -7.465 -10.219 -3.650 1.00 0.00 O ATOM 811 CB ARG A 56 -6.512 -12.976 -4.979 1.00 0.00 C ATOM 812 CG ARG A 56 -5.107 -13.579 -5.015 1.00 0.00 C ATOM 813 CD ARG A 56 -5.158 -15.072 -5.348 1.00 0.00 C ATOM 814 NE ARG A 56 -5.416 -15.855 -4.119 1.00 0.00 N ATOM 815 CZ ARG A 56 -5.572 -17.186 -4.096 1.00 0.00 C ATOM 816 NH1 ARG A 56 -5.498 -17.889 -5.234 1.00 0.00 N ATOM 817 NH2 ARG A 56 -5.802 -17.813 -2.934 1.00 0.00 N ATOM 0 H ARG A 56 -7.254 -14.577 -3.188 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.985 -12.234 -3.035 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.234 -13.705 -5.346 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -6.560 -12.116 -5.647 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -4.503 -13.058 -5.758 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -4.621 -13.435 -4.050 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -5.941 -15.263 -6.082 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -4.216 -15.385 -5.798 1.00 0.00 H new ATOM 0 HE ARG A 56 -5.479 -15.351 -3.235 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -5.323 -17.411 -6.118 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -5.617 -18.902 -5.216 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -5.858 -17.277 -2.068 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -5.921 -18.826 -2.916 1.00 0.00 H new ATOM 831 N LEU A 57 -9.152 -11.726 -3.668 1.00 0.00 N ATOM 832 CA LEU A 57 -10.198 -10.720 -3.737 1.00 0.00 C ATOM 833 C LEU A 57 -10.161 -9.864 -2.469 1.00 0.00 C ATOM 834 O LEU A 57 -9.817 -8.684 -2.523 1.00 0.00 O ATOM 835 CB LEU A 57 -11.556 -11.376 -3.996 1.00 0.00 C ATOM 836 CG LEU A 57 -12.502 -10.615 -4.927 1.00 0.00 C ATOM 837 CD1 LEU A 57 -13.216 -9.487 -4.179 1.00 0.00 C ATOM 838 CD2 LEU A 57 -11.760 -10.103 -6.163 1.00 0.00 C ATOM 0 H LEU A 57 -9.487 -12.689 -3.651 1.00 0.00 H new ATOM 0 HA LEU A 57 -10.027 -10.050 -4.580 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -11.384 -12.367 -4.416 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -12.057 -11.518 -3.038 1.00 0.00 H new ATOM 0 HG LEU A 57 -13.269 -11.307 -5.276 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -13.882 -8.962 -4.863 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -13.796 -9.906 -3.357 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -12.478 -8.789 -3.783 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -12.455 -9.566 -6.808 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -10.959 -9.432 -5.854 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -11.337 -10.946 -6.709 1.00 0.00 H new ATOM 850 N GLU A 58 -10.520 -10.491 -1.359 1.00 0.00 N ATOM 851 CA GLU A 58 -10.532 -9.801 -0.080 1.00 0.00 C ATOM 852 C GLU A 58 -9.292 -8.916 0.057 1.00 0.00 C ATOM 853 O GLU A 58 -9.343 -7.865 0.695 1.00 0.00 O ATOM 854 CB GLU A 58 -10.627 -10.796 1.078 1.00 0.00 C ATOM 855 CG GLU A 58 -12.073 -11.247 1.297 1.00 0.00 C ATOM 856 CD GLU A 58 -12.140 -12.412 2.288 1.00 0.00 C ATOM 857 OE1 GLU A 58 -11.720 -12.197 3.445 1.00 0.00 O ATOM 858 OE2 GLU A 58 -12.609 -13.490 1.865 1.00 0.00 O ATOM 0 H GLU A 58 -10.805 -11.470 -1.318 1.00 0.00 H new ATOM 0 HA GLU A 58 -11.415 -9.163 -0.041 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -10.000 -11.663 0.870 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -10.244 -10.337 1.989 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -12.665 -10.412 1.671 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -12.512 -11.548 0.346 1.00 0.00 H new ATOM 865 N ALA A 59 -8.207 -9.373 -0.551 1.00 0.00 N ATOM 866 CA ALA A 59 -6.956 -8.636 -0.505 1.00 0.00 C ATOM 867 C ALA A 59 -7.003 -7.496 -1.523 1.00 0.00 C ATOM 868 O ALA A 59 -6.617 -6.369 -1.217 1.00 0.00 O ATOM 869 CB ALA A 59 -5.790 -9.594 -0.755 1.00 0.00 C ATOM 0 H ALA A 59 -8.169 -10.245 -1.078 1.00 0.00 H new ATOM 0 HA ALA A 59 -6.808 -8.192 0.479 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.851 -9.041 -0.721 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -5.784 -10.368 0.013 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -5.903 -10.057 -1.736 1.00 0.00 H new ATOM 875 N VAL A 60 -7.480 -7.828 -2.714 1.00 0.00 N ATOM 876 CA VAL A 60 -7.582 -6.845 -3.780 1.00 0.00 C ATOM 877 C VAL A 60 -8.359 -5.629 -3.273 1.00 0.00 C ATOM 878 O VAL A 60 -7.965 -4.490 -3.518 1.00 0.00 O ATOM 879 CB VAL A 60 -8.212 -7.482 -5.020 1.00 0.00 C ATOM 880 CG1 VAL A 60 -8.634 -6.414 -6.031 1.00 0.00 C ATOM 881 CG2 VAL A 60 -7.260 -8.496 -5.659 1.00 0.00 C ATOM 0 H VAL A 60 -7.800 -8.764 -2.964 1.00 0.00 H new ATOM 0 HA VAL A 60 -6.592 -6.498 -4.076 1.00 0.00 H new ATOM 0 HB VAL A 60 -9.108 -8.016 -4.704 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.079 -6.894 -6.903 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.364 -5.747 -5.572 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -7.761 -5.839 -6.339 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.732 -8.934 -6.538 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -6.338 -7.994 -5.954 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -7.031 -9.283 -4.940 1.00 0.00 H new ATOM 891 N THR A 61 -9.449 -5.911 -2.575 1.00 0.00 N ATOM 892 CA THR A 61 -10.285 -4.854 -2.032 1.00 0.00 C ATOM 893 C THR A 61 -9.570 -4.150 -0.878 1.00 0.00 C ATOM 894 O THR A 61 -9.590 -2.923 -0.787 1.00 0.00 O ATOM 895 CB THR A 61 -11.626 -5.472 -1.630 1.00 0.00 C ATOM 896 OG1 THR A 61 -12.503 -5.124 -2.698 1.00 0.00 O ATOM 897 CG2 THR A 61 -12.241 -4.790 -0.406 1.00 0.00 C ATOM 0 H THR A 61 -9.773 -6.857 -2.373 1.00 0.00 H new ATOM 0 HA THR A 61 -10.477 -4.080 -2.775 1.00 0.00 H new ATOM 0 HB THR A 61 -11.489 -6.534 -1.424 1.00 0.00 H new ATOM 0 HG1 THR A 61 -13.396 -5.487 -2.520 1.00 0.00 H new ATOM 0 HG21 THR A 61 -13.191 -5.266 -0.163 1.00 0.00 H new ATOM 0 HG22 THR A 61 -11.562 -4.882 0.441 1.00 0.00 H new ATOM 0 HG23 THR A 61 -12.409 -3.735 -0.623 1.00 0.00 H new ATOM 905 N LEU A 62 -8.956 -4.955 -0.024 1.00 0.00 N ATOM 906 CA LEU A 62 -8.236 -4.424 1.121 1.00 0.00 C ATOM 907 C LEU A 62 -7.196 -3.410 0.639 1.00 0.00 C ATOM 908 O LEU A 62 -6.978 -2.385 1.283 1.00 0.00 O ATOM 909 CB LEU A 62 -7.645 -5.561 1.957 1.00 0.00 C ATOM 910 CG LEU A 62 -8.378 -5.887 3.259 1.00 0.00 C ATOM 911 CD1 LEU A 62 -8.863 -7.338 3.267 1.00 0.00 C ATOM 912 CD2 LEU A 62 -7.504 -5.569 4.475 1.00 0.00 C ATOM 0 H LEU A 62 -8.942 -5.972 -0.102 1.00 0.00 H new ATOM 0 HA LEU A 62 -8.917 -3.892 1.785 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.619 -6.461 1.343 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.612 -5.309 2.198 1.00 0.00 H new ATOM 0 HG LEU A 62 -9.261 -5.251 3.321 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -9.381 -7.543 4.204 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -9.546 -7.498 2.432 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.009 -8.008 3.170 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -8.049 -5.810 5.388 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.590 -6.161 4.431 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.250 -4.509 4.473 1.00 0.00 H new ATOM 924 N ALA A 63 -6.582 -3.732 -0.491 1.00 0.00 N ATOM 925 CA ALA A 63 -5.571 -2.862 -1.067 1.00 0.00 C ATOM 926 C ALA A 63 -6.221 -1.546 -1.496 1.00 0.00 C ATOM 927 O ALA A 63 -5.821 -0.475 -1.042 1.00 0.00 O ATOM 928 CB ALA A 63 -4.883 -3.579 -2.230 1.00 0.00 C ATOM 0 H ALA A 63 -6.766 -4.583 -1.022 1.00 0.00 H new ATOM 0 HA ALA A 63 -4.803 -2.625 -0.330 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -4.124 -2.926 -2.662 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -4.412 -4.492 -1.867 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.622 -3.830 -2.991 1.00 0.00 H new ATOM 934 N SER A 64 -7.213 -1.668 -2.365 1.00 0.00 N ATOM 935 CA SER A 64 -7.923 -0.501 -2.861 1.00 0.00 C ATOM 936 C SER A 64 -8.426 0.342 -1.687 1.00 0.00 C ATOM 937 O SER A 64 -8.516 1.565 -1.791 1.00 0.00 O ATOM 938 CB SER A 64 -9.091 -0.908 -3.761 1.00 0.00 C ATOM 939 OG SER A 64 -10.286 -1.129 -3.018 1.00 0.00 O ATOM 0 H SER A 64 -7.542 -2.558 -2.739 1.00 0.00 H new ATOM 0 HA SER A 64 -7.231 0.093 -3.457 1.00 0.00 H new ATOM 0 HB2 SER A 64 -9.265 -0.129 -4.504 1.00 0.00 H new ATOM 0 HB3 SER A 64 -8.830 -1.815 -4.306 1.00 0.00 H new ATOM 0 HG SER A 64 -10.097 -1.725 -2.264 1.00 0.00 H new ATOM 945 N MET A 65 -8.742 -0.344 -0.599 1.00 0.00 N ATOM 946 CA MET A 65 -9.234 0.327 0.592 1.00 0.00 C ATOM 947 C MET A 65 -8.156 1.227 1.200 1.00 0.00 C ATOM 948 O MET A 65 -8.427 2.372 1.556 1.00 0.00 O ATOM 949 CB MET A 65 -9.668 -0.717 1.624 1.00 0.00 C ATOM 950 CG MET A 65 -11.051 -1.278 1.287 1.00 0.00 C ATOM 951 SD MET A 65 -12.100 -1.221 2.730 1.00 0.00 S ATOM 952 CE MET A 65 -11.438 -2.600 3.649 1.00 0.00 C ATOM 0 H MET A 65 -8.667 -1.358 -0.517 1.00 0.00 H new ATOM 0 HA MET A 65 -10.084 0.949 0.310 1.00 0.00 H new ATOM 0 HB2 MET A 65 -8.940 -1.528 1.655 1.00 0.00 H new ATOM 0 HB3 MET A 65 -9.686 -0.267 2.617 1.00 0.00 H new ATOM 0 HG2 MET A 65 -11.499 -0.701 0.478 1.00 0.00 H new ATOM 0 HG3 MET A 65 -10.960 -2.305 0.934 1.00 0.00 H new ATOM 0 HE1 MET A 65 -12.171 -3.406 3.674 1.00 0.00 H new ATOM 0 HE2 MET A 65 -10.526 -2.954 3.168 1.00 0.00 H new ATOM 0 HE3 MET A 65 -11.211 -2.284 4.667 1.00 0.00 H new ATOM 962 N LEU A 66 -6.956 0.674 1.299 1.00 0.00 N ATOM 963 CA LEU A 66 -5.835 1.412 1.857 1.00 0.00 C ATOM 964 C LEU A 66 -5.579 2.660 1.009 1.00 0.00 C ATOM 965 O LEU A 66 -5.398 3.752 1.544 1.00 0.00 O ATOM 966 CB LEU A 66 -4.612 0.504 1.999 1.00 0.00 C ATOM 967 CG LEU A 66 -4.825 -0.788 2.790 1.00 0.00 C ATOM 968 CD1 LEU A 66 -3.923 -1.907 2.266 1.00 0.00 C ATOM 969 CD2 LEU A 66 -4.633 -0.552 4.289 1.00 0.00 C ATOM 0 H LEU A 66 -6.735 -0.277 1.002 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.068 1.753 2.866 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.261 0.242 1.001 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.815 1.073 2.478 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.856 -1.111 2.645 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.094 -2.814 2.846 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.152 -2.098 1.217 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.879 -1.608 2.361 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.790 -1.487 4.828 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.621 -0.192 4.474 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.351 0.191 4.635 1.00 0.00 H new ATOM 981 N MET A 67 -5.573 2.455 -0.300 1.00 0.00 N ATOM 982 CA MET A 67 -5.342 3.550 -1.228 1.00 0.00 C ATOM 983 C MET A 67 -6.357 4.675 -1.011 1.00 0.00 C ATOM 984 O MET A 67 -5.995 5.851 -1.013 1.00 0.00 O ATOM 985 CB MET A 67 -5.450 3.034 -2.664 1.00 0.00 C ATOM 986 CG MET A 67 -4.172 2.305 -3.082 1.00 0.00 C ATOM 987 SD MET A 67 -3.915 2.482 -4.839 1.00 0.00 S ATOM 988 CE MET A 67 -5.479 1.870 -5.445 1.00 0.00 C ATOM 0 H MET A 67 -5.724 1.547 -0.740 1.00 0.00 H new ATOM 0 HA MET A 67 -4.343 3.948 -1.050 1.00 0.00 H new ATOM 0 HB2 MET A 67 -6.302 2.359 -2.749 1.00 0.00 H new ATOM 0 HB3 MET A 67 -5.635 3.868 -3.341 1.00 0.00 H new ATOM 0 HG2 MET A 67 -3.318 2.710 -2.539 1.00 0.00 H new ATOM 0 HG3 MET A 67 -4.244 1.249 -2.821 1.00 0.00 H new ATOM 0 HE1 MET A 67 -5.432 1.760 -6.528 1.00 0.00 H new ATOM 0 HE2 MET A 67 -5.692 0.902 -4.991 1.00 0.00 H new ATOM 0 HE3 MET A 67 -6.270 2.574 -5.186 1.00 0.00 H new ATOM 998 N GLU A 68 -7.607 4.274 -0.831 1.00 0.00 N ATOM 999 CA GLU A 68 -8.676 5.234 -0.614 1.00 0.00 C ATOM 1000 C GLU A 68 -8.407 6.051 0.652 1.00 0.00 C ATOM 1001 O GLU A 68 -8.517 7.276 0.640 1.00 0.00 O ATOM 1002 CB GLU A 68 -10.034 4.534 -0.537 1.00 0.00 C ATOM 1003 CG GLU A 68 -10.812 4.701 -1.843 1.00 0.00 C ATOM 1004 CD GLU A 68 -12.061 5.560 -1.631 1.00 0.00 C ATOM 1005 OE1 GLU A 68 -13.034 5.017 -1.066 1.00 0.00 O ATOM 1006 OE2 GLU A 68 -12.013 6.741 -2.040 1.00 0.00 O ATOM 0 H GLU A 68 -7.903 3.298 -0.831 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.704 5.916 -1.464 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -9.889 3.474 -0.329 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.613 4.945 0.290 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -10.172 5.162 -2.595 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -11.100 3.722 -2.227 1.00 0.00 H new ATOM 1013 N GLU A 69 -8.061 5.339 1.715 1.00 0.00 N ATOM 1014 CA GLU A 69 -7.776 5.982 2.986 1.00 0.00 C ATOM 1015 C GLU A 69 -6.578 6.924 2.847 1.00 0.00 C ATOM 1016 O GLU A 69 -6.311 7.730 3.738 1.00 0.00 O ATOM 1017 CB GLU A 69 -7.533 4.944 4.083 1.00 0.00 C ATOM 1018 CG GLU A 69 -8.843 4.564 4.777 1.00 0.00 C ATOM 1019 CD GLU A 69 -8.991 5.300 6.110 1.00 0.00 C ATOM 1020 OE1 GLU A 69 -9.503 6.440 6.075 1.00 0.00 O ATOM 1021 OE2 GLU A 69 -8.590 4.707 7.134 1.00 0.00 O ATOM 0 H GLU A 69 -7.972 4.323 1.722 1.00 0.00 H new ATOM 0 HA GLU A 69 -8.646 6.572 3.276 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.074 4.054 3.652 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.831 5.341 4.816 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.685 4.805 4.129 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -8.870 3.488 4.947 1.00 0.00 H new ATOM 1028 N ASN A 70 -5.889 6.792 1.724 1.00 0.00 N ATOM 1029 CA ASN A 70 -4.726 7.621 1.457 1.00 0.00 C ATOM 1030 C ASN A 70 -3.493 6.986 2.104 1.00 0.00 C ATOM 1031 O ASN A 70 -2.620 7.690 2.609 1.00 0.00 O ATOM 1032 CB ASN A 70 -4.901 9.021 2.048 1.00 0.00 C ATOM 1033 CG ASN A 70 -4.122 10.059 1.237 1.00 0.00 C ATOM 1034 OD1 ASN A 70 -3.957 9.949 0.034 1.00 0.00 O ATOM 1035 ND2 ASN A 70 -3.654 11.072 1.962 1.00 0.00 N ATOM 0 H ASN A 70 -6.114 6.123 0.988 1.00 0.00 H new ATOM 0 HA ASN A 70 -4.607 7.697 0.376 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -5.959 9.284 2.062 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -4.557 9.029 3.082 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -3.121 11.817 1.513 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -3.828 11.103 2.967 1.00 0.00 H new ATOM 1042 N PHE A 71 -3.461 5.662 2.067 1.00 0.00 N ATOM 1043 CA PHE A 71 -2.350 4.924 2.643 1.00 0.00 C ATOM 1044 C PHE A 71 -1.409 4.408 1.552 1.00 0.00 C ATOM 1045 O PHE A 71 -0.262 4.062 1.828 1.00 0.00 O ATOM 1046 CB PHE A 71 -2.945 3.730 3.392 1.00 0.00 C ATOM 1047 CG PHE A 71 -3.668 4.106 4.687 1.00 0.00 C ATOM 1048 CD1 PHE A 71 -3.085 4.965 5.566 1.00 0.00 C ATOM 1049 CD2 PHE A 71 -4.893 3.581 4.959 1.00 0.00 C ATOM 1050 CE1 PHE A 71 -3.756 5.313 6.768 1.00 0.00 C ATOM 1051 CE2 PHE A 71 -5.563 3.930 6.161 1.00 0.00 C ATOM 1052 CZ PHE A 71 -4.981 4.789 7.041 1.00 0.00 C ATOM 0 H PHE A 71 -4.187 5.081 1.647 1.00 0.00 H new ATOM 0 HA PHE A 71 -1.776 5.574 3.304 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -3.644 3.213 2.734 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -2.146 3.026 3.625 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.112 5.382 5.350 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -5.356 2.899 4.261 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -3.293 5.995 7.466 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -6.536 3.513 6.377 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.491 5.054 7.955 1.00 0.00 H new ATOM 1062 N LEU A 72 -1.931 4.373 0.334 1.00 0.00 N ATOM 1063 CA LEU A 72 -1.152 3.906 -0.800 1.00 0.00 C ATOM 1064 C LEU A 72 -1.759 4.458 -2.092 1.00 0.00 C ATOM 1065 O LEU A 72 -2.855 5.016 -2.078 1.00 0.00 O ATOM 1066 CB LEU A 72 -1.036 2.381 -0.778 1.00 0.00 C ATOM 1067 CG LEU A 72 -2.165 1.632 -0.068 1.00 0.00 C ATOM 1068 CD1 LEU A 72 -2.790 0.581 -0.988 1.00 0.00 C ATOM 1069 CD2 LEU A 72 -1.677 1.024 1.248 1.00 0.00 C ATOM 0 H LEU A 72 -2.883 4.660 0.108 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.130 4.281 -0.741 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -0.982 2.026 -1.807 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.093 2.115 -0.299 1.00 0.00 H new ATOM 0 HG LEU A 72 -2.948 2.349 0.179 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.590 0.063 -0.458 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -3.198 1.069 -1.874 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.028 -0.139 -1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.499 0.497 1.732 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -0.866 0.324 1.047 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.317 1.817 1.904 1.00 0.00 H new ATOM 1081 N ARG A 73 -1.020 4.282 -3.177 1.00 0.00 N ATOM 1082 CA ARG A 73 -1.471 4.755 -4.475 1.00 0.00 C ATOM 1083 C ARG A 73 -1.004 3.804 -5.579 1.00 0.00 C ATOM 1084 O ARG A 73 -0.032 3.072 -5.402 1.00 0.00 O ATOM 1085 CB ARG A 73 -0.940 6.161 -4.764 1.00 0.00 C ATOM 1086 CG ARG A 73 0.103 6.577 -3.725 1.00 0.00 C ATOM 1087 CD ARG A 73 -0.014 8.067 -3.397 1.00 0.00 C ATOM 1088 NE ARG A 73 1.252 8.759 -3.728 1.00 0.00 N ATOM 1089 CZ ARG A 73 2.456 8.374 -3.285 1.00 0.00 C ATOM 1090 NH1 ARG A 73 2.566 7.300 -2.491 1.00 0.00 N ATOM 1091 NH2 ARG A 73 3.551 9.062 -3.636 1.00 0.00 N ATOM 0 H ARG A 73 -0.112 3.818 -3.184 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.560 4.787 -4.456 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -0.498 6.189 -5.760 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -1.765 6.873 -4.761 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -0.029 5.989 -2.816 1.00 0.00 H new ATOM 0 HG3 ARG A 73 1.103 6.361 -4.102 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -0.837 8.508 -3.959 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -0.244 8.198 -2.340 1.00 0.00 H new ATOM 0 HE ARG A 73 1.205 9.580 -4.331 1.00 0.00 H new ATOM 0 HH11 ARG A 73 1.733 6.776 -2.224 1.00 0.00 H new ATOM 0 HH12 ARG A 73 3.483 7.007 -2.154 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.468 9.879 -4.241 1.00 0.00 H new ATOM 0 HH22 ARG A 73 4.468 8.769 -3.298 1.00 0.00 H new ATOM 1105 N PRO A 74 -1.739 3.847 -6.723 1.00 0.00 N ATOM 1106 CA PRO A 74 -1.410 2.998 -7.855 1.00 0.00 C ATOM 1107 C PRO A 74 -0.172 3.518 -8.589 1.00 0.00 C ATOM 1108 O PRO A 74 -0.076 4.707 -8.886 1.00 0.00 O ATOM 1109 CB PRO A 74 -2.658 2.998 -8.722 1.00 0.00 C ATOM 1110 CG PRO A 74 -3.468 4.209 -8.287 1.00 0.00 C ATOM 1111 CD PRO A 74 -2.897 4.702 -6.968 1.00 0.00 C ATOM 0 HA PRO A 74 -1.148 1.983 -7.557 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -2.399 3.060 -9.779 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -3.227 2.078 -8.587 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -3.417 4.994 -9.042 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -4.519 3.944 -8.173 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.609 5.751 -7.029 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.628 4.618 -6.164 1.00 0.00 H new ATOM 1119 N VAL A 75 0.744 2.600 -8.861 1.00 0.00 N ATOM 1120 CA VAL A 75 1.972 2.951 -9.554 1.00 0.00 C ATOM 1121 C VAL A 75 2.190 1.981 -10.718 1.00 0.00 C ATOM 1122 O VAL A 75 1.594 0.906 -10.754 1.00 0.00 O ATOM 1123 CB VAL A 75 3.141 2.974 -8.568 1.00 0.00 C ATOM 1124 CG1 VAL A 75 4.469 2.720 -9.286 1.00 0.00 C ATOM 1125 CG2 VAL A 75 3.180 4.293 -7.795 1.00 0.00 C ATOM 0 H VAL A 75 0.660 1.614 -8.614 1.00 0.00 H new ATOM 0 HA VAL A 75 1.900 3.954 -9.975 1.00 0.00 H new ATOM 0 HB VAL A 75 2.989 2.169 -7.849 1.00 0.00 H new ATOM 0 HG11 VAL A 75 5.284 2.742 -8.562 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.440 1.744 -9.771 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.630 3.493 -10.037 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.020 4.283 -7.101 1.00 0.00 H new ATOM 0 HG22 VAL A 75 3.296 5.121 -8.494 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.251 4.416 -7.238 1.00 0.00 H new ATOM 1135 N GLY A 76 3.045 2.397 -11.640 1.00 0.00 N ATOM 1136 CA GLY A 76 3.350 1.578 -12.802 1.00 0.00 C ATOM 1137 C GLY A 76 2.334 1.817 -13.921 1.00 0.00 C ATOM 1138 O GLY A 76 1.286 2.420 -13.696 1.00 0.00 O ATOM 0 H GLY A 76 3.536 3.290 -11.607 1.00 0.00 H new ATOM 0 HA2 GLY A 76 4.353 1.808 -13.161 1.00 0.00 H new ATOM 0 HA3 GLY A 76 3.346 0.525 -12.521 1.00 0.00 H new ATOM 1142 N VAL A 77 2.681 1.331 -15.104 1.00 0.00 N ATOM 1143 CA VAL A 77 1.813 1.483 -16.259 1.00 0.00 C ATOM 1144 C VAL A 77 0.597 0.568 -16.102 1.00 0.00 C ATOM 1145 O VAL A 77 -0.492 0.890 -16.577 1.00 0.00 O ATOM 1146 CB VAL A 77 2.600 1.217 -17.544 1.00 0.00 C ATOM 1147 CG1 VAL A 77 3.909 2.008 -17.559 1.00 0.00 C ATOM 1148 CG2 VAL A 77 2.861 -0.280 -17.727 1.00 0.00 C ATOM 0 H VAL A 77 3.551 0.832 -15.287 1.00 0.00 H new ATOM 0 HA VAL A 77 1.443 2.506 -16.327 1.00 0.00 H new ATOM 0 HB VAL A 77 1.994 1.557 -18.384 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.449 1.801 -18.483 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.691 3.074 -17.498 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.522 1.714 -16.707 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.422 -0.442 -18.648 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.437 -0.655 -16.881 1.00 0.00 H new ATOM 0 HG23 VAL A 77 1.911 -0.811 -17.783 1.00 0.00 H new ATOM 1158 N ARG A 78 0.823 -0.554 -15.435 1.00 0.00 N ATOM 1159 CA ARG A 78 -0.241 -1.518 -15.210 1.00 0.00 C ATOM 1160 C ARG A 78 -1.373 -0.880 -14.403 1.00 0.00 C ATOM 1161 O ARG A 78 -2.498 -0.764 -14.888 1.00 0.00 O ATOM 1162 CB ARG A 78 0.279 -2.748 -14.463 1.00 0.00 C ATOM 1163 CG ARG A 78 -0.609 -3.966 -14.727 1.00 0.00 C ATOM 1164 CD ARG A 78 -0.333 -4.555 -16.112 1.00 0.00 C ATOM 1165 NE ARG A 78 -1.573 -5.142 -16.667 1.00 0.00 N ATOM 1166 CZ ARG A 78 -1.759 -5.414 -17.966 1.00 0.00 C ATOM 1167 NH1 ARG A 78 -0.787 -5.153 -18.851 1.00 0.00 N ATOM 1168 NH2 ARG A 78 -2.917 -5.946 -18.380 1.00 0.00 N ATOM 0 H ARG A 78 1.727 -0.817 -15.043 1.00 0.00 H new ATOM 0 HA ARG A 78 -0.617 -1.831 -16.184 1.00 0.00 H new ATOM 0 HB2 ARG A 78 1.300 -2.963 -14.777 1.00 0.00 H new ATOM 0 HB3 ARG A 78 0.311 -2.542 -13.393 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -0.430 -4.723 -13.964 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.658 -3.679 -14.652 1.00 0.00 H new ATOM 0 HD2 ARG A 78 0.042 -3.778 -16.779 1.00 0.00 H new ATOM 0 HD3 ARG A 78 0.442 -5.318 -16.044 1.00 0.00 H new ATOM 0 HE ARG A 78 -2.333 -5.353 -16.021 1.00 0.00 H new ATOM 0 HH11 ARG A 78 0.094 -4.747 -18.536 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -0.928 -5.360 -19.840 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -3.657 -6.144 -17.706 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -3.059 -6.153 -19.369 1.00 0.00 H new ATOM 1182 N SER A 79 -1.037 -0.482 -13.184 1.00 0.00 N ATOM 1183 CA SER A 79 -2.012 0.141 -12.305 1.00 0.00 C ATOM 1184 C SER A 79 -2.334 1.553 -12.799 1.00 0.00 C ATOM 1185 O SER A 79 -1.956 1.928 -13.907 1.00 0.00 O ATOM 1186 CB SER A 79 -1.503 0.186 -10.863 1.00 0.00 C ATOM 1187 OG SER A 79 -2.548 0.467 -9.936 1.00 0.00 O ATOM 0 H SER A 79 -0.103 -0.579 -12.785 1.00 0.00 H new ATOM 0 HA SER A 79 -2.922 -0.459 -12.322 1.00 0.00 H new ATOM 0 HB2 SER A 79 -1.042 -0.769 -10.611 1.00 0.00 H new ATOM 0 HB3 SER A 79 -0.727 0.947 -10.776 1.00 0.00 H new ATOM 0 HG SER A 79 -2.362 0.015 -9.087 1.00 0.00 H new ATOM 1193 N MET A 80 -3.030 2.297 -11.951 1.00 0.00 N ATOM 1194 CA MET A 80 -3.408 3.659 -12.288 1.00 0.00 C ATOM 1195 C MET A 80 -3.868 3.757 -13.743 1.00 0.00 C ATOM 1196 O MET A 80 -4.165 2.743 -14.374 1.00 0.00 O ATOM 1197 CB MET A 80 -2.214 4.589 -12.066 1.00 0.00 C ATOM 1198 CG MET A 80 -1.094 4.293 -13.066 1.00 0.00 C ATOM 1199 SD MET A 80 -0.028 5.715 -13.227 1.00 0.00 S ATOM 1200 CE MET A 80 -0.222 6.434 -11.605 1.00 0.00 C ATOM 0 H MET A 80 -3.342 1.982 -11.032 1.00 0.00 H new ATOM 0 HA MET A 80 -4.236 3.956 -11.645 1.00 0.00 H new ATOM 0 HB2 MET A 80 -2.533 5.626 -12.168 1.00 0.00 H new ATOM 0 HB3 MET A 80 -1.840 4.469 -11.049 1.00 0.00 H new ATOM 0 HG2 MET A 80 -0.516 3.431 -12.733 1.00 0.00 H new ATOM 0 HG3 MET A 80 -1.520 4.036 -14.036 1.00 0.00 H new ATOM 0 HE1 MET A 80 0.605 7.116 -11.408 1.00 0.00 H new ATOM 0 HE2 MET A 80 -1.163 6.982 -11.560 1.00 0.00 H new ATOM 0 HE3 MET A 80 -0.226 5.643 -10.855 1.00 0.00 H new ATOM 1210 N GLY A 81 -3.912 4.986 -14.235 1.00 0.00 N ATOM 1211 CA GLY A 81 -4.331 5.230 -15.605 1.00 0.00 C ATOM 1212 C GLY A 81 -5.416 6.307 -15.663 1.00 0.00 C ATOM 1213 O GLY A 81 -5.490 7.068 -16.627 1.00 0.00 O ATOM 0 H GLY A 81 -3.664 5.824 -13.709 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -3.473 5.540 -16.202 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.707 4.306 -16.044 1.00 0.00 H new ATOM 1217 N ALA A 82 -6.232 6.337 -14.619 1.00 0.00 N ATOM 1218 CA ALA A 82 -7.310 7.308 -14.540 1.00 0.00 C ATOM 1219 C ALA A 82 -7.855 7.342 -13.111 1.00 0.00 C ATOM 1220 O ALA A 82 -8.030 8.415 -12.534 1.00 0.00 O ATOM 1221 CB ALA A 82 -8.388 6.959 -15.567 1.00 0.00 C ATOM 0 H ALA A 82 -6.168 5.705 -13.821 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.945 8.307 -14.778 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -9.197 7.688 -15.508 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.956 6.977 -16.568 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.780 5.964 -15.359 1.00 0.00 H new ATOM 1227 N ILE A 83 -8.109 6.155 -12.580 1.00 0.00 N ATOM 1228 CA ILE A 83 -8.630 6.036 -11.229 1.00 0.00 C ATOM 1229 C ILE A 83 -9.678 7.125 -10.993 1.00 0.00 C ATOM 1230 O ILE A 83 -10.615 7.271 -11.777 1.00 0.00 O ATOM 1231 CB ILE A 83 -7.489 6.050 -10.210 1.00 0.00 C ATOM 1232 CG1 ILE A 83 -6.313 5.197 -10.692 1.00 0.00 C ATOM 1233 CG2 ILE A 83 -7.982 5.617 -8.828 1.00 0.00 C ATOM 1234 CD1 ILE A 83 -5.219 6.071 -11.308 1.00 0.00 C ATOM 0 H ILE A 83 -7.964 5.267 -13.061 1.00 0.00 H new ATOM 0 HA ILE A 83 -9.131 5.077 -11.098 1.00 0.00 H new ATOM 0 HB ILE A 83 -7.128 7.074 -10.116 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -5.903 4.630 -9.856 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.662 4.472 -11.428 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -7.151 5.636 -8.123 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.761 6.300 -8.489 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.386 4.606 -8.886 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -4.395 5.441 -11.642 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -5.626 6.618 -12.159 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -4.855 6.778 -10.562 1.00 0.00 H new ATOM 1246 N ARG A 84 -9.485 7.863 -9.910 1.00 0.00 N ATOM 1247 CA ARG A 84 -10.402 8.935 -9.561 1.00 0.00 C ATOM 1248 C ARG A 84 -11.791 8.369 -9.259 1.00 0.00 C ATOM 1249 O ARG A 84 -12.777 9.104 -9.251 1.00 0.00 O ATOM 1250 CB ARG A 84 -10.510 9.957 -10.694 1.00 0.00 C ATOM 1251 CG ARG A 84 -9.196 10.721 -10.872 1.00 0.00 C ATOM 1252 CD ARG A 84 -8.870 11.548 -9.627 1.00 0.00 C ATOM 1253 NE ARG A 84 -7.957 12.658 -9.982 1.00 0.00 N ATOM 1254 CZ ARG A 84 -7.794 13.762 -9.241 1.00 0.00 C ATOM 1255 NH1 ARG A 84 -8.481 13.911 -8.100 1.00 0.00 N ATOM 1256 NH2 ARG A 84 -6.944 14.718 -9.640 1.00 0.00 N ATOM 0 H ARG A 84 -8.707 7.740 -9.262 1.00 0.00 H new ATOM 0 HA ARG A 84 -10.009 9.432 -8.674 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -10.768 9.449 -11.623 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -11.316 10.658 -10.480 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -8.386 10.018 -11.068 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -9.267 11.376 -11.740 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -9.788 11.945 -9.194 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -8.408 10.914 -8.870 1.00 0.00 H new ATOM 0 HE ARG A 84 -7.419 12.577 -10.845 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -9.128 13.184 -7.796 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -8.357 14.752 -7.536 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -6.421 14.605 -10.508 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -6.820 15.558 -9.075 1.00 0.00 H new ATOM 1270 N SER A 85 -11.824 7.066 -9.018 1.00 0.00 N ATOM 1271 CA SER A 85 -13.076 6.393 -8.717 1.00 0.00 C ATOM 1272 C SER A 85 -13.093 5.951 -7.252 1.00 0.00 C ATOM 1273 O SER A 85 -12.849 4.783 -6.950 1.00 0.00 O ATOM 1274 CB SER A 85 -13.290 5.190 -9.637 1.00 0.00 C ATOM 1275 OG SER A 85 -14.415 5.365 -10.493 1.00 0.00 O ATOM 0 H SER A 85 -11.004 6.459 -9.025 1.00 0.00 H new ATOM 0 HA SER A 85 -13.892 7.096 -8.888 1.00 0.00 H new ATOM 0 HB2 SER A 85 -12.396 5.032 -10.241 1.00 0.00 H new ATOM 0 HB3 SER A 85 -13.430 4.293 -9.034 1.00 0.00 H new ATOM 0 HG SER A 85 -14.516 4.576 -11.065 1.00 0.00 H new ATOM 1281 N GLY A 86 -13.383 6.906 -6.382 1.00 0.00 N ATOM 1282 CA GLY A 86 -13.434 6.630 -4.956 1.00 0.00 C ATOM 1283 C GLY A 86 -14.434 5.512 -4.651 1.00 0.00 C ATOM 1284 O GLY A 86 -14.189 4.351 -4.972 1.00 0.00 O ATOM 0 H GLY A 86 -13.585 7.873 -6.637 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.444 6.344 -4.601 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -13.717 7.534 -4.417 1.00 0.00 H new ATOM 1288 N ASP A 87 -15.539 5.903 -4.033 1.00 0.00 N ATOM 1289 CA ASP A 87 -16.576 4.949 -3.680 1.00 0.00 C ATOM 1290 C ASP A 87 -15.926 3.650 -3.200 1.00 0.00 C ATOM 1291 O ASP A 87 -14.774 3.650 -2.769 1.00 0.00 O ATOM 1292 CB ASP A 87 -17.455 4.619 -4.888 1.00 0.00 C ATOM 1293 CG ASP A 87 -16.819 3.677 -5.912 1.00 0.00 C ATOM 1294 OD1 ASP A 87 -15.951 4.163 -6.668 1.00 0.00 O ATOM 1295 OD2 ASP A 87 -17.216 2.491 -5.916 1.00 0.00 O ATOM 0 H ASP A 87 -15.738 6.868 -3.768 1.00 0.00 H new ATOM 0 HA ASP A 87 -17.191 5.393 -2.897 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -18.383 4.171 -4.532 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -17.722 5.549 -5.389 1.00 0.00 H new ATOM 1300 N LEU A 88 -16.693 2.573 -3.289 1.00 0.00 N ATOM 1301 CA LEU A 88 -16.206 1.270 -2.869 1.00 0.00 C ATOM 1302 C LEU A 88 -15.566 0.560 -4.064 1.00 0.00 C ATOM 1303 O LEU A 88 -15.506 -0.668 -4.102 1.00 0.00 O ATOM 1304 CB LEU A 88 -17.327 0.468 -2.206 1.00 0.00 C ATOM 1305 CG LEU A 88 -16.944 -0.296 -0.936 1.00 0.00 C ATOM 1306 CD1 LEU A 88 -15.730 -1.193 -1.181 1.00 0.00 C ATOM 1307 CD2 LEU A 88 -16.721 0.664 0.235 1.00 0.00 C ATOM 0 H LEU A 88 -17.649 2.576 -3.646 1.00 0.00 H new ATOM 0 HA LEU A 88 -15.431 1.379 -2.110 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -18.141 1.151 -1.964 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -17.715 -0.246 -2.933 1.00 0.00 H new ATOM 0 HG LEU A 88 -17.775 -0.947 -0.665 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -15.479 -1.724 -0.263 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -15.962 -1.913 -1.965 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -14.882 -0.581 -1.490 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -16.450 0.096 1.125 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -15.917 1.358 -0.011 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -17.637 1.223 0.427 1.00 0.00 H new ATOM 1319 N ALA A 89 -15.103 1.364 -5.010 1.00 0.00 N ATOM 1320 CA ALA A 89 -14.469 0.828 -6.203 1.00 0.00 C ATOM 1321 C ALA A 89 -13.340 -0.121 -5.793 1.00 0.00 C ATOM 1322 O ALA A 89 -13.044 -0.263 -4.608 1.00 0.00 O ATOM 1323 CB ALA A 89 -13.973 1.980 -7.079 1.00 0.00 C ATOM 0 H ALA A 89 -15.154 2.382 -4.975 1.00 0.00 H new ATOM 0 HA ALA A 89 -15.184 0.254 -6.793 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -13.497 1.578 -7.974 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -14.817 2.607 -7.367 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.251 2.576 -6.521 1.00 0.00 H new ATOM 1329 N GLU A 90 -12.742 -0.746 -6.796 1.00 0.00 N ATOM 1330 CA GLU A 90 -11.653 -1.677 -6.555 1.00 0.00 C ATOM 1331 C GLU A 90 -10.518 -1.436 -7.553 1.00 0.00 C ATOM 1332 O GLU A 90 -9.998 -2.380 -8.146 1.00 0.00 O ATOM 1333 CB GLU A 90 -12.144 -3.124 -6.622 1.00 0.00 C ATOM 1334 CG GLU A 90 -13.237 -3.381 -5.582 1.00 0.00 C ATOM 1335 CD GLU A 90 -14.303 -4.332 -6.130 1.00 0.00 C ATOM 1336 OE1 GLU A 90 -13.910 -5.251 -6.881 1.00 0.00 O ATOM 1337 OE2 GLU A 90 -15.485 -4.118 -5.786 1.00 0.00 O ATOM 0 H GLU A 90 -12.991 -0.626 -7.778 1.00 0.00 H new ATOM 0 HA GLU A 90 -11.269 -1.505 -5.549 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -12.529 -3.335 -7.620 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -11.309 -3.803 -6.452 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -12.794 -3.806 -4.681 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -13.700 -2.437 -5.295 1.00 0.00 H new ATOM 1344 N GLN A 91 -10.168 -0.168 -7.708 1.00 0.00 N ATOM 1345 CA GLN A 91 -9.105 0.209 -8.624 1.00 0.00 C ATOM 1346 C GLN A 91 -7.774 -0.395 -8.169 1.00 0.00 C ATOM 1347 O GLN A 91 -6.934 0.302 -7.602 1.00 0.00 O ATOM 1348 CB GLN A 91 -9.002 1.730 -8.749 1.00 0.00 C ATOM 1349 CG GLN A 91 -9.280 2.182 -10.184 1.00 0.00 C ATOM 1350 CD GLN A 91 -8.504 1.328 -11.188 1.00 0.00 C ATOM 1351 OE1 GLN A 91 -7.285 1.341 -11.241 1.00 0.00 O ATOM 1352 NE2 GLN A 91 -9.275 0.588 -11.979 1.00 0.00 N ATOM 0 H GLN A 91 -10.602 0.612 -7.214 1.00 0.00 H new ATOM 0 HA GLN A 91 -9.344 -0.188 -9.611 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -9.712 2.203 -8.071 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -8.007 2.057 -8.447 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -10.348 2.112 -10.391 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -9.001 3.229 -10.300 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -10.290 0.625 -11.881 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -8.852 -0.016 -12.683 1.00 0.00 H new ATOM 1361 N PHE A 92 -7.625 -1.684 -8.435 1.00 0.00 N ATOM 1362 CA PHE A 92 -6.411 -2.389 -8.060 1.00 0.00 C ATOM 1363 C PHE A 92 -6.206 -3.630 -8.932 1.00 0.00 C ATOM 1364 O PHE A 92 -7.079 -3.990 -9.721 1.00 0.00 O ATOM 1365 CB PHE A 92 -6.578 -2.826 -6.603 1.00 0.00 C ATOM 1366 CG PHE A 92 -5.265 -3.187 -5.907 1.00 0.00 C ATOM 1367 CD1 PHE A 92 -4.484 -2.208 -5.377 1.00 0.00 C ATOM 1368 CD2 PHE A 92 -4.878 -4.488 -5.817 1.00 0.00 C ATOM 1369 CE1 PHE A 92 -3.265 -2.543 -4.731 1.00 0.00 C ATOM 1370 CE2 PHE A 92 -3.659 -4.824 -5.171 1.00 0.00 C ATOM 1371 CZ PHE A 92 -2.879 -3.844 -4.641 1.00 0.00 C ATOM 0 H PHE A 92 -8.324 -2.259 -8.905 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.547 -1.738 -8.192 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -7.063 -2.024 -6.047 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.245 -3.687 -6.567 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -4.791 -1.175 -5.448 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.498 -5.266 -6.237 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -2.644 -1.765 -4.311 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.351 -5.857 -5.101 1.00 0.00 H new ATOM 0 HZ PHE A 92 -1.952 -4.099 -4.148 1.00 0.00 H new ATOM 1381 N LEU A 93 -5.048 -4.251 -8.760 1.00 0.00 N ATOM 1382 CA LEU A 93 -4.718 -5.444 -9.521 1.00 0.00 C ATOM 1383 C LEU A 93 -3.970 -6.428 -8.619 1.00 0.00 C ATOM 1384 O LEU A 93 -3.637 -6.102 -7.481 1.00 0.00 O ATOM 1385 CB LEU A 93 -3.955 -5.073 -10.794 1.00 0.00 C ATOM 1386 CG LEU A 93 -4.444 -3.824 -11.529 1.00 0.00 C ATOM 1387 CD1 LEU A 93 -3.303 -3.161 -12.304 1.00 0.00 C ATOM 1388 CD2 LEU A 93 -5.635 -4.150 -12.432 1.00 0.00 C ATOM 0 H LEU A 93 -4.327 -3.950 -8.105 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.626 -5.946 -9.856 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.905 -4.931 -10.536 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -4.003 -5.917 -11.482 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.790 -3.105 -10.786 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -3.678 -2.276 -12.817 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.513 -2.871 -11.611 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -2.904 -3.863 -13.036 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -5.963 -3.245 -12.943 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.339 -4.896 -13.170 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -6.453 -4.542 -11.828 1.00 0.00 H new ATOM 1400 N ASP A 94 -3.727 -7.611 -9.163 1.00 0.00 N ATOM 1401 CA ASP A 94 -3.024 -8.645 -8.422 1.00 0.00 C ATOM 1402 C ASP A 94 -2.148 -9.449 -9.384 1.00 0.00 C ATOM 1403 O ASP A 94 -2.473 -10.586 -9.723 1.00 0.00 O ATOM 1404 CB ASP A 94 -4.007 -9.611 -7.757 1.00 0.00 C ATOM 1405 CG ASP A 94 -3.371 -10.861 -7.145 1.00 0.00 C ATOM 1406 OD1 ASP A 94 -2.811 -10.727 -6.036 1.00 0.00 O ATOM 1407 OD2 ASP A 94 -3.459 -11.922 -7.801 1.00 0.00 O ATOM 0 H ASP A 94 -4.004 -7.877 -10.108 1.00 0.00 H new ATOM 0 HA ASP A 94 -2.421 -8.160 -7.655 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -4.546 -9.076 -6.975 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -4.744 -9.922 -8.497 1.00 0.00 H new ATOM 1412 N ASP A 95 -1.053 -8.828 -9.796 1.00 0.00 N ATOM 1413 CA ASP A 95 -0.127 -9.471 -10.712 1.00 0.00 C ATOM 1414 C ASP A 95 1.306 -9.086 -10.337 1.00 0.00 C ATOM 1415 O ASP A 95 1.525 -8.375 -9.358 1.00 0.00 O ATOM 1416 CB ASP A 95 -0.375 -9.021 -12.153 1.00 0.00 C ATOM 1417 CG ASP A 95 -0.933 -10.102 -13.081 1.00 0.00 C ATOM 1418 OD1 ASP A 95 -0.770 -11.291 -12.730 1.00 0.00 O ATOM 1419 OD2 ASP A 95 -1.509 -9.716 -14.121 1.00 0.00 O ATOM 0 H ASP A 95 -0.786 -7.885 -9.512 1.00 0.00 H new ATOM 0 HA ASP A 95 -0.276 -10.548 -10.640 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.069 -8.180 -12.141 1.00 0.00 H new ATOM 0 HB3 ASP A 95 0.563 -8.654 -12.570 1.00 0.00 H new ATOM 1424 N SER A 96 2.244 -9.573 -11.136 1.00 0.00 N ATOM 1425 CA SER A 96 3.649 -9.289 -10.900 1.00 0.00 C ATOM 1426 C SER A 96 4.073 -8.052 -11.694 1.00 0.00 C ATOM 1427 O SER A 96 5.221 -7.950 -12.124 1.00 0.00 O ATOM 1428 CB SER A 96 4.524 -10.487 -11.275 1.00 0.00 C ATOM 1429 OG SER A 96 4.791 -10.535 -12.674 1.00 0.00 O ATOM 0 H SER A 96 2.058 -10.162 -11.947 1.00 0.00 H new ATOM 0 HA SER A 96 3.785 -9.094 -9.836 1.00 0.00 H new ATOM 0 HB2 SER A 96 5.465 -10.434 -10.728 1.00 0.00 H new ATOM 0 HB3 SER A 96 4.028 -11.408 -10.969 1.00 0.00 H new ATOM 0 HG SER A 96 5.344 -9.767 -12.928 1.00 0.00 H new ATOM 1435 N THR A 97 3.124 -7.144 -11.865 1.00 0.00 N ATOM 1436 CA THR A 97 3.385 -5.918 -12.601 1.00 0.00 C ATOM 1437 C THR A 97 2.824 -4.713 -11.844 1.00 0.00 C ATOM 1438 O THR A 97 3.531 -3.731 -11.620 1.00 0.00 O ATOM 1439 CB THR A 97 2.804 -6.077 -14.007 1.00 0.00 C ATOM 1440 OG1 THR A 97 1.609 -6.828 -13.806 1.00 0.00 O ATOM 1441 CG2 THR A 97 3.663 -6.976 -14.898 1.00 0.00 C ATOM 0 H THR A 97 2.173 -7.232 -11.507 1.00 0.00 H new ATOM 0 HA THR A 97 4.455 -5.734 -12.696 1.00 0.00 H new ATOM 0 HB THR A 97 2.704 -5.096 -14.471 1.00 0.00 H new ATOM 0 HG1 THR A 97 1.167 -6.976 -14.668 1.00 0.00 H new ATOM 0 HG21 THR A 97 3.205 -7.055 -15.884 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.660 -6.547 -14.994 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.736 -7.968 -14.452 1.00 0.00 H new ATOM 1449 N ALA A 98 1.558 -4.826 -11.471 1.00 0.00 N ATOM 1450 CA ALA A 98 0.893 -3.757 -10.744 1.00 0.00 C ATOM 1451 C ALA A 98 1.805 -3.270 -9.616 1.00 0.00 C ATOM 1452 O ALA A 98 2.220 -4.055 -8.765 1.00 0.00 O ATOM 1453 CB ALA A 98 -0.458 -4.255 -10.227 1.00 0.00 C ATOM 0 H ALA A 98 0.975 -5.641 -11.658 1.00 0.00 H new ATOM 0 HA ALA A 98 0.698 -2.909 -11.401 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -0.957 -3.454 -9.682 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -1.079 -4.562 -11.069 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -0.302 -5.104 -9.562 1.00 0.00 H new ATOM 1459 N LEU A 99 2.091 -1.976 -9.646 1.00 0.00 N ATOM 1460 CA LEU A 99 2.946 -1.375 -8.637 1.00 0.00 C ATOM 1461 C LEU A 99 2.100 -0.491 -7.718 1.00 0.00 C ATOM 1462 O LEU A 99 1.144 0.141 -8.167 1.00 0.00 O ATOM 1463 CB LEU A 99 4.114 -0.638 -9.295 1.00 0.00 C ATOM 1464 CG LEU A 99 5.353 -1.481 -9.599 1.00 0.00 C ATOM 1465 CD1 LEU A 99 6.516 -0.601 -10.061 1.00 0.00 C ATOM 1466 CD2 LEU A 99 5.734 -2.351 -8.399 1.00 0.00 C ATOM 0 H LEU A 99 1.745 -1.328 -10.353 1.00 0.00 H new ATOM 0 HA LEU A 99 3.397 -2.145 -8.012 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.761 -0.198 -10.228 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.410 0.186 -8.646 1.00 0.00 H new ATOM 0 HG LEU A 99 5.113 -2.155 -10.421 1.00 0.00 H new ATOM 0 HD11 LEU A 99 7.384 -1.226 -10.270 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.229 -0.064 -10.965 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.765 0.115 -9.277 1.00 0.00 H new ATOM 0 HD21 LEU A 99 6.618 -2.940 -8.643 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.948 -1.714 -7.541 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.908 -3.020 -8.158 1.00 0.00 H new ATOM 1478 N TYR A 100 2.481 -0.475 -6.450 1.00 0.00 N ATOM 1479 CA TYR A 100 1.769 0.321 -5.464 1.00 0.00 C ATOM 1480 C TYR A 100 2.731 0.883 -4.415 1.00 0.00 C ATOM 1481 O TYR A 100 3.637 0.185 -3.962 1.00 0.00 O ATOM 1482 CB TYR A 100 0.788 -0.633 -4.781 1.00 0.00 C ATOM 1483 CG TYR A 100 -0.364 -1.089 -5.679 1.00 0.00 C ATOM 1484 CD1 TYR A 100 -1.348 -0.195 -6.047 1.00 0.00 C ATOM 1485 CD2 TYR A 100 -0.418 -2.396 -6.121 1.00 0.00 C ATOM 1486 CE1 TYR A 100 -2.432 -0.625 -6.893 1.00 0.00 C ATOM 1487 CE2 TYR A 100 -1.501 -2.825 -6.967 1.00 0.00 C ATOM 1488 CZ TYR A 100 -2.455 -1.919 -7.311 1.00 0.00 C ATOM 1489 OH TYR A 100 -3.478 -2.325 -8.109 1.00 0.00 O ATOM 0 H TYR A 100 3.274 -1.001 -6.082 1.00 0.00 H new ATOM 0 HA TYR A 100 1.269 1.164 -5.940 1.00 0.00 H new ATOM 0 HB2 TYR A 100 1.333 -1.510 -4.433 1.00 0.00 H new ATOM 0 HB3 TYR A 100 0.376 -0.143 -3.899 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -1.306 0.827 -5.701 1.00 0.00 H new ATOM 0 HD2 TYR A 100 0.352 -3.096 -5.832 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -3.209 0.065 -7.189 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -1.555 -3.844 -7.321 1.00 0.00 H new ATOM 0 HH TYR A 100 -3.119 -2.646 -8.963 1.00 0.00 H new ATOM 1499 N THR A 101 2.500 2.138 -4.058 1.00 0.00 N ATOM 1500 CA THR A 101 3.334 2.801 -3.071 1.00 0.00 C ATOM 1501 C THR A 101 2.470 3.409 -1.964 1.00 0.00 C ATOM 1502 O THR A 101 1.255 3.529 -2.116 1.00 0.00 O ATOM 1503 CB THR A 101 4.202 3.829 -3.798 1.00 0.00 C ATOM 1504 OG1 THR A 101 4.975 4.427 -2.761 1.00 0.00 O ATOM 1505 CG2 THR A 101 3.382 4.989 -4.368 1.00 0.00 C ATOM 0 H THR A 101 1.747 2.713 -4.435 1.00 0.00 H new ATOM 0 HA THR A 101 3.995 2.092 -2.572 1.00 0.00 H new ATOM 0 HB THR A 101 4.747 3.338 -4.605 1.00 0.00 H new ATOM 0 HG1 THR A 101 5.824 3.947 -2.668 1.00 0.00 H new ATOM 0 HG21 THR A 101 4.046 5.690 -4.874 1.00 0.00 H new ATOM 0 HG22 THR A 101 2.652 4.603 -5.079 1.00 0.00 H new ATOM 0 HG23 THR A 101 2.863 5.501 -3.557 1.00 0.00 H new ATOM 1513 N PHE A 102 3.130 3.776 -0.876 1.00 0.00 N ATOM 1514 CA PHE A 102 2.438 4.369 0.255 1.00 0.00 C ATOM 1515 C PHE A 102 2.218 5.868 0.040 1.00 0.00 C ATOM 1516 O PHE A 102 3.161 6.602 -0.251 1.00 0.00 O ATOM 1517 CB PHE A 102 3.330 4.168 1.482 1.00 0.00 C ATOM 1518 CG PHE A 102 3.523 2.702 1.877 1.00 0.00 C ATOM 1519 CD1 PHE A 102 2.472 1.982 2.353 1.00 0.00 C ATOM 1520 CD2 PHE A 102 4.746 2.120 1.752 1.00 0.00 C ATOM 1521 CE1 PHE A 102 2.652 0.622 2.720 1.00 0.00 C ATOM 1522 CE2 PHE A 102 4.925 0.760 2.119 1.00 0.00 C ATOM 1523 CZ PHE A 102 3.874 0.040 2.595 1.00 0.00 C ATOM 0 H PHE A 102 4.137 3.674 -0.754 1.00 0.00 H new ATOM 0 HA PHE A 102 1.462 3.900 0.380 1.00 0.00 H new ATOM 0 HB2 PHE A 102 4.306 4.612 1.286 1.00 0.00 H new ATOM 0 HB3 PHE A 102 2.898 4.707 2.325 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.501 2.444 2.452 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.580 2.692 1.374 1.00 0.00 H new ATOM 0 HE1 PHE A 102 1.818 0.050 3.099 1.00 0.00 H new ATOM 0 HE2 PHE A 102 5.896 0.297 2.020 1.00 0.00 H new ATOM 0 HZ PHE A 102 4.010 -0.994 2.874 1.00 0.00 H new ATOM 1533 N ALA A 103 0.967 6.278 0.191 1.00 0.00 N ATOM 1534 CA ALA A 103 0.612 7.676 0.017 1.00 0.00 C ATOM 1535 C ALA A 103 1.165 8.488 1.189 1.00 0.00 C ATOM 1536 O ALA A 103 1.279 7.979 2.303 1.00 0.00 O ATOM 1537 CB ALA A 103 -0.907 7.804 -0.117 1.00 0.00 C ATOM 0 H ALA A 103 0.187 5.667 0.432 1.00 0.00 H new ATOM 0 HA ALA A 103 1.054 8.074 -0.896 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.174 8.853 -0.248 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.245 7.233 -0.982 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.386 7.417 0.783 1.00 0.00 H new ATOM 1543 N GLU A 104 1.494 9.739 0.899 1.00 0.00 N ATOM 1544 CA GLU A 104 2.032 10.626 1.915 1.00 0.00 C ATOM 1545 C GLU A 104 3.521 10.347 2.129 1.00 0.00 C ATOM 1546 O GLU A 104 4.341 11.263 2.079 1.00 0.00 O ATOM 1547 CB GLU A 104 1.255 10.493 3.226 1.00 0.00 C ATOM 1548 CG GLU A 104 -0.245 10.352 2.963 1.00 0.00 C ATOM 1549 CD GLU A 104 -1.060 10.803 4.177 1.00 0.00 C ATOM 1550 OE1 GLU A 104 -1.225 9.967 5.092 1.00 0.00 O ATOM 1551 OE2 GLU A 104 -1.500 11.973 4.162 1.00 0.00 O ATOM 0 H GLU A 104 1.398 10.159 -0.026 1.00 0.00 H new ATOM 0 HA GLU A 104 1.921 11.653 1.568 1.00 0.00 H new ATOM 0 HB2 GLU A 104 1.614 9.625 3.779 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.438 11.367 3.851 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -0.523 10.947 2.093 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.480 9.314 2.728 1.00 0.00 H new ATOM 1558 N SER A 105 3.825 9.079 2.363 1.00 0.00 N ATOM 1559 CA SER A 105 5.201 8.668 2.585 1.00 0.00 C ATOM 1560 C SER A 105 5.607 8.959 4.031 1.00 0.00 C ATOM 1561 O SER A 105 5.054 9.856 4.666 1.00 0.00 O ATOM 1562 CB SER A 105 6.150 9.374 1.614 1.00 0.00 C ATOM 1563 OG SER A 105 5.571 9.534 0.322 1.00 0.00 O ATOM 0 H SER A 105 3.142 8.323 2.404 1.00 0.00 H new ATOM 0 HA SER A 105 5.271 7.595 2.404 1.00 0.00 H new ATOM 0 HB2 SER A 105 6.417 10.352 2.015 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.073 8.801 1.529 1.00 0.00 H new ATOM 0 HG SER A 105 6.207 9.990 -0.267 1.00 0.00 H new ATOM 1569 N TYR A 106 6.570 8.185 4.508 1.00 0.00 N ATOM 1570 CA TYR A 106 7.057 8.348 5.868 1.00 0.00 C ATOM 1571 C TYR A 106 8.518 7.909 5.983 1.00 0.00 C ATOM 1572 O TYR A 106 9.177 7.659 4.975 1.00 0.00 O ATOM 1573 CB TYR A 106 6.192 7.435 6.738 1.00 0.00 C ATOM 1574 CG TYR A 106 6.089 5.998 6.223 1.00 0.00 C ATOM 1575 CD1 TYR A 106 7.184 5.161 6.289 1.00 0.00 C ATOM 1576 CD2 TYR A 106 4.901 5.539 5.691 1.00 0.00 C ATOM 1577 CE1 TYR A 106 7.087 3.809 5.804 1.00 0.00 C ATOM 1578 CE2 TYR A 106 4.804 4.187 5.206 1.00 0.00 C ATOM 1579 CZ TYR A 106 5.902 3.389 5.286 1.00 0.00 C ATOM 1580 OH TYR A 106 5.811 2.111 4.828 1.00 0.00 O ATOM 0 H TYR A 106 7.027 7.443 3.977 1.00 0.00 H new ATOM 0 HA TYR A 106 7.000 9.393 6.174 1.00 0.00 H new ATOM 0 HB2 TYR A 106 6.601 7.419 7.748 1.00 0.00 H new ATOM 0 HB3 TYR A 106 5.190 7.858 6.806 1.00 0.00 H new ATOM 0 HD1 TYR A 106 8.114 5.520 6.705 1.00 0.00 H new ATOM 0 HD2 TYR A 106 4.044 6.194 5.639 1.00 0.00 H new ATOM 0 HE1 TYR A 106 7.936 3.143 5.851 1.00 0.00 H new ATOM 0 HE2 TYR A 106 3.880 3.815 4.788 1.00 0.00 H new ATOM 0 HH TYR A 106 5.489 2.117 3.902 1.00 0.00 H new ATOM 1590 N LYS A 107 8.982 7.827 7.222 1.00 0.00 N ATOM 1591 CA LYS A 107 10.353 7.422 7.483 1.00 0.00 C ATOM 1592 C LYS A 107 10.654 6.134 6.713 1.00 0.00 C ATOM 1593 O LYS A 107 10.283 5.045 7.149 1.00 0.00 O ATOM 1594 CB LYS A 107 10.602 7.311 8.988 1.00 0.00 C ATOM 1595 CG LYS A 107 11.248 8.587 9.532 1.00 0.00 C ATOM 1596 CD LYS A 107 12.754 8.596 9.264 1.00 0.00 C ATOM 1597 CE LYS A 107 13.325 10.010 9.394 1.00 0.00 C ATOM 1598 NZ LYS A 107 14.543 10.154 8.565 1.00 0.00 N ATOM 0 H LYS A 107 8.433 8.034 8.056 1.00 0.00 H new ATOM 0 HA LYS A 107 11.049 8.180 7.124 1.00 0.00 H new ATOM 0 HB2 LYS A 107 9.659 7.128 9.504 1.00 0.00 H new ATOM 0 HB3 LYS A 107 11.248 6.457 9.191 1.00 0.00 H new ATOM 0 HG2 LYS A 107 10.787 9.459 9.068 1.00 0.00 H new ATOM 0 HG3 LYS A 107 11.065 8.663 10.604 1.00 0.00 H new ATOM 0 HD2 LYS A 107 13.256 7.931 9.967 1.00 0.00 H new ATOM 0 HD3 LYS A 107 12.951 8.211 8.264 1.00 0.00 H new ATOM 0 HE2 LYS A 107 12.578 10.740 9.084 1.00 0.00 H new ATOM 0 HE3 LYS A 107 13.561 10.219 10.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 14.918 11.119 8.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 15.260 9.470 8.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 14.308 9.975 7.568 1.00 0.00 H new ATOM 1612 N LYS A 108 11.325 6.301 5.583 1.00 0.00 N ATOM 1613 CA LYS A 108 11.681 5.166 4.749 1.00 0.00 C ATOM 1614 C LYS A 108 12.812 5.569 3.802 1.00 0.00 C ATOM 1615 O LYS A 108 12.564 5.944 2.657 1.00 0.00 O ATOM 1616 CB LYS A 108 10.445 4.619 4.033 1.00 0.00 C ATOM 1617 CG LYS A 108 10.770 3.320 3.293 1.00 0.00 C ATOM 1618 CD LYS A 108 9.650 2.292 3.471 1.00 0.00 C ATOM 1619 CE LYS A 108 10.182 1.005 4.102 1.00 0.00 C ATOM 1620 NZ LYS A 108 10.053 1.059 5.576 1.00 0.00 N ATOM 0 H LYS A 108 11.632 7.206 5.225 1.00 0.00 H new ATOM 0 HA LYS A 108 12.055 4.346 5.362 1.00 0.00 H new ATOM 0 HB2 LYS A 108 9.650 4.440 4.757 1.00 0.00 H new ATOM 0 HB3 LYS A 108 10.072 5.360 3.327 1.00 0.00 H new ATOM 0 HG2 LYS A 108 10.913 3.527 2.232 1.00 0.00 H new ATOM 0 HG3 LYS A 108 11.708 2.909 3.667 1.00 0.00 H new ATOM 0 HD2 LYS A 108 8.864 2.711 4.099 1.00 0.00 H new ATOM 0 HD3 LYS A 108 9.200 2.068 2.504 1.00 0.00 H new ATOM 0 HE2 LYS A 108 9.631 0.148 3.714 1.00 0.00 H new ATOM 0 HE3 LYS A 108 11.227 0.863 3.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 10.419 0.177 5.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 10.598 1.865 5.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 9.052 1.172 5.833 1.00 0.00 H new ATOM 1634 N LYS A 109 14.031 5.479 4.314 1.00 0.00 N ATOM 1635 CA LYS A 109 15.201 5.830 3.528 1.00 0.00 C ATOM 1636 C LYS A 109 15.445 4.748 2.474 1.00 0.00 C ATOM 1637 O LYS A 109 15.220 3.566 2.729 1.00 0.00 O ATOM 1638 CB LYS A 109 16.403 6.082 4.440 1.00 0.00 C ATOM 1639 CG LYS A 109 17.688 6.237 3.623 1.00 0.00 C ATOM 1640 CD LYS A 109 18.561 7.363 4.181 1.00 0.00 C ATOM 1641 CE LYS A 109 19.993 7.261 3.652 1.00 0.00 C ATOM 1642 NZ LYS A 109 20.304 8.411 2.774 1.00 0.00 N ATOM 0 H LYS A 109 14.233 5.168 5.264 1.00 0.00 H new ATOM 0 HA LYS A 109 15.034 6.765 2.993 1.00 0.00 H new ATOM 0 HB2 LYS A 109 16.233 6.982 5.031 1.00 0.00 H new ATOM 0 HB3 LYS A 109 16.511 5.255 5.142 1.00 0.00 H new ATOM 0 HG2 LYS A 109 18.245 5.300 3.634 1.00 0.00 H new ATOM 0 HG3 LYS A 109 17.439 6.447 2.583 1.00 0.00 H new ATOM 0 HD2 LYS A 109 18.136 8.328 3.905 1.00 0.00 H new ATOM 0 HD3 LYS A 109 18.568 7.317 5.270 1.00 0.00 H new ATOM 0 HE2 LYS A 109 20.694 7.233 4.486 1.00 0.00 H new ATOM 0 HE3 LYS A 109 20.117 6.330 3.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 21.279 8.326 2.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 19.646 8.421 1.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 20.205 9.295 3.312 1.00 0.00 H new ATOM 1656 N VAL A 110 15.903 5.191 1.312 1.00 0.00 N ATOM 1657 CA VAL A 110 16.181 4.275 0.218 1.00 0.00 C ATOM 1658 C VAL A 110 17.432 4.742 -0.527 1.00 0.00 C ATOM 1659 O VAL A 110 17.482 5.868 -1.020 1.00 0.00 O ATOM 1660 CB VAL A 110 14.954 4.157 -0.688 1.00 0.00 C ATOM 1661 CG1 VAL A 110 15.260 3.294 -1.914 1.00 0.00 C ATOM 1662 CG2 VAL A 110 13.753 3.607 0.083 1.00 0.00 C ATOM 0 H VAL A 110 16.089 6.172 1.104 1.00 0.00 H new ATOM 0 HA VAL A 110 16.385 3.274 0.599 1.00 0.00 H new ATOM 0 HB VAL A 110 14.698 5.157 -1.037 1.00 0.00 H new ATOM 0 HG11 VAL A 110 14.372 3.226 -2.542 1.00 0.00 H new ATOM 0 HG12 VAL A 110 16.073 3.745 -2.483 1.00 0.00 H new ATOM 0 HG13 VAL A 110 15.554 2.295 -1.592 1.00 0.00 H new ATOM 0 HG21 VAL A 110 12.895 3.533 -0.585 1.00 0.00 H new ATOM 0 HG22 VAL A 110 13.994 2.619 0.475 1.00 0.00 H new ATOM 0 HG23 VAL A 110 13.514 4.276 0.909 1.00 0.00 H new ATOM 1672 N SER A 111 18.413 3.853 -0.586 1.00 0.00 N ATOM 1673 CA SER A 111 19.661 4.160 -1.263 1.00 0.00 C ATOM 1674 C SER A 111 19.638 3.596 -2.685 1.00 0.00 C ATOM 1675 O SER A 111 18.916 2.640 -2.966 1.00 0.00 O ATOM 1676 CB SER A 111 20.859 3.602 -0.491 1.00 0.00 C ATOM 1677 OG SER A 111 22.009 4.434 -0.615 1.00 0.00 O ATOM 0 H SER A 111 18.368 2.920 -0.176 1.00 0.00 H new ATOM 0 HA SER A 111 19.766 5.244 -1.310 1.00 0.00 H new ATOM 0 HB2 SER A 111 20.596 3.501 0.562 1.00 0.00 H new ATOM 0 HB3 SER A 111 21.093 2.603 -0.858 1.00 0.00 H new ATOM 0 HG SER A 111 22.751 4.044 -0.107 1.00 0.00 H new ATOM 1683 N SER A 112 20.436 4.212 -3.545 1.00 0.00 N ATOM 1684 CA SER A 112 20.516 3.783 -4.931 1.00 0.00 C ATOM 1685 C SER A 112 21.425 4.728 -5.720 1.00 0.00 C ATOM 1686 O SER A 112 21.632 5.873 -5.320 1.00 0.00 O ATOM 1687 CB SER A 112 19.127 3.726 -5.571 1.00 0.00 C ATOM 1688 OG SER A 112 18.939 2.537 -6.334 1.00 0.00 O ATOM 0 H SER A 112 21.033 5.005 -3.309 1.00 0.00 H new ATOM 0 HA SER A 112 20.939 2.779 -4.954 1.00 0.00 H new ATOM 0 HB2 SER A 112 18.366 3.781 -4.792 1.00 0.00 H new ATOM 0 HB3 SER A 112 18.988 4.595 -6.214 1.00 0.00 H new ATOM 0 HG SER A 112 17.992 2.286 -6.321 1.00 0.00 H new ATOM 1694 N LYS A 113 21.943 4.213 -6.825 1.00 0.00 N ATOM 1695 CA LYS A 113 22.825 4.997 -7.673 1.00 0.00 C ATOM 1696 C LYS A 113 22.948 4.318 -9.039 1.00 0.00 C ATOM 1697 O LYS A 113 22.846 3.097 -9.141 1.00 0.00 O ATOM 1698 CB LYS A 113 24.169 5.229 -6.979 1.00 0.00 C ATOM 1699 CG LYS A 113 25.151 5.944 -7.910 1.00 0.00 C ATOM 1700 CD LYS A 113 25.896 4.942 -8.794 1.00 0.00 C ATOM 1701 CE LYS A 113 27.388 4.917 -8.455 1.00 0.00 C ATOM 1702 NZ LYS A 113 28.002 3.650 -8.912 1.00 0.00 N ATOM 0 H LYS A 113 21.769 3.263 -7.153 1.00 0.00 H new ATOM 0 HA LYS A 113 22.406 5.988 -7.845 1.00 0.00 H new ATOM 0 HB2 LYS A 113 24.019 5.823 -6.077 1.00 0.00 H new ATOM 0 HB3 LYS A 113 24.590 4.274 -6.665 1.00 0.00 H new ATOM 0 HG2 LYS A 113 24.612 6.656 -8.535 1.00 0.00 H new ATOM 0 HG3 LYS A 113 25.867 6.516 -7.320 1.00 0.00 H new ATOM 0 HD2 LYS A 113 25.472 3.947 -8.659 1.00 0.00 H new ATOM 0 HD3 LYS A 113 25.762 5.207 -9.843 1.00 0.00 H new ATOM 0 HE2 LYS A 113 27.889 5.762 -8.928 1.00 0.00 H new ATOM 0 HE3 LYS A 113 27.524 5.027 -7.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 29.014 3.649 -8.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 27.535 2.849 -8.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 27.888 3.561 -9.942 1.00 0.00 H new ATOM 1716 N GLU A 114 23.165 5.140 -10.055 1.00 0.00 N ATOM 1717 CA GLU A 114 23.303 4.635 -11.410 1.00 0.00 C ATOM 1718 C GLU A 114 23.546 5.788 -12.385 1.00 0.00 C ATOM 1719 O GLU A 114 24.587 5.844 -13.039 1.00 0.00 O ATOM 1720 CB GLU A 114 22.074 3.821 -11.820 1.00 0.00 C ATOM 1721 CG GLU A 114 22.455 2.703 -12.792 1.00 0.00 C ATOM 1722 CD GLU A 114 21.459 1.544 -12.713 1.00 0.00 C ATOM 1723 OE1 GLU A 114 20.447 1.615 -13.444 1.00 0.00 O ATOM 1724 OE2 GLU A 114 21.731 0.614 -11.923 1.00 0.00 O ATOM 0 H GLU A 114 23.249 6.153 -9.967 1.00 0.00 H new ATOM 0 HA GLU A 114 24.166 3.970 -11.442 1.00 0.00 H new ATOM 0 HB2 GLU A 114 21.605 3.393 -10.934 1.00 0.00 H new ATOM 0 HB3 GLU A 114 21.338 4.477 -12.285 1.00 0.00 H new ATOM 0 HG2 GLU A 114 22.483 3.094 -13.809 1.00 0.00 H new ATOM 0 HG3 GLU A 114 23.457 2.342 -12.562 1.00 0.00 H new ATOM 1731 N SER A 115 22.569 6.681 -12.452 1.00 0.00 N ATOM 1732 CA SER A 115 22.664 7.830 -13.336 1.00 0.00 C ATOM 1733 C SER A 115 24.071 8.427 -13.269 1.00 0.00 C ATOM 1734 O SER A 115 24.798 8.204 -12.302 1.00 0.00 O ATOM 1735 CB SER A 115 21.621 8.889 -12.976 1.00 0.00 C ATOM 1736 OG SER A 115 21.899 9.510 -11.724 1.00 0.00 O ATOM 0 H SER A 115 21.708 6.632 -11.908 1.00 0.00 H new ATOM 0 HA SER A 115 22.466 7.495 -14.354 1.00 0.00 H new ATOM 0 HB2 SER A 115 21.590 9.648 -13.758 1.00 0.00 H new ATOM 0 HB3 SER A 115 20.634 8.428 -12.940 1.00 0.00 H new ATOM 0 HG SER A 115 21.211 10.181 -11.532 1.00 0.00 H new ATOM 1742 N GLY A 116 24.413 9.174 -14.309 1.00 0.00 N ATOM 1743 CA GLY A 116 25.720 9.804 -14.380 1.00 0.00 C ATOM 1744 C GLY A 116 25.823 10.717 -15.603 1.00 0.00 C ATOM 1745 O GLY A 116 25.152 10.490 -16.609 1.00 0.00 O ATOM 0 H GLY A 116 23.807 9.357 -15.109 1.00 0.00 H new ATOM 0 HA2 GLY A 116 25.898 10.383 -13.474 1.00 0.00 H new ATOM 0 HA3 GLY A 116 26.495 9.039 -14.427 1.00 0.00 H new ATOM 1749 N PRO A 117 26.689 11.757 -15.474 1.00 0.00 N ATOM 1750 CA PRO A 117 26.888 12.705 -16.556 1.00 0.00 C ATOM 1751 C PRO A 117 27.736 12.093 -17.673 1.00 0.00 C ATOM 1752 O PRO A 117 28.868 11.671 -17.437 1.00 0.00 O ATOM 1753 CB PRO A 117 27.544 13.913 -15.907 1.00 0.00 C ATOM 1754 CG PRO A 117 28.110 13.419 -14.585 1.00 0.00 C ATOM 1755 CD PRO A 117 27.500 12.057 -14.297 1.00 0.00 C ATOM 0 HA PRO A 117 25.955 12.989 -17.042 1.00 0.00 H new ATOM 0 HB2 PRO A 117 28.332 14.318 -16.542 1.00 0.00 H new ATOM 0 HB3 PRO A 117 26.820 14.712 -15.748 1.00 0.00 H new ATOM 0 HG2 PRO A 117 29.196 13.347 -14.638 1.00 0.00 H new ATOM 0 HG3 PRO A 117 27.875 14.120 -13.784 1.00 0.00 H new ATOM 0 HD2 PRO A 117 28.271 11.302 -14.145 1.00 0.00 H new ATOM 0 HD3 PRO A 117 26.892 12.079 -13.392 1.00 0.00 H new ATOM 1763 N SER A 118 27.157 12.062 -18.864 1.00 0.00 N ATOM 1764 CA SER A 118 27.846 11.508 -20.017 1.00 0.00 C ATOM 1765 C SER A 118 27.094 11.872 -21.300 1.00 0.00 C ATOM 1766 O SER A 118 25.871 12.002 -21.291 1.00 0.00 O ATOM 1767 CB SER A 118 27.987 9.990 -19.897 1.00 0.00 C ATOM 1768 OG SER A 118 29.237 9.528 -20.403 1.00 0.00 O ATOM 0 H SER A 118 26.218 12.412 -19.056 1.00 0.00 H new ATOM 0 HA SER A 118 28.847 11.936 -20.056 1.00 0.00 H new ATOM 0 HB2 SER A 118 27.889 9.698 -18.851 1.00 0.00 H new ATOM 0 HB3 SER A 118 27.175 9.506 -20.440 1.00 0.00 H new ATOM 0 HG SER A 118 29.289 8.554 -20.307 1.00 0.00 H new ATOM 1774 N SER A 119 27.858 12.024 -22.372 1.00 0.00 N ATOM 1775 CA SER A 119 27.279 12.370 -23.659 1.00 0.00 C ATOM 1776 C SER A 119 27.657 11.316 -24.702 1.00 0.00 C ATOM 1777 O SER A 119 28.665 11.455 -25.394 1.00 0.00 O ATOM 1778 CB SER A 119 27.739 13.756 -24.115 1.00 0.00 C ATOM 1779 OG SER A 119 26.653 14.674 -24.208 1.00 0.00 O ATOM 0 H SER A 119 28.872 11.914 -22.376 1.00 0.00 H new ATOM 0 HA SER A 119 26.195 12.394 -23.551 1.00 0.00 H new ATOM 0 HB2 SER A 119 28.480 14.141 -23.415 1.00 0.00 H new ATOM 0 HB3 SER A 119 28.229 13.675 -25.085 1.00 0.00 H new ATOM 0 HG SER A 119 26.987 15.548 -24.500 1.00 0.00 H new ATOM 1785 N GLY A 120 26.828 10.285 -24.783 1.00 0.00 N ATOM 1786 CA GLY A 120 27.063 9.209 -25.730 1.00 0.00 C ATOM 1787 C GLY A 120 26.951 9.712 -27.170 1.00 0.00 C ATOM 1788 O GLY A 120 26.515 10.837 -27.407 1.00 0.00 O ATOM 0 H GLY A 120 25.993 10.173 -24.208 1.00 0.00 H new ATOM 0 HA2 GLY A 120 28.053 8.785 -25.565 1.00 0.00 H new ATOM 0 HA3 GLY A 120 26.342 8.409 -25.563 1.00 0.00 H new TER 1792 GLY A 120