USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 757 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 118 THR OG1 : rot 140:sc= -0.793! USER MOD Set 1.2: A 123 HIS : no HD1:sc= -13.4! C(o=-14!,f=-23!) USER MOD Single : A 36 ASN : amide:sc= -1.18 K(o=-1.2,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 HIS : no HE2:sc= -1.35 K(o=-1.3,f=-2.3!) USER MOD Single : A 45 CYS SG : rot -66:sc= -4.85! USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 HIS : no HE2:sc= -10! C(o=-10!,f=-13!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 MET CE :methyl -117:sc= -0.0494 (180deg=-0.621) USER MOD Single : A 55 MET CE :methyl -128:sc= -1.72 (180deg=-5.72!) USER MOD Single : A 57 LYS NZ :NH3+ -128:sc=-0.000183 (180deg=-0.239) USER MOD Single : A 59 LYS NZ :NH3+ 137:sc= 1.2 (180deg=-0.485) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 MET CE :methyl 137:sc= -0.252 (180deg=-1.56!) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 70 GLN : amide:sc= -4.8! K(o=-4.8!,f=-1.1) USER MOD Single : A 71 TYR OH : rot 30:sc= -0.181 USER MOD Single : A 72 SER OG : rot -100:sc= 1.24 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= 0.161 X(o=0.16,f=-0.19) USER MOD Single : A 85 MET CE :methyl -121:sc= -6.22! (180deg=-16.5!) USER MOD Single : A 86 THR OG1 : rot 134:sc= -0.344 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl -137:sc= -1.14 (180deg=-3.26!) USER MOD Single : A 95 GLN : amide:sc= -0.966 K(o=-0.97,f=-0.03) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot -110:sc= -3.37! USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 TYR OH : rot 110:sc= 0 USER MOD Single : A 126 MET CE :methyl -151:sc= -0.926 (180deg=-4.12!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 36 1.421 -17.509 -13.475 1.00 0.00 N ATOM 2 CA ASN A 36 0.840 -17.541 -14.847 1.00 0.00 C ATOM 3 C ASN A 36 -0.009 -16.291 -15.080 1.00 0.00 C ATOM 4 O ASN A 36 0.088 -15.642 -16.103 1.00 0.00 O ATOM 5 CB ASN A 36 -0.029 -18.799 -14.882 1.00 0.00 C ATOM 6 CG ASN A 36 -0.432 -19.101 -16.326 1.00 0.00 C ATOM 7 OD1 ASN A 36 0.187 -19.914 -16.985 1.00 0.00 O ATOM 8 ND2 ASN A 36 -1.451 -18.476 -16.849 1.00 0.00 N ATOM 0 HA ASN A 36 1.605 -17.558 -15.624 1.00 0.00 H new ATOM 0 HB2 ASN A 36 0.518 -19.643 -14.462 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -0.918 -18.657 -14.267 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -1.729 -18.669 -17.811 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -1.970 -17.794 -16.296 1.00 0.00 H new ATOM 15 N ALA A 37 -0.838 -15.944 -14.135 1.00 0.00 N ATOM 16 CA ALA A 37 -1.687 -14.732 -14.298 1.00 0.00 C ATOM 17 C ALA A 37 -1.068 -13.555 -13.545 1.00 0.00 C ATOM 18 O ALA A 37 -0.315 -13.731 -12.608 1.00 0.00 O ATOM 19 CB ALA A 37 -3.042 -15.108 -13.699 1.00 0.00 C ATOM 0 H ALA A 37 -0.964 -16.448 -13.257 1.00 0.00 H new ATOM 0 HA ALA A 37 -1.780 -14.428 -15.341 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -3.724 -14.262 -13.782 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -3.454 -15.961 -14.238 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -2.915 -15.370 -12.648 1.00 0.00 H new ATOM 25 N VAL A 38 -1.369 -12.355 -13.955 1.00 0.00 N ATOM 26 CA VAL A 38 -0.789 -11.168 -13.269 1.00 0.00 C ATOM 27 C VAL A 38 -1.852 -10.078 -13.108 1.00 0.00 C ATOM 28 O VAL A 38 -2.826 -10.037 -13.831 1.00 0.00 O ATOM 29 CB VAL A 38 0.332 -10.698 -14.194 1.00 0.00 C ATOM 30 CG1 VAL A 38 1.424 -11.768 -14.258 1.00 0.00 C ATOM 31 CG2 VAL A 38 -0.229 -10.458 -15.597 1.00 0.00 C ATOM 0 H VAL A 38 -1.991 -12.145 -14.735 1.00 0.00 H new ATOM 0 HA VAL A 38 -0.425 -11.399 -12.268 1.00 0.00 H new ATOM 0 HB VAL A 38 0.754 -9.770 -13.808 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.224 -11.433 -14.918 1.00 0.00 H new ATOM 0 HG12 VAL A 38 1.825 -11.938 -13.259 1.00 0.00 H new ATOM 0 HG13 VAL A 38 1.002 -12.696 -14.643 1.00 0.00 H new ATOM 0 HG21 VAL A 38 0.571 -10.123 -16.256 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.653 -11.385 -15.983 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -1.006 -9.695 -15.553 1.00 0.00 H new ATOM 41 N LYS A 39 -1.663 -9.182 -12.177 1.00 0.00 N ATOM 42 CA LYS A 39 -2.657 -8.089 -11.979 1.00 0.00 C ATOM 43 C LYS A 39 -2.150 -6.806 -12.635 1.00 0.00 C ATOM 44 O LYS A 39 -1.066 -6.330 -12.335 1.00 0.00 O ATOM 45 CB LYS A 39 -2.770 -7.923 -10.466 1.00 0.00 C ATOM 46 CG LYS A 39 -4.240 -7.992 -10.052 1.00 0.00 C ATOM 47 CD LYS A 39 -4.663 -6.652 -9.449 1.00 0.00 C ATOM 48 CE LYS A 39 -3.930 -6.437 -8.122 1.00 0.00 C ATOM 49 NZ LYS A 39 -4.430 -5.130 -7.615 1.00 0.00 N ATOM 0 H LYS A 39 -0.863 -9.160 -11.545 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.624 -8.314 -12.428 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -2.202 -8.704 -9.961 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -2.340 -6.969 -10.161 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -4.862 -8.227 -10.916 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -4.387 -8.792 -9.327 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.433 -5.841 -10.140 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -5.741 -6.637 -9.288 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -4.143 -7.241 -7.418 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -2.850 -6.418 -8.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -3.973 -4.912 -6.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -4.207 -4.382 -8.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -5.460 -5.181 -7.481 1.00 0.00 H new ATOM 63 N VAL A 40 -2.908 -6.251 -13.547 1.00 0.00 N ATOM 64 CA VAL A 40 -2.426 -5.010 -14.231 1.00 0.00 C ATOM 65 C VAL A 40 -3.412 -3.842 -14.113 1.00 0.00 C ATOM 66 O VAL A 40 -4.575 -4.004 -13.808 1.00 0.00 O ATOM 67 CB VAL A 40 -2.260 -5.403 -15.701 1.00 0.00 C ATOM 68 CG1 VAL A 40 -3.628 -5.628 -16.340 1.00 0.00 C ATOM 69 CG2 VAL A 40 -1.530 -4.281 -16.448 1.00 0.00 C ATOM 0 H VAL A 40 -3.822 -6.594 -13.844 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.502 -4.660 -13.771 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.681 -6.325 -15.761 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -3.500 -5.907 -17.386 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -4.149 -6.427 -15.812 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -4.214 -4.711 -16.279 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.411 -4.559 -17.495 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.111 -3.361 -16.381 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.549 -4.124 -16.000 1.00 0.00 H new ATOM 79 N ARG A 41 -2.917 -2.659 -14.367 1.00 0.00 N ATOM 80 CA ARG A 41 -3.757 -1.423 -14.305 1.00 0.00 C ATOM 81 C ARG A 41 -3.301 -0.480 -15.428 1.00 0.00 C ATOM 82 O ARG A 41 -2.126 -0.214 -15.565 1.00 0.00 O ATOM 83 CB ARG A 41 -3.449 -0.818 -12.934 1.00 0.00 C ATOM 84 CG ARG A 41 -4.224 0.489 -12.755 1.00 0.00 C ATOM 85 CD ARG A 41 -4.063 0.981 -11.316 1.00 0.00 C ATOM 86 NE ARG A 41 -4.750 -0.042 -10.481 1.00 0.00 N ATOM 87 CZ ARG A 41 -4.828 0.118 -9.190 1.00 0.00 C ATOM 88 NH1 ARG A 41 -3.783 0.514 -8.518 1.00 0.00 N ATOM 89 NH2 ARG A 41 -5.952 -0.120 -8.571 1.00 0.00 N ATOM 0 H ARG A 41 -1.943 -2.493 -14.621 1.00 0.00 H new ATOM 0 HA ARG A 41 -4.824 -1.607 -14.429 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.720 -1.522 -12.147 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.379 -0.632 -12.841 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -3.855 1.242 -13.452 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.279 0.334 -12.982 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.011 1.071 -11.045 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.511 1.965 -11.183 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.159 -0.867 -10.919 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -2.905 0.698 -9.003 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -3.844 0.639 -7.508 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -6.768 -0.431 -9.098 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -6.014 0.005 -7.561 1.00 0.00 H new ATOM 103 N HIS A 42 -4.186 0.011 -16.255 1.00 0.00 N ATOM 104 CA HIS A 42 -3.705 0.894 -17.362 1.00 0.00 C ATOM 105 C HIS A 42 -4.629 2.090 -17.625 1.00 0.00 C ATOM 106 O HIS A 42 -5.701 2.215 -17.068 1.00 0.00 O ATOM 107 CB HIS A 42 -3.656 -0.020 -18.593 1.00 0.00 C ATOM 108 CG HIS A 42 -4.995 -0.041 -19.290 1.00 0.00 C ATOM 109 ND1 HIS A 42 -5.184 0.529 -20.540 1.00 0.00 N ATOM 110 CD2 HIS A 42 -6.215 -0.550 -18.922 1.00 0.00 C ATOM 111 CE1 HIS A 42 -6.475 0.354 -20.875 1.00 0.00 C ATOM 112 NE2 HIS A 42 -7.149 -0.298 -19.924 1.00 0.00 N ATOM 0 H HIS A 42 -5.192 -0.153 -16.217 1.00 0.00 H new ATOM 0 HA HIS A 42 -2.740 1.334 -17.109 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -2.886 0.329 -19.282 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -3.380 -1.031 -18.292 1.00 0.00 H new ATOM 0 HD1 HIS A 42 -4.473 0.996 -21.103 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -6.420 -1.067 -17.996 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -6.913 0.699 -21.800 1.00 0.00 H new ATOM 120 N ILE A 43 -4.205 2.950 -18.517 1.00 0.00 N ATOM 121 CA ILE A 43 -5.017 4.140 -18.901 1.00 0.00 C ATOM 122 C ILE A 43 -5.133 4.174 -20.428 1.00 0.00 C ATOM 123 O ILE A 43 -4.136 4.148 -21.127 1.00 0.00 O ATOM 124 CB ILE A 43 -4.229 5.358 -18.402 1.00 0.00 C ATOM 125 CG1 ILE A 43 -4.279 5.419 -16.875 1.00 0.00 C ATOM 126 CG2 ILE A 43 -4.840 6.638 -18.978 1.00 0.00 C ATOM 127 CD1 ILE A 43 -3.064 6.192 -16.358 1.00 0.00 C ATOM 0 H ILE A 43 -3.312 2.873 -19.004 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.021 4.122 -18.478 1.00 0.00 H new ATOM 0 HB ILE A 43 -3.193 5.268 -18.728 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.199 5.905 -16.549 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -4.287 4.411 -16.460 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -4.278 7.502 -18.622 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -4.799 6.603 -20.067 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.878 6.723 -18.656 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.098 6.237 -15.269 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -2.151 5.687 -16.672 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.077 7.204 -16.763 1.00 0.00 H new ATOM 139 N LEU A 44 -6.327 4.221 -20.956 1.00 0.00 N ATOM 140 CA LEU A 44 -6.474 4.246 -22.442 1.00 0.00 C ATOM 141 C LEU A 44 -6.863 5.646 -22.920 1.00 0.00 C ATOM 142 O LEU A 44 -7.771 6.262 -22.400 1.00 0.00 O ATOM 143 CB LEU A 44 -7.590 3.249 -22.764 1.00 0.00 C ATOM 144 CG LEU A 44 -7.408 2.742 -24.196 1.00 0.00 C ATOM 145 CD1 LEU A 44 -8.418 1.631 -24.495 1.00 0.00 C ATOM 146 CD2 LEU A 44 -7.628 3.896 -25.171 1.00 0.00 C ATOM 0 H LEU A 44 -7.200 4.243 -20.429 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.540 3.985 -22.940 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.563 2.415 -22.063 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.564 3.726 -22.655 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.398 2.346 -24.308 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.279 1.278 -25.517 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.265 0.804 -23.802 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -9.430 2.019 -24.380 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -7.499 3.539 -26.193 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.637 4.288 -25.048 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -6.905 4.686 -24.969 1.00 0.00 H new ATOM 158 N CYS A 45 -6.181 6.153 -23.913 1.00 0.00 N ATOM 159 CA CYS A 45 -6.512 7.513 -24.429 1.00 0.00 C ATOM 160 C CYS A 45 -6.350 7.547 -25.947 1.00 0.00 C ATOM 161 O CYS A 45 -5.705 6.698 -26.522 1.00 0.00 O ATOM 162 CB CYS A 45 -5.496 8.436 -23.773 1.00 0.00 C ATOM 163 SG CYS A 45 -5.414 8.087 -22.001 1.00 0.00 S ATOM 0 H CYS A 45 -5.410 5.684 -24.388 1.00 0.00 H new ATOM 0 HA CYS A 45 -7.538 7.804 -24.205 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -4.515 8.295 -24.227 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -5.776 9.477 -23.936 1.00 0.00 H new ATOM 0 HG CYS A 45 -6.548 8.395 -21.445 1.00 0.00 H new ATOM 169 N GLU A 46 -6.922 8.522 -26.599 1.00 0.00 N ATOM 170 CA GLU A 46 -6.790 8.603 -28.082 1.00 0.00 C ATOM 171 C GLU A 46 -5.392 9.115 -28.461 1.00 0.00 C ATOM 172 O GLU A 46 -4.688 9.683 -27.650 1.00 0.00 O ATOM 173 CB GLU A 46 -7.876 9.586 -28.520 1.00 0.00 C ATOM 174 CG GLU A 46 -9.236 8.886 -28.496 1.00 0.00 C ATOM 175 CD GLU A 46 -10.320 9.860 -28.962 1.00 0.00 C ATOM 176 OE1 GLU A 46 -10.102 11.056 -28.851 1.00 0.00 O ATOM 177 OE2 GLU A 46 -11.351 9.395 -29.420 1.00 0.00 O ATOM 0 H GLU A 46 -7.474 9.265 -26.170 1.00 0.00 H new ATOM 0 HA GLU A 46 -6.907 7.634 -28.567 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.888 10.451 -27.856 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.663 9.957 -29.523 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.217 8.009 -29.144 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.458 8.533 -27.489 1.00 0.00 H new ATOM 184 N LYS A 47 -4.979 8.899 -29.683 1.00 0.00 N ATOM 185 CA LYS A 47 -3.619 9.350 -30.112 1.00 0.00 C ATOM 186 C LYS A 47 -3.551 10.875 -30.271 1.00 0.00 C ATOM 187 O LYS A 47 -4.257 11.458 -31.071 1.00 0.00 O ATOM 188 CB LYS A 47 -3.389 8.666 -31.461 1.00 0.00 C ATOM 189 CG LYS A 47 -1.966 8.946 -31.942 1.00 0.00 C ATOM 190 CD LYS A 47 -1.825 8.505 -33.401 1.00 0.00 C ATOM 191 CE LYS A 47 -0.384 8.733 -33.865 1.00 0.00 C ATOM 192 NZ LYS A 47 -0.289 8.060 -35.193 1.00 0.00 N ATOM 0 H LYS A 47 -5.525 8.429 -30.405 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.862 9.090 -29.372 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -3.547 7.592 -31.367 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -4.109 9.031 -32.193 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -1.742 10.009 -31.849 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -1.248 8.413 -31.319 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -2.088 7.452 -33.501 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -2.515 9.067 -34.031 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -0.160 9.797 -33.946 1.00 0.00 H new ATOM 0 HE3 LYS A 47 0.329 8.310 -33.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 0.672 8.175 -35.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -0.500 7.047 -35.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -0.973 8.488 -35.849 1.00 0.00 H new ATOM 206 N HIS A 48 -2.698 11.520 -29.517 1.00 0.00 N ATOM 207 CA HIS A 48 -2.567 13.007 -29.622 1.00 0.00 C ATOM 208 C HIS A 48 -1.093 13.410 -29.693 1.00 0.00 C ATOM 209 O HIS A 48 -0.765 14.576 -29.789 1.00 0.00 O ATOM 210 CB HIS A 48 -3.183 13.554 -28.338 1.00 0.00 C ATOM 211 CG HIS A 48 -4.529 12.932 -28.129 1.00 0.00 C ATOM 212 ND1 HIS A 48 -5.368 12.624 -29.184 1.00 0.00 N ATOM 213 CD2 HIS A 48 -5.194 12.554 -26.994 1.00 0.00 C ATOM 214 CE1 HIS A 48 -6.484 12.085 -28.667 1.00 0.00 C ATOM 215 NE2 HIS A 48 -6.431 12.018 -27.334 1.00 0.00 N ATOM 0 H HIS A 48 -2.084 11.081 -28.831 1.00 0.00 H new ATOM 0 HA HIS A 48 -3.056 13.392 -30.517 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -2.534 13.338 -27.489 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -3.277 14.638 -28.399 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -5.175 12.778 -30.174 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -4.816 12.656 -25.988 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -7.323 11.747 -29.257 1.00 0.00 H new ATOM 223 N GLY A 49 -0.202 12.461 -29.623 1.00 0.00 N ATOM 224 CA GLY A 49 1.247 12.803 -29.659 1.00 0.00 C ATOM 225 C GLY A 49 1.646 13.386 -28.303 1.00 0.00 C ATOM 226 O GLY A 49 2.694 13.983 -28.151 1.00 0.00 O ATOM 0 H GLY A 49 -0.413 11.466 -29.543 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.840 11.915 -29.878 1.00 0.00 H new ATOM 0 HA3 GLY A 49 1.446 13.523 -30.453 1.00 0.00 H new ATOM 230 N LYS A 50 0.808 13.215 -27.314 1.00 0.00 N ATOM 231 CA LYS A 50 1.117 13.751 -25.957 1.00 0.00 C ATOM 232 C LYS A 50 1.477 12.602 -25.011 1.00 0.00 C ATOM 233 O LYS A 50 1.490 12.755 -23.806 1.00 0.00 O ATOM 234 CB LYS A 50 -0.178 14.429 -25.500 1.00 0.00 C ATOM 235 CG LYS A 50 -1.246 13.362 -25.243 1.00 0.00 C ATOM 236 CD LYS A 50 -2.573 14.035 -24.885 1.00 0.00 C ATOM 237 CE LYS A 50 -2.405 14.845 -23.597 1.00 0.00 C ATOM 238 NZ LYS A 50 -3.747 15.437 -23.333 1.00 0.00 N ATOM 0 H LYS A 50 -0.083 12.724 -27.390 1.00 0.00 H new ATOM 0 HA LYS A 50 1.962 14.440 -25.964 1.00 0.00 H new ATOM 0 HB2 LYS A 50 0.001 15.006 -24.593 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -0.523 15.129 -26.261 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -1.371 12.738 -26.128 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -0.930 12.705 -24.432 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -2.893 14.687 -25.698 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -3.351 13.283 -24.755 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -2.085 14.210 -22.771 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -1.648 15.621 -23.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -3.710 16.007 -22.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -4.023 16.042 -24.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -4.446 14.675 -23.218 1.00 0.00 H new ATOM 252 N ILE A 51 1.764 11.450 -25.553 1.00 0.00 N ATOM 253 CA ILE A 51 2.118 10.283 -24.692 1.00 0.00 C ATOM 254 C ILE A 51 3.137 10.695 -23.625 1.00 0.00 C ATOM 255 O ILE A 51 2.950 10.455 -22.448 1.00 0.00 O ATOM 256 CB ILE A 51 2.733 9.255 -25.643 1.00 0.00 C ATOM 257 CG1 ILE A 51 1.681 8.788 -26.652 1.00 0.00 C ATOM 258 CG2 ILE A 51 3.229 8.054 -24.838 1.00 0.00 C ATOM 259 CD1 ILE A 51 1.875 9.533 -27.974 1.00 0.00 C ATOM 0 H ILE A 51 1.769 11.265 -26.556 1.00 0.00 H new ATOM 0 HA ILE A 51 1.249 9.887 -24.167 1.00 0.00 H new ATOM 0 HB ILE A 51 3.567 9.711 -26.176 1.00 0.00 H new ATOM 0 HG12 ILE A 51 1.767 7.713 -26.812 1.00 0.00 H new ATOM 0 HG13 ILE A 51 0.680 8.973 -26.262 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.668 7.320 -25.513 1.00 0.00 H new ATOM 0 HG22 ILE A 51 3.981 8.382 -24.121 1.00 0.00 H new ATOM 0 HG23 ILE A 51 2.392 7.602 -24.305 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.126 9.200 -28.692 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.767 10.605 -27.807 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.871 9.326 -28.366 1.00 0.00 H new ATOM 271 N MET A 52 4.218 11.305 -24.028 1.00 0.00 N ATOM 272 CA MET A 52 5.253 11.725 -23.039 1.00 0.00 C ATOM 273 C MET A 52 4.626 12.581 -21.935 1.00 0.00 C ATOM 274 O MET A 52 4.983 12.477 -20.779 1.00 0.00 O ATOM 275 CB MET A 52 6.260 12.546 -23.846 1.00 0.00 C ATOM 276 CG MET A 52 7.485 12.850 -22.980 1.00 0.00 C ATOM 277 SD MET A 52 8.615 13.930 -23.893 1.00 0.00 S ATOM 278 CE MET A 52 7.669 15.459 -23.697 1.00 0.00 C ATOM 0 H MET A 52 4.430 11.531 -25.000 1.00 0.00 H new ATOM 0 HA MET A 52 5.719 10.871 -22.547 1.00 0.00 H new ATOM 0 HB2 MET A 52 6.560 11.997 -24.739 1.00 0.00 H new ATOM 0 HB3 MET A 52 5.800 13.475 -24.183 1.00 0.00 H new ATOM 0 HG2 MET A 52 7.177 13.330 -22.051 1.00 0.00 H new ATOM 0 HG3 MET A 52 7.991 11.923 -22.708 1.00 0.00 H new ATOM 0 HE1 MET A 52 7.349 15.817 -24.676 1.00 0.00 H new ATOM 0 HE2 MET A 52 6.793 15.268 -23.077 1.00 0.00 H new ATOM 0 HE3 MET A 52 8.293 16.215 -23.220 1.00 0.00 H new ATOM 288 N GLU A 53 3.695 13.427 -22.280 1.00 0.00 N ATOM 289 CA GLU A 53 3.054 14.287 -21.244 1.00 0.00 C ATOM 290 C GLU A 53 2.163 13.443 -20.329 1.00 0.00 C ATOM 291 O GLU A 53 2.111 13.652 -19.133 1.00 0.00 O ATOM 292 CB GLU A 53 2.221 15.296 -22.033 1.00 0.00 C ATOM 293 CG GLU A 53 3.150 16.158 -22.892 1.00 0.00 C ATOM 294 CD GLU A 53 2.318 17.107 -23.756 1.00 0.00 C ATOM 295 OE1 GLU A 53 1.202 16.745 -24.094 1.00 0.00 O ATOM 296 OE2 GLU A 53 2.810 18.180 -24.067 1.00 0.00 O ATOM 0 H GLU A 53 3.351 13.560 -23.231 1.00 0.00 H new ATOM 0 HA GLU A 53 3.785 14.777 -20.601 1.00 0.00 H new ATOM 0 HB2 GLU A 53 1.501 14.776 -22.665 1.00 0.00 H new ATOM 0 HB3 GLU A 53 1.650 15.925 -21.351 1.00 0.00 H new ATOM 0 HG2 GLU A 53 3.825 16.729 -22.255 1.00 0.00 H new ATOM 0 HG3 GLU A 53 3.770 15.523 -23.525 1.00 0.00 H new ATOM 303 N ALA A 54 1.463 12.490 -20.879 1.00 0.00 N ATOM 304 CA ALA A 54 0.579 11.635 -20.036 1.00 0.00 C ATOM 305 C ALA A 54 1.399 10.923 -18.958 1.00 0.00 C ATOM 306 O ALA A 54 1.156 11.076 -17.776 1.00 0.00 O ATOM 307 CB ALA A 54 -0.029 10.618 -21.001 1.00 0.00 C ATOM 0 H ALA A 54 1.464 12.266 -21.874 1.00 0.00 H new ATOM 0 HA ALA A 54 -0.185 12.218 -19.521 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -0.694 9.950 -20.454 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.594 11.141 -21.773 1.00 0.00 H new ATOM 0 HB3 ALA A 54 0.767 10.036 -21.466 1.00 0.00 H new ATOM 313 N MET A 55 2.365 10.142 -19.354 1.00 0.00 N ATOM 314 CA MET A 55 3.193 9.419 -18.349 1.00 0.00 C ATOM 315 C MET A 55 3.875 10.419 -17.408 1.00 0.00 C ATOM 316 O MET A 55 4.079 10.149 -16.240 1.00 0.00 O ATOM 317 CB MET A 55 4.223 8.638 -19.172 1.00 0.00 C ATOM 318 CG MET A 55 5.371 9.562 -19.586 1.00 0.00 C ATOM 319 SD MET A 55 6.594 8.620 -20.532 1.00 0.00 S ATOM 320 CE MET A 55 7.363 7.771 -19.130 1.00 0.00 C ATOM 0 H MET A 55 2.617 9.973 -20.328 1.00 0.00 H new ATOM 0 HA MET A 55 2.601 8.756 -17.718 1.00 0.00 H new ATOM 0 HB2 MET A 55 4.610 7.803 -18.588 1.00 0.00 H new ATOM 0 HB3 MET A 55 3.748 8.215 -20.057 1.00 0.00 H new ATOM 0 HG2 MET A 55 4.989 10.388 -20.186 1.00 0.00 H new ATOM 0 HG3 MET A 55 5.837 9.999 -18.703 1.00 0.00 H new ATOM 0 HE1 MET A 55 8.443 7.915 -19.166 1.00 0.00 H new ATOM 0 HE2 MET A 55 6.973 8.181 -18.198 1.00 0.00 H new ATOM 0 HE3 MET A 55 7.137 6.706 -19.181 1.00 0.00 H new ATOM 330 N GLU A 56 4.228 11.573 -17.905 1.00 0.00 N ATOM 331 CA GLU A 56 4.893 12.586 -17.036 1.00 0.00 C ATOM 332 C GLU A 56 3.878 13.199 -16.067 1.00 0.00 C ATOM 333 O GLU A 56 4.204 13.554 -14.953 1.00 0.00 O ATOM 334 CB GLU A 56 5.425 13.649 -17.999 1.00 0.00 C ATOM 335 CG GLU A 56 6.209 14.701 -17.213 1.00 0.00 C ATOM 336 CD GLU A 56 7.425 14.047 -16.556 1.00 0.00 C ATOM 337 OE1 GLU A 56 8.013 13.178 -17.178 1.00 0.00 O ATOM 338 OE2 GLU A 56 7.748 14.425 -15.441 1.00 0.00 O ATOM 0 H GLU A 56 4.085 11.858 -18.874 1.00 0.00 H new ATOM 0 HA GLU A 56 5.688 12.151 -16.430 1.00 0.00 H new ATOM 0 HB2 GLU A 56 6.067 13.187 -18.749 1.00 0.00 H new ATOM 0 HB3 GLU A 56 4.598 14.119 -18.532 1.00 0.00 H new ATOM 0 HG2 GLU A 56 6.529 15.503 -17.878 1.00 0.00 H new ATOM 0 HG3 GLU A 56 5.571 15.153 -16.453 1.00 0.00 H new ATOM 345 N LYS A 57 2.649 13.328 -16.486 1.00 0.00 N ATOM 346 CA LYS A 57 1.614 13.919 -15.591 1.00 0.00 C ATOM 347 C LYS A 57 1.408 13.031 -14.360 1.00 0.00 C ATOM 348 O LYS A 57 1.441 13.493 -13.237 1.00 0.00 O ATOM 349 CB LYS A 57 0.342 13.970 -16.437 1.00 0.00 C ATOM 350 CG LYS A 57 0.400 15.184 -17.366 1.00 0.00 C ATOM 351 CD LYS A 57 0.267 16.465 -16.540 1.00 0.00 C ATOM 352 CE LYS A 57 0.271 17.677 -17.473 1.00 0.00 C ATOM 353 NZ LYS A 57 -1.106 17.732 -18.038 1.00 0.00 N ATOM 0 H LYS A 57 2.317 13.050 -17.409 1.00 0.00 H new ATOM 0 HA LYS A 57 1.899 14.905 -15.225 1.00 0.00 H new ATOM 0 HB2 LYS A 57 0.243 13.055 -17.021 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -0.535 14.033 -15.792 1.00 0.00 H new ATOM 0 HG2 LYS A 57 1.341 15.190 -17.916 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -0.401 15.129 -18.104 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -0.656 16.442 -15.960 1.00 0.00 H new ATOM 0 HD3 LYS A 57 1.089 16.538 -15.828 1.00 0.00 H new ATOM 0 HE2 LYS A 57 0.512 18.592 -16.931 1.00 0.00 H new ATOM 0 HE3 LYS A 57 1.017 17.567 -18.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -1.054 17.782 -19.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -1.630 16.878 -17.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -1.597 18.574 -17.675 1.00 0.00 H new ATOM 367 N LEU A 58 1.196 11.760 -14.563 1.00 0.00 N ATOM 368 CA LEU A 58 0.988 10.846 -13.403 1.00 0.00 C ATOM 369 C LEU A 58 2.317 10.598 -12.679 1.00 0.00 C ATOM 370 O LEU A 58 2.346 10.209 -11.529 1.00 0.00 O ATOM 371 CB LEU A 58 0.448 9.548 -14.006 1.00 0.00 C ATOM 372 CG LEU A 58 1.454 8.988 -15.011 1.00 0.00 C ATOM 373 CD1 LEU A 58 2.322 7.932 -14.327 1.00 0.00 C ATOM 374 CD2 LEU A 58 0.702 8.345 -16.178 1.00 0.00 C ATOM 0 H LEU A 58 1.158 11.315 -15.480 1.00 0.00 H new ATOM 0 HA LEU A 58 0.301 11.264 -12.667 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.263 8.819 -13.217 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.507 9.734 -14.498 1.00 0.00 H new ATOM 0 HG LEU A 58 2.085 9.796 -15.382 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.040 7.532 -15.043 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.856 8.385 -13.492 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.690 7.125 -13.958 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.418 7.945 -16.896 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.073 7.537 -15.804 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.079 9.094 -16.666 1.00 0.00 H new ATOM 386 N LYS A 59 3.417 10.830 -13.345 1.00 0.00 N ATOM 387 CA LYS A 59 4.746 10.621 -12.698 1.00 0.00 C ATOM 388 C LYS A 59 4.851 9.206 -12.115 1.00 0.00 C ATOM 389 O LYS A 59 4.456 8.238 -12.734 1.00 0.00 O ATOM 390 CB LYS A 59 4.815 11.671 -11.590 1.00 0.00 C ATOM 391 CG LYS A 59 4.585 13.059 -12.190 1.00 0.00 C ATOM 392 CD LYS A 59 5.842 13.503 -12.940 1.00 0.00 C ATOM 393 CE LYS A 59 6.912 13.934 -11.932 1.00 0.00 C ATOM 394 NZ LYS A 59 8.066 14.386 -12.759 1.00 0.00 N ATOM 0 H LYS A 59 3.453 11.156 -14.311 1.00 0.00 H new ATOM 0 HA LYS A 59 5.567 10.722 -13.408 1.00 0.00 H new ATOM 0 HB2 LYS A 59 4.063 11.463 -10.829 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.786 11.632 -11.097 1.00 0.00 H new ATOM 0 HG2 LYS A 59 3.732 13.037 -12.868 1.00 0.00 H new ATOM 0 HG3 LYS A 59 4.347 13.773 -11.402 1.00 0.00 H new ATOM 0 HD2 LYS A 59 6.217 12.687 -13.558 1.00 0.00 H new ATOM 0 HD3 LYS A 59 5.606 14.329 -13.611 1.00 0.00 H new ATOM 0 HE2 LYS A 59 6.548 14.737 -11.291 1.00 0.00 H new ATOM 0 HE3 LYS A 59 7.194 13.108 -11.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 8.457 15.263 -12.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 8.800 13.650 -12.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 7.747 14.561 -13.733 1.00 0.00 H new ATOM 408 N SER A 60 5.390 9.078 -10.931 1.00 0.00 N ATOM 409 CA SER A 60 5.530 7.728 -10.314 1.00 0.00 C ATOM 410 C SER A 60 4.187 6.994 -10.321 1.00 0.00 C ATOM 411 O SER A 60 4.124 5.804 -10.558 1.00 0.00 O ATOM 412 CB SER A 60 5.998 7.992 -8.884 1.00 0.00 C ATOM 413 OG SER A 60 6.289 6.754 -8.248 1.00 0.00 O ATOM 0 H SER A 60 5.739 9.851 -10.365 1.00 0.00 H new ATOM 0 HA SER A 60 6.231 7.097 -10.860 1.00 0.00 H new ATOM 0 HB2 SER A 60 6.884 8.627 -8.891 1.00 0.00 H new ATOM 0 HB3 SER A 60 5.226 8.526 -8.330 1.00 0.00 H new ATOM 0 HG SER A 60 6.591 6.921 -7.331 1.00 0.00 H new ATOM 419 N GLY A 61 3.112 7.688 -10.068 1.00 0.00 N ATOM 420 CA GLY A 61 1.783 7.014 -10.069 1.00 0.00 C ATOM 421 C GLY A 61 0.917 7.571 -8.939 1.00 0.00 C ATOM 422 O GLY A 61 -0.263 7.291 -8.855 1.00 0.00 O ATOM 0 H GLY A 61 3.096 8.687 -9.862 1.00 0.00 H new ATOM 0 HA2 GLY A 61 1.288 7.168 -11.028 1.00 0.00 H new ATOM 0 HA3 GLY A 61 1.911 5.939 -9.945 1.00 0.00 H new ATOM 426 N MET A 62 1.487 8.357 -8.068 1.00 0.00 N ATOM 427 CA MET A 62 0.685 8.926 -6.948 1.00 0.00 C ATOM 428 C MET A 62 -0.577 9.601 -7.497 1.00 0.00 C ATOM 429 O MET A 62 -1.626 9.564 -6.886 1.00 0.00 O ATOM 430 CB MET A 62 1.605 9.951 -6.279 1.00 0.00 C ATOM 431 CG MET A 62 1.663 11.225 -7.124 1.00 0.00 C ATOM 432 SD MET A 62 3.011 12.281 -6.534 1.00 0.00 S ATOM 433 CE MET A 62 4.380 11.224 -7.071 1.00 0.00 C ATOM 0 H MET A 62 2.470 8.629 -8.083 1.00 0.00 H new ATOM 0 HA MET A 62 0.354 8.163 -6.243 1.00 0.00 H new ATOM 0 HB2 MET A 62 1.239 10.183 -5.279 1.00 0.00 H new ATOM 0 HB3 MET A 62 2.606 9.534 -6.164 1.00 0.00 H new ATOM 0 HG2 MET A 62 1.818 10.972 -8.173 1.00 0.00 H new ATOM 0 HG3 MET A 62 0.715 11.759 -7.062 1.00 0.00 H new ATOM 0 HE1 MET A 62 5.159 11.839 -7.522 1.00 0.00 H new ATOM 0 HE2 MET A 62 4.789 10.693 -6.211 1.00 0.00 H new ATOM 0 HE3 MET A 62 4.017 10.503 -7.803 1.00 0.00 H new ATOM 443 N ARG A 63 -0.480 10.214 -8.646 1.00 0.00 N ATOM 444 CA ARG A 63 -1.673 10.888 -9.234 1.00 0.00 C ATOM 445 C ARG A 63 -2.284 10.015 -10.333 1.00 0.00 C ATOM 446 O ARG A 63 -3.162 10.437 -11.058 1.00 0.00 O ATOM 447 CB ARG A 63 -1.139 12.193 -9.825 1.00 0.00 C ATOM 448 CG ARG A 63 -1.375 13.336 -8.836 1.00 0.00 C ATOM 449 CD ARG A 63 -0.523 14.543 -9.235 1.00 0.00 C ATOM 450 NE ARG A 63 -1.077 15.682 -8.450 1.00 0.00 N ATOM 451 CZ ARG A 63 -0.797 16.909 -8.794 1.00 0.00 C ATOM 452 NH1 ARG A 63 -1.412 17.459 -9.805 1.00 0.00 N ATOM 453 NH2 ARG A 63 0.098 17.587 -8.129 1.00 0.00 N ATOM 0 H ARG A 63 0.373 10.277 -9.202 1.00 0.00 H new ATOM 0 HA ARG A 63 -2.454 11.064 -8.494 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -0.075 12.098 -10.040 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -1.638 12.407 -10.770 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.430 13.610 -8.826 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -1.119 13.015 -7.826 1.00 0.00 H new ATOM 0 HD2 ARG A 63 0.529 14.378 -9.002 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -0.586 14.734 -10.306 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.675 15.502 -7.644 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -2.111 16.930 -10.326 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -1.194 18.418 -10.074 1.00 0.00 H new ATOM 0 HH21 ARG A 63 0.580 17.158 -7.339 1.00 0.00 H new ATOM 0 HH22 ARG A 63 0.316 18.546 -8.399 1.00 0.00 H new ATOM 467 N PHE A 64 -1.826 8.800 -10.461 1.00 0.00 N ATOM 468 CA PHE A 64 -2.376 7.902 -11.510 1.00 0.00 C ATOM 469 C PHE A 64 -3.901 8.003 -11.536 1.00 0.00 C ATOM 470 O PHE A 64 -4.504 8.168 -12.577 1.00 0.00 O ATOM 471 CB PHE A 64 -1.937 6.497 -11.099 1.00 0.00 C ATOM 472 CG PHE A 64 -2.117 5.555 -12.264 1.00 0.00 C ATOM 473 CD1 PHE A 64 -1.139 5.480 -13.262 1.00 0.00 C ATOM 474 CD2 PHE A 64 -3.266 4.760 -12.347 1.00 0.00 C ATOM 475 CE1 PHE A 64 -1.309 4.608 -14.344 1.00 0.00 C ATOM 476 CE2 PHE A 64 -3.435 3.887 -13.429 1.00 0.00 C ATOM 477 CZ PHE A 64 -2.457 3.812 -14.428 1.00 0.00 C ATOM 0 H PHE A 64 -1.093 8.391 -9.882 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.021 8.161 -12.508 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.894 6.508 -10.784 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -2.524 6.155 -10.247 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.253 6.095 -13.198 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.021 4.820 -11.577 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.554 4.550 -15.114 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.320 3.271 -13.493 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.588 3.140 -15.263 1.00 0.00 H new ATOM 487 N ASN A 65 -4.531 7.906 -10.397 1.00 0.00 N ATOM 488 CA ASN A 65 -6.015 7.999 -10.366 1.00 0.00 C ATOM 489 C ASN A 65 -6.465 9.335 -10.965 1.00 0.00 C ATOM 490 O ASN A 65 -7.441 9.406 -11.683 1.00 0.00 O ATOM 491 CB ASN A 65 -6.399 7.908 -8.890 1.00 0.00 C ATOM 492 CG ASN A 65 -7.922 7.862 -8.762 1.00 0.00 C ATOM 493 OD1 ASN A 65 -8.573 7.061 -9.403 1.00 0.00 O ATOM 494 ND2 ASN A 65 -8.523 8.697 -7.959 1.00 0.00 N ATOM 0 H ASN A 65 -4.083 7.767 -9.491 1.00 0.00 H new ATOM 0 HA ASN A 65 -6.491 7.210 -10.949 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -5.959 7.017 -8.443 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -6.003 8.766 -8.347 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -9.539 8.677 -7.870 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -7.977 9.370 -7.421 1.00 0.00 H new ATOM 501 N GLU A 66 -5.751 10.391 -10.683 1.00 0.00 N ATOM 502 CA GLU A 66 -6.132 11.718 -11.247 1.00 0.00 C ATOM 503 C GLU A 66 -5.863 11.732 -12.753 1.00 0.00 C ATOM 504 O GLU A 66 -6.640 12.245 -13.533 1.00 0.00 O ATOM 505 CB GLU A 66 -5.231 12.728 -10.536 1.00 0.00 C ATOM 506 CG GLU A 66 -5.578 12.773 -9.046 1.00 0.00 C ATOM 507 CD GLU A 66 -4.987 14.039 -8.424 1.00 0.00 C ATOM 508 OE1 GLU A 66 -4.727 14.973 -9.163 1.00 0.00 O ATOM 509 OE2 GLU A 66 -4.803 14.053 -7.217 1.00 0.00 O ATOM 0 H GLU A 66 -4.922 10.393 -10.088 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.188 11.946 -11.101 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.185 12.451 -10.667 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.357 13.716 -10.978 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.660 12.760 -8.913 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.184 11.890 -8.543 1.00 0.00 H new ATOM 516 N VAL A 67 -4.761 11.166 -13.163 1.00 0.00 N ATOM 517 CA VAL A 67 -4.424 11.134 -14.614 1.00 0.00 C ATOM 518 C VAL A 67 -5.417 10.241 -15.364 1.00 0.00 C ATOM 519 O VAL A 67 -5.967 10.625 -16.377 1.00 0.00 O ATOM 520 CB VAL A 67 -3.008 10.552 -14.662 1.00 0.00 C ATOM 521 CG1 VAL A 67 -2.638 10.160 -16.095 1.00 0.00 C ATOM 522 CG2 VAL A 67 -2.020 11.603 -14.158 1.00 0.00 C ATOM 0 H VAL A 67 -4.076 10.722 -12.551 1.00 0.00 H new ATOM 0 HA VAL A 67 -4.476 12.115 -15.086 1.00 0.00 H new ATOM 0 HB VAL A 67 -2.968 9.663 -14.033 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -1.629 9.748 -16.111 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -3.341 9.411 -16.460 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -2.680 11.041 -16.736 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.009 11.197 -14.189 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -2.075 12.488 -14.792 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -2.270 11.876 -13.133 1.00 0.00 H new ATOM 532 N ALA A 68 -5.650 9.055 -14.875 1.00 0.00 N ATOM 533 CA ALA A 68 -6.610 8.143 -15.561 1.00 0.00 C ATOM 534 C ALA A 68 -7.987 8.805 -15.660 1.00 0.00 C ATOM 535 O ALA A 68 -8.554 8.928 -16.728 1.00 0.00 O ATOM 536 CB ALA A 68 -6.678 6.901 -14.672 1.00 0.00 C ATOM 0 H ALA A 68 -5.218 8.677 -14.031 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.298 7.902 -16.577 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.367 6.178 -15.109 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.686 6.456 -14.593 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.030 7.183 -13.680 1.00 0.00 H new ATOM 542 N ALA A 69 -8.528 9.231 -14.551 1.00 0.00 N ATOM 543 CA ALA A 69 -9.868 9.885 -14.575 1.00 0.00 C ATOM 544 C ALA A 69 -9.930 10.926 -15.694 1.00 0.00 C ATOM 545 O ALA A 69 -10.836 10.928 -16.503 1.00 0.00 O ATOM 546 CB ALA A 69 -10.000 10.561 -13.210 1.00 0.00 C ATOM 0 H ALA A 69 -8.100 9.154 -13.628 1.00 0.00 H new ATOM 0 HA ALA A 69 -10.672 9.172 -14.760 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -10.963 11.067 -13.146 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -9.933 9.809 -12.424 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -9.198 11.289 -13.086 1.00 0.00 H new ATOM 552 N GLN A 70 -8.974 11.813 -15.749 1.00 0.00 N ATOM 553 CA GLN A 70 -8.985 12.852 -16.818 1.00 0.00 C ATOM 554 C GLN A 70 -8.555 12.239 -18.151 1.00 0.00 C ATOM 555 O GLN A 70 -8.752 12.814 -19.203 1.00 0.00 O ATOM 556 CB GLN A 70 -7.971 13.898 -16.358 1.00 0.00 C ATOM 557 CG GLN A 70 -8.369 14.436 -14.985 1.00 0.00 C ATOM 558 CD GLN A 70 -9.811 14.925 -15.039 1.00 0.00 C ATOM 559 OE1 GLN A 70 -10.062 16.112 -15.092 1.00 0.00 O ATOM 560 NE2 GLN A 70 -10.777 14.054 -15.029 1.00 0.00 N ATOM 0 H GLN A 70 -8.187 11.863 -15.102 1.00 0.00 H new ATOM 0 HA GLN A 70 -9.975 13.282 -16.970 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.975 13.457 -16.311 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -7.924 14.714 -17.079 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.265 13.656 -14.231 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -7.706 15.251 -14.694 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -10.565 13.057 -14.984 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -11.747 14.368 -15.066 1.00 0.00 H new ATOM 569 N TYR A 71 -7.966 11.075 -18.113 1.00 0.00 N ATOM 570 CA TYR A 71 -7.516 10.422 -19.375 1.00 0.00 C ATOM 571 C TYR A 71 -8.364 9.180 -19.667 1.00 0.00 C ATOM 572 O TYR A 71 -7.978 8.323 -20.437 1.00 0.00 O ATOM 573 CB TYR A 71 -6.064 10.013 -19.109 1.00 0.00 C ATOM 574 CG TYR A 71 -5.167 11.230 -19.041 1.00 0.00 C ATOM 575 CD1 TYR A 71 -5.671 12.509 -19.313 1.00 0.00 C ATOM 576 CD2 TYR A 71 -3.819 11.072 -18.701 1.00 0.00 C ATOM 577 CE1 TYR A 71 -4.828 13.624 -19.245 1.00 0.00 C ATOM 578 CE2 TYR A 71 -2.976 12.187 -18.631 1.00 0.00 C ATOM 579 CZ TYR A 71 -3.480 13.464 -18.904 1.00 0.00 C ATOM 580 OH TYR A 71 -2.649 14.564 -18.834 1.00 0.00 O ATOM 0 H TYR A 71 -7.777 10.547 -17.261 1.00 0.00 H new ATOM 0 HA TYR A 71 -7.612 11.085 -20.235 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -6.003 9.458 -18.173 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -5.719 9.345 -19.898 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -6.711 12.634 -19.575 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -3.428 10.087 -18.492 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -5.218 14.609 -19.456 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -1.936 12.062 -18.366 1.00 0.00 H new ATOM 0 HH TYR A 71 -3.170 15.352 -18.574 1.00 0.00 H new ATOM 590 N SER A 72 -9.514 9.070 -19.060 1.00 0.00 N ATOM 591 CA SER A 72 -10.374 7.880 -19.308 1.00 0.00 C ATOM 592 C SER A 72 -11.129 8.036 -20.628 1.00 0.00 C ATOM 593 O SER A 72 -12.199 8.609 -20.679 1.00 0.00 O ATOM 594 CB SER A 72 -11.352 7.841 -18.136 1.00 0.00 C ATOM 595 OG SER A 72 -11.943 9.124 -17.979 1.00 0.00 O ATOM 0 H SER A 72 -9.894 9.752 -18.404 1.00 0.00 H new ATOM 0 HA SER A 72 -9.790 6.962 -19.382 1.00 0.00 H new ATOM 0 HB2 SER A 72 -12.123 7.091 -18.315 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.832 7.552 -17.222 1.00 0.00 H new ATOM 0 HG SER A 72 -11.499 9.601 -17.247 1.00 0.00 H new ATOM 601 N GLU A 73 -10.586 7.521 -21.693 1.00 0.00 N ATOM 602 CA GLU A 73 -11.275 7.629 -23.007 1.00 0.00 C ATOM 603 C GLU A 73 -11.805 6.255 -23.421 1.00 0.00 C ATOM 604 O GLU A 73 -12.271 6.065 -24.527 1.00 0.00 O ATOM 605 CB GLU A 73 -10.197 8.099 -23.980 1.00 0.00 C ATOM 606 CG GLU A 73 -9.999 9.610 -23.837 1.00 0.00 C ATOM 607 CD GLU A 73 -9.171 9.901 -22.583 1.00 0.00 C ATOM 608 OE1 GLU A 73 -7.975 9.666 -22.620 1.00 0.00 O ATOM 609 OE2 GLU A 73 -9.748 10.353 -21.608 1.00 0.00 O ATOM 0 H GLU A 73 -9.693 7.029 -21.711 1.00 0.00 H new ATOM 0 HA GLU A 73 -12.124 8.313 -22.981 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -9.260 7.579 -23.780 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -10.485 7.855 -25.003 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -9.495 10.006 -24.718 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -10.966 10.109 -23.771 1.00 0.00 H new ATOM 616 N ASP A 74 -11.733 5.295 -22.539 1.00 0.00 N ATOM 617 CA ASP A 74 -12.227 3.931 -22.885 1.00 0.00 C ATOM 618 C ASP A 74 -13.473 3.594 -22.066 1.00 0.00 C ATOM 619 O ASP A 74 -13.670 2.471 -21.647 1.00 0.00 O ATOM 620 CB ASP A 74 -11.081 2.991 -22.518 1.00 0.00 C ATOM 621 CG ASP A 74 -10.656 3.250 -21.071 1.00 0.00 C ATOM 622 OD1 ASP A 74 -11.528 3.297 -20.219 1.00 0.00 O ATOM 623 OD2 ASP A 74 -9.468 3.390 -20.838 1.00 0.00 O ATOM 0 H ASP A 74 -11.355 5.395 -21.597 1.00 0.00 H new ATOM 0 HA ASP A 74 -12.505 3.849 -23.936 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -11.394 1.954 -22.637 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -10.237 3.148 -23.190 1.00 0.00 H new ATOM 628 N LYS A 75 -14.316 4.559 -21.834 1.00 0.00 N ATOM 629 CA LYS A 75 -15.550 4.295 -21.044 1.00 0.00 C ATOM 630 C LYS A 75 -16.266 3.051 -21.576 1.00 0.00 C ATOM 631 O LYS A 75 -16.916 2.335 -20.842 1.00 0.00 O ATOM 632 CB LYS A 75 -16.420 5.534 -21.246 1.00 0.00 C ATOM 633 CG LYS A 75 -17.709 5.390 -20.434 1.00 0.00 C ATOM 634 CD LYS A 75 -17.409 5.628 -18.953 1.00 0.00 C ATOM 635 CE LYS A 75 -18.686 5.423 -18.135 1.00 0.00 C ATOM 636 NZ LYS A 75 -18.375 5.976 -16.787 1.00 0.00 N ATOM 0 H LYS A 75 -14.204 5.520 -22.157 1.00 0.00 H new ATOM 0 HA LYS A 75 -15.333 4.112 -19.992 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -15.878 6.427 -20.933 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -16.655 5.658 -22.303 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -18.454 6.105 -20.784 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -18.131 4.395 -20.575 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -16.633 4.942 -18.613 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -17.028 6.639 -18.806 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -19.532 5.940 -18.588 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -18.952 4.368 -18.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -19.205 5.871 -16.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -17.570 5.460 -16.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -18.132 6.984 -16.873 1.00 0.00 H new ATOM 650 N ALA A 76 -16.155 2.794 -22.852 1.00 0.00 N ATOM 651 CA ALA A 76 -16.834 1.602 -23.437 1.00 0.00 C ATOM 652 C ALA A 76 -16.058 0.324 -23.102 1.00 0.00 C ATOM 653 O ALA A 76 -16.637 -0.707 -22.818 1.00 0.00 O ATOM 654 CB ALA A 76 -16.832 1.851 -24.946 1.00 0.00 C ATOM 0 H ALA A 76 -15.623 3.358 -23.515 1.00 0.00 H new ATOM 0 HA ALA A 76 -17.842 1.468 -23.044 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -17.316 1.016 -25.453 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -17.374 2.771 -25.164 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -15.805 1.943 -25.298 1.00 0.00 H new ATOM 660 N ARG A 77 -14.754 0.380 -23.133 1.00 0.00 N ATOM 661 CA ARG A 77 -13.947 -0.835 -22.815 1.00 0.00 C ATOM 662 C ARG A 77 -13.618 -0.878 -21.321 1.00 0.00 C ATOM 663 O ARG A 77 -12.890 -1.736 -20.863 1.00 0.00 O ATOM 664 CB ARG A 77 -12.664 -0.688 -23.637 1.00 0.00 C ATOM 665 CG ARG A 77 -13.020 -0.489 -25.112 1.00 0.00 C ATOM 666 CD ARG A 77 -13.685 -1.756 -25.653 1.00 0.00 C ATOM 667 NE ARG A 77 -13.655 -1.599 -27.134 1.00 0.00 N ATOM 668 CZ ARG A 77 -12.711 -2.170 -27.831 1.00 0.00 C ATOM 669 NH1 ARG A 77 -11.493 -2.216 -27.364 1.00 0.00 N ATOM 670 NH2 ARG A 77 -12.984 -2.690 -28.996 1.00 0.00 N ATOM 0 H ARG A 77 -14.212 1.213 -23.364 1.00 0.00 H new ATOM 0 HA ARG A 77 -14.482 -1.755 -23.051 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -12.083 0.160 -23.275 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -12.041 -1.575 -23.519 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -13.691 0.362 -25.223 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -12.122 -0.264 -25.687 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -13.147 -2.650 -25.339 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -14.707 -1.854 -25.286 1.00 0.00 H new ATOM 0 HE ARG A 77 -14.372 -1.045 -27.603 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -11.280 -1.806 -26.455 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -10.755 -2.662 -27.908 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -13.935 -2.650 -29.362 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -12.246 -3.136 -29.541 1.00 0.00 H new ATOM 684 N GLN A 78 -14.142 0.040 -20.558 1.00 0.00 N ATOM 685 CA GLN A 78 -13.844 0.043 -19.098 1.00 0.00 C ATOM 686 C GLN A 78 -12.330 -0.027 -18.883 1.00 0.00 C ATOM 687 O GLN A 78 -11.833 -0.858 -18.148 1.00 0.00 O ATOM 688 CB GLN A 78 -14.528 -1.212 -18.552 1.00 0.00 C ATOM 689 CG GLN A 78 -16.043 -1.087 -18.735 1.00 0.00 C ATOM 690 CD GLN A 78 -16.587 -0.033 -17.769 1.00 0.00 C ATOM 691 OE1 GLN A 78 -16.373 -0.118 -16.575 1.00 0.00 O ATOM 692 NE2 GLN A 78 -17.289 0.964 -18.236 1.00 0.00 N ATOM 0 H GLN A 78 -14.760 0.785 -20.879 1.00 0.00 H new ATOM 0 HA GLN A 78 -14.199 0.944 -18.597 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -14.160 -2.096 -19.073 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -14.288 -1.340 -17.497 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -16.274 -0.808 -19.763 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -16.523 -2.048 -18.550 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -17.469 1.036 -19.237 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -17.657 1.671 -17.599 1.00 0.00 H new ATOM 701 N GLY A 79 -11.594 0.839 -19.527 1.00 0.00 N ATOM 702 CA GLY A 79 -10.113 0.822 -19.370 1.00 0.00 C ATOM 703 C GLY A 79 -9.724 1.479 -18.047 1.00 0.00 C ATOM 704 O GLY A 79 -9.929 2.658 -17.838 1.00 0.00 O ATOM 0 H GLY A 79 -11.956 1.557 -20.155 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.747 -0.204 -19.398 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -9.644 1.350 -20.200 1.00 0.00 H new ATOM 708 N GLY A 80 -9.157 0.716 -17.159 1.00 0.00 N ATOM 709 CA GLY A 80 -8.738 1.269 -15.842 1.00 0.00 C ATOM 710 C GLY A 80 -7.863 0.230 -15.141 1.00 0.00 C ATOM 711 O GLY A 80 -6.866 -0.213 -15.675 1.00 0.00 O ATOM 0 H GLY A 80 -8.964 -0.277 -17.289 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.187 2.199 -15.979 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -9.611 1.503 -15.233 1.00 0.00 H new ATOM 715 N ASP A 81 -8.237 -0.184 -13.961 1.00 0.00 N ATOM 716 CA ASP A 81 -7.429 -1.216 -13.256 1.00 0.00 C ATOM 717 C ASP A 81 -7.896 -2.602 -13.699 1.00 0.00 C ATOM 718 O ASP A 81 -9.076 -2.888 -13.720 1.00 0.00 O ATOM 719 CB ASP A 81 -7.702 -1.000 -11.766 1.00 0.00 C ATOM 720 CG ASP A 81 -9.206 -1.093 -11.502 1.00 0.00 C ATOM 721 OD1 ASP A 81 -9.956 -1.123 -12.464 1.00 0.00 O ATOM 722 OD2 ASP A 81 -9.581 -1.134 -10.343 1.00 0.00 O ATOM 0 H ASP A 81 -9.061 0.146 -13.459 1.00 0.00 H new ATOM 0 HA ASP A 81 -6.364 -1.141 -13.474 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -7.172 -1.748 -11.177 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -7.327 -0.025 -11.455 1.00 0.00 H new ATOM 727 N LEU A 82 -6.990 -3.466 -14.059 1.00 0.00 N ATOM 728 CA LEU A 82 -7.405 -4.823 -14.503 1.00 0.00 C ATOM 729 C LEU A 82 -7.159 -5.839 -13.393 1.00 0.00 C ATOM 730 O LEU A 82 -6.410 -5.595 -12.468 1.00 0.00 O ATOM 731 CB LEU A 82 -6.504 -5.132 -15.692 1.00 0.00 C ATOM 732 CG LEU A 82 -7.062 -4.499 -16.962 1.00 0.00 C ATOM 733 CD1 LEU A 82 -7.412 -3.034 -16.696 1.00 0.00 C ATOM 734 CD2 LEU A 82 -5.996 -4.580 -18.056 1.00 0.00 C ATOM 0 H LEU A 82 -5.985 -3.292 -14.065 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.464 -4.868 -14.756 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -5.499 -4.755 -15.502 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.421 -6.211 -15.822 1.00 0.00 H new ATOM 0 HG LEU A 82 -7.962 -5.027 -17.277 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -7.811 -2.584 -17.605 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -8.160 -2.976 -15.905 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.516 -2.496 -16.388 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -6.380 -4.131 -18.972 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.104 -4.043 -17.735 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.744 -5.624 -18.242 1.00 0.00 H new ATOM 746 N GLY A 83 -7.771 -6.983 -13.483 1.00 0.00 N ATOM 747 CA GLY A 83 -7.559 -8.017 -12.440 1.00 0.00 C ATOM 748 C GLY A 83 -6.434 -8.947 -12.887 1.00 0.00 C ATOM 749 O GLY A 83 -5.401 -8.504 -13.371 1.00 0.00 O ATOM 0 H GLY A 83 -8.409 -7.246 -14.234 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -7.305 -7.547 -11.490 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -8.476 -8.584 -12.280 1.00 0.00 H new ATOM 753 N TRP A 84 -6.630 -10.231 -12.729 1.00 0.00 N ATOM 754 CA TRP A 84 -5.585 -11.214 -13.133 1.00 0.00 C ATOM 755 C TRP A 84 -5.869 -11.765 -14.534 1.00 0.00 C ATOM 756 O TRP A 84 -6.972 -12.173 -14.838 1.00 0.00 O ATOM 757 CB TRP A 84 -5.690 -12.345 -12.106 1.00 0.00 C ATOM 758 CG TRP A 84 -5.036 -11.934 -10.828 1.00 0.00 C ATOM 759 CD1 TRP A 84 -3.705 -11.976 -10.590 1.00 0.00 C ATOM 760 CD2 TRP A 84 -5.654 -11.429 -9.609 1.00 0.00 C ATOM 761 NE1 TRP A 84 -3.467 -11.528 -9.305 1.00 0.00 N ATOM 762 CE2 TRP A 84 -4.636 -11.179 -8.659 1.00 0.00 C ATOM 763 CE3 TRP A 84 -6.987 -11.168 -9.238 1.00 0.00 C ATOM 764 CZ2 TRP A 84 -4.928 -10.685 -7.387 1.00 0.00 C ATOM 765 CZ3 TRP A 84 -7.284 -10.670 -7.959 1.00 0.00 C ATOM 766 CH2 TRP A 84 -6.256 -10.430 -7.035 1.00 0.00 C ATOM 0 H TRP A 84 -7.476 -10.642 -12.334 1.00 0.00 H new ATOM 0 HA TRP A 84 -4.595 -10.759 -13.161 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -6.737 -12.589 -11.927 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -5.215 -13.246 -12.494 1.00 0.00 H new ATOM 0 HD1 TRP A 84 -2.952 -12.306 -11.290 1.00 0.00 H new ATOM 0 HE1 TRP A 84 -2.540 -11.463 -8.885 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -7.786 -11.352 -9.941 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 -4.133 -10.501 -6.679 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -8.310 -10.471 -7.685 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -6.491 -10.048 -6.052 1.00 0.00 H new ATOM 777 N MET A 85 -4.876 -11.806 -15.380 1.00 0.00 N ATOM 778 CA MET A 85 -5.083 -12.364 -16.748 1.00 0.00 C ATOM 779 C MET A 85 -3.869 -13.186 -17.157 1.00 0.00 C ATOM 780 O MET A 85 -2.833 -13.137 -16.528 1.00 0.00 O ATOM 781 CB MET A 85 -5.224 -11.171 -17.688 1.00 0.00 C ATOM 782 CG MET A 85 -3.894 -10.424 -17.766 1.00 0.00 C ATOM 783 SD MET A 85 -4.082 -8.773 -17.054 1.00 0.00 S ATOM 784 CE MET A 85 -2.332 -8.324 -17.098 1.00 0.00 C ATOM 0 H MET A 85 -3.930 -11.478 -15.184 1.00 0.00 H new ATOM 0 HA MET A 85 -5.963 -13.006 -16.781 1.00 0.00 H new ATOM 0 HB2 MET A 85 -5.522 -11.510 -18.680 1.00 0.00 H new ATOM 0 HB3 MET A 85 -6.008 -10.503 -17.330 1.00 0.00 H new ATOM 0 HG2 MET A 85 -3.123 -10.977 -17.229 1.00 0.00 H new ATOM 0 HG3 MET A 85 -3.568 -10.349 -18.803 1.00 0.00 H new ATOM 0 HE1 MET A 85 -1.989 -8.098 -16.088 1.00 0.00 H new ATOM 0 HE2 MET A 85 -1.753 -9.155 -17.501 1.00 0.00 H new ATOM 0 HE3 MET A 85 -2.197 -7.447 -17.731 1.00 0.00 H new ATOM 794 N THR A 86 -3.985 -13.926 -18.216 1.00 0.00 N ATOM 795 CA THR A 86 -2.835 -14.739 -18.679 1.00 0.00 C ATOM 796 C THR A 86 -2.577 -14.453 -20.162 1.00 0.00 C ATOM 797 O THR A 86 -2.405 -13.321 -20.564 1.00 0.00 O ATOM 798 CB THR A 86 -3.271 -16.188 -18.450 1.00 0.00 C ATOM 799 OG1 THR A 86 -4.310 -16.516 -19.364 1.00 0.00 O ATOM 800 CG2 THR A 86 -3.773 -16.345 -17.014 1.00 0.00 C ATOM 0 H THR A 86 -4.829 -14.004 -18.783 1.00 0.00 H new ATOM 0 HA THR A 86 -1.906 -14.519 -18.152 1.00 0.00 H new ATOM 0 HB THR A 86 -2.426 -16.858 -18.610 1.00 0.00 H new ATOM 0 HG1 THR A 86 -4.125 -17.388 -19.770 1.00 0.00 H new ATOM 0 HG21 THR A 86 -4.084 -17.376 -16.848 1.00 0.00 H new ATOM 0 HG22 THR A 86 -2.973 -16.091 -16.319 1.00 0.00 H new ATOM 0 HG23 THR A 86 -4.620 -15.679 -16.850 1.00 0.00 H new ATOM 808 N ARG A 87 -2.550 -15.464 -20.980 1.00 0.00 N ATOM 809 CA ARG A 87 -2.305 -15.237 -22.431 1.00 0.00 C ATOM 810 C ARG A 87 -3.554 -15.605 -23.231 1.00 0.00 C ATOM 811 O ARG A 87 -4.527 -16.094 -22.689 1.00 0.00 O ATOM 812 CB ARG A 87 -1.133 -16.151 -22.793 1.00 0.00 C ATOM 813 CG ARG A 87 -1.429 -17.585 -22.353 1.00 0.00 C ATOM 814 CD ARG A 87 -0.333 -18.512 -22.888 1.00 0.00 C ATOM 815 NE ARG A 87 -0.857 -19.889 -22.678 1.00 0.00 N ATOM 816 CZ ARG A 87 -1.208 -20.615 -23.705 1.00 0.00 C ATOM 817 NH1 ARG A 87 -2.173 -20.215 -24.487 1.00 0.00 N ATOM 818 NH2 ARG A 87 -0.588 -21.737 -23.953 1.00 0.00 N ATOM 0 H ARG A 87 -2.687 -16.438 -20.709 1.00 0.00 H new ATOM 0 HA ARG A 87 -2.078 -14.195 -22.656 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -0.957 -16.121 -23.868 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -0.222 -15.795 -22.311 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -1.472 -17.643 -21.265 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -2.403 -17.899 -22.728 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -0.135 -18.322 -23.943 1.00 0.00 H new ATOM 0 HD3 ARG A 87 0.606 -18.361 -22.355 1.00 0.00 H new ATOM 0 HE ARG A 87 -0.942 -20.265 -21.734 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -2.653 -19.335 -24.296 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -2.447 -20.782 -25.289 1.00 0.00 H new ATOM 0 HH21 ARG A 87 0.170 -22.046 -23.345 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -0.862 -22.304 -24.755 1.00 0.00 H new ATOM 832 N GLY A 88 -3.545 -15.366 -24.513 1.00 0.00 N ATOM 833 CA GLY A 88 -4.742 -15.694 -25.335 1.00 0.00 C ATOM 834 C GLY A 88 -5.900 -14.792 -24.909 1.00 0.00 C ATOM 835 O GLY A 88 -7.039 -15.007 -25.274 1.00 0.00 O ATOM 0 H GLY A 88 -2.763 -14.959 -25.025 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -4.523 -15.551 -26.393 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -5.013 -16.742 -25.204 1.00 0.00 H new ATOM 839 N SER A 89 -5.616 -13.781 -24.132 1.00 0.00 N ATOM 840 CA SER A 89 -6.694 -12.859 -23.673 1.00 0.00 C ATOM 841 C SER A 89 -6.535 -11.492 -24.339 1.00 0.00 C ATOM 842 O SER A 89 -7.493 -10.780 -24.560 1.00 0.00 O ATOM 843 CB SER A 89 -6.488 -12.737 -22.166 1.00 0.00 C ATOM 844 OG SER A 89 -7.422 -11.802 -21.640 1.00 0.00 O ATOM 0 H SER A 89 -4.681 -13.554 -23.795 1.00 0.00 H new ATOM 0 HA SER A 89 -7.689 -13.227 -23.925 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.620 -13.708 -21.689 1.00 0.00 H new ATOM 0 HB3 SER A 89 -5.470 -12.412 -21.951 1.00 0.00 H new ATOM 0 HG SER A 89 -7.294 -11.722 -20.672 1.00 0.00 H new ATOM 850 N MET A 90 -5.327 -11.121 -24.658 1.00 0.00 N ATOM 851 CA MET A 90 -5.100 -9.798 -25.308 1.00 0.00 C ATOM 852 C MET A 90 -4.308 -9.977 -26.604 1.00 0.00 C ATOM 853 O MET A 90 -3.906 -11.069 -26.954 1.00 0.00 O ATOM 854 CB MET A 90 -4.298 -8.956 -24.303 1.00 0.00 C ATOM 855 CG MET A 90 -3.453 -9.857 -23.394 1.00 0.00 C ATOM 856 SD MET A 90 -2.620 -8.845 -22.147 1.00 0.00 S ATOM 857 CE MET A 90 -1.692 -10.183 -21.356 1.00 0.00 C ATOM 0 H MET A 90 -4.486 -11.676 -24.497 1.00 0.00 H new ATOM 0 HA MET A 90 -6.042 -9.314 -25.565 1.00 0.00 H new ATOM 0 HB2 MET A 90 -3.651 -8.261 -24.838 1.00 0.00 H new ATOM 0 HB3 MET A 90 -4.979 -8.357 -23.698 1.00 0.00 H new ATOM 0 HG2 MET A 90 -4.087 -10.600 -22.910 1.00 0.00 H new ATOM 0 HG3 MET A 90 -2.718 -10.402 -23.986 1.00 0.00 H new ATOM 0 HE1 MET A 90 -1.737 -10.067 -20.273 1.00 0.00 H new ATOM 0 HE2 MET A 90 -2.127 -11.142 -21.636 1.00 0.00 H new ATOM 0 HE3 MET A 90 -0.652 -10.147 -21.682 1.00 0.00 H new ATOM 867 N VAL A 91 -4.088 -8.912 -27.321 1.00 0.00 N ATOM 868 CA VAL A 91 -3.329 -9.018 -28.602 1.00 0.00 C ATOM 869 C VAL A 91 -1.860 -9.368 -28.336 1.00 0.00 C ATOM 870 O VAL A 91 -1.464 -9.639 -27.220 1.00 0.00 O ATOM 871 CB VAL A 91 -3.450 -7.639 -29.251 1.00 0.00 C ATOM 872 CG1 VAL A 91 -4.901 -7.398 -29.670 1.00 0.00 C ATOM 873 CG2 VAL A 91 -3.024 -6.565 -28.248 1.00 0.00 C ATOM 0 H VAL A 91 -4.400 -7.972 -27.078 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.721 -9.806 -29.245 1.00 0.00 H new ATOM 0 HB VAL A 91 -2.806 -7.593 -30.129 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -4.988 -6.415 -30.133 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -5.205 -8.163 -30.384 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -5.546 -7.444 -28.792 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -3.110 -5.581 -28.710 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -3.668 -6.611 -27.370 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.990 -6.736 -27.949 1.00 0.00 H new ATOM 883 N GLY A 92 -1.058 -9.385 -29.367 1.00 0.00 N ATOM 884 CA GLY A 92 0.382 -9.737 -29.209 1.00 0.00 C ATOM 885 C GLY A 92 1.199 -8.567 -28.632 1.00 0.00 C ATOM 886 O GLY A 92 1.985 -8.767 -27.727 1.00 0.00 O ATOM 0 H GLY A 92 -1.343 -9.168 -30.322 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.474 -10.603 -28.553 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.794 -10.025 -30.176 1.00 0.00 H new ATOM 890 N PRO A 93 1.018 -7.385 -29.176 1.00 0.00 N ATOM 891 CA PRO A 93 1.795 -6.211 -28.688 1.00 0.00 C ATOM 892 C PRO A 93 1.421 -5.868 -27.245 1.00 0.00 C ATOM 893 O PRO A 93 2.277 -5.660 -26.408 1.00 0.00 O ATOM 894 CB PRO A 93 1.400 -5.093 -29.651 1.00 0.00 C ATOM 895 CG PRO A 93 0.071 -5.508 -30.185 1.00 0.00 C ATOM 896 CD PRO A 93 0.096 -7.011 -30.260 1.00 0.00 C ATOM 0 HA PRO A 93 2.870 -6.388 -28.673 1.00 0.00 H new ATOM 0 HB2 PRO A 93 1.339 -4.132 -29.140 1.00 0.00 H new ATOM 0 HB3 PRO A 93 2.132 -4.982 -30.451 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -0.734 -5.165 -29.535 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -0.106 -5.073 -31.168 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -0.896 -7.438 -30.111 1.00 0.00 H new ATOM 0 HD3 PRO A 93 0.451 -7.360 -31.230 1.00 0.00 H new ATOM 904 N PHE A 94 0.156 -5.815 -26.939 1.00 0.00 N ATOM 905 CA PHE A 94 -0.254 -5.493 -25.543 1.00 0.00 C ATOM 906 C PHE A 94 0.172 -6.622 -24.600 1.00 0.00 C ATOM 907 O PHE A 94 0.624 -6.389 -23.497 1.00 0.00 O ATOM 908 CB PHE A 94 -1.776 -5.379 -25.591 1.00 0.00 C ATOM 909 CG PHE A 94 -2.256 -4.587 -24.400 1.00 0.00 C ATOM 910 CD1 PHE A 94 -1.954 -5.018 -23.104 1.00 0.00 C ATOM 911 CD2 PHE A 94 -3.003 -3.421 -24.593 1.00 0.00 C ATOM 912 CE1 PHE A 94 -2.400 -4.284 -21.999 1.00 0.00 C ATOM 913 CE2 PHE A 94 -3.451 -2.685 -23.489 1.00 0.00 C ATOM 914 CZ PHE A 94 -3.149 -3.116 -22.192 1.00 0.00 C ATOM 0 H PHE A 94 -0.610 -5.980 -27.592 1.00 0.00 H new ATOM 0 HA PHE A 94 0.208 -4.577 -25.175 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.086 -4.891 -26.515 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.227 -6.372 -25.587 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -1.376 -5.918 -22.956 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -3.235 -3.088 -25.594 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -2.167 -4.618 -20.999 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -4.029 -1.785 -23.638 1.00 0.00 H new ATOM 0 HZ PHE A 94 -3.493 -2.548 -21.340 1.00 0.00 H new ATOM 924 N GLN A 95 0.037 -7.846 -25.033 1.00 0.00 N ATOM 925 CA GLN A 95 0.437 -8.996 -24.172 1.00 0.00 C ATOM 926 C GLN A 95 1.961 -9.036 -24.026 1.00 0.00 C ATOM 927 O GLN A 95 2.488 -9.225 -22.949 1.00 0.00 O ATOM 928 CB GLN A 95 -0.067 -10.233 -24.922 1.00 0.00 C ATOM 929 CG GLN A 95 0.382 -11.502 -24.195 1.00 0.00 C ATOM 930 CD GLN A 95 0.288 -12.691 -25.152 1.00 0.00 C ATOM 931 OE1 GLN A 95 1.018 -12.763 -26.121 1.00 0.00 O ATOM 932 NE2 GLN A 95 -0.590 -13.631 -24.925 1.00 0.00 N ATOM 0 H GLN A 95 -0.334 -8.100 -25.949 1.00 0.00 H new ATOM 0 HA GLN A 95 0.025 -8.931 -23.165 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -1.155 -10.209 -24.991 1.00 0.00 H new ATOM 0 HB3 GLN A 95 0.318 -10.232 -25.942 1.00 0.00 H new ATOM 0 HG2 GLN A 95 1.405 -11.388 -23.838 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -0.244 -11.674 -23.319 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -1.203 -13.571 -24.112 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -0.663 -14.425 -25.561 1.00 0.00 H new ATOM 941 N GLU A 96 2.669 -8.853 -25.108 1.00 0.00 N ATOM 942 CA GLU A 96 4.160 -8.874 -25.047 1.00 0.00 C ATOM 943 C GLU A 96 4.666 -7.930 -23.951 1.00 0.00 C ATOM 944 O GLU A 96 5.734 -8.116 -23.404 1.00 0.00 O ATOM 945 CB GLU A 96 4.612 -8.380 -26.421 1.00 0.00 C ATOM 946 CG GLU A 96 6.127 -8.548 -26.555 1.00 0.00 C ATOM 947 CD GLU A 96 6.520 -8.449 -28.029 1.00 0.00 C ATOM 948 OE1 GLU A 96 5.920 -7.649 -28.729 1.00 0.00 O ATOM 949 OE2 GLU A 96 7.414 -9.173 -28.435 1.00 0.00 O ATOM 0 H GLU A 96 2.278 -8.689 -26.036 1.00 0.00 H new ATOM 0 HA GLU A 96 4.548 -9.865 -24.813 1.00 0.00 H new ATOM 0 HB2 GLU A 96 4.103 -8.940 -27.205 1.00 0.00 H new ATOM 0 HB3 GLU A 96 4.339 -7.332 -26.550 1.00 0.00 H new ATOM 0 HG2 GLU A 96 6.642 -7.780 -25.978 1.00 0.00 H new ATOM 0 HG3 GLU A 96 6.435 -9.512 -26.149 1.00 0.00 H new ATOM 956 N ALA A 97 3.911 -6.914 -23.634 1.00 0.00 N ATOM 957 CA ALA A 97 4.356 -5.954 -22.580 1.00 0.00 C ATOM 958 C ALA A 97 3.856 -6.401 -21.202 1.00 0.00 C ATOM 959 O ALA A 97 4.544 -6.268 -20.209 1.00 0.00 O ATOM 960 CB ALA A 97 3.718 -4.619 -22.973 1.00 0.00 C ATOM 0 H ALA A 97 3.007 -6.706 -24.057 1.00 0.00 H new ATOM 0 HA ALA A 97 5.442 -5.889 -22.514 1.00 0.00 H new ATOM 0 HB1 ALA A 97 3.996 -3.855 -22.247 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.070 -4.325 -23.962 1.00 0.00 H new ATOM 0 HB3 ALA A 97 2.633 -4.725 -22.991 1.00 0.00 H new ATOM 966 N ALA A 98 2.660 -6.918 -21.136 1.00 0.00 N ATOM 967 CA ALA A 98 2.101 -7.360 -19.824 1.00 0.00 C ATOM 968 C ALA A 98 2.934 -8.489 -19.206 1.00 0.00 C ATOM 969 O ALA A 98 3.177 -8.507 -18.017 1.00 0.00 O ATOM 970 CB ALA A 98 0.695 -7.864 -20.148 1.00 0.00 C ATOM 0 H ALA A 98 2.043 -7.054 -21.936 1.00 0.00 H new ATOM 0 HA ALA A 98 2.103 -6.547 -19.098 1.00 0.00 H new ATOM 0 HB1 ALA A 98 0.212 -8.209 -19.234 1.00 0.00 H new ATOM 0 HB2 ALA A 98 0.110 -7.054 -20.584 1.00 0.00 H new ATOM 0 HB3 ALA A 98 0.759 -8.689 -20.858 1.00 0.00 H new ATOM 976 N PHE A 99 3.351 -9.447 -19.989 1.00 0.00 N ATOM 977 CA PHE A 99 4.137 -10.579 -19.414 1.00 0.00 C ATOM 978 C PHE A 99 5.637 -10.423 -19.681 1.00 0.00 C ATOM 979 O PHE A 99 6.445 -11.121 -19.102 1.00 0.00 O ATOM 980 CB PHE A 99 3.603 -11.825 -20.118 1.00 0.00 C ATOM 981 CG PHE A 99 2.456 -12.389 -19.320 1.00 0.00 C ATOM 982 CD1 PHE A 99 2.711 -13.127 -18.159 1.00 0.00 C ATOM 983 CD2 PHE A 99 1.139 -12.171 -19.737 1.00 0.00 C ATOM 984 CE1 PHE A 99 1.648 -13.647 -17.413 1.00 0.00 C ATOM 985 CE2 PHE A 99 0.075 -12.692 -18.991 1.00 0.00 C ATOM 986 CZ PHE A 99 0.330 -13.429 -17.829 1.00 0.00 C ATOM 0 H PHE A 99 3.184 -9.496 -20.994 1.00 0.00 H new ATOM 0 HA PHE A 99 4.027 -10.626 -18.331 1.00 0.00 H new ATOM 0 HB2 PHE A 99 3.272 -11.575 -21.126 1.00 0.00 H new ATOM 0 HB3 PHE A 99 4.394 -12.569 -20.217 1.00 0.00 H new ATOM 0 HD1 PHE A 99 3.729 -13.295 -17.839 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.943 -11.601 -20.633 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.845 -14.216 -16.517 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -0.943 -12.525 -19.312 1.00 0.00 H new ATOM 0 HZ PHE A 99 -0.491 -13.830 -17.253 1.00 0.00 H new ATOM 996 N ALA A 100 6.027 -9.532 -20.548 1.00 0.00 N ATOM 997 CA ALA A 100 7.484 -9.377 -20.824 1.00 0.00 C ATOM 998 C ALA A 100 7.994 -8.018 -20.336 1.00 0.00 C ATOM 999 O ALA A 100 9.116 -7.640 -20.607 1.00 0.00 O ATOM 1000 CB ALA A 100 7.619 -9.494 -22.342 1.00 0.00 C ATOM 0 H ALA A 100 5.410 -8.911 -21.072 1.00 0.00 H new ATOM 0 HA ALA A 100 8.076 -10.130 -20.303 1.00 0.00 H new ATOM 0 HB1 ALA A 100 8.667 -9.390 -22.623 1.00 0.00 H new ATOM 0 HB2 ALA A 100 7.251 -10.468 -22.666 1.00 0.00 H new ATOM 0 HB3 ALA A 100 7.035 -8.708 -22.821 1.00 0.00 H new ATOM 1006 N LEU A 101 7.189 -7.280 -19.614 1.00 0.00 N ATOM 1007 CA LEU A 101 7.657 -5.952 -19.113 1.00 0.00 C ATOM 1008 C LEU A 101 9.096 -6.075 -18.599 1.00 0.00 C ATOM 1009 O LEU A 101 9.435 -7.025 -17.922 1.00 0.00 O ATOM 1010 CB LEU A 101 6.690 -5.578 -17.983 1.00 0.00 C ATOM 1011 CG LEU A 101 6.963 -6.443 -16.749 1.00 0.00 C ATOM 1012 CD1 LEU A 101 6.179 -5.890 -15.556 1.00 0.00 C ATOM 1013 CD2 LEU A 101 6.516 -7.880 -17.025 1.00 0.00 C ATOM 0 H LEU A 101 6.237 -7.536 -19.352 1.00 0.00 H new ATOM 0 HA LEU A 101 7.662 -5.188 -19.890 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.804 -4.524 -17.730 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.661 -5.717 -18.314 1.00 0.00 H new ATOM 0 HG LEU A 101 8.030 -6.429 -16.524 1.00 0.00 H new ATOM 0 HD11 LEU A 101 6.372 -6.505 -14.677 1.00 0.00 H new ATOM 0 HD12 LEU A 101 6.493 -4.865 -15.358 1.00 0.00 H new ATOM 0 HD13 LEU A 101 5.113 -5.906 -15.782 1.00 0.00 H new ATOM 0 HD21 LEU A 101 6.710 -8.496 -16.147 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.449 -7.893 -17.249 1.00 0.00 H new ATOM 0 HD23 LEU A 101 7.070 -8.276 -17.876 1.00 0.00 H new ATOM 1025 N PRO A 102 9.905 -5.118 -18.966 1.00 0.00 N ATOM 1026 CA PRO A 102 11.335 -5.126 -18.563 1.00 0.00 C ATOM 1027 C PRO A 102 11.504 -4.831 -17.069 1.00 0.00 C ATOM 1028 O PRO A 102 12.552 -5.067 -16.500 1.00 0.00 O ATOM 1029 CB PRO A 102 11.950 -4.017 -19.413 1.00 0.00 C ATOM 1030 CG PRO A 102 10.813 -3.102 -19.737 1.00 0.00 C ATOM 1031 CD PRO A 102 9.567 -3.948 -19.783 1.00 0.00 C ATOM 0 HA PRO A 102 11.807 -6.096 -18.717 1.00 0.00 H new ATOM 0 HB2 PRO A 102 12.736 -3.493 -18.869 1.00 0.00 H new ATOM 0 HB3 PRO A 102 12.403 -4.419 -20.319 1.00 0.00 H new ATOM 0 HG2 PRO A 102 10.721 -2.320 -18.984 1.00 0.00 H new ATOM 0 HG3 PRO A 102 10.978 -2.606 -20.693 1.00 0.00 H new ATOM 0 HD2 PRO A 102 8.706 -3.414 -19.380 1.00 0.00 H new ATOM 0 HD3 PRO A 102 9.315 -4.233 -20.804 1.00 0.00 H new ATOM 1039 N VAL A 103 10.493 -4.320 -16.421 1.00 0.00 N ATOM 1040 CA VAL A 103 10.631 -4.025 -14.965 1.00 0.00 C ATOM 1041 C VAL A 103 10.046 -5.171 -14.133 1.00 0.00 C ATOM 1042 O VAL A 103 8.864 -5.452 -14.177 1.00 0.00 O ATOM 1043 CB VAL A 103 9.858 -2.726 -14.735 1.00 0.00 C ATOM 1044 CG1 VAL A 103 10.609 -1.566 -15.389 1.00 0.00 C ATOM 1045 CG2 VAL A 103 8.461 -2.839 -15.349 1.00 0.00 C ATOM 0 H VAL A 103 9.586 -4.096 -16.831 1.00 0.00 H new ATOM 0 HA VAL A 103 11.674 -3.923 -14.664 1.00 0.00 H new ATOM 0 HB VAL A 103 9.766 -2.546 -13.664 1.00 0.00 H new ATOM 0 HG11 VAL A 103 10.059 -0.639 -15.226 1.00 0.00 H new ATOM 0 HG12 VAL A 103 11.602 -1.481 -14.948 1.00 0.00 H new ATOM 0 HG13 VAL A 103 10.701 -1.750 -16.459 1.00 0.00 H new ATOM 0 HG21 VAL A 103 7.914 -1.911 -15.182 1.00 0.00 H new ATOM 0 HG22 VAL A 103 8.548 -3.022 -16.420 1.00 0.00 H new ATOM 0 HG23 VAL A 103 7.924 -3.665 -14.882 1.00 0.00 H new ATOM 1055 N SER A 104 10.872 -5.838 -13.378 1.00 0.00 N ATOM 1056 CA SER A 104 10.381 -6.971 -12.542 1.00 0.00 C ATOM 1057 C SER A 104 10.790 -6.769 -11.081 1.00 0.00 C ATOM 1058 O SER A 104 10.900 -7.711 -10.321 1.00 0.00 O ATOM 1059 CB SER A 104 11.064 -8.210 -13.122 1.00 0.00 C ATOM 1060 OG SER A 104 12.471 -8.093 -12.953 1.00 0.00 O ATOM 0 H SER A 104 11.871 -5.647 -13.303 1.00 0.00 H new ATOM 0 HA SER A 104 9.294 -7.056 -12.557 1.00 0.00 H new ATOM 0 HB2 SER A 104 10.700 -9.108 -12.623 1.00 0.00 H new ATOM 0 HB3 SER A 104 10.820 -8.312 -14.179 1.00 0.00 H new ATOM 0 HG SER A 104 12.912 -8.886 -13.322 1.00 0.00 H new ATOM 1066 N GLY A 105 11.020 -5.547 -10.683 1.00 0.00 N ATOM 1067 CA GLY A 105 11.426 -5.286 -9.273 1.00 0.00 C ATOM 1068 C GLY A 105 12.898 -4.871 -9.237 1.00 0.00 C ATOM 1069 O GLY A 105 13.405 -4.434 -8.223 1.00 0.00 O ATOM 0 H GLY A 105 10.944 -4.719 -11.273 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.805 -4.500 -8.843 1.00 0.00 H new ATOM 0 HA3 GLY A 105 11.274 -6.180 -8.668 1.00 0.00 H new ATOM 1073 N MET A 106 13.588 -5.011 -10.336 1.00 0.00 N ATOM 1074 CA MET A 106 15.029 -4.632 -10.366 1.00 0.00 C ATOM 1075 C MET A 106 15.188 -3.124 -10.592 1.00 0.00 C ATOM 1076 O MET A 106 16.147 -2.522 -10.153 1.00 0.00 O ATOM 1077 CB MET A 106 15.616 -5.414 -11.542 1.00 0.00 C ATOM 1078 CG MET A 106 15.525 -6.913 -11.255 1.00 0.00 C ATOM 1079 SD MET A 106 16.125 -7.842 -12.688 1.00 0.00 S ATOM 1080 CE MET A 106 17.870 -7.894 -12.211 1.00 0.00 C ATOM 0 H MET A 106 13.216 -5.372 -11.215 1.00 0.00 H new ATOM 0 HA MET A 106 15.532 -4.861 -9.426 1.00 0.00 H new ATOM 0 HB2 MET A 106 15.075 -5.175 -12.458 1.00 0.00 H new ATOM 0 HB3 MET A 106 16.655 -5.126 -11.701 1.00 0.00 H new ATOM 0 HG2 MET A 106 16.117 -7.162 -10.374 1.00 0.00 H new ATOM 0 HG3 MET A 106 14.494 -7.190 -11.035 1.00 0.00 H new ATOM 0 HE1 MET A 106 18.439 -8.432 -12.969 1.00 0.00 H new ATOM 0 HE2 MET A 106 18.254 -6.878 -12.123 1.00 0.00 H new ATOM 0 HE3 MET A 106 17.970 -8.404 -11.253 1.00 0.00 H new ATOM 1090 N ASP A 107 14.262 -2.506 -11.277 1.00 0.00 N ATOM 1091 CA ASP A 107 14.381 -1.040 -11.524 1.00 0.00 C ATOM 1092 C ASP A 107 13.091 -0.316 -11.120 1.00 0.00 C ATOM 1093 O ASP A 107 12.910 0.048 -9.974 1.00 0.00 O ATOM 1094 CB ASP A 107 14.641 -0.910 -13.028 1.00 0.00 C ATOM 1095 CG ASP A 107 14.861 0.562 -13.380 1.00 0.00 C ATOM 1096 OD1 ASP A 107 14.767 1.385 -12.485 1.00 0.00 O ATOM 1097 OD2 ASP A 107 15.124 0.842 -14.539 1.00 0.00 O ATOM 0 H ASP A 107 13.434 -2.950 -11.674 1.00 0.00 H new ATOM 0 HA ASP A 107 15.180 -0.587 -10.936 1.00 0.00 H new ATOM 0 HB2 ASP A 107 15.515 -1.497 -13.309 1.00 0.00 H new ATOM 0 HB3 ASP A 107 13.796 -1.307 -13.590 1.00 0.00 H new ATOM 1102 N LYS A 108 12.194 -0.092 -12.044 1.00 0.00 N ATOM 1103 CA LYS A 108 10.930 0.619 -11.696 1.00 0.00 C ATOM 1104 C LYS A 108 9.712 -0.146 -12.229 1.00 0.00 C ATOM 1105 O LYS A 108 9.227 0.131 -13.308 1.00 0.00 O ATOM 1106 CB LYS A 108 11.047 1.982 -12.380 1.00 0.00 C ATOM 1107 CG LYS A 108 12.143 2.804 -11.697 1.00 0.00 C ATOM 1108 CD LYS A 108 12.427 4.061 -12.522 1.00 0.00 C ATOM 1109 CE LYS A 108 13.796 4.628 -12.141 1.00 0.00 C ATOM 1110 NZ LYS A 108 13.502 5.916 -11.451 1.00 0.00 N ATOM 0 H LYS A 108 12.282 -0.370 -13.021 1.00 0.00 H new ATOM 0 HA LYS A 108 10.794 0.707 -10.618 1.00 0.00 H new ATOM 0 HB2 LYS A 108 11.281 1.852 -13.437 1.00 0.00 H new ATOM 0 HB3 LYS A 108 10.095 2.510 -12.327 1.00 0.00 H new ATOM 0 HG2 LYS A 108 11.831 3.080 -10.690 1.00 0.00 H new ATOM 0 HG3 LYS A 108 13.051 2.208 -11.598 1.00 0.00 H new ATOM 0 HD2 LYS A 108 12.404 3.823 -13.585 1.00 0.00 H new ATOM 0 HD3 LYS A 108 11.652 4.807 -12.346 1.00 0.00 H new ATOM 0 HE2 LYS A 108 14.338 3.945 -11.487 1.00 0.00 H new ATOM 0 HE3 LYS A 108 14.417 4.785 -13.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 14.394 6.365 -11.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 12.992 6.549 -12.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 12.915 5.734 -10.612 1.00 0.00 H new ATOM 1124 N PRO A 109 9.256 -1.082 -11.443 1.00 0.00 N ATOM 1125 CA PRO A 109 8.077 -1.899 -11.826 1.00 0.00 C ATOM 1126 C PRO A 109 6.788 -1.092 -11.657 1.00 0.00 C ATOM 1127 O PRO A 109 5.872 -1.505 -10.971 1.00 0.00 O ATOM 1128 CB PRO A 109 8.114 -3.062 -10.842 1.00 0.00 C ATOM 1129 CG PRO A 109 8.854 -2.542 -9.650 1.00 0.00 C ATOM 1130 CD PRO A 109 9.795 -1.469 -10.135 1.00 0.00 C ATOM 0 HA PRO A 109 8.102 -2.222 -12.867 1.00 0.00 H new ATOM 0 HB2 PRO A 109 7.108 -3.382 -10.572 1.00 0.00 H new ATOM 0 HB3 PRO A 109 8.619 -3.927 -11.273 1.00 0.00 H new ATOM 0 HG2 PRO A 109 8.159 -2.139 -8.913 1.00 0.00 H new ATOM 0 HG3 PRO A 109 9.406 -3.345 -9.161 1.00 0.00 H new ATOM 0 HD2 PRO A 109 9.821 -0.622 -9.449 1.00 0.00 H new ATOM 0 HD3 PRO A 109 10.815 -1.843 -10.219 1.00 0.00 H new ATOM 1138 N VAL A 110 6.706 0.051 -12.274 1.00 0.00 N ATOM 1139 CA VAL A 110 5.473 0.878 -12.144 1.00 0.00 C ATOM 1140 C VAL A 110 4.629 0.782 -13.421 1.00 0.00 C ATOM 1141 O VAL A 110 3.936 -0.199 -13.642 1.00 0.00 O ATOM 1142 CB VAL A 110 5.979 2.303 -11.923 1.00 0.00 C ATOM 1143 CG1 VAL A 110 4.789 3.252 -11.773 1.00 0.00 C ATOM 1144 CG2 VAL A 110 6.824 2.347 -10.652 1.00 0.00 C ATOM 0 H VAL A 110 7.437 0.450 -12.863 1.00 0.00 H new ATOM 0 HA VAL A 110 4.832 0.546 -11.327 1.00 0.00 H new ATOM 0 HB VAL A 110 6.583 2.611 -12.777 1.00 0.00 H new ATOM 0 HG11 VAL A 110 5.151 4.268 -11.615 1.00 0.00 H new ATOM 0 HG12 VAL A 110 4.182 3.220 -12.677 1.00 0.00 H new ATOM 0 HG13 VAL A 110 4.185 2.946 -10.919 1.00 0.00 H new ATOM 0 HG21 VAL A 110 7.187 3.362 -10.491 1.00 0.00 H new ATOM 0 HG22 VAL A 110 6.217 2.039 -9.801 1.00 0.00 H new ATOM 0 HG23 VAL A 110 7.673 1.671 -10.756 1.00 0.00 H new ATOM 1154 N PHE A 111 4.671 1.787 -14.260 1.00 0.00 N ATOM 1155 CA PHE A 111 3.862 1.743 -15.508 1.00 0.00 C ATOM 1156 C PHE A 111 4.757 1.550 -16.734 1.00 0.00 C ATOM 1157 O PHE A 111 5.967 1.631 -16.660 1.00 0.00 O ATOM 1158 CB PHE A 111 3.142 3.094 -15.570 1.00 0.00 C ATOM 1159 CG PHE A 111 4.138 4.204 -15.815 1.00 0.00 C ATOM 1160 CD1 PHE A 111 4.476 4.563 -17.125 1.00 0.00 C ATOM 1161 CD2 PHE A 111 4.714 4.880 -14.734 1.00 0.00 C ATOM 1162 CE1 PHE A 111 5.392 5.596 -17.354 1.00 0.00 C ATOM 1163 CE2 PHE A 111 5.630 5.915 -14.961 1.00 0.00 C ATOM 1164 CZ PHE A 111 5.969 6.272 -16.272 1.00 0.00 C ATOM 0 H PHE A 111 5.229 2.631 -14.132 1.00 0.00 H new ATOM 0 HA PHE A 111 3.161 0.908 -15.505 1.00 0.00 H new ATOM 0 HB2 PHE A 111 2.397 3.081 -16.366 1.00 0.00 H new ATOM 0 HB3 PHE A 111 2.608 3.273 -14.637 1.00 0.00 H new ATOM 0 HD1 PHE A 111 4.030 4.043 -17.959 1.00 0.00 H new ATOM 0 HD2 PHE A 111 4.452 4.603 -13.723 1.00 0.00 H new ATOM 0 HE1 PHE A 111 5.654 5.872 -18.365 1.00 0.00 H new ATOM 0 HE2 PHE A 111 6.074 6.437 -14.126 1.00 0.00 H new ATOM 0 HZ PHE A 111 6.676 7.069 -16.449 1.00 0.00 H new ATOM 1174 N THR A 112 4.159 1.282 -17.863 1.00 0.00 N ATOM 1175 CA THR A 112 4.949 1.066 -19.109 1.00 0.00 C ATOM 1176 C THR A 112 5.579 2.376 -19.591 1.00 0.00 C ATOM 1177 O THR A 112 4.893 3.314 -19.944 1.00 0.00 O ATOM 1178 CB THR A 112 3.923 0.562 -20.120 1.00 0.00 C ATOM 1179 OG1 THR A 112 3.204 -0.520 -19.552 1.00 0.00 O ATOM 1180 CG2 THR A 112 4.634 0.095 -21.389 1.00 0.00 C ATOM 0 H THR A 112 3.148 1.203 -17.976 1.00 0.00 H new ATOM 0 HA THR A 112 5.773 0.368 -18.961 1.00 0.00 H new ATOM 0 HB THR A 112 3.235 1.368 -20.374 1.00 0.00 H new ATOM 0 HG1 THR A 112 3.454 -1.352 -20.005 1.00 0.00 H new ATOM 0 HG21 THR A 112 3.897 -0.264 -22.108 1.00 0.00 H new ATOM 0 HG22 THR A 112 5.188 0.927 -21.823 1.00 0.00 H new ATOM 0 HG23 THR A 112 5.324 -0.712 -21.143 1.00 0.00 H new ATOM 1188 N ASP A 113 6.883 2.444 -19.610 1.00 0.00 N ATOM 1189 CA ASP A 113 7.561 3.690 -20.070 1.00 0.00 C ATOM 1190 C ASP A 113 8.696 3.345 -21.046 1.00 0.00 C ATOM 1191 O ASP A 113 9.678 2.751 -20.647 1.00 0.00 O ATOM 1192 CB ASP A 113 8.133 4.312 -18.798 1.00 0.00 C ATOM 1193 CG ASP A 113 9.123 3.338 -18.154 1.00 0.00 C ATOM 1194 OD1 ASP A 113 8.898 2.143 -18.259 1.00 0.00 O ATOM 1195 OD2 ASP A 113 10.087 3.802 -17.569 1.00 0.00 O ATOM 0 H ASP A 113 7.508 1.690 -19.327 1.00 0.00 H new ATOM 0 HA ASP A 113 6.881 4.364 -20.592 1.00 0.00 H new ATOM 0 HB2 ASP A 113 8.632 5.252 -19.033 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.328 4.544 -18.100 1.00 0.00 H new ATOM 1200 N PRO A 114 8.543 3.722 -22.295 1.00 0.00 N ATOM 1201 CA PRO A 114 7.333 4.449 -22.759 1.00 0.00 C ATOM 1202 C PRO A 114 6.160 3.479 -22.926 1.00 0.00 C ATOM 1203 O PRO A 114 6.354 2.285 -23.053 1.00 0.00 O ATOM 1204 CB PRO A 114 7.751 5.012 -24.112 1.00 0.00 C ATOM 1205 CG PRO A 114 8.838 4.106 -24.597 1.00 0.00 C ATOM 1206 CD PRO A 114 9.499 3.501 -23.386 1.00 0.00 C ATOM 0 HA PRO A 114 7.004 5.218 -22.060 1.00 0.00 H new ATOM 0 HB2 PRO A 114 6.912 5.028 -24.808 1.00 0.00 H new ATOM 0 HB3 PRO A 114 8.107 6.038 -24.018 1.00 0.00 H new ATOM 0 HG2 PRO A 114 8.429 3.327 -25.240 1.00 0.00 H new ATOM 0 HG3 PRO A 114 9.563 4.662 -25.192 1.00 0.00 H new ATOM 0 HD2 PRO A 114 9.697 2.439 -23.531 1.00 0.00 H new ATOM 0 HD3 PRO A 114 10.457 3.978 -23.177 1.00 0.00 H new ATOM 1214 N PRO A 115 4.977 4.030 -22.932 1.00 0.00 N ATOM 1215 CA PRO A 115 3.756 3.207 -23.101 1.00 0.00 C ATOM 1216 C PRO A 115 3.647 2.728 -24.550 1.00 0.00 C ATOM 1217 O PRO A 115 4.521 2.969 -25.357 1.00 0.00 O ATOM 1218 CB PRO A 115 2.624 4.174 -22.764 1.00 0.00 C ATOM 1219 CG PRO A 115 3.186 5.532 -23.034 1.00 0.00 C ATOM 1220 CD PRO A 115 4.669 5.456 -22.785 1.00 0.00 C ATOM 0 HA PRO A 115 3.745 2.314 -22.476 1.00 0.00 H new ATOM 0 HB2 PRO A 115 1.744 3.981 -23.378 1.00 0.00 H new ATOM 0 HB3 PRO A 115 2.315 4.074 -21.723 1.00 0.00 H new ATOM 0 HG2 PRO A 115 2.983 5.835 -24.061 1.00 0.00 H new ATOM 0 HG3 PRO A 115 2.724 6.276 -22.385 1.00 0.00 H new ATOM 0 HD2 PRO A 115 5.226 6.061 -23.500 1.00 0.00 H new ATOM 0 HD3 PRO A 115 4.927 5.820 -21.790 1.00 0.00 H new ATOM 1228 N VAL A 116 2.582 2.057 -24.890 1.00 0.00 N ATOM 1229 CA VAL A 116 2.435 1.574 -26.291 1.00 0.00 C ATOM 1230 C VAL A 116 1.471 2.474 -27.063 1.00 0.00 C ATOM 1231 O VAL A 116 0.517 2.995 -26.520 1.00 0.00 O ATOM 1232 CB VAL A 116 1.870 0.159 -26.173 1.00 0.00 C ATOM 1233 CG1 VAL A 116 2.917 -0.754 -25.533 1.00 0.00 C ATOM 1234 CG2 VAL A 116 0.610 0.182 -25.304 1.00 0.00 C ATOM 0 H VAL A 116 1.812 1.823 -24.263 1.00 0.00 H new ATOM 0 HA VAL A 116 3.382 1.587 -26.830 1.00 0.00 H new ATOM 0 HB VAL A 116 1.618 -0.216 -27.165 1.00 0.00 H new ATOM 0 HG11 VAL A 116 2.516 -1.764 -25.448 1.00 0.00 H new ATOM 0 HG12 VAL A 116 3.813 -0.771 -26.153 1.00 0.00 H new ATOM 0 HG13 VAL A 116 3.169 -0.379 -24.541 1.00 0.00 H new ATOM 0 HG21 VAL A 116 0.207 -0.827 -25.220 1.00 0.00 H new ATOM 0 HG22 VAL A 116 0.859 0.557 -24.311 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -0.135 0.833 -25.761 1.00 0.00 H new ATOM 1244 N LYS A 117 1.709 2.650 -28.333 1.00 0.00 N ATOM 1245 CA LYS A 117 0.806 3.501 -29.153 1.00 0.00 C ATOM 1246 C LYS A 117 0.110 2.628 -30.192 1.00 0.00 C ATOM 1247 O LYS A 117 0.712 1.755 -30.784 1.00 0.00 O ATOM 1248 CB LYS A 117 1.717 4.528 -29.827 1.00 0.00 C ATOM 1249 CG LYS A 117 2.501 5.292 -28.758 1.00 0.00 C ATOM 1250 CD LYS A 117 3.766 5.886 -29.379 1.00 0.00 C ATOM 1251 CE LYS A 117 4.429 6.835 -28.379 1.00 0.00 C ATOM 1252 NZ LYS A 117 5.884 6.524 -28.461 1.00 0.00 N ATOM 0 H LYS A 117 2.493 2.239 -28.839 1.00 0.00 H new ATOM 0 HA LYS A 117 0.033 3.991 -28.562 1.00 0.00 H new ATOM 0 HB2 LYS A 117 2.404 4.028 -30.510 1.00 0.00 H new ATOM 0 HB3 LYS A 117 1.123 5.221 -30.423 1.00 0.00 H new ATOM 0 HG2 LYS A 117 1.883 6.085 -28.336 1.00 0.00 H new ATOM 0 HG3 LYS A 117 2.765 4.624 -27.938 1.00 0.00 H new ATOM 0 HD2 LYS A 117 4.457 5.089 -29.654 1.00 0.00 H new ATOM 0 HD3 LYS A 117 3.517 6.422 -30.295 1.00 0.00 H new ATOM 0 HE2 LYS A 117 4.233 7.877 -28.633 1.00 0.00 H new ATOM 0 HE3 LYS A 117 4.047 6.676 -27.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 6.407 7.136 -27.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 6.041 5.528 -28.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 6.221 6.691 -29.431 1.00 0.00 H new ATOM 1266 N THR A 118 -1.153 2.836 -30.407 1.00 0.00 N ATOM 1267 CA THR A 118 -1.876 1.993 -31.396 1.00 0.00 C ATOM 1268 C THR A 118 -2.783 2.850 -32.275 1.00 0.00 C ATOM 1269 O THR A 118 -2.780 4.063 -32.197 1.00 0.00 O ATOM 1270 CB THR A 118 -2.711 1.039 -30.546 1.00 0.00 C ATOM 1271 OG1 THR A 118 -3.621 1.794 -29.757 1.00 0.00 O ATOM 1272 CG2 THR A 118 -1.794 0.223 -29.632 1.00 0.00 C ATOM 0 H THR A 118 -1.716 3.549 -29.944 1.00 0.00 H new ATOM 0 HA THR A 118 -1.195 1.470 -32.067 1.00 0.00 H new ATOM 0 HB THR A 118 -3.263 0.360 -31.195 1.00 0.00 H new ATOM 0 HG1 THR A 118 -4.486 1.335 -29.727 1.00 0.00 H new ATOM 0 HG21 THR A 118 -2.394 -0.457 -29.027 1.00 0.00 H new ATOM 0 HG22 THR A 118 -1.095 -0.353 -30.238 1.00 0.00 H new ATOM 0 HG23 THR A 118 -1.239 0.896 -28.979 1.00 0.00 H new ATOM 1280 N LYS A 119 -3.569 2.226 -33.106 1.00 0.00 N ATOM 1281 CA LYS A 119 -4.486 2.999 -33.985 1.00 0.00 C ATOM 1282 C LYS A 119 -5.681 3.496 -33.167 1.00 0.00 C ATOM 1283 O LYS A 119 -6.446 4.327 -33.614 1.00 0.00 O ATOM 1284 CB LYS A 119 -4.934 2.010 -35.061 1.00 0.00 C ATOM 1285 CG LYS A 119 -5.793 0.914 -34.426 1.00 0.00 C ATOM 1286 CD LYS A 119 -6.190 -0.107 -35.495 1.00 0.00 C ATOM 1287 CE LYS A 119 -4.977 -0.968 -35.855 1.00 0.00 C ATOM 1288 NZ LYS A 119 -5.338 -1.625 -37.143 1.00 0.00 N ATOM 0 H LYS A 119 -3.615 1.213 -33.214 1.00 0.00 H new ATOM 0 HA LYS A 119 -4.010 3.876 -34.424 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -5.502 2.530 -35.833 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -4.065 1.568 -35.548 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -5.240 0.422 -33.626 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -6.685 1.351 -33.976 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -7.000 -0.737 -35.128 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -6.562 0.406 -36.382 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.079 -0.360 -35.961 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -4.773 -1.706 -35.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -4.554 -2.233 -37.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -6.193 -2.203 -37.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -5.520 -0.898 -37.864 1.00 0.00 H new ATOM 1302 N PHE A 120 -5.834 3.005 -31.965 1.00 0.00 N ATOM 1303 CA PHE A 120 -6.972 3.471 -31.115 1.00 0.00 C ATOM 1304 C PHE A 120 -6.456 4.430 -30.042 1.00 0.00 C ATOM 1305 O PHE A 120 -7.164 4.787 -29.121 1.00 0.00 O ATOM 1306 CB PHE A 120 -7.603 2.220 -30.469 1.00 0.00 C ATOM 1307 CG PHE A 120 -6.579 1.124 -30.260 1.00 0.00 C ATOM 1308 CD1 PHE A 120 -6.232 0.277 -31.320 1.00 0.00 C ATOM 1309 CD2 PHE A 120 -5.991 0.946 -29.002 1.00 0.00 C ATOM 1310 CE1 PHE A 120 -5.295 -0.745 -31.123 1.00 0.00 C ATOM 1311 CE2 PHE A 120 -5.056 -0.079 -28.804 1.00 0.00 C ATOM 1312 CZ PHE A 120 -4.708 -0.923 -29.864 1.00 0.00 C ATOM 0 H PHE A 120 -5.226 2.307 -31.537 1.00 0.00 H new ATOM 0 HA PHE A 120 -7.714 4.004 -31.709 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -8.049 2.490 -29.512 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -8.409 1.850 -31.103 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -6.687 0.412 -32.290 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -6.258 1.599 -28.184 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -5.025 -1.396 -31.942 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -4.604 -0.217 -27.833 1.00 0.00 H new ATOM 0 HZ PHE A 120 -3.987 -1.712 -29.711 1.00 0.00 H new ATOM 1322 N GLY A 121 -5.227 4.858 -30.157 1.00 0.00 N ATOM 1323 CA GLY A 121 -4.670 5.802 -29.147 1.00 0.00 C ATOM 1324 C GLY A 121 -3.484 5.151 -28.432 1.00 0.00 C ATOM 1325 O GLY A 121 -2.972 4.137 -28.861 1.00 0.00 O ATOM 0 H GLY A 121 -4.586 4.595 -30.906 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -4.352 6.724 -29.633 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -5.440 6.072 -28.424 1.00 0.00 H new ATOM 1329 N TYR A 122 -3.034 5.725 -27.343 1.00 0.00 N ATOM 1330 CA TYR A 122 -1.878 5.120 -26.621 1.00 0.00 C ATOM 1331 C TYR A 122 -2.326 4.494 -25.298 1.00 0.00 C ATOM 1332 O TYR A 122 -3.359 4.833 -24.756 1.00 0.00 O ATOM 1333 CB TYR A 122 -0.891 6.265 -26.380 1.00 0.00 C ATOM 1334 CG TYR A 122 -1.543 7.412 -25.636 1.00 0.00 C ATOM 1335 CD1 TYR A 122 -1.510 7.439 -24.236 1.00 0.00 C ATOM 1336 CD2 TYR A 122 -2.147 8.464 -26.340 1.00 0.00 C ATOM 1337 CE1 TYR A 122 -2.075 8.515 -23.541 1.00 0.00 C ATOM 1338 CE2 TYR A 122 -2.719 9.537 -25.642 1.00 0.00 C ATOM 1339 CZ TYR A 122 -2.679 9.563 -24.243 1.00 0.00 C ATOM 1340 OH TYR A 122 -3.237 10.623 -23.556 1.00 0.00 O ATOM 0 H TYR A 122 -3.414 6.576 -26.929 1.00 0.00 H new ATOM 0 HA TYR A 122 -1.422 4.317 -27.200 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -0.038 5.898 -25.809 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -0.506 6.622 -27.335 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -1.048 6.629 -23.692 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -2.171 8.448 -27.420 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -2.044 8.536 -22.462 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -3.191 10.344 -26.184 1.00 0.00 H new ATOM 0 HH TYR A 122 -2.693 11.426 -23.695 1.00 0.00 H new ATOM 1350 N HIS A 123 -1.559 3.569 -24.780 1.00 0.00 N ATOM 1351 CA HIS A 123 -1.948 2.908 -23.501 1.00 0.00 C ATOM 1352 C HIS A 123 -0.767 2.829 -22.531 1.00 0.00 C ATOM 1353 O HIS A 123 0.350 2.543 -22.913 1.00 0.00 O ATOM 1354 CB HIS A 123 -2.372 1.494 -23.896 1.00 0.00 C ATOM 1355 CG HIS A 123 -3.339 1.558 -25.042 1.00 0.00 C ATOM 1356 ND1 HIS A 123 -4.668 1.198 -24.902 1.00 0.00 N ATOM 1357 CD2 HIS A 123 -3.188 1.938 -26.351 1.00 0.00 C ATOM 1358 CE1 HIS A 123 -5.262 1.369 -26.095 1.00 0.00 C ATOM 1359 NE2 HIS A 123 -4.405 1.819 -27.015 1.00 0.00 N ATOM 0 H HIS A 123 -0.682 3.244 -25.188 1.00 0.00 H new ATOM 0 HA HIS A 123 -2.737 3.466 -22.997 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -1.498 0.907 -24.178 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -2.833 0.991 -23.046 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -2.265 2.278 -26.798 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -6.306 1.167 -26.287 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -4.600 2.030 -27.994 1.00 0.00 H new ATOM 1367 N ILE A 124 -1.024 3.046 -21.272 1.00 0.00 N ATOM 1368 CA ILE A 124 0.062 2.950 -20.252 1.00 0.00 C ATOM 1369 C ILE A 124 -0.409 2.014 -19.135 1.00 0.00 C ATOM 1370 O ILE A 124 -1.333 2.321 -18.405 1.00 0.00 O ATOM 1371 CB ILE A 124 0.268 4.376 -19.738 1.00 0.00 C ATOM 1372 CG1 ILE A 124 1.541 4.432 -18.892 1.00 0.00 C ATOM 1373 CG2 ILE A 124 -0.930 4.792 -18.887 1.00 0.00 C ATOM 1374 CD1 ILE A 124 1.891 5.889 -18.586 1.00 0.00 C ATOM 0 H ILE A 124 -1.943 3.287 -20.902 1.00 0.00 H new ATOM 0 HA ILE A 124 0.996 2.550 -20.648 1.00 0.00 H new ATOM 0 HB ILE A 124 0.363 5.057 -20.584 1.00 0.00 H new ATOM 0 HG12 ILE A 124 1.397 3.879 -17.964 1.00 0.00 H new ATOM 0 HG13 ILE A 124 2.364 3.954 -19.423 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -0.781 5.808 -18.522 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -1.837 4.752 -19.491 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -1.028 4.113 -18.040 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.798 5.926 -17.983 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.053 6.428 -19.519 1.00 0.00 H new ATOM 0 HD13 ILE A 124 1.071 6.353 -18.037 1.00 0.00 H new ATOM 1386 N ILE A 125 0.183 0.857 -19.013 1.00 0.00 N ATOM 1387 CA ILE A 125 -0.282 -0.095 -17.964 1.00 0.00 C ATOM 1388 C ILE A 125 0.728 -0.219 -16.819 1.00 0.00 C ATOM 1389 O ILE A 125 1.888 0.119 -16.949 1.00 0.00 O ATOM 1390 CB ILE A 125 -0.444 -1.430 -18.697 1.00 0.00 C ATOM 1391 CG1 ILE A 125 0.914 -1.924 -19.176 1.00 0.00 C ATOM 1392 CG2 ILE A 125 -1.346 -1.244 -19.917 1.00 0.00 C ATOM 1393 CD1 ILE A 125 0.734 -3.267 -19.880 1.00 0.00 C ATOM 0 H ILE A 125 0.960 0.532 -19.588 1.00 0.00 H new ATOM 0 HA ILE A 125 -1.209 0.241 -17.499 1.00 0.00 H new ATOM 0 HB ILE A 125 -0.885 -2.153 -18.011 1.00 0.00 H new ATOM 0 HG12 ILE A 125 1.360 -1.199 -19.857 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.595 -2.030 -18.332 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -1.458 -2.196 -20.435 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -2.325 -0.889 -19.595 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -0.899 -0.514 -20.592 1.00 0.00 H new ATOM 0 HD11 ILE A 125 1.702 -3.629 -20.227 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.305 -3.988 -19.184 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.066 -3.144 -20.733 1.00 0.00 H new ATOM 1405 N MET A 126 0.275 -0.709 -15.696 1.00 0.00 N ATOM 1406 CA MET A 126 1.166 -0.882 -14.514 1.00 0.00 C ATOM 1407 C MET A 126 1.045 -2.318 -14.001 1.00 0.00 C ATOM 1408 O MET A 126 -0.019 -2.903 -14.031 1.00 0.00 O ATOM 1409 CB MET A 126 0.635 0.101 -13.467 1.00 0.00 C ATOM 1410 CG MET A 126 0.753 1.531 -13.994 1.00 0.00 C ATOM 1411 SD MET A 126 0.875 2.682 -12.601 1.00 0.00 S ATOM 1412 CE MET A 126 -0.727 2.299 -11.852 1.00 0.00 C ATOM 0 H MET A 126 -0.691 -1.001 -15.547 1.00 0.00 H new ATOM 0 HA MET A 126 2.215 -0.697 -14.746 1.00 0.00 H new ATOM 0 HB2 MET A 126 -0.406 -0.127 -13.236 1.00 0.00 H new ATOM 0 HB3 MET A 126 1.198 -0.002 -12.539 1.00 0.00 H new ATOM 0 HG2 MET A 126 1.631 1.623 -14.633 1.00 0.00 H new ATOM 0 HG3 MET A 126 -0.114 1.776 -14.607 1.00 0.00 H new ATOM 0 HE1 MET A 126 -1.102 3.177 -11.327 1.00 0.00 H new ATOM 0 HE2 MET A 126 -1.434 2.012 -12.631 1.00 0.00 H new ATOM 0 HE3 MET A 126 -0.611 1.476 -11.146 1.00 0.00 H new ATOM 1422 N VAL A 127 2.114 -2.895 -13.533 1.00 0.00 N ATOM 1423 CA VAL A 127 2.022 -4.300 -13.029 1.00 0.00 C ATOM 1424 C VAL A 127 2.380 -4.362 -11.545 1.00 0.00 C ATOM 1425 O VAL A 127 3.403 -3.857 -11.124 1.00 0.00 O ATOM 1426 CB VAL A 127 3.031 -5.092 -13.855 1.00 0.00 C ATOM 1427 CG1 VAL A 127 2.839 -6.585 -13.587 1.00 0.00 C ATOM 1428 CG2 VAL A 127 2.807 -4.810 -15.341 1.00 0.00 C ATOM 0 H VAL A 127 3.037 -2.466 -13.476 1.00 0.00 H new ATOM 0 HA VAL A 127 1.013 -4.700 -13.127 1.00 0.00 H new ATOM 0 HB VAL A 127 4.043 -4.796 -13.578 1.00 0.00 H new ATOM 0 HG11 VAL A 127 3.558 -7.156 -14.175 1.00 0.00 H new ATOM 0 HG12 VAL A 127 2.995 -6.787 -12.527 1.00 0.00 H new ATOM 0 HG13 VAL A 127 1.827 -6.878 -13.867 1.00 0.00 H new ATOM 0 HG21 VAL A 127 3.528 -5.376 -15.931 1.00 0.00 H new ATOM 0 HG22 VAL A 127 1.796 -5.108 -15.620 1.00 0.00 H new ATOM 0 HG23 VAL A 127 2.937 -3.745 -15.533 1.00 0.00 H new ATOM 1438 N GLU A 128 1.546 -4.965 -10.739 1.00 0.00 N ATOM 1439 CA GLU A 128 1.863 -5.027 -9.281 1.00 0.00 C ATOM 1440 C GLU A 128 1.408 -6.351 -8.656 1.00 0.00 C ATOM 1441 O GLU A 128 2.068 -6.897 -7.794 1.00 0.00 O ATOM 1442 CB GLU A 128 1.089 -3.862 -8.669 1.00 0.00 C ATOM 1443 CG GLU A 128 1.520 -3.673 -7.215 1.00 0.00 C ATOM 1444 CD GLU A 128 0.994 -2.334 -6.696 1.00 0.00 C ATOM 1445 OE1 GLU A 128 0.630 -1.506 -7.513 1.00 0.00 O ATOM 1446 OE2 GLU A 128 0.965 -2.161 -5.488 1.00 0.00 O ATOM 0 H GLU A 128 0.673 -5.411 -11.020 1.00 0.00 H new ATOM 0 HA GLU A 128 2.937 -4.965 -9.104 1.00 0.00 H new ATOM 0 HB2 GLU A 128 1.275 -2.950 -9.236 1.00 0.00 H new ATOM 0 HB3 GLU A 128 0.018 -4.056 -8.720 1.00 0.00 H new ATOM 0 HG2 GLU A 128 1.136 -4.489 -6.602 1.00 0.00 H new ATOM 0 HG3 GLU A 128 2.607 -3.702 -7.140 1.00 0.00 H new ATOM 1453 N GLY A 129 0.281 -6.863 -9.062 1.00 0.00 N ATOM 1454 CA GLY A 129 -0.211 -8.138 -8.465 1.00 0.00 C ATOM 1455 C GLY A 129 0.328 -9.337 -9.248 1.00 0.00 C ATOM 1456 O GLY A 129 -0.303 -9.825 -10.164 1.00 0.00 O ATOM 0 H GLY A 129 -0.320 -6.457 -9.779 1.00 0.00 H new ATOM 0 HA2 GLY A 129 0.104 -8.205 -7.424 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -1.301 -8.153 -8.470 1.00 0.00 H new ATOM 1460 N ARG A 130 1.484 -9.824 -8.888 1.00 0.00 N ATOM 1461 CA ARG A 130 2.054 -11.001 -9.608 1.00 0.00 C ATOM 1462 C ARG A 130 2.229 -12.175 -8.639 1.00 0.00 C ATOM 1463 O ARG A 130 2.696 -12.011 -7.529 1.00 0.00 O ATOM 1464 CB ARG A 130 3.411 -10.532 -10.132 1.00 0.00 C ATOM 1465 CG ARG A 130 4.081 -11.670 -10.909 1.00 0.00 C ATOM 1466 CD ARG A 130 5.022 -11.084 -11.965 1.00 0.00 C ATOM 1467 NE ARG A 130 5.573 -12.265 -12.688 1.00 0.00 N ATOM 1468 CZ ARG A 130 6.410 -12.093 -13.677 1.00 0.00 C ATOM 1469 NH1 ARG A 130 7.237 -11.084 -13.661 1.00 0.00 N ATOM 1470 NH2 ARG A 130 6.416 -12.927 -14.679 1.00 0.00 N ATOM 0 H ARG A 130 2.058 -9.459 -8.128 1.00 0.00 H new ATOM 0 HA ARG A 130 1.406 -11.345 -10.414 1.00 0.00 H new ATOM 0 HB2 ARG A 130 3.283 -9.663 -10.778 1.00 0.00 H new ATOM 0 HB3 ARG A 130 4.046 -10.222 -9.302 1.00 0.00 H new ATOM 0 HG2 ARG A 130 4.638 -12.312 -10.226 1.00 0.00 H new ATOM 0 HG3 ARG A 130 3.325 -12.293 -11.386 1.00 0.00 H new ATOM 0 HD2 ARG A 130 4.488 -10.419 -12.644 1.00 0.00 H new ATOM 0 HD3 ARG A 130 5.817 -10.497 -11.504 1.00 0.00 H new ATOM 0 HE ARG A 130 5.297 -13.207 -12.411 1.00 0.00 H new ATOM 0 HH11 ARG A 130 7.230 -10.431 -12.877 1.00 0.00 H new ATOM 0 HH12 ARG A 130 7.891 -10.948 -14.432 1.00 0.00 H new ATOM 0 HH21 ARG A 130 5.767 -13.714 -14.691 1.00 0.00 H new ATOM 0 HH22 ARG A 130 7.069 -12.792 -15.451 1.00 0.00 H new ATOM 1484 N LYS A 131 1.857 -13.356 -9.049 1.00 0.00 N ATOM 1485 CA LYS A 131 2.001 -14.539 -8.150 1.00 0.00 C ATOM 1486 C LYS A 131 3.106 -15.466 -8.665 1.00 0.00 C ATOM 1487 O LYS A 131 3.602 -15.217 -9.751 1.00 0.00 O ATOM 1488 CB LYS A 131 0.643 -15.241 -8.197 1.00 0.00 C ATOM 1489 CG LYS A 131 0.380 -15.749 -9.616 1.00 0.00 C ATOM 1490 CD LYS A 131 -0.953 -16.499 -9.652 1.00 0.00 C ATOM 1491 CE LYS A 131 -0.779 -17.882 -9.019 1.00 0.00 C ATOM 1492 NZ LYS A 131 -2.138 -18.491 -9.046 1.00 0.00 N ATOM 1493 OXT LYS A 131 3.436 -16.407 -7.963 1.00 0.00 O ATOM 0 H LYS A 131 1.459 -13.555 -9.967 1.00 0.00 H new ATOM 0 HA LYS A 131 2.276 -14.254 -7.135 1.00 0.00 H new ATOM 0 HB2 LYS A 131 0.627 -16.073 -7.493 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -0.145 -14.552 -7.894 1.00 0.00 H new ATOM 0 HG2 LYS A 131 0.358 -14.913 -10.315 1.00 0.00 H new ATOM 0 HG3 LYS A 131 1.188 -16.408 -9.933 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -1.715 -15.934 -9.114 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -1.298 -16.599 -10.681 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -0.065 -18.486 -9.579 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -0.401 -17.805 -8.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -2.100 -19.443 -8.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -2.795 -17.898 -8.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -2.469 -18.558 -10.030 1.00 0.00 H new TER 1507 LYS A 131