USER MOD reduce.3.24.130724 H: found=0, std=0, add=874, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 873 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 125 GLN : amide:sc=-0.00413 X(o=-0.0041,f=0.002) USER MOD Set 1.2: A 128 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 111 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 142 THR OG1 : rot 123:sc= 0.0208 USER MOD Set 3.1: A 47 LYS NZ :NH3+ -98:sc= 1.39 (180deg=-1.01) USER MOD Set 3.2: A 106 MET CE :methyl 166:sc= -0.0107 (180deg=-0.541) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0103) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ -176:sc= 0.291 (180deg=0.178) USER MOD Single : A 64 GLN : amide:sc= -0.0446 K(o=-0.045,f=-0.64) USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.0344 USER MOD Single : A 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= -0.0227 X(o=-0.023,f=-0.11) USER MOD Single : A 72 THR OG1 : rot 99:sc= 0.0352 USER MOD Single : A 73 SER OG : rot 78:sc= 0.0913 USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 CYS SG : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 SER OG : rot -19:sc= 0.821 USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot -90:sc= 0.542 USER MOD Single : A 118 SER OG : rot 83:sc= 0.127 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 CYS SG : rot 133:sc= -1.38 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 HIS : no HE2:sc= 0.0811 X(o=0.081,f=-0.4) USER MOD Single : A 138 CYS SG : rot -12:sc= 0.582 USER MOD Single : A 144 LYS NZ :NH3+ -119:sc= 0.958 (180deg=-0.331) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 42 N GLU A 35 -5.982 20.894 -0.393 1.00 0.00 N ATOM 43 CA GLU A 35 -4.781 20.314 -1.060 1.00 0.00 C ATOM 44 C GLU A 35 -4.564 18.775 -0.814 1.00 0.00 C ATOM 45 O GLU A 35 -5.224 18.167 0.038 1.00 0.00 O ATOM 46 CB GLU A 35 -3.656 21.254 -0.520 1.00 0.00 C ATOM 47 CG GLU A 35 -2.208 21.059 -1.030 1.00 0.00 C ATOM 48 CD GLU A 35 -1.375 19.996 -0.333 1.00 0.00 C ATOM 49 OE1 GLU A 35 -1.440 19.837 0.903 1.00 0.00 O ATOM 50 OE2 GLU A 35 -0.619 19.304 -1.037 1.00 0.00 O ATOM 0 HA GLU A 35 -4.841 20.300 -2.148 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -3.949 22.280 -0.744 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.639 21.157 0.566 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -2.251 20.815 -2.091 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.686 22.012 -0.943 1.00 0.00 H new ATOM 57 N TRP A 36 -3.648 18.141 -1.568 1.00 0.00 N ATOM 58 CA TRP A 36 -3.279 16.699 -1.417 1.00 0.00 C ATOM 59 C TRP A 36 -2.975 16.277 0.058 1.00 0.00 C ATOM 60 O TRP A 36 -2.113 16.862 0.723 1.00 0.00 O ATOM 61 CB TRP A 36 -2.047 16.370 -2.305 1.00 0.00 C ATOM 62 CG TRP A 36 -2.216 16.491 -3.828 1.00 0.00 C ATOM 63 CD1 TRP A 36 -2.304 17.692 -4.567 1.00 0.00 C ATOM 64 CD2 TRP A 36 -2.256 15.479 -4.768 1.00 0.00 C ATOM 65 NE1 TRP A 36 -2.421 17.451 -5.949 1.00 0.00 N ATOM 66 CE2 TRP A 36 -2.393 16.071 -6.050 1.00 0.00 C ATOM 67 CE3 TRP A 36 -2.177 14.071 -4.633 1.00 0.00 C ATOM 68 CZ2 TRP A 36 -2.468 15.253 -7.203 1.00 0.00 C ATOM 69 CZ3 TRP A 36 -2.245 13.287 -5.783 1.00 0.00 C ATOM 70 CH2 TRP A 36 -2.395 13.868 -7.048 1.00 0.00 C ATOM 0 H TRP A 36 -3.130 18.610 -2.311 1.00 0.00 H new ATOM 0 HA TRP A 36 -4.152 16.130 -1.736 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -1.231 17.027 -2.004 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -1.734 15.350 -2.081 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -2.284 18.677 -4.125 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -2.507 18.135 -6.701 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -2.066 13.615 -3.660 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -2.580 15.692 -8.183 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -2.181 12.212 -5.697 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -2.455 13.233 -7.919 1.00 0.00 H new ATOM 81 N LEU A 37 -3.753 15.301 0.559 1.00 0.00 N ATOM 82 CA LEU A 37 -3.853 14.997 2.011 1.00 0.00 C ATOM 83 C LEU A 37 -2.648 14.136 2.484 1.00 0.00 C ATOM 84 O LEU A 37 -2.526 12.955 2.144 1.00 0.00 O ATOM 85 CB LEU A 37 -5.229 14.319 2.266 1.00 0.00 C ATOM 86 CG LEU A 37 -5.628 14.035 3.742 1.00 0.00 C ATOM 87 CD1 LEU A 37 -5.870 15.315 4.568 1.00 0.00 C ATOM 88 CD2 LEU A 37 -6.881 13.139 3.783 1.00 0.00 C ATOM 0 H LEU A 37 -4.332 14.697 -0.025 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.803 15.911 2.603 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.001 14.949 1.824 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.242 13.372 1.726 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.782 13.524 4.201 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -6.145 15.044 5.587 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.960 15.915 4.585 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.677 15.892 4.116 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.155 12.944 4.820 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.705 13.643 3.278 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.670 12.195 3.280 1.00 0.00 H new ATOM 100 N ASP A 38 -1.772 14.767 3.279 1.00 0.00 N ATOM 101 CA ASP A 38 -0.494 14.178 3.744 1.00 0.00 C ATOM 102 C ASP A 38 -0.612 13.527 5.153 1.00 0.00 C ATOM 103 O ASP A 38 -0.580 14.192 6.193 1.00 0.00 O ATOM 104 CB ASP A 38 0.630 15.242 3.616 1.00 0.00 C ATOM 105 CG ASP A 38 0.485 16.659 4.202 1.00 0.00 C ATOM 106 OD1 ASP A 38 -0.640 17.147 4.444 1.00 0.00 O ATOM 107 OD2 ASP A 38 1.527 17.354 4.260 1.00 0.00 O ATOM 0 H ASP A 38 -1.927 15.714 3.625 1.00 0.00 H new ATOM 0 HA ASP A 38 -0.224 13.340 3.102 1.00 0.00 H new ATOM 0 HB2 ASP A 38 1.525 14.808 4.061 1.00 0.00 H new ATOM 0 HB3 ASP A 38 0.830 15.361 2.551 1.00 0.00 H new ATOM 112 N ILE A 39 -0.710 12.185 5.150 1.00 0.00 N ATOM 113 CA ILE A 39 -0.635 11.349 6.385 1.00 0.00 C ATOM 114 C ILE A 39 0.785 11.254 7.040 1.00 0.00 C ATOM 115 O ILE A 39 0.855 11.162 8.270 1.00 0.00 O ATOM 116 CB ILE A 39 -1.327 9.951 6.220 1.00 0.00 C ATOM 117 CG1 ILE A 39 -0.795 9.003 5.100 1.00 0.00 C ATOM 118 CG2 ILE A 39 -2.872 10.054 6.216 1.00 0.00 C ATOM 119 CD1 ILE A 39 -1.122 9.339 3.632 1.00 0.00 C ATOM 0 H ILE A 39 -0.843 11.640 4.298 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.224 11.905 7.114 1.00 0.00 H new ATOM 0 HB ILE A 39 -1.009 9.435 7.126 1.00 0.00 H new ATOM 0 HG12 ILE A 39 0.290 8.955 5.195 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.177 8.003 5.304 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -3.303 9.060 6.099 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -3.210 10.488 7.157 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -3.192 10.687 5.389 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.681 8.585 2.979 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.203 9.351 3.494 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.713 10.318 3.383 1.00 0.00 H new ATOM 131 N LEU A 40 1.895 11.343 6.272 1.00 0.00 N ATOM 132 CA LEU A 40 3.226 11.720 6.831 1.00 0.00 C ATOM 133 C LEU A 40 3.284 13.183 7.384 1.00 0.00 C ATOM 134 O LEU A 40 3.771 13.362 8.505 1.00 0.00 O ATOM 135 CB LEU A 40 4.373 11.453 5.801 1.00 0.00 C ATOM 136 CG LEU A 40 5.112 10.086 5.861 1.00 0.00 C ATOM 137 CD1 LEU A 40 5.922 9.901 7.162 1.00 0.00 C ATOM 138 CD2 LEU A 40 4.205 8.872 5.602 1.00 0.00 C ATOM 0 H LEU A 40 1.902 11.161 5.268 1.00 0.00 H new ATOM 0 HA LEU A 40 3.381 11.071 7.693 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.954 11.561 4.801 1.00 0.00 H new ATOM 0 HB3 LEU A 40 5.118 12.240 5.921 1.00 0.00 H new ATOM 0 HG LEU A 40 5.818 10.126 5.031 1.00 0.00 H new ATOM 0 HD11 LEU A 40 6.416 8.929 7.148 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.672 10.688 7.239 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.251 9.954 8.019 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.795 7.958 5.661 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.414 8.842 6.351 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.762 8.954 4.610 1.00 0.00 H new ATOM 150 N GLY A 41 2.822 14.200 6.625 1.00 0.00 N ATOM 151 CA GLY A 41 2.923 15.621 7.048 1.00 0.00 C ATOM 152 C GLY A 41 4.055 16.460 6.406 1.00 0.00 C ATOM 153 O GLY A 41 3.861 17.658 6.187 1.00 0.00 O ATOM 0 H GLY A 41 2.376 14.068 5.717 1.00 0.00 H new ATOM 0 HA2 GLY A 41 1.973 16.109 6.830 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.053 15.645 8.130 1.00 0.00 H new ATOM 157 N ASN A 42 5.235 15.858 6.153 1.00 0.00 N ATOM 158 CA ASN A 42 6.470 16.586 5.746 1.00 0.00 C ATOM 159 C ASN A 42 6.388 17.097 4.272 1.00 0.00 C ATOM 160 O ASN A 42 6.235 18.302 4.054 1.00 0.00 O ATOM 161 CB ASN A 42 7.736 15.716 6.032 1.00 0.00 C ATOM 162 CG ASN A 42 7.931 15.224 7.485 1.00 0.00 C ATOM 163 OD1 ASN A 42 8.277 15.992 8.381 1.00 0.00 O ATOM 164 ND2 ASN A 42 7.701 13.942 7.740 1.00 0.00 N ATOM 0 H ASN A 42 5.366 14.849 6.224 1.00 0.00 H new ATOM 0 HA ASN A 42 6.559 17.485 6.356 1.00 0.00 H new ATOM 0 HB2 ASN A 42 7.703 14.843 5.380 1.00 0.00 H new ATOM 0 HB3 ASN A 42 8.616 16.293 5.748 1.00 0.00 H new ATOM 0 HD21 ASN A 42 7.811 13.583 8.688 1.00 0.00 H new ATOM 0 HD22 ASN A 42 7.415 13.316 6.988 1.00 0.00 H new ATOM 171 N GLY A 43 6.464 16.188 3.285 1.00 0.00 N ATOM 172 CA GLY A 43 6.305 16.526 1.852 1.00 0.00 C ATOM 173 C GLY A 43 6.774 15.378 0.942 1.00 0.00 C ATOM 174 O GLY A 43 7.724 15.554 0.174 1.00 0.00 O ATOM 0 H GLY A 43 6.637 15.197 3.454 1.00 0.00 H new ATOM 0 HA2 GLY A 43 5.259 16.750 1.645 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.875 17.427 1.625 1.00 0.00 H new ATOM 178 N LEU A 44 6.123 14.205 1.061 1.00 0.00 N ATOM 179 CA LEU A 44 6.601 12.938 0.451 1.00 0.00 C ATOM 180 C LEU A 44 5.343 12.149 -0.013 1.00 0.00 C ATOM 181 O LEU A 44 5.049 12.158 -1.211 1.00 0.00 O ATOM 182 CB LEU A 44 7.530 12.137 1.421 1.00 0.00 C ATOM 183 CG LEU A 44 8.889 12.773 1.831 1.00 0.00 C ATOM 184 CD1 LEU A 44 9.507 12.022 3.025 1.00 0.00 C ATOM 185 CD2 LEU A 44 9.892 12.833 0.664 1.00 0.00 C ATOM 0 H LEU A 44 5.251 14.103 1.581 1.00 0.00 H new ATOM 0 HA LEU A 44 7.234 13.134 -0.414 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.967 11.939 2.333 1.00 0.00 H new ATOM 0 HB3 LEU A 44 7.740 11.172 0.960 1.00 0.00 H new ATOM 0 HG LEU A 44 8.675 13.800 2.126 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.457 12.485 3.294 1.00 0.00 H new ATOM 0 HD12 LEU A 44 8.827 12.069 3.876 1.00 0.00 H new ATOM 0 HD13 LEU A 44 9.675 10.980 2.752 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.822 13.286 1.007 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.091 11.824 0.303 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.474 13.432 -0.145 1.00 0.00 H new ATOM 197 N LEU A 45 4.592 11.509 0.916 1.00 0.00 N ATOM 198 CA LEU A 45 3.348 10.763 0.597 1.00 0.00 C ATOM 199 C LEU A 45 2.138 11.740 0.648 1.00 0.00 C ATOM 200 O LEU A 45 1.860 12.352 1.685 1.00 0.00 O ATOM 201 CB LEU A 45 3.216 9.586 1.605 1.00 0.00 C ATOM 202 CG LEU A 45 2.025 8.609 1.395 1.00 0.00 C ATOM 203 CD1 LEU A 45 2.096 7.843 0.062 1.00 0.00 C ATOM 204 CD2 LEU A 45 1.931 7.608 2.559 1.00 0.00 C ATOM 0 H LEU A 45 4.831 11.495 1.908 1.00 0.00 H new ATOM 0 HA LEU A 45 3.376 10.344 -0.409 1.00 0.00 H new ATOM 0 HB2 LEU A 45 4.139 9.007 1.573 1.00 0.00 H new ATOM 0 HB3 LEU A 45 3.137 10.006 2.608 1.00 0.00 H new ATOM 0 HG LEU A 45 1.129 9.229 1.364 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.236 7.179 -0.022 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.089 8.552 -0.766 1.00 0.00 H new ATOM 0 HD13 LEU A 45 3.013 7.255 0.029 1.00 0.00 H new ATOM 0 HD21 LEU A 45 1.091 6.934 2.392 1.00 0.00 H new ATOM 0 HD22 LEU A 45 2.854 7.031 2.618 1.00 0.00 H new ATOM 0 HD23 LEU A 45 1.782 8.149 3.493 1.00 0.00 H new ATOM 216 N ARG A 46 1.447 11.873 -0.496 1.00 0.00 N ATOM 217 CA ARG A 46 0.360 12.872 -0.692 1.00 0.00 C ATOM 218 C ARG A 46 -0.830 12.211 -1.456 1.00 0.00 C ATOM 219 O ARG A 46 -0.664 11.689 -2.560 1.00 0.00 O ATOM 220 CB ARG A 46 0.955 14.137 -1.400 1.00 0.00 C ATOM 221 CG ARG A 46 1.060 15.339 -0.438 1.00 0.00 C ATOM 222 CD ARG A 46 1.743 16.614 -0.988 1.00 0.00 C ATOM 223 NE ARG A 46 1.370 17.817 -0.185 1.00 0.00 N ATOM 224 CZ ARG A 46 1.643 18.003 1.107 1.00 0.00 C ATOM 225 NH1 ARG A 46 2.592 17.373 1.742 1.00 0.00 N ATOM 226 NH2 ARG A 46 0.904 18.814 1.804 1.00 0.00 N ATOM 0 H ARG A 46 1.619 11.294 -1.318 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.049 13.210 0.260 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.943 13.901 -1.795 1.00 0.00 H new ATOM 0 HB3 ARG A 46 0.328 14.406 -2.250 1.00 0.00 H new ATOM 0 HG2 ARG A 46 0.053 15.605 -0.115 1.00 0.00 H new ATOM 0 HG3 ARG A 46 1.605 15.017 0.450 1.00 0.00 H new ATOM 0 HD2 ARG A 46 2.825 16.485 -0.973 1.00 0.00 H new ATOM 0 HD3 ARG A 46 1.454 16.764 -2.028 1.00 0.00 H new ATOM 0 HE ARG A 46 0.863 18.560 -0.666 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.173 16.695 1.249 1.00 0.00 H new ATOM 0 HH12 ARG A 46 2.753 17.558 2.732 1.00 0.00 H new ATOM 0 HH21 ARG A 46 0.124 19.301 1.362 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.104 18.964 2.793 1.00 0.00 H new ATOM 240 N LYS A 47 -2.033 12.212 -0.851 1.00 0.00 N ATOM 241 CA LYS A 47 -3.164 11.345 -1.285 1.00 0.00 C ATOM 242 C LYS A 47 -4.408 12.216 -1.663 1.00 0.00 C ATOM 243 O LYS A 47 -5.053 12.786 -0.778 1.00 0.00 O ATOM 244 CB LYS A 47 -3.460 10.358 -0.106 1.00 0.00 C ATOM 245 CG LYS A 47 -4.026 8.960 -0.454 1.00 0.00 C ATOM 246 CD LYS A 47 -5.226 8.921 -1.427 1.00 0.00 C ATOM 247 CE LYS A 47 -5.802 7.505 -1.636 1.00 0.00 C ATOM 248 NZ LYS A 47 -7.030 7.277 -0.826 1.00 0.00 N ATOM 0 H LYS A 47 -2.255 12.806 -0.053 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.913 10.778 -2.181 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.533 10.214 0.450 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -4.164 10.845 0.569 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -3.221 8.364 -0.883 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.324 8.473 0.474 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -6.013 9.573 -1.047 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -4.916 9.324 -2.391 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -6.032 7.359 -2.692 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -5.049 6.764 -1.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -6.781 6.768 0.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -7.460 8.192 -0.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -7.708 6.712 -1.376 1.00 0.00 H new ATOM 262 N LYS A 48 -4.788 12.298 -2.956 1.00 0.00 N ATOM 263 CA LYS A 48 -6.046 12.978 -3.388 1.00 0.00 C ATOM 264 C LYS A 48 -7.007 11.948 -4.055 1.00 0.00 C ATOM 265 O LYS A 48 -6.616 11.206 -4.960 1.00 0.00 O ATOM 266 CB LYS A 48 -5.697 14.179 -4.305 1.00 0.00 C ATOM 267 CG LYS A 48 -6.904 15.031 -4.779 1.00 0.00 C ATOM 268 CD LYS A 48 -6.519 16.396 -5.403 1.00 0.00 C ATOM 269 CE LYS A 48 -6.174 17.524 -4.404 1.00 0.00 C ATOM 270 NZ LYS A 48 -7.388 17.976 -3.665 1.00 0.00 N ATOM 0 H LYS A 48 -4.247 11.904 -3.726 1.00 0.00 H new ATOM 0 HA LYS A 48 -6.578 13.381 -2.526 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.002 14.829 -3.774 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.173 13.803 -5.184 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -7.472 14.458 -5.512 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.565 15.207 -3.930 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.662 16.244 -6.059 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.345 16.733 -6.030 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.424 17.171 -3.696 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.735 18.366 -4.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.138 18.768 -3.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.112 18.287 -4.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -7.762 17.189 -3.097 1.00 0.00 H new ATOM 284 N THR A 49 -8.273 11.964 -3.605 1.00 0.00 N ATOM 285 CA THR A 49 -9.353 11.112 -4.164 1.00 0.00 C ATOM 286 C THR A 49 -10.104 11.912 -5.270 1.00 0.00 C ATOM 287 O THR A 49 -10.707 12.957 -5.000 1.00 0.00 O ATOM 288 CB THR A 49 -10.269 10.604 -3.010 1.00 0.00 C ATOM 289 OG1 THR A 49 -9.502 9.828 -2.090 1.00 0.00 O ATOM 290 CG2 THR A 49 -11.432 9.715 -3.482 1.00 0.00 C ATOM 0 H THR A 49 -8.584 12.566 -2.843 1.00 0.00 H new ATOM 0 HA THR A 49 -8.951 10.218 -4.642 1.00 0.00 H new ATOM 0 HB THR A 49 -10.686 11.503 -2.555 1.00 0.00 H new ATOM 0 HG1 THR A 49 -10.082 9.512 -1.366 1.00 0.00 H new ATOM 0 HG21 THR A 49 -12.023 9.402 -2.621 1.00 0.00 H new ATOM 0 HG22 THR A 49 -12.063 10.277 -4.171 1.00 0.00 H new ATOM 0 HG23 THR A 49 -11.035 8.835 -3.989 1.00 0.00 H new ATOM 298 N LEU A 50 -10.073 11.376 -6.504 1.00 0.00 N ATOM 299 CA LEU A 50 -10.778 11.966 -7.674 1.00 0.00 C ATOM 300 C LEU A 50 -12.254 11.464 -7.720 1.00 0.00 C ATOM 301 O LEU A 50 -13.162 12.260 -7.461 1.00 0.00 O ATOM 302 CB LEU A 50 -10.005 11.743 -9.014 1.00 0.00 C ATOM 303 CG LEU A 50 -8.582 12.346 -9.215 1.00 0.00 C ATOM 304 CD1 LEU A 50 -8.503 13.857 -8.924 1.00 0.00 C ATOM 305 CD2 LEU A 50 -7.466 11.576 -8.479 1.00 0.00 C ATOM 0 H LEU A 50 -9.561 10.522 -6.726 1.00 0.00 H new ATOM 0 HA LEU A 50 -10.806 13.048 -7.548 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.922 10.666 -9.163 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -10.634 12.128 -9.816 1.00 0.00 H new ATOM 0 HG LEU A 50 -8.396 12.219 -10.282 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -7.483 14.206 -9.085 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.179 14.392 -9.591 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -8.791 14.044 -7.890 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.506 12.057 -8.668 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.668 11.578 -7.408 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.434 10.548 -8.840 1.00 0.00 H new ATOM 317 N VAL A 51 -12.495 10.162 -7.996 1.00 0.00 N ATOM 318 CA VAL A 51 -13.850 9.543 -7.921 1.00 0.00 C ATOM 319 C VAL A 51 -14.084 9.114 -6.424 1.00 0.00 C ATOM 320 O VAL A 51 -13.271 8.334 -5.916 1.00 0.00 O ATOM 321 CB VAL A 51 -14.003 8.347 -8.925 1.00 0.00 C ATOM 322 CG1 VAL A 51 -15.391 7.666 -8.859 1.00 0.00 C ATOM 323 CG2 VAL A 51 -13.746 8.739 -10.401 1.00 0.00 C ATOM 0 H VAL A 51 -11.764 9.509 -8.276 1.00 0.00 H new ATOM 0 HA VAL A 51 -14.615 10.259 -8.222 1.00 0.00 H new ATOM 0 HB VAL A 51 -13.234 7.648 -8.596 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -15.429 6.848 -9.578 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -15.557 7.275 -7.855 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -16.166 8.395 -9.097 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -13.870 7.862 -11.037 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -14.457 9.509 -10.702 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -12.731 9.122 -10.504 1.00 0.00 H new ATOM 333 N PRO A 52 -15.146 9.566 -5.691 1.00 0.00 N ATOM 334 CA PRO A 52 -15.319 9.261 -4.246 1.00 0.00 C ATOM 335 C PRO A 52 -15.789 7.807 -3.939 1.00 0.00 C ATOM 336 O PRO A 52 -16.421 7.138 -4.765 1.00 0.00 O ATOM 337 CB PRO A 52 -16.344 10.327 -3.812 1.00 0.00 C ATOM 338 CG PRO A 52 -17.175 10.625 -5.060 1.00 0.00 C ATOM 339 CD PRO A 52 -16.175 10.493 -6.208 1.00 0.00 C ATOM 0 HA PRO A 52 -14.377 9.301 -3.699 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -16.972 9.960 -3.000 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -15.846 11.226 -3.448 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -18.001 9.922 -5.167 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -17.609 11.624 -5.022 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -16.650 10.099 -7.106 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -15.744 11.458 -6.473 1.00 0.00 H new ATOM 347 N GLY A 53 -15.487 7.361 -2.710 1.00 0.00 N ATOM 348 CA GLY A 53 -15.942 6.054 -2.195 1.00 0.00 C ATOM 349 C GLY A 53 -17.403 6.083 -1.666 1.00 0.00 C ATOM 350 O GLY A 53 -17.650 6.872 -0.748 1.00 0.00 O ATOM 0 H GLY A 53 -14.923 7.891 -2.045 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -15.864 5.310 -2.988 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -15.277 5.735 -1.392 1.00 0.00 H new ATOM 354 N PRO A 54 -18.385 5.281 -2.173 1.00 0.00 N ATOM 355 CA PRO A 54 -19.815 5.412 -1.785 1.00 0.00 C ATOM 356 C PRO A 54 -20.148 4.966 -0.315 1.00 0.00 C ATOM 357 O PRO A 54 -19.537 3.997 0.152 1.00 0.00 O ATOM 358 CB PRO A 54 -20.532 4.550 -2.844 1.00 0.00 C ATOM 359 CG PRO A 54 -19.494 3.533 -3.317 1.00 0.00 C ATOM 360 CD PRO A 54 -18.172 4.299 -3.254 1.00 0.00 C ATOM 0 HA PRO A 54 -20.134 6.454 -1.771 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -21.404 4.052 -2.419 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -20.887 5.162 -3.673 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -19.476 2.652 -2.675 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -19.707 3.186 -4.328 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -17.336 3.636 -3.033 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -17.948 4.789 -4.201 1.00 0.00 H new ATOM 368 N PRO A 55 -21.099 5.609 0.433 1.00 0.00 N ATOM 369 CA PRO A 55 -21.401 5.256 1.846 1.00 0.00 C ATOM 370 C PRO A 55 -22.185 3.916 1.975 1.00 0.00 C ATOM 371 O PRO A 55 -23.285 3.765 1.432 1.00 0.00 O ATOM 372 CB PRO A 55 -22.198 6.481 2.333 1.00 0.00 C ATOM 373 CG PRO A 55 -22.863 7.060 1.082 1.00 0.00 C ATOM 374 CD PRO A 55 -21.854 6.791 -0.034 1.00 0.00 C ATOM 0 HA PRO A 55 -20.511 5.068 2.446 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -22.942 6.195 3.076 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -21.543 7.214 2.804 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -23.819 6.578 0.880 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -23.060 8.126 1.193 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -22.353 6.595 -0.983 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -21.197 7.646 -0.191 1.00 0.00 H new ATOM 382 N GLY A 56 -21.567 2.950 2.670 1.00 0.00 N ATOM 383 CA GLY A 56 -22.044 1.550 2.689 1.00 0.00 C ATOM 384 C GLY A 56 -20.835 0.602 2.713 1.00 0.00 C ATOM 385 O GLY A 56 -20.429 0.149 3.786 1.00 0.00 O ATOM 0 H GLY A 56 -20.730 3.109 3.231 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -22.672 1.379 3.564 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -22.659 1.351 1.811 1.00 0.00 H new ATOM 389 N SER A 57 -20.248 0.346 1.527 1.00 0.00 N ATOM 390 CA SER A 57 -18.951 -0.370 1.409 1.00 0.00 C ATOM 391 C SER A 57 -17.806 0.682 1.481 1.00 0.00 C ATOM 392 O SER A 57 -17.516 1.388 0.508 1.00 0.00 O ATOM 393 CB SER A 57 -18.918 -1.208 0.110 1.00 0.00 C ATOM 394 OG SER A 57 -19.945 -2.194 0.098 1.00 0.00 O ATOM 0 H SER A 57 -20.649 0.623 0.631 1.00 0.00 H new ATOM 0 HA SER A 57 -18.818 -1.076 2.229 1.00 0.00 H new ATOM 0 HB2 SER A 57 -19.034 -0.550 -0.751 1.00 0.00 H new ATOM 0 HB3 SER A 57 -17.946 -1.692 0.013 1.00 0.00 H new ATOM 0 HG SER A 57 -19.898 -2.705 -0.737 1.00 0.00 H new ATOM 400 N SER A 58 -17.220 0.812 2.685 1.00 0.00 N ATOM 401 CA SER A 58 -16.274 1.906 3.030 1.00 0.00 C ATOM 402 C SER A 58 -15.250 1.372 4.069 1.00 0.00 C ATOM 403 O SER A 58 -15.627 0.745 5.067 1.00 0.00 O ATOM 404 CB SER A 58 -17.027 3.131 3.609 1.00 0.00 C ATOM 405 OG SER A 58 -17.830 3.763 2.619 1.00 0.00 O ATOM 0 H SER A 58 -17.385 0.162 3.454 1.00 0.00 H new ATOM 0 HA SER A 58 -15.758 2.229 2.126 1.00 0.00 H new ATOM 0 HB2 SER A 58 -17.656 2.814 4.441 1.00 0.00 H new ATOM 0 HB3 SER A 58 -16.308 3.847 4.008 1.00 0.00 H new ATOM 0 HG SER A 58 -18.293 4.530 3.015 1.00 0.00 H new ATOM 411 N ARG A 59 -13.954 1.656 3.824 1.00 0.00 N ATOM 412 CA ARG A 59 -12.811 1.262 4.707 1.00 0.00 C ATOM 413 C ARG A 59 -12.836 -0.196 5.308 1.00 0.00 C ATOM 414 O ARG A 59 -13.120 -0.331 6.505 1.00 0.00 O ATOM 415 CB ARG A 59 -12.537 2.415 5.720 1.00 0.00 C ATOM 416 CG ARG A 59 -11.563 3.505 5.193 1.00 0.00 C ATOM 417 CD ARG A 59 -11.808 4.912 5.768 1.00 0.00 C ATOM 418 NE ARG A 59 -12.840 5.594 4.940 1.00 0.00 N ATOM 419 CZ ARG A 59 -13.213 6.863 5.045 1.00 0.00 C ATOM 420 NH1 ARG A 59 -12.838 7.641 6.029 1.00 0.00 N ATOM 421 NH2 ARG A 59 -13.990 7.359 4.126 1.00 0.00 N ATOM 0 H ARG A 59 -13.656 2.173 2.997 1.00 0.00 H new ATOM 0 HA ARG A 59 -11.936 1.148 4.067 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -13.484 2.886 5.983 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -12.128 1.989 6.636 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -10.541 3.204 5.425 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -11.643 3.551 4.107 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -12.139 4.844 6.804 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -10.882 5.487 5.767 1.00 0.00 H new ATOM 0 HE ARG A 59 -13.304 5.033 4.225 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -12.230 7.278 6.763 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -13.154 8.610 6.062 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -14.298 6.775 3.349 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -14.291 8.332 4.183 1.00 0.00 H new ATOM 435 N PRO A 60 -12.552 -1.292 4.540 1.00 0.00 N ATOM 436 CA PRO A 60 -12.678 -2.682 5.047 1.00 0.00 C ATOM 437 C PRO A 60 -11.513 -3.131 5.982 1.00 0.00 C ATOM 438 O PRO A 60 -10.431 -2.534 6.030 1.00 0.00 O ATOM 439 CB PRO A 60 -12.795 -3.494 3.741 1.00 0.00 C ATOM 440 CG PRO A 60 -12.049 -2.688 2.680 1.00 0.00 C ATOM 441 CD PRO A 60 -12.260 -1.232 3.092 1.00 0.00 C ATOM 0 HA PRO A 60 -13.531 -2.819 5.711 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -12.358 -4.486 3.857 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -13.839 -3.636 3.461 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -10.990 -2.945 2.657 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -12.445 -2.880 1.683 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -11.373 -0.631 2.891 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -13.084 -0.779 2.540 1.00 0.00 H new ATOM 449 N VAL A 61 -11.797 -4.198 6.740 1.00 0.00 N ATOM 450 CA VAL A 61 -10.895 -4.748 7.796 1.00 0.00 C ATOM 451 C VAL A 61 -10.069 -5.968 7.260 1.00 0.00 C ATOM 452 O VAL A 61 -10.325 -6.479 6.162 1.00 0.00 O ATOM 453 CB VAL A 61 -11.729 -5.057 9.094 1.00 0.00 C ATOM 454 CG1 VAL A 61 -12.260 -3.776 9.784 1.00 0.00 C ATOM 455 CG2 VAL A 61 -12.886 -6.072 8.907 1.00 0.00 C ATOM 0 H VAL A 61 -12.668 -4.720 6.647 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.149 -4.003 8.071 1.00 0.00 H new ATOM 0 HB VAL A 61 -11.000 -5.538 9.746 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.828 -4.050 10.673 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.421 -3.142 10.070 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -12.906 -3.233 9.095 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -13.399 -6.218 9.857 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -13.591 -5.689 8.169 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.483 -7.024 8.563 1.00 0.00 H new ATOM 465 N LYS A 62 -9.072 -6.444 8.046 1.00 0.00 N ATOM 466 CA LYS A 62 -8.238 -7.618 7.651 1.00 0.00 C ATOM 467 C LYS A 62 -9.045 -8.957 7.720 1.00 0.00 C ATOM 468 O LYS A 62 -9.516 -9.382 8.782 1.00 0.00 O ATOM 469 CB LYS A 62 -6.908 -7.677 8.455 1.00 0.00 C ATOM 470 CG LYS A 62 -5.841 -8.573 7.769 1.00 0.00 C ATOM 471 CD LYS A 62 -4.492 -8.664 8.515 1.00 0.00 C ATOM 472 CE LYS A 62 -3.365 -9.208 7.612 1.00 0.00 C ATOM 473 NZ LYS A 62 -2.057 -9.230 8.318 1.00 0.00 N ATOM 0 H LYS A 62 -8.823 -6.041 8.949 1.00 0.00 H new ATOM 0 HA LYS A 62 -7.961 -7.482 6.606 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -6.511 -6.668 8.571 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -7.109 -8.058 9.457 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -6.248 -9.578 7.660 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -5.659 -8.192 6.764 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -4.215 -7.677 8.884 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -4.602 -9.311 9.386 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -3.617 -10.216 7.282 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -3.285 -8.590 6.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -1.312 -9.537 7.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -1.836 -8.277 8.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -2.106 -9.892 9.119 1.00 0.00 H new ATOM 487 N GLY A 63 -9.206 -9.563 6.540 1.00 0.00 N ATOM 488 CA GLY A 63 -10.315 -10.501 6.265 1.00 0.00 C ATOM 489 C GLY A 63 -10.737 -10.374 4.789 1.00 0.00 C ATOM 490 O GLY A 63 -10.568 -11.325 4.020 1.00 0.00 O ATOM 0 H GLY A 63 -8.579 -9.423 5.748 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.003 -11.523 6.479 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -11.161 -10.283 6.917 1.00 0.00 H new ATOM 494 N GLN A 64 -11.240 -9.183 4.393 1.00 0.00 N ATOM 495 CA GLN A 64 -11.462 -8.821 2.970 1.00 0.00 C ATOM 496 C GLN A 64 -10.096 -8.607 2.255 1.00 0.00 C ATOM 497 O GLN A 64 -9.341 -7.685 2.586 1.00 0.00 O ATOM 498 CB GLN A 64 -12.319 -7.532 2.832 1.00 0.00 C ATOM 499 CG GLN A 64 -13.807 -7.616 3.241 1.00 0.00 C ATOM 500 CD GLN A 64 -14.076 -7.565 4.757 1.00 0.00 C ATOM 501 OE1 GLN A 64 -13.734 -6.598 5.437 1.00 0.00 O ATOM 502 NE2 GLN A 64 -14.696 -8.592 5.316 1.00 0.00 N ATOM 0 H GLN A 64 -11.504 -8.446 5.047 1.00 0.00 H new ATOM 0 HA GLN A 64 -12.003 -9.644 2.503 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -11.850 -6.751 3.430 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -12.274 -7.208 1.792 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -14.345 -6.796 2.765 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -14.224 -8.542 2.845 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -14.977 -9.390 4.746 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -14.893 -8.585 6.317 1.00 0.00 H new ATOM 511 N VAL A 65 -9.803 -9.480 1.277 1.00 0.00 N ATOM 512 CA VAL A 65 -8.532 -9.446 0.500 1.00 0.00 C ATOM 513 C VAL A 65 -8.782 -8.492 -0.709 1.00 0.00 C ATOM 514 O VAL A 65 -9.616 -8.766 -1.581 1.00 0.00 O ATOM 515 CB VAL A 65 -8.064 -10.885 0.089 1.00 0.00 C ATOM 516 CG1 VAL A 65 -6.708 -10.865 -0.654 1.00 0.00 C ATOM 517 CG2 VAL A 65 -7.926 -11.867 1.282 1.00 0.00 C ATOM 0 H VAL A 65 -10.433 -10.231 0.996 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.704 -9.065 1.097 1.00 0.00 H new ATOM 0 HB VAL A 65 -8.859 -11.240 -0.567 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.423 -11.883 -0.919 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -6.798 -10.266 -1.560 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -5.945 -10.432 -0.007 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.599 -12.840 0.916 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -7.192 -11.480 1.989 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -8.890 -11.972 1.780 1.00 0.00 H new ATOM 527 N VAL A 66 -8.066 -7.355 -0.710 1.00 0.00 N ATOM 528 CA VAL A 66 -8.329 -6.219 -1.639 1.00 0.00 C ATOM 529 C VAL A 66 -7.468 -6.329 -2.930 1.00 0.00 C ATOM 530 O VAL A 66 -6.266 -6.611 -2.883 1.00 0.00 O ATOM 531 CB VAL A 66 -8.179 -4.822 -0.945 1.00 0.00 C ATOM 532 CG1 VAL A 66 -9.409 -4.479 -0.079 1.00 0.00 C ATOM 533 CG2 VAL A 66 -6.874 -4.607 -0.140 1.00 0.00 C ATOM 0 H VAL A 66 -7.288 -7.188 -0.072 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.375 -6.293 -1.938 1.00 0.00 H new ATOM 0 HB VAL A 66 -8.113 -4.127 -1.782 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -9.266 -3.503 0.385 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -10.300 -4.456 -0.706 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -9.530 -5.235 0.696 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.876 -3.608 0.297 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.810 -5.350 0.655 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.016 -4.711 -0.804 1.00 0.00 H new ATOM 543 N THR A 67 -8.129 -6.079 -4.074 1.00 0.00 N ATOM 544 CA THR A 67 -7.513 -6.163 -5.423 1.00 0.00 C ATOM 545 C THR A 67 -7.628 -4.761 -6.084 1.00 0.00 C ATOM 546 O THR A 67 -8.726 -4.201 -6.176 1.00 0.00 O ATOM 547 CB THR A 67 -8.196 -7.274 -6.273 1.00 0.00 C ATOM 548 OG1 THR A 67 -8.266 -8.498 -5.546 1.00 0.00 O ATOM 549 CG2 THR A 67 -7.451 -7.578 -7.581 1.00 0.00 C ATOM 0 H THR A 67 -9.113 -5.811 -4.096 1.00 0.00 H new ATOM 0 HA THR A 67 -6.461 -6.441 -5.351 1.00 0.00 H new ATOM 0 HB THR A 67 -9.188 -6.885 -6.505 1.00 0.00 H new ATOM 0 HG1 THR A 67 -8.700 -9.182 -6.098 1.00 0.00 H new ATOM 0 HG21 THR A 67 -7.978 -8.361 -8.127 1.00 0.00 H new ATOM 0 HG22 THR A 67 -7.406 -6.677 -8.192 1.00 0.00 H new ATOM 0 HG23 THR A 67 -6.439 -7.913 -7.354 1.00 0.00 H new ATOM 557 N VAL A 68 -6.485 -4.213 -6.544 1.00 0.00 N ATOM 558 CA VAL A 68 -6.412 -2.831 -7.106 1.00 0.00 C ATOM 559 C VAL A 68 -5.905 -2.854 -8.582 1.00 0.00 C ATOM 560 O VAL A 68 -4.959 -3.569 -8.933 1.00 0.00 O ATOM 561 CB VAL A 68 -5.579 -1.841 -6.216 1.00 0.00 C ATOM 562 CG1 VAL A 68 -6.215 -1.583 -4.833 1.00 0.00 C ATOM 563 CG2 VAL A 68 -4.094 -2.213 -6.026 1.00 0.00 C ATOM 0 H VAL A 68 -5.590 -4.703 -6.541 1.00 0.00 H new ATOM 0 HA VAL A 68 -7.430 -2.440 -7.103 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.605 -0.924 -6.805 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.590 -0.891 -4.268 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -7.207 -1.152 -4.964 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.297 -2.524 -4.289 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.610 -1.466 -5.397 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.022 -3.191 -5.550 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.600 -2.245 -6.997 1.00 0.00 H new ATOM 573 N HIS A 69 -6.501 -1.977 -9.410 1.00 0.00 N ATOM 574 CA HIS A 69 -5.930 -1.553 -10.713 1.00 0.00 C ATOM 575 C HIS A 69 -5.040 -0.306 -10.462 1.00 0.00 C ATOM 576 O HIS A 69 -5.524 0.832 -10.465 1.00 0.00 O ATOM 577 CB HIS A 69 -7.103 -1.349 -11.719 1.00 0.00 C ATOM 578 CG HIS A 69 -6.828 -0.674 -13.072 1.00 0.00 C ATOM 579 ND1 HIS A 69 -7.771 0.098 -13.729 1.00 0.00 N ATOM 580 CD2 HIS A 69 -5.648 -0.725 -13.842 1.00 0.00 C ATOM 581 CE1 HIS A 69 -7.063 0.442 -14.849 1.00 0.00 C ATOM 582 NE2 HIS A 69 -5.779 -0.004 -15.019 1.00 0.00 N ATOM 0 H HIS A 69 -7.397 -1.537 -9.198 1.00 0.00 H new ATOM 0 HA HIS A 69 -5.280 -2.301 -11.167 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -7.532 -2.330 -11.924 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -7.871 -0.765 -11.212 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -4.755 -1.258 -13.552 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -7.519 1.068 -15.602 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -5.119 0.148 -15.781 1.00 0.00 H new ATOM 590 N LEU A 70 -3.733 -0.557 -10.259 1.00 0.00 N ATOM 591 CA LEU A 70 -2.723 0.515 -10.076 1.00 0.00 C ATOM 592 C LEU A 70 -1.989 0.814 -11.411 1.00 0.00 C ATOM 593 O LEU A 70 -1.693 -0.093 -12.198 1.00 0.00 O ATOM 594 CB LEU A 70 -1.798 0.217 -8.857 1.00 0.00 C ATOM 595 CG LEU A 70 -0.735 -0.922 -8.928 1.00 0.00 C ATOM 596 CD1 LEU A 70 0.564 -0.498 -9.648 1.00 0.00 C ATOM 597 CD2 LEU A 70 -0.358 -1.407 -7.514 1.00 0.00 C ATOM 0 H LEU A 70 -3.345 -1.499 -10.217 1.00 0.00 H new ATOM 0 HA LEU A 70 -3.222 1.448 -9.815 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -1.266 1.139 -8.624 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -2.446 -0.000 -8.008 1.00 0.00 H new ATOM 0 HG LEU A 70 -1.203 -1.721 -9.503 1.00 0.00 H new ATOM 0 HD11 LEU A 70 1.262 -1.335 -9.663 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.333 -0.200 -10.671 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.016 0.341 -9.119 1.00 0.00 H new ATOM 0 HD21 LEU A 70 0.385 -2.201 -7.588 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.055 -0.576 -6.942 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.247 -1.787 -7.011 1.00 0.00 H new ATOM 609 N GLN A 71 -1.682 2.102 -11.632 1.00 0.00 N ATOM 610 CA GLN A 71 -0.889 2.557 -12.805 1.00 0.00 C ATOM 611 C GLN A 71 0.285 3.407 -12.255 1.00 0.00 C ATOM 612 O GLN A 71 0.153 4.628 -12.111 1.00 0.00 O ATOM 613 CB GLN A 71 -1.771 3.358 -13.813 1.00 0.00 C ATOM 614 CG GLN A 71 -2.969 2.632 -14.472 1.00 0.00 C ATOM 615 CD GLN A 71 -2.601 1.482 -15.422 1.00 0.00 C ATOM 616 OE1 GLN A 71 -2.543 0.319 -15.025 1.00 0.00 O ATOM 617 NE2 GLN A 71 -2.370 1.772 -16.694 1.00 0.00 N ATOM 0 H GLN A 71 -1.970 2.859 -11.012 1.00 0.00 H new ATOM 0 HA GLN A 71 -0.505 1.705 -13.366 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -2.157 4.235 -13.294 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -1.121 3.720 -14.610 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -3.612 2.239 -13.684 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -3.556 3.365 -15.026 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -2.420 2.739 -17.014 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -2.142 1.028 -17.353 1.00 0.00 H new ATOM 626 N THR A 72 1.446 2.771 -11.962 1.00 0.00 N ATOM 627 CA THR A 72 2.665 3.497 -11.491 1.00 0.00 C ATOM 628 C THR A 72 3.285 4.228 -12.712 1.00 0.00 C ATOM 629 O THR A 72 3.668 3.582 -13.690 1.00 0.00 O ATOM 630 CB THR A 72 3.694 2.561 -10.790 1.00 0.00 C ATOM 631 OG1 THR A 72 3.058 1.750 -9.808 1.00 0.00 O ATOM 632 CG2 THR A 72 4.839 3.294 -10.074 1.00 0.00 C ATOM 0 H THR A 72 1.570 1.762 -12.041 1.00 0.00 H new ATOM 0 HA THR A 72 2.378 4.219 -10.727 1.00 0.00 H new ATOM 0 HB THR A 72 4.113 1.973 -11.607 1.00 0.00 H new ATOM 0 HG1 THR A 72 2.878 0.863 -10.183 1.00 0.00 H new ATOM 0 HG21 THR A 72 5.507 2.565 -9.615 1.00 0.00 H new ATOM 0 HG22 THR A 72 5.396 3.892 -10.796 1.00 0.00 H new ATOM 0 HG23 THR A 72 4.428 3.946 -9.303 1.00 0.00 H new ATOM 640 N SER A 73 3.296 5.571 -12.661 1.00 0.00 N ATOM 641 CA SER A 73 3.503 6.410 -13.867 1.00 0.00 C ATOM 642 C SER A 73 4.391 7.620 -13.509 1.00 0.00 C ATOM 643 O SER A 73 4.001 8.462 -12.694 1.00 0.00 O ATOM 644 CB SER A 73 2.138 6.888 -14.419 1.00 0.00 C ATOM 645 OG SER A 73 1.343 5.790 -14.852 1.00 0.00 O ATOM 0 H SER A 73 3.165 6.104 -11.801 1.00 0.00 H new ATOM 0 HA SER A 73 4.001 5.820 -14.636 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.605 7.443 -13.647 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.299 7.573 -15.251 1.00 0.00 H new ATOM 0 HG SER A 73 0.943 5.349 -14.074 1.00 0.00 H new ATOM 651 N LEU A 74 5.565 7.731 -14.160 1.00 0.00 N ATOM 652 CA LEU A 74 6.465 8.907 -14.000 1.00 0.00 C ATOM 653 C LEU A 74 5.874 10.151 -14.726 1.00 0.00 C ATOM 654 O LEU A 74 5.355 10.040 -15.843 1.00 0.00 O ATOM 655 CB LEU A 74 7.884 8.521 -14.508 1.00 0.00 C ATOM 656 CG LEU A 74 9.033 9.545 -14.280 1.00 0.00 C ATOM 657 CD1 LEU A 74 9.309 9.830 -12.788 1.00 0.00 C ATOM 658 CD2 LEU A 74 10.321 9.069 -14.980 1.00 0.00 C ATOM 0 H LEU A 74 5.919 7.024 -14.804 1.00 0.00 H new ATOM 0 HA LEU A 74 6.549 9.185 -12.949 1.00 0.00 H new ATOM 0 HB2 LEU A 74 8.169 7.584 -14.029 1.00 0.00 H new ATOM 0 HB3 LEU A 74 7.816 8.325 -15.578 1.00 0.00 H new ATOM 0 HG LEU A 74 8.701 10.486 -14.720 1.00 0.00 H new ATOM 0 HD11 LEU A 74 10.121 10.552 -12.700 1.00 0.00 H new ATOM 0 HD12 LEU A 74 8.411 10.236 -12.323 1.00 0.00 H new ATOM 0 HD13 LEU A 74 9.590 8.904 -12.287 1.00 0.00 H new ATOM 0 HD21 LEU A 74 11.116 9.795 -14.812 1.00 0.00 H new ATOM 0 HD22 LEU A 74 10.620 8.103 -14.574 1.00 0.00 H new ATOM 0 HD23 LEU A 74 10.139 8.972 -16.050 1.00 0.00 H new ATOM 670 N GLU A 75 5.948 11.319 -14.058 1.00 0.00 N ATOM 671 CA GLU A 75 5.259 12.567 -14.499 1.00 0.00 C ATOM 672 C GLU A 75 5.975 13.254 -15.711 1.00 0.00 C ATOM 673 O GLU A 75 6.852 14.114 -15.567 1.00 0.00 O ATOM 674 CB GLU A 75 5.105 13.507 -13.271 1.00 0.00 C ATOM 675 CG GLU A 75 4.123 13.008 -12.178 1.00 0.00 C ATOM 676 CD GLU A 75 3.944 13.967 -11.016 1.00 0.00 C ATOM 677 OE1 GLU A 75 3.172 14.939 -11.158 1.00 0.00 O ATOM 678 OE2 GLU A 75 4.541 13.732 -9.947 1.00 0.00 O ATOM 0 H GLU A 75 6.484 11.433 -13.198 1.00 0.00 H new ATOM 0 HA GLU A 75 4.268 12.317 -14.876 1.00 0.00 H new ATOM 0 HB2 GLU A 75 6.086 13.651 -12.818 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.769 14.483 -13.620 1.00 0.00 H new ATOM 0 HG2 GLU A 75 3.151 12.824 -12.636 1.00 0.00 H new ATOM 0 HG3 GLU A 75 4.480 12.052 -11.794 1.00 0.00 H new ATOM 685 N ASN A 76 5.578 12.802 -16.911 1.00 0.00 N ATOM 686 CA ASN A 76 6.232 13.125 -18.206 1.00 0.00 C ATOM 687 C ASN A 76 5.273 12.554 -19.299 1.00 0.00 C ATOM 688 O ASN A 76 4.534 13.326 -19.918 1.00 0.00 O ATOM 689 CB ASN A 76 7.710 12.617 -18.283 1.00 0.00 C ATOM 690 CG ASN A 76 8.469 13.035 -19.556 1.00 0.00 C ATOM 691 OD1 ASN A 76 8.765 14.212 -19.768 1.00 0.00 O ATOM 692 ND2 ASN A 76 8.800 12.087 -20.419 1.00 0.00 N ATOM 0 H ASN A 76 4.773 12.185 -17.019 1.00 0.00 H new ATOM 0 HA ASN A 76 6.361 14.198 -18.351 1.00 0.00 H new ATOM 0 HB2 ASN A 76 8.253 12.989 -17.414 1.00 0.00 H new ATOM 0 HB3 ASN A 76 7.710 11.529 -18.217 1.00 0.00 H new ATOM 0 HD21 ASN A 76 9.306 12.327 -21.271 1.00 0.00 H new ATOM 0 HD22 ASN A 76 8.549 11.116 -20.231 1.00 0.00 H new ATOM 699 N GLY A 77 5.261 11.220 -19.499 1.00 0.00 N ATOM 700 CA GLY A 77 4.236 10.533 -20.313 1.00 0.00 C ATOM 701 C GLY A 77 4.584 9.044 -20.495 1.00 0.00 C ATOM 702 O GLY A 77 4.968 8.640 -21.596 1.00 0.00 O ATOM 0 H GLY A 77 5.959 10.590 -19.103 1.00 0.00 H new ATOM 0 HA2 GLY A 77 3.262 10.627 -19.833 1.00 0.00 H new ATOM 0 HA3 GLY A 77 4.158 11.014 -21.288 1.00 0.00 H new ATOM 706 N THR A 78 4.468 8.243 -19.414 1.00 0.00 N ATOM 707 CA THR A 78 4.922 6.823 -19.396 1.00 0.00 C ATOM 708 C THR A 78 4.270 6.069 -18.199 1.00 0.00 C ATOM 709 O THR A 78 4.195 6.594 -17.083 1.00 0.00 O ATOM 710 CB THR A 78 6.484 6.690 -19.396 1.00 0.00 C ATOM 711 OG1 THR A 78 6.849 5.320 -19.539 1.00 0.00 O ATOM 712 CG2 THR A 78 7.234 7.263 -18.178 1.00 0.00 C ATOM 0 H THR A 78 4.061 8.553 -18.532 1.00 0.00 H new ATOM 0 HA THR A 78 4.588 6.354 -20.321 1.00 0.00 H new ATOM 0 HB THR A 78 6.794 7.307 -20.240 1.00 0.00 H new ATOM 0 HG1 THR A 78 7.826 5.240 -19.540 1.00 0.00 H new ATOM 0 HG21 THR A 78 8.305 7.106 -18.304 1.00 0.00 H new ATOM 0 HG22 THR A 78 7.031 8.331 -18.095 1.00 0.00 H new ATOM 0 HG23 THR A 78 6.897 6.758 -17.273 1.00 0.00 H new ATOM 720 N ARG A 79 3.886 4.798 -18.429 1.00 0.00 N ATOM 721 CA ARG A 79 3.694 3.803 -17.332 1.00 0.00 C ATOM 722 C ARG A 79 5.047 3.062 -17.077 1.00 0.00 C ATOM 723 O ARG A 79 5.526 2.303 -17.930 1.00 0.00 O ATOM 724 CB ARG A 79 2.565 2.789 -17.681 1.00 0.00 C ATOM 725 CG ARG A 79 1.109 3.154 -17.281 1.00 0.00 C ATOM 726 CD ARG A 79 0.335 4.098 -18.215 1.00 0.00 C ATOM 727 NE ARG A 79 0.844 5.492 -18.107 1.00 0.00 N ATOM 728 CZ ARG A 79 0.151 6.570 -17.747 1.00 0.00 C ATOM 729 NH1 ARG A 79 -1.110 6.546 -17.394 1.00 0.00 N ATOM 730 NH2 ARG A 79 0.769 7.716 -17.737 1.00 0.00 N ATOM 0 H ARG A 79 3.700 4.427 -19.361 1.00 0.00 H new ATOM 0 HA ARG A 79 3.388 4.326 -16.426 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.584 2.625 -18.758 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.813 1.838 -17.209 1.00 0.00 H new ATOM 0 HG2 ARG A 79 0.542 2.228 -17.193 1.00 0.00 H new ATOM 0 HG3 ARG A 79 1.135 3.607 -16.290 1.00 0.00 H new ATOM 0 HD2 ARG A 79 0.427 3.752 -19.245 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -0.726 4.074 -17.964 1.00 0.00 H new ATOM 0 HE ARG A 79 1.828 5.637 -18.333 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -1.620 5.663 -17.384 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -1.582 7.411 -17.129 1.00 0.00 H new ATOM 0 HH21 ARG A 79 1.753 7.767 -18.000 1.00 0.00 H new ATOM 0 HH22 ARG A 79 0.269 8.563 -17.466 1.00 0.00 H new ATOM 744 N VAL A 80 5.634 3.283 -15.889 1.00 0.00 N ATOM 745 CA VAL A 80 6.858 2.558 -15.433 1.00 0.00 C ATOM 746 C VAL A 80 6.577 1.111 -14.909 1.00 0.00 C ATOM 747 O VAL A 80 7.252 0.181 -15.359 1.00 0.00 O ATOM 748 CB VAL A 80 7.773 3.413 -14.486 1.00 0.00 C ATOM 749 CG1 VAL A 80 8.414 4.620 -15.209 1.00 0.00 C ATOM 750 CG2 VAL A 80 7.131 3.887 -13.163 1.00 0.00 C ATOM 0 H VAL A 80 5.285 3.962 -15.213 1.00 0.00 H new ATOM 0 HA VAL A 80 7.451 2.408 -16.335 1.00 0.00 H new ATOM 0 HB VAL A 80 8.544 2.696 -14.203 1.00 0.00 H new ATOM 0 HG11 VAL A 80 9.036 5.176 -14.507 1.00 0.00 H new ATOM 0 HG12 VAL A 80 9.029 4.264 -16.036 1.00 0.00 H new ATOM 0 HG13 VAL A 80 7.630 5.272 -15.594 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.857 4.467 -12.594 1.00 0.00 H new ATOM 0 HG22 VAL A 80 6.262 4.508 -13.382 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.820 3.021 -12.579 1.00 0.00 H new ATOM 760 N GLN A 81 5.619 0.922 -13.978 1.00 0.00 N ATOM 761 CA GLN A 81 5.285 -0.413 -13.399 1.00 0.00 C ATOM 762 C GLN A 81 3.740 -0.521 -13.217 1.00 0.00 C ATOM 763 O GLN A 81 3.210 -0.336 -12.116 1.00 0.00 O ATOM 764 CB GLN A 81 6.038 -0.657 -12.053 1.00 0.00 C ATOM 765 CG GLN A 81 7.574 -0.833 -12.097 1.00 0.00 C ATOM 766 CD GLN A 81 8.075 -2.157 -12.702 1.00 0.00 C ATOM 767 OE1 GLN A 81 7.773 -3.243 -12.205 1.00 0.00 O ATOM 768 NE2 GLN A 81 8.869 -2.104 -13.759 1.00 0.00 N ATOM 0 H GLN A 81 5.052 1.682 -13.602 1.00 0.00 H new ATOM 0 HA GLN A 81 5.616 -1.191 -14.087 1.00 0.00 H new ATOM 0 HB2 GLN A 81 5.818 0.181 -11.391 1.00 0.00 H new ATOM 0 HB3 GLN A 81 5.614 -1.548 -11.591 1.00 0.00 H new ATOM 0 HG2 GLN A 81 8.000 -0.009 -12.669 1.00 0.00 H new ATOM 0 HG3 GLN A 81 7.961 -0.749 -11.081 1.00 0.00 H new ATOM 0 HE21 GLN A 81 9.116 -1.202 -14.167 1.00 0.00 H new ATOM 0 HE22 GLN A 81 9.234 -2.965 -14.166 1.00 0.00 H new ATOM 777 N GLU A 82 3.011 -0.844 -14.304 1.00 0.00 N ATOM 778 CA GLU A 82 1.525 -0.973 -14.275 1.00 0.00 C ATOM 779 C GLU A 82 1.042 -2.421 -13.928 1.00 0.00 C ATOM 780 O GLU A 82 1.345 -3.384 -14.641 1.00 0.00 O ATOM 781 CB GLU A 82 0.932 -0.401 -15.589 1.00 0.00 C ATOM 782 CG GLU A 82 1.227 -1.140 -16.922 1.00 0.00 C ATOM 783 CD GLU A 82 0.615 -0.469 -18.139 1.00 0.00 C ATOM 784 OE1 GLU A 82 -0.620 -0.540 -18.310 1.00 0.00 O ATOM 785 OE2 GLU A 82 1.365 0.146 -18.925 1.00 0.00 O ATOM 0 H GLU A 82 3.422 -1.023 -15.220 1.00 0.00 H new ATOM 0 HA GLU A 82 1.136 -0.374 -13.452 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -0.150 -0.353 -15.470 1.00 0.00 H new ATOM 0 HB3 GLU A 82 1.287 0.624 -15.693 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.306 -1.207 -17.059 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.850 -2.161 -16.853 1.00 0.00 H new ATOM 792 N GLU A 83 0.292 -2.569 -12.820 1.00 0.00 N ATOM 793 CA GLU A 83 -0.147 -3.897 -12.302 1.00 0.00 C ATOM 794 C GLU A 83 -1.717 -3.920 -12.210 1.00 0.00 C ATOM 795 O GLU A 83 -2.257 -3.459 -11.195 1.00 0.00 O ATOM 796 CB GLU A 83 0.569 -4.207 -10.955 1.00 0.00 C ATOM 797 CG GLU A 83 2.113 -4.359 -11.045 1.00 0.00 C ATOM 798 CD GLU A 83 2.809 -4.653 -9.728 1.00 0.00 C ATOM 799 OE1 GLU A 83 2.964 -3.724 -8.908 1.00 0.00 O ATOM 800 OE2 GLU A 83 3.232 -5.811 -9.523 1.00 0.00 O ATOM 0 H GLU A 83 -0.030 -1.783 -12.255 1.00 0.00 H new ATOM 0 HA GLU A 83 0.141 -4.697 -12.984 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.339 -3.410 -10.248 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.153 -5.127 -10.544 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.343 -5.161 -11.747 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.529 -3.442 -11.461 1.00 0.00 H new ATOM 807 N PRO A 84 -2.493 -4.418 -13.224 1.00 0.00 N ATOM 808 CA PRO A 84 -3.978 -4.314 -13.237 1.00 0.00 C ATOM 809 C PRO A 84 -4.765 -5.224 -12.245 1.00 0.00 C ATOM 810 O PRO A 84 -5.683 -4.721 -11.594 1.00 0.00 O ATOM 811 CB PRO A 84 -4.337 -4.530 -14.720 1.00 0.00 C ATOM 812 CG PRO A 84 -3.188 -5.360 -15.295 1.00 0.00 C ATOM 813 CD PRO A 84 -1.957 -4.897 -14.515 1.00 0.00 C ATOM 0 HA PRO A 84 -4.295 -3.346 -12.850 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -5.289 -5.051 -14.823 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -4.436 -3.579 -15.244 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -3.364 -6.428 -15.163 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -3.069 -5.187 -16.365 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -1.248 -5.713 -14.372 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -1.428 -4.104 -15.043 1.00 0.00 H new ATOM 821 N GLU A 85 -4.424 -6.521 -12.112 1.00 0.00 N ATOM 822 CA GLU A 85 -5.037 -7.416 -11.087 1.00 0.00 C ATOM 823 C GLU A 85 -4.015 -7.704 -9.940 1.00 0.00 C ATOM 824 O GLU A 85 -3.408 -8.781 -9.872 1.00 0.00 O ATOM 825 CB GLU A 85 -5.593 -8.679 -11.818 1.00 0.00 C ATOM 826 CG GLU A 85 -6.892 -9.274 -11.210 1.00 0.00 C ATOM 827 CD GLU A 85 -8.137 -8.415 -11.405 1.00 0.00 C ATOM 828 OE1 GLU A 85 -8.412 -7.992 -12.547 1.00 0.00 O ATOM 829 OE2 GLU A 85 -8.817 -8.086 -10.418 1.00 0.00 O ATOM 0 H GLU A 85 -3.727 -6.981 -12.698 1.00 0.00 H new ATOM 0 HA GLU A 85 -5.883 -6.947 -10.584 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -5.783 -8.422 -12.860 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -4.823 -9.450 -11.815 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -7.070 -10.254 -11.654 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -6.739 -9.431 -10.142 1.00 0.00 H new ATOM 836 N LEU A 86 -3.825 -6.709 -9.048 1.00 0.00 N ATOM 837 CA LEU A 86 -2.825 -6.775 -7.948 1.00 0.00 C ATOM 838 C LEU A 86 -3.577 -7.162 -6.651 1.00 0.00 C ATOM 839 O LEU A 86 -4.096 -6.296 -5.942 1.00 0.00 O ATOM 840 CB LEU A 86 -2.065 -5.414 -7.892 1.00 0.00 C ATOM 841 CG LEU A 86 -0.869 -5.223 -6.915 1.00 0.00 C ATOM 842 CD1 LEU A 86 -1.266 -4.989 -5.451 1.00 0.00 C ATOM 843 CD2 LEU A 86 0.243 -6.284 -6.991 1.00 0.00 C ATOM 0 H LEU A 86 -4.356 -5.838 -9.065 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.060 -7.536 -8.101 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -1.697 -5.208 -8.897 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.800 -4.643 -7.658 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.442 -4.298 -7.303 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.368 -4.867 -4.846 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.877 -4.089 -5.379 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.835 -5.844 -5.087 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.022 -6.048 -6.266 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.175 -7.266 -6.768 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.671 -6.291 -7.993 1.00 0.00 H new ATOM 855 N VAL A 87 -3.630 -8.477 -6.365 1.00 0.00 N ATOM 856 CA VAL A 87 -4.297 -9.024 -5.154 1.00 0.00 C ATOM 857 C VAL A 87 -3.270 -9.083 -3.985 1.00 0.00 C ATOM 858 O VAL A 87 -2.132 -9.543 -4.141 1.00 0.00 O ATOM 859 CB VAL A 87 -5.019 -10.378 -5.464 1.00 0.00 C ATOM 860 CG1 VAL A 87 -4.088 -11.574 -5.759 1.00 0.00 C ATOM 861 CG2 VAL A 87 -5.994 -10.778 -4.339 1.00 0.00 C ATOM 0 H VAL A 87 -3.215 -9.193 -6.961 1.00 0.00 H new ATOM 0 HA VAL A 87 -5.099 -8.361 -4.829 1.00 0.00 H new ATOM 0 HB VAL A 87 -5.559 -10.166 -6.387 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -4.688 -12.461 -5.960 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.470 -11.349 -6.628 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -3.447 -11.758 -4.897 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -6.474 -11.723 -4.593 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -5.445 -10.890 -3.404 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -6.753 -10.005 -4.223 1.00 0.00 H new ATOM 871 N PHE A 88 -3.707 -8.592 -2.819 1.00 0.00 N ATOM 872 CA PHE A 88 -2.841 -8.447 -1.622 1.00 0.00 C ATOM 873 C PHE A 88 -3.711 -8.453 -0.334 1.00 0.00 C ATOM 874 O PHE A 88 -4.801 -7.866 -0.285 1.00 0.00 O ATOM 875 CB PHE A 88 -1.892 -7.212 -1.735 1.00 0.00 C ATOM 876 CG PHE A 88 -2.491 -5.805 -1.533 1.00 0.00 C ATOM 877 CD1 PHE A 88 -3.246 -5.182 -2.533 1.00 0.00 C ATOM 878 CD2 PHE A 88 -2.276 -5.139 -0.322 1.00 0.00 C ATOM 879 CE1 PHE A 88 -3.786 -3.916 -2.319 1.00 0.00 C ATOM 880 CE2 PHE A 88 -2.815 -3.875 -0.110 1.00 0.00 C ATOM 881 CZ PHE A 88 -3.573 -3.265 -1.108 1.00 0.00 C ATOM 0 H PHE A 88 -4.667 -8.282 -2.669 1.00 0.00 H new ATOM 0 HA PHE A 88 -2.173 -9.306 -1.560 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -1.092 -7.340 -1.005 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -1.430 -7.238 -2.722 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -3.411 -5.685 -3.475 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -1.688 -5.609 0.453 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -4.370 -3.440 -3.093 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -2.646 -3.366 0.828 1.00 0.00 H new ATOM 0 HZ PHE A 88 -3.996 -2.285 -0.941 1.00 0.00 H new ATOM 891 N THR A 89 -3.177 -9.078 0.730 1.00 0.00 N ATOM 892 CA THR A 89 -3.845 -9.142 2.059 1.00 0.00 C ATOM 893 C THR A 89 -3.748 -7.752 2.772 1.00 0.00 C ATOM 894 O THR A 89 -2.687 -7.115 2.795 1.00 0.00 O ATOM 895 CB THR A 89 -3.238 -10.301 2.906 1.00 0.00 C ATOM 896 OG1 THR A 89 -3.208 -11.521 2.164 1.00 0.00 O ATOM 897 CG2 THR A 89 -4.043 -10.609 4.180 1.00 0.00 C ATOM 0 H THR A 89 -2.275 -9.553 0.702 1.00 0.00 H new ATOM 0 HA THR A 89 -4.905 -9.363 1.934 1.00 0.00 H new ATOM 0 HB THR A 89 -2.239 -9.953 3.169 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.821 -12.231 2.718 1.00 0.00 H new ATOM 0 HG21 THR A 89 -3.566 -11.425 4.723 1.00 0.00 H new ATOM 0 HG22 THR A 89 -4.076 -9.722 4.813 1.00 0.00 H new ATOM 0 HG23 THR A 89 -5.058 -10.898 3.908 1.00 0.00 H new ATOM 905 N LEU A 90 -4.888 -7.298 3.322 1.00 0.00 N ATOM 906 CA LEU A 90 -5.099 -5.892 3.763 1.00 0.00 C ATOM 907 C LEU A 90 -4.274 -5.541 5.036 1.00 0.00 C ATOM 908 O LEU A 90 -4.587 -6.006 6.136 1.00 0.00 O ATOM 909 CB LEU A 90 -6.632 -5.725 3.977 1.00 0.00 C ATOM 910 CG LEU A 90 -7.172 -4.277 4.152 1.00 0.00 C ATOM 911 CD1 LEU A 90 -8.666 -4.218 3.800 1.00 0.00 C ATOM 912 CD2 LEU A 90 -6.975 -3.682 5.565 1.00 0.00 C ATOM 0 H LEU A 90 -5.700 -7.895 3.478 1.00 0.00 H new ATOM 0 HA LEU A 90 -4.741 -5.191 3.009 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -7.143 -6.175 3.126 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -6.914 -6.300 4.859 1.00 0.00 H new ATOM 0 HG LEU A 90 -6.577 -3.671 3.469 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -9.030 -3.198 3.927 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -8.808 -4.528 2.765 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -9.222 -4.886 4.458 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.381 -2.671 5.594 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -7.493 -4.302 6.296 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.912 -3.653 5.802 1.00 0.00 H new ATOM 924 N GLY A 91 -3.236 -4.708 4.871 1.00 0.00 N ATOM 925 CA GLY A 91 -2.313 -4.357 5.978 1.00 0.00 C ATOM 926 C GLY A 91 -1.212 -5.409 6.217 1.00 0.00 C ATOM 927 O GLY A 91 -1.212 -6.078 7.253 1.00 0.00 O ATOM 0 H GLY A 91 -3.008 -4.261 3.983 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -1.846 -3.397 5.760 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -2.889 -4.231 6.895 1.00 0.00 H new ATOM 931 N ASP A 92 -0.291 -5.536 5.247 1.00 0.00 N ATOM 932 CA ASP A 92 0.863 -6.475 5.316 1.00 0.00 C ATOM 933 C ASP A 92 2.075 -5.877 4.541 1.00 0.00 C ATOM 934 O ASP A 92 1.939 -5.263 3.473 1.00 0.00 O ATOM 935 CB ASP A 92 0.476 -7.881 4.759 1.00 0.00 C ATOM 936 CG ASP A 92 -0.243 -8.780 5.760 1.00 0.00 C ATOM 937 OD1 ASP A 92 0.196 -8.899 6.926 1.00 0.00 O ATOM 938 OD2 ASP A 92 -1.288 -9.361 5.419 1.00 0.00 O ATOM 0 H ASP A 92 -0.318 -4.992 4.385 1.00 0.00 H new ATOM 0 HA ASP A 92 1.147 -6.607 6.360 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.161 -7.749 3.885 1.00 0.00 H new ATOM 0 HB3 ASP A 92 1.381 -8.386 4.421 1.00 0.00 H new ATOM 943 N CYS A 93 3.288 -6.151 5.064 1.00 0.00 N ATOM 944 CA CYS A 93 4.562 -5.847 4.356 1.00 0.00 C ATOM 945 C CYS A 93 4.845 -6.866 3.206 1.00 0.00 C ATOM 946 O CYS A 93 5.672 -7.778 3.312 1.00 0.00 O ATOM 947 CB CYS A 93 5.717 -5.767 5.377 1.00 0.00 C ATOM 948 SG CYS A 93 5.462 -4.391 6.548 1.00 0.00 S ATOM 0 H CYS A 93 3.418 -6.584 5.978 1.00 0.00 H new ATOM 0 HA CYS A 93 4.473 -4.875 3.872 1.00 0.00 H new ATOM 0 HB2 CYS A 93 5.788 -6.707 5.925 1.00 0.00 H new ATOM 0 HB3 CYS A 93 6.662 -5.632 4.852 1.00 0.00 H new ATOM 0 HG CYS A 93 6.448 -4.353 7.394 1.00 0.00 H new ATOM 954 N ASP A 94 4.114 -6.661 2.099 1.00 0.00 N ATOM 955 CA ASP A 94 4.199 -7.475 0.855 1.00 0.00 C ATOM 956 C ASP A 94 4.366 -6.509 -0.365 1.00 0.00 C ATOM 957 O ASP A 94 5.417 -6.505 -1.017 1.00 0.00 O ATOM 958 CB ASP A 94 2.954 -8.408 0.806 1.00 0.00 C ATOM 959 CG ASP A 94 2.993 -9.440 -0.315 1.00 0.00 C ATOM 960 OD1 ASP A 94 3.591 -10.519 -0.120 1.00 0.00 O ATOM 961 OD2 ASP A 94 2.433 -9.167 -1.398 1.00 0.00 O ATOM 0 H ASP A 94 3.428 -5.909 2.033 1.00 0.00 H new ATOM 0 HA ASP A 94 5.070 -8.130 0.827 1.00 0.00 H new ATOM 0 HB2 ASP A 94 2.865 -8.927 1.760 1.00 0.00 H new ATOM 0 HB3 ASP A 94 2.059 -7.796 0.691 1.00 0.00 H new ATOM 966 N VAL A 95 3.349 -5.657 -0.617 1.00 0.00 N ATOM 967 CA VAL A 95 3.378 -4.593 -1.660 1.00 0.00 C ATOM 968 C VAL A 95 4.333 -3.404 -1.296 1.00 0.00 C ATOM 969 O VAL A 95 4.914 -3.334 -0.206 1.00 0.00 O ATOM 970 CB VAL A 95 1.908 -4.124 -1.979 1.00 0.00 C ATOM 971 CG1 VAL A 95 1.034 -5.235 -2.589 1.00 0.00 C ATOM 972 CG2 VAL A 95 1.155 -3.444 -0.811 1.00 0.00 C ATOM 0 H VAL A 95 2.471 -5.684 -0.099 1.00 0.00 H new ATOM 0 HA VAL A 95 3.805 -5.019 -2.568 1.00 0.00 H new ATOM 0 HB VAL A 95 2.070 -3.350 -2.729 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.035 -4.846 -2.785 1.00 0.00 H new ATOM 0 HG12 VAL A 95 1.480 -5.577 -3.523 1.00 0.00 H new ATOM 0 HG13 VAL A 95 0.968 -6.070 -1.892 1.00 0.00 H new ATOM 0 HG21 VAL A 95 0.155 -3.161 -1.139 1.00 0.00 H new ATOM 0 HG22 VAL A 95 1.080 -4.138 0.026 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.699 -2.553 -0.497 1.00 0.00 H new ATOM 982 N ILE A 96 4.451 -2.443 -2.234 1.00 0.00 N ATOM 983 CA ILE A 96 5.155 -1.146 -2.017 1.00 0.00 C ATOM 984 C ILE A 96 4.524 -0.311 -0.853 1.00 0.00 C ATOM 985 O ILE A 96 3.298 -0.287 -0.693 1.00 0.00 O ATOM 986 CB ILE A 96 5.277 -0.329 -3.356 1.00 0.00 C ATOM 987 CG1 ILE A 96 3.978 0.244 -4.003 1.00 0.00 C ATOM 988 CG2 ILE A 96 6.155 -1.035 -4.420 1.00 0.00 C ATOM 989 CD1 ILE A 96 3.012 -0.736 -4.691 1.00 0.00 C ATOM 0 H ILE A 96 4.061 -2.538 -3.172 1.00 0.00 H new ATOM 0 HA ILE A 96 6.170 -1.379 -1.695 1.00 0.00 H new ATOM 0 HB ILE A 96 5.782 0.564 -2.988 1.00 0.00 H new ATOM 0 HG12 ILE A 96 3.422 0.768 -3.225 1.00 0.00 H new ATOM 0 HG13 ILE A 96 4.275 0.990 -4.740 1.00 0.00 H new ATOM 0 HG21 ILE A 96 6.200 -0.422 -5.320 1.00 0.00 H new ATOM 0 HG22 ILE A 96 7.162 -1.176 -4.026 1.00 0.00 H new ATOM 0 HG23 ILE A 96 5.722 -2.005 -4.663 1.00 0.00 H new ATOM 0 HD11 ILE A 96 2.159 -0.187 -5.090 1.00 0.00 H new ATOM 0 HD12 ILE A 96 3.529 -1.245 -5.505 1.00 0.00 H new ATOM 0 HD13 ILE A 96 2.663 -1.472 -3.966 1.00 0.00 H new ATOM 1001 N GLN A 97 5.373 0.354 -0.040 1.00 0.00 N ATOM 1002 CA GLN A 97 4.918 1.126 1.161 1.00 0.00 C ATOM 1003 C GLN A 97 3.951 2.319 0.881 1.00 0.00 C ATOM 1004 O GLN A 97 3.063 2.553 1.699 1.00 0.00 O ATOM 1005 CB GLN A 97 6.089 1.643 2.043 1.00 0.00 C ATOM 1006 CG GLN A 97 7.107 0.599 2.548 1.00 0.00 C ATOM 1007 CD GLN A 97 8.248 1.244 3.353 1.00 0.00 C ATOM 1008 OE1 GLN A 97 9.179 1.822 2.792 1.00 0.00 O ATOM 1009 NE2 GLN A 97 8.202 1.165 4.675 1.00 0.00 N ATOM 0 H GLN A 97 6.382 0.378 -0.185 1.00 0.00 H new ATOM 0 HA GLN A 97 4.348 0.369 1.699 1.00 0.00 H new ATOM 0 HB2 GLN A 97 6.633 2.397 1.474 1.00 0.00 H new ATOM 0 HB3 GLN A 97 5.662 2.145 2.911 1.00 0.00 H new ATOM 0 HG2 GLN A 97 6.595 -0.134 3.171 1.00 0.00 H new ATOM 0 HG3 GLN A 97 7.524 0.059 1.698 1.00 0.00 H new ATOM 0 HE21 GLN A 97 7.426 0.684 5.130 1.00 0.00 H new ATOM 0 HE22 GLN A 97 8.942 1.585 5.237 1.00 0.00 H new ATOM 1018 N ALA A 98 4.078 3.037 -0.256 1.00 0.00 N ATOM 1019 CA ALA A 98 3.051 4.012 -0.724 1.00 0.00 C ATOM 1020 C ALA A 98 1.597 3.463 -0.886 1.00 0.00 C ATOM 1021 O ALA A 98 0.647 4.140 -0.481 1.00 0.00 O ATOM 1022 CB ALA A 98 3.550 4.630 -2.043 1.00 0.00 C ATOM 0 H ALA A 98 4.885 2.963 -0.875 1.00 0.00 H new ATOM 0 HA ALA A 98 2.950 4.753 0.069 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.816 5.349 -2.409 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.500 5.137 -1.871 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.688 3.843 -2.784 1.00 0.00 H new ATOM 1028 N LEU A 99 1.437 2.233 -1.424 1.00 0.00 N ATOM 1029 CA LEU A 99 0.141 1.502 -1.455 1.00 0.00 C ATOM 1030 C LEU A 99 -0.376 1.109 -0.028 1.00 0.00 C ATOM 1031 O LEU A 99 -1.485 1.512 0.322 1.00 0.00 O ATOM 1032 CB LEU A 99 0.262 0.272 -2.410 1.00 0.00 C ATOM 1033 CG LEU A 99 -0.979 -0.160 -3.245 1.00 0.00 C ATOM 1034 CD1 LEU A 99 -0.761 -1.567 -3.839 1.00 0.00 C ATOM 1035 CD2 LEU A 99 -2.329 -0.121 -2.502 1.00 0.00 C ATOM 0 H LEU A 99 2.204 1.714 -1.852 1.00 0.00 H new ATOM 0 HA LEU A 99 -0.620 2.175 -1.848 1.00 0.00 H new ATOM 0 HB2 LEU A 99 1.074 0.476 -3.108 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.567 -0.584 -1.808 1.00 0.00 H new ATOM 0 HG LEU A 99 -1.056 0.594 -4.029 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.637 -1.856 -4.420 1.00 0.00 H new ATOM 0 HD12 LEU A 99 0.117 -1.557 -4.485 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -0.609 -2.283 -3.032 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -3.124 -0.440 -3.175 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.291 -0.790 -1.642 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -2.528 0.895 -2.162 1.00 0.00 H new ATOM 1047 N ASP A 100 0.409 0.362 0.786 1.00 0.00 N ATOM 1048 CA ASP A 100 -0.003 -0.077 2.158 1.00 0.00 C ATOM 1049 C ASP A 100 -0.273 1.060 3.212 1.00 0.00 C ATOM 1050 O ASP A 100 -1.245 0.973 3.967 1.00 0.00 O ATOM 1051 CB ASP A 100 1.026 -1.136 2.632 1.00 0.00 C ATOM 1052 CG ASP A 100 0.550 -1.978 3.817 1.00 0.00 C ATOM 1053 OD1 ASP A 100 -0.349 -2.827 3.629 1.00 0.00 O ATOM 1054 OD2 ASP A 100 1.066 -1.779 4.937 1.00 0.00 O ATOM 0 H ASP A 100 1.341 0.044 0.520 1.00 0.00 H new ATOM 0 HA ASP A 100 -1.000 -0.510 2.080 1.00 0.00 H new ATOM 0 HB2 ASP A 100 1.260 -1.799 1.799 1.00 0.00 H new ATOM 0 HB3 ASP A 100 1.952 -0.631 2.907 1.00 0.00 H new ATOM 1059 N LEU A 101 0.540 2.135 3.234 1.00 0.00 N ATOM 1060 CA LEU A 101 0.251 3.373 4.020 1.00 0.00 C ATOM 1061 C LEU A 101 -1.063 4.134 3.634 1.00 0.00 C ATOM 1062 O LEU A 101 -1.721 4.663 4.535 1.00 0.00 O ATOM 1063 CB LEU A 101 1.473 4.335 3.986 1.00 0.00 C ATOM 1064 CG LEU A 101 2.770 3.854 4.702 1.00 0.00 C ATOM 1065 CD1 LEU A 101 3.965 4.741 4.312 1.00 0.00 C ATOM 1066 CD2 LEU A 101 2.626 3.814 6.237 1.00 0.00 C ATOM 0 H LEU A 101 1.415 2.180 2.712 1.00 0.00 H new ATOM 0 HA LEU A 101 0.072 3.020 5.036 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.717 4.537 2.943 1.00 0.00 H new ATOM 0 HB3 LEU A 101 1.171 5.283 4.432 1.00 0.00 H new ATOM 0 HG LEU A 101 2.948 2.832 4.367 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.861 4.389 4.822 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.118 4.692 3.234 1.00 0.00 H new ATOM 0 HD13 LEU A 101 3.763 5.772 4.603 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.561 3.472 6.681 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.393 4.813 6.607 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.823 3.130 6.509 1.00 0.00 H new ATOM 1078 N SER A 102 -1.466 4.162 2.343 1.00 0.00 N ATOM 1079 CA SER A 102 -2.826 4.618 1.931 1.00 0.00 C ATOM 1080 C SER A 102 -4.031 3.647 2.206 1.00 0.00 C ATOM 1081 O SER A 102 -5.166 4.113 2.113 1.00 0.00 O ATOM 1082 CB SER A 102 -2.787 5.087 0.457 1.00 0.00 C ATOM 1083 OG SER A 102 -2.587 4.014 -0.458 1.00 0.00 O ATOM 0 H SER A 102 -0.873 3.875 1.564 1.00 0.00 H new ATOM 0 HA SER A 102 -3.053 5.447 2.601 1.00 0.00 H new ATOM 0 HB2 SER A 102 -3.722 5.594 0.217 1.00 0.00 H new ATOM 0 HB3 SER A 102 -1.987 5.817 0.334 1.00 0.00 H new ATOM 0 HG SER A 102 -2.212 3.244 0.018 1.00 0.00 H new ATOM 1089 N VAL A 103 -3.824 2.356 2.570 1.00 0.00 N ATOM 1090 CA VAL A 103 -4.910 1.390 2.952 1.00 0.00 C ATOM 1091 C VAL A 103 -5.840 1.863 4.132 1.00 0.00 C ATOM 1092 O VAL A 103 -7.052 1.795 3.908 1.00 0.00 O ATOM 1093 CB VAL A 103 -4.347 -0.066 3.148 1.00 0.00 C ATOM 1094 CG1 VAL A 103 -5.332 -1.098 3.746 1.00 0.00 C ATOM 1095 CG2 VAL A 103 -3.815 -0.678 1.832 1.00 0.00 C ATOM 0 H VAL A 103 -2.892 1.943 2.610 1.00 0.00 H new ATOM 0 HA VAL A 103 -5.586 1.366 2.097 1.00 0.00 H new ATOM 0 HB VAL A 103 -3.549 0.103 3.871 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.836 -2.065 3.836 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.656 -0.763 4.732 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -6.199 -1.194 3.093 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -3.438 -1.683 2.024 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -4.622 -0.727 1.101 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -3.009 -0.057 1.442 1.00 0.00 H new ATOM 1105 N PRO A 104 -5.413 2.335 5.346 1.00 0.00 N ATOM 1106 CA PRO A 104 -6.338 2.927 6.360 1.00 0.00 C ATOM 1107 C PRO A 104 -7.283 4.097 5.919 1.00 0.00 C ATOM 1108 O PRO A 104 -8.363 4.237 6.496 1.00 0.00 O ATOM 1109 CB PRO A 104 -5.394 3.309 7.520 1.00 0.00 C ATOM 1110 CG PRO A 104 -3.993 3.360 6.909 1.00 0.00 C ATOM 1111 CD PRO A 104 -4.015 2.299 5.814 1.00 0.00 C ATOM 0 HA PRO A 104 -7.105 2.196 6.615 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -5.670 4.272 7.949 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -5.444 2.575 8.325 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -3.774 4.347 6.501 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -3.227 3.145 7.654 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -3.315 2.532 5.012 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -3.743 1.316 6.199 1.00 0.00 H new ATOM 1119 N LEU A 105 -6.901 4.883 4.892 1.00 0.00 N ATOM 1120 CA LEU A 105 -7.813 5.801 4.162 1.00 0.00 C ATOM 1121 C LEU A 105 -8.061 5.259 2.718 1.00 0.00 C ATOM 1122 O LEU A 105 -7.535 5.802 1.745 1.00 0.00 O ATOM 1123 CB LEU A 105 -7.307 7.276 4.259 1.00 0.00 C ATOM 1124 CG LEU A 105 -5.925 7.709 3.662 1.00 0.00 C ATOM 1125 CD1 LEU A 105 -5.830 9.248 3.593 1.00 0.00 C ATOM 1126 CD2 LEU A 105 -4.695 7.156 4.417 1.00 0.00 C ATOM 0 H LEU A 105 -5.944 4.902 4.539 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.797 5.827 4.630 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -8.065 7.902 3.789 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.290 7.536 5.317 1.00 0.00 H new ATOM 0 HG LEU A 105 -5.895 7.270 2.665 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -4.864 9.535 3.176 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -6.628 9.634 2.959 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -5.930 9.664 4.595 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -3.783 7.507 3.934 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.715 7.504 5.450 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.718 6.066 4.401 1.00 0.00 H new ATOM 1138 N MET A 106 -8.857 4.175 2.573 1.00 0.00 N ATOM 1139 CA MET A 106 -9.129 3.541 1.254 1.00 0.00 C ATOM 1140 C MET A 106 -10.545 2.917 1.294 1.00 0.00 C ATOM 1141 O MET A 106 -10.759 1.874 1.922 1.00 0.00 O ATOM 1142 CB MET A 106 -8.044 2.490 0.896 1.00 0.00 C ATOM 1143 CG MET A 106 -8.061 1.989 -0.558 1.00 0.00 C ATOM 1144 SD MET A 106 -7.747 3.324 -1.740 1.00 0.00 S ATOM 1145 CE MET A 106 -6.028 3.760 -1.402 1.00 0.00 C ATOM 0 H MET A 106 -9.326 3.717 3.354 1.00 0.00 H new ATOM 0 HA MET A 106 -9.091 4.295 0.468 1.00 0.00 H new ATOM 0 HB2 MET A 106 -7.064 2.921 1.102 1.00 0.00 H new ATOM 0 HB3 MET A 106 -8.161 1.633 1.559 1.00 0.00 H new ATOM 0 HG2 MET A 106 -7.308 1.211 -0.682 1.00 0.00 H new ATOM 0 HG3 MET A 106 -9.028 1.534 -0.773 1.00 0.00 H new ATOM 0 HE1 MET A 106 -5.644 4.380 -2.212 1.00 0.00 H new ATOM 0 HE2 MET A 106 -5.970 4.312 -0.464 1.00 0.00 H new ATOM 0 HE3 MET A 106 -5.430 2.852 -1.326 1.00 0.00 H new ATOM 1155 N ASP A 107 -11.494 3.550 0.587 1.00 0.00 N ATOM 1156 CA ASP A 107 -12.884 3.035 0.450 1.00 0.00 C ATOM 1157 C ASP A 107 -13.071 2.098 -0.788 1.00 0.00 C ATOM 1158 O ASP A 107 -12.264 2.060 -1.725 1.00 0.00 O ATOM 1159 CB ASP A 107 -13.856 4.247 0.457 1.00 0.00 C ATOM 1160 CG ASP A 107 -14.078 4.936 1.803 1.00 0.00 C ATOM 1161 OD1 ASP A 107 -13.862 4.316 2.864 1.00 0.00 O ATOM 1162 OD2 ASP A 107 -14.484 6.114 1.828 1.00 0.00 O ATOM 0 H ASP A 107 -11.331 4.428 0.094 1.00 0.00 H new ATOM 0 HA ASP A 107 -13.114 2.391 1.299 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -13.481 4.989 -0.248 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -14.823 3.911 0.082 1.00 0.00 H new ATOM 1167 N VAL A 108 -14.167 1.312 -0.755 1.00 0.00 N ATOM 1168 CA VAL A 108 -14.447 0.259 -1.776 1.00 0.00 C ATOM 1169 C VAL A 108 -15.090 0.957 -3.014 1.00 0.00 C ATOM 1170 O VAL A 108 -16.265 1.336 -2.989 1.00 0.00 O ATOM 1171 CB VAL A 108 -15.321 -0.912 -1.204 1.00 0.00 C ATOM 1172 CG1 VAL A 108 -15.496 -2.079 -2.205 1.00 0.00 C ATOM 1173 CG2 VAL A 108 -14.803 -1.513 0.125 1.00 0.00 C ATOM 0 H VAL A 108 -14.882 1.381 -0.031 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.518 -0.224 -2.079 1.00 0.00 H new ATOM 0 HB VAL A 108 -16.278 -0.425 -1.016 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -16.109 -2.858 -1.752 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -15.983 -1.713 -3.109 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -14.519 -2.489 -2.460 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -15.468 -2.315 0.445 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -13.799 -1.911 -0.023 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -14.776 -0.737 0.890 1.00 0.00 H new ATOM 1183 N GLY A 109 -14.276 1.138 -4.066 1.00 0.00 N ATOM 1184 CA GLY A 109 -14.642 1.951 -5.248 1.00 0.00 C ATOM 1185 C GLY A 109 -14.213 3.433 -5.177 1.00 0.00 C ATOM 1186 O GLY A 109 -15.068 4.313 -5.302 1.00 0.00 O ATOM 0 H GLY A 109 -13.344 0.727 -4.126 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -14.194 1.500 -6.133 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -15.723 1.907 -5.380 1.00 0.00 H new ATOM 1190 N GLU A 110 -12.897 3.694 -5.037 1.00 0.00 N ATOM 1191 CA GLU A 110 -12.306 5.052 -5.191 1.00 0.00 C ATOM 1192 C GLU A 110 -11.147 5.010 -6.238 1.00 0.00 C ATOM 1193 O GLU A 110 -10.177 4.259 -6.078 1.00 0.00 O ATOM 1194 CB GLU A 110 -11.886 5.679 -3.826 1.00 0.00 C ATOM 1195 CG GLU A 110 -10.734 5.026 -3.010 1.00 0.00 C ATOM 1196 CD GLU A 110 -10.139 5.900 -1.916 1.00 0.00 C ATOM 1197 OE1 GLU A 110 -10.670 5.925 -0.789 1.00 0.00 O ATOM 1198 OE2 GLU A 110 -9.095 6.540 -2.161 1.00 0.00 O ATOM 0 H GLU A 110 -12.209 2.974 -4.814 1.00 0.00 H new ATOM 0 HA GLU A 110 -13.074 5.723 -5.577 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -11.607 6.716 -4.014 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -12.770 5.697 -3.188 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -11.107 4.108 -2.557 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -9.938 4.742 -3.699 1.00 0.00 H new ATOM 1205 N THR A 111 -11.240 5.847 -7.290 1.00 0.00 N ATOM 1206 CA THR A 111 -10.117 6.083 -8.244 1.00 0.00 C ATOM 1207 C THR A 111 -9.328 7.301 -7.687 1.00 0.00 C ATOM 1208 O THR A 111 -9.795 8.441 -7.770 1.00 0.00 O ATOM 1209 CB THR A 111 -10.646 6.300 -9.692 1.00 0.00 C ATOM 1210 OG1 THR A 111 -11.408 5.171 -10.107 1.00 0.00 O ATOM 1211 CG2 THR A 111 -9.548 6.522 -10.749 1.00 0.00 C ATOM 0 H THR A 111 -12.083 6.378 -7.509 1.00 0.00 H new ATOM 0 HA THR A 111 -9.457 5.219 -8.320 1.00 0.00 H new ATOM 0 HB THR A 111 -11.244 7.210 -9.637 1.00 0.00 H new ATOM 0 HG1 THR A 111 -11.738 5.316 -11.018 1.00 0.00 H new ATOM 0 HG21 THR A 111 -10.008 6.664 -11.727 1.00 0.00 H new ATOM 0 HG22 THR A 111 -8.967 7.407 -10.489 1.00 0.00 H new ATOM 0 HG23 THR A 111 -8.891 5.652 -10.780 1.00 0.00 H new ATOM 1219 N ALA A 112 -8.166 7.028 -7.069 1.00 0.00 N ATOM 1220 CA ALA A 112 -7.475 8.012 -6.204 1.00 0.00 C ATOM 1221 C ALA A 112 -5.948 7.953 -6.433 1.00 0.00 C ATOM 1222 O ALA A 112 -5.314 6.912 -6.229 1.00 0.00 O ATOM 1223 CB ALA A 112 -7.842 7.703 -4.744 1.00 0.00 C ATOM 0 H ALA A 112 -7.681 6.134 -7.150 1.00 0.00 H new ATOM 0 HA ALA A 112 -7.792 9.026 -6.448 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -7.345 8.415 -4.085 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -8.921 7.782 -4.616 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -7.520 6.692 -4.494 1.00 0.00 H new ATOM 1229 N MET A 113 -5.367 9.093 -6.849 1.00 0.00 N ATOM 1230 CA MET A 113 -3.922 9.195 -7.169 1.00 0.00 C ATOM 1231 C MET A 113 -3.086 9.435 -5.879 1.00 0.00 C ATOM 1232 O MET A 113 -3.490 10.159 -4.962 1.00 0.00 O ATOM 1233 CB MET A 113 -3.740 10.288 -8.256 1.00 0.00 C ATOM 1234 CG MET A 113 -2.334 10.349 -8.880 1.00 0.00 C ATOM 1235 SD MET A 113 -2.365 11.404 -10.347 1.00 0.00 S ATOM 1236 CE MET A 113 -2.588 10.182 -11.659 1.00 0.00 C ATOM 0 H MET A 113 -5.878 9.967 -6.974 1.00 0.00 H new ATOM 0 HA MET A 113 -3.543 8.258 -7.578 1.00 0.00 H new ATOM 0 HB2 MET A 113 -4.467 10.116 -9.049 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.970 11.259 -7.817 1.00 0.00 H new ATOM 0 HG2 MET A 113 -1.620 10.739 -8.155 1.00 0.00 H new ATOM 0 HG3 MET A 113 -2.001 9.346 -9.148 1.00 0.00 H new ATOM 0 HE1 MET A 113 -2.625 10.687 -12.624 1.00 0.00 H new ATOM 0 HE2 MET A 113 -1.754 9.481 -11.649 1.00 0.00 H new ATOM 0 HE3 MET A 113 -3.520 9.640 -11.497 1.00 0.00 H new ATOM 1246 N VAL A 114 -1.915 8.782 -5.841 1.00 0.00 N ATOM 1247 CA VAL A 114 -0.997 8.794 -4.674 1.00 0.00 C ATOM 1248 C VAL A 114 0.364 9.298 -5.241 1.00 0.00 C ATOM 1249 O VAL A 114 1.149 8.520 -5.792 1.00 0.00 O ATOM 1250 CB VAL A 114 -0.930 7.383 -3.981 1.00 0.00 C ATOM 1251 CG1 VAL A 114 -0.020 7.385 -2.733 1.00 0.00 C ATOM 1252 CG2 VAL A 114 -2.306 6.811 -3.559 1.00 0.00 C ATOM 0 H VAL A 114 -1.569 8.224 -6.621 1.00 0.00 H new ATOM 0 HA VAL A 114 -1.334 9.451 -3.872 1.00 0.00 H new ATOM 0 HB VAL A 114 -0.515 6.741 -4.758 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -0.007 6.389 -2.291 1.00 0.00 H new ATOM 0 HG12 VAL A 114 0.993 7.667 -3.021 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -0.403 8.100 -2.005 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -2.167 5.837 -3.090 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -2.781 7.490 -2.851 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -2.940 6.703 -4.439 1.00 0.00 H new ATOM 1262 N THR A 115 0.638 10.611 -5.091 1.00 0.00 N ATOM 1263 CA THR A 115 1.940 11.225 -5.484 1.00 0.00 C ATOM 1264 C THR A 115 2.973 10.980 -4.348 1.00 0.00 C ATOM 1265 O THR A 115 2.898 11.595 -3.280 1.00 0.00 O ATOM 1266 CB THR A 115 1.807 12.736 -5.845 1.00 0.00 C ATOM 1267 OG1 THR A 115 1.089 13.456 -4.844 1.00 0.00 O ATOM 1268 CG2 THR A 115 1.153 12.986 -7.215 1.00 0.00 C ATOM 0 H THR A 115 -0.026 11.278 -4.698 1.00 0.00 H new ATOM 0 HA THR A 115 2.292 10.746 -6.398 1.00 0.00 H new ATOM 0 HB THR A 115 2.832 13.103 -5.897 1.00 0.00 H new ATOM 0 HG1 THR A 115 0.132 13.445 -5.056 1.00 0.00 H new ATOM 0 HG21 THR A 115 1.093 14.059 -7.399 1.00 0.00 H new ATOM 0 HG22 THR A 115 1.752 12.517 -7.995 1.00 0.00 H new ATOM 0 HG23 THR A 115 0.150 12.560 -7.222 1.00 0.00 H new ATOM 1276 N ALA A 116 3.897 10.035 -4.594 1.00 0.00 N ATOM 1277 CA ALA A 116 4.802 9.485 -3.556 1.00 0.00 C ATOM 1278 C ALA A 116 6.253 9.379 -4.084 1.00 0.00 C ATOM 1279 O ALA A 116 6.497 8.944 -5.216 1.00 0.00 O ATOM 1280 CB ALA A 116 4.285 8.101 -3.126 1.00 0.00 C ATOM 0 H ALA A 116 4.042 9.627 -5.518 1.00 0.00 H new ATOM 0 HA ALA A 116 4.812 10.157 -2.698 1.00 0.00 H new ATOM 0 HB1 ALA A 116 4.944 7.688 -2.362 1.00 0.00 H new ATOM 0 HB2 ALA A 116 3.277 8.198 -2.722 1.00 0.00 H new ATOM 0 HB3 ALA A 116 4.267 7.435 -3.989 1.00 0.00 H new ATOM 1286 N ASP A 117 7.214 9.733 -3.210 1.00 0.00 N ATOM 1287 CA ASP A 117 8.673 9.632 -3.496 1.00 0.00 C ATOM 1288 C ASP A 117 9.185 8.169 -3.736 1.00 0.00 C ATOM 1289 O ASP A 117 8.680 7.207 -3.137 1.00 0.00 O ATOM 1290 CB ASP A 117 9.382 10.356 -2.316 1.00 0.00 C ATOM 1291 CG ASP A 117 10.886 10.600 -2.472 1.00 0.00 C ATOM 1292 OD1 ASP A 117 11.356 10.859 -3.600 1.00 0.00 O ATOM 1293 OD2 ASP A 117 11.602 10.537 -1.453 1.00 0.00 O ATOM 0 H ASP A 117 7.008 10.099 -2.280 1.00 0.00 H new ATOM 0 HA ASP A 117 8.908 10.109 -4.448 1.00 0.00 H new ATOM 0 HB2 ASP A 117 8.894 11.318 -2.163 1.00 0.00 H new ATOM 0 HB3 ASP A 117 9.223 9.770 -1.411 1.00 0.00 H new ATOM 1298 N SER A 118 10.234 8.026 -4.576 1.00 0.00 N ATOM 1299 CA SER A 118 11.006 6.752 -4.695 1.00 0.00 C ATOM 1300 C SER A 118 11.874 6.508 -3.419 1.00 0.00 C ATOM 1301 O SER A 118 13.055 6.852 -3.328 1.00 0.00 O ATOM 1302 CB SER A 118 11.832 6.737 -5.998 1.00 0.00 C ATOM 1303 OG SER A 118 10.987 6.705 -7.141 1.00 0.00 O ATOM 0 H SER A 118 10.571 8.772 -5.184 1.00 0.00 H new ATOM 0 HA SER A 118 10.308 5.917 -4.758 1.00 0.00 H new ATOM 0 HB2 SER A 118 12.469 7.620 -6.038 1.00 0.00 H new ATOM 0 HB3 SER A 118 12.490 5.868 -6.005 1.00 0.00 H new ATOM 0 HG SER A 118 10.694 7.615 -7.357 1.00 0.00 H new ATOM 1309 N LYS A 119 11.177 5.968 -2.407 1.00 0.00 N ATOM 1310 CA LYS A 119 11.573 6.004 -0.972 1.00 0.00 C ATOM 1311 C LYS A 119 10.556 5.093 -0.209 1.00 0.00 C ATOM 1312 O LYS A 119 10.924 4.006 0.247 1.00 0.00 O ATOM 1313 CB LYS A 119 11.634 7.473 -0.449 1.00 0.00 C ATOM 1314 CG LYS A 119 12.105 7.664 1.010 1.00 0.00 C ATOM 1315 CD LYS A 119 12.122 9.167 1.378 1.00 0.00 C ATOM 1316 CE LYS A 119 12.623 9.501 2.794 1.00 0.00 C ATOM 1317 NZ LYS A 119 14.105 9.367 2.863 1.00 0.00 N ATOM 0 H LYS A 119 10.295 5.478 -2.559 1.00 0.00 H new ATOM 0 HA LYS A 119 12.580 5.620 -0.810 1.00 0.00 H new ATOM 0 HB2 LYS A 119 12.300 8.040 -1.100 1.00 0.00 H new ATOM 0 HB3 LYS A 119 10.641 7.912 -0.548 1.00 0.00 H new ATOM 0 HG2 LYS A 119 11.442 7.125 1.687 1.00 0.00 H new ATOM 0 HG3 LYS A 119 13.102 7.241 1.136 1.00 0.00 H new ATOM 0 HD2 LYS A 119 12.749 9.692 0.657 1.00 0.00 H new ATOM 0 HD3 LYS A 119 11.112 9.561 1.268 1.00 0.00 H new ATOM 0 HE2 LYS A 119 12.330 10.516 3.061 1.00 0.00 H new ATOM 0 HE3 LYS A 119 12.157 8.834 3.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 14.430 9.595 3.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 14.377 8.391 2.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 14.545 10.021 2.185 1.00 0.00 H new ATOM 1331 N TYR A 120 9.277 5.526 -0.132 1.00 0.00 N ATOM 1332 CA TYR A 120 8.122 4.638 0.186 1.00 0.00 C ATOM 1333 C TYR A 120 7.739 3.708 -1.006 1.00 0.00 C ATOM 1334 O TYR A 120 7.563 2.506 -0.793 1.00 0.00 O ATOM 1335 CB TYR A 120 6.883 5.454 0.670 1.00 0.00 C ATOM 1336 CG TYR A 120 7.117 6.355 1.897 1.00 0.00 C ATOM 1337 CD1 TYR A 120 7.340 5.784 3.157 1.00 0.00 C ATOM 1338 CD2 TYR A 120 7.216 7.740 1.741 1.00 0.00 C ATOM 1339 CE1 TYR A 120 7.692 6.593 4.235 1.00 0.00 C ATOM 1340 CE2 TYR A 120 7.565 8.544 2.822 1.00 0.00 C ATOM 1341 CZ TYR A 120 7.821 7.967 4.065 1.00 0.00 C ATOM 1342 OH TYR A 120 8.240 8.755 5.105 1.00 0.00 O ATOM 0 H TYR A 120 9.011 6.498 -0.287 1.00 0.00 H new ATOM 0 HA TYR A 120 8.447 3.997 1.005 1.00 0.00 H new ATOM 0 HB2 TYR A 120 6.536 6.077 -0.155 1.00 0.00 H new ATOM 0 HB3 TYR A 120 6.079 4.756 0.902 1.00 0.00 H new ATOM 0 HD1 TYR A 120 7.239 4.717 3.292 1.00 0.00 H new ATOM 0 HD2 TYR A 120 7.021 8.188 0.778 1.00 0.00 H new ATOM 0 HE1 TYR A 120 7.865 6.152 5.205 1.00 0.00 H new ATOM 0 HE2 TYR A 120 7.637 9.614 2.698 1.00 0.00 H new ATOM 0 HH TYR A 120 8.276 9.690 4.813 1.00 0.00 H new ATOM 1352 N CYS A 121 7.654 4.233 -2.251 1.00 0.00 N ATOM 1353 CA CYS A 121 7.465 3.407 -3.472 1.00 0.00 C ATOM 1354 C CYS A 121 8.585 2.353 -3.706 1.00 0.00 C ATOM 1355 O CYS A 121 8.262 1.168 -3.812 1.00 0.00 O ATOM 1356 CB CYS A 121 7.284 4.318 -4.705 1.00 0.00 C ATOM 1357 SG CYS A 121 5.887 5.454 -4.468 1.00 0.00 S ATOM 0 H CYS A 121 7.714 5.234 -2.439 1.00 0.00 H new ATOM 0 HA CYS A 121 6.557 2.825 -3.313 1.00 0.00 H new ATOM 0 HB2 CYS A 121 8.197 4.888 -4.879 1.00 0.00 H new ATOM 0 HB3 CYS A 121 7.116 3.708 -5.592 1.00 0.00 H new ATOM 0 HG CYS A 121 6.249 6.660 -4.792 1.00 0.00 H new ATOM 1363 N TYR A 122 9.873 2.758 -3.789 1.00 0.00 N ATOM 1364 CA TYR A 122 10.990 1.819 -4.078 1.00 0.00 C ATOM 1365 C TYR A 122 12.208 2.206 -3.194 1.00 0.00 C ATOM 1366 O TYR A 122 12.377 1.612 -2.124 1.00 0.00 O ATOM 1367 CB TYR A 122 11.283 1.699 -5.608 1.00 0.00 C ATOM 1368 CG TYR A 122 10.141 1.128 -6.474 1.00 0.00 C ATOM 1369 CD1 TYR A 122 9.939 -0.253 -6.567 1.00 0.00 C ATOM 1370 CD2 TYR A 122 9.255 1.995 -7.125 1.00 0.00 C ATOM 1371 CE1 TYR A 122 8.859 -0.758 -7.287 1.00 0.00 C ATOM 1372 CE2 TYR A 122 8.172 1.489 -7.838 1.00 0.00 C ATOM 1373 CZ TYR A 122 7.971 0.113 -7.917 1.00 0.00 C ATOM 1374 OH TYR A 122 6.888 -0.384 -8.592 1.00 0.00 O ATOM 0 H TYR A 122 10.168 3.726 -3.661 1.00 0.00 H new ATOM 0 HA TYR A 122 10.711 0.802 -3.804 1.00 0.00 H new ATOM 0 HB2 TYR A 122 11.540 2.688 -5.987 1.00 0.00 H new ATOM 0 HB3 TYR A 122 12.162 1.069 -5.741 1.00 0.00 H new ATOM 0 HD1 TYR A 122 10.623 -0.931 -6.078 1.00 0.00 H new ATOM 0 HD2 TYR A 122 9.413 3.062 -7.074 1.00 0.00 H new ATOM 0 HE1 TYR A 122 8.709 -1.825 -7.357 1.00 0.00 H new ATOM 0 HE2 TYR A 122 7.487 2.164 -8.330 1.00 0.00 H new ATOM 0 HH TYR A 122 6.371 0.357 -8.971 1.00 0.00 H new ATOM 1384 N GLY A 123 13.045 3.173 -3.621 1.00 0.00 N ATOM 1385 CA GLY A 123 14.282 3.546 -2.897 1.00 0.00 C ATOM 1386 C GLY A 123 15.432 4.074 -3.805 1.00 0.00 C ATOM 1387 O GLY A 123 15.232 4.210 -5.018 1.00 0.00 O ATOM 0 H GLY A 123 12.887 3.715 -4.470 1.00 0.00 H new ATOM 0 HA2 GLY A 123 14.039 4.311 -2.160 1.00 0.00 H new ATOM 0 HA3 GLY A 123 14.641 2.676 -2.347 1.00 0.00 H new ATOM 1391 N PRO A 124 16.658 4.362 -3.270 1.00 0.00 N ATOM 1392 CA PRO A 124 17.806 4.865 -4.072 1.00 0.00 C ATOM 1393 C PRO A 124 18.429 3.763 -4.983 1.00 0.00 C ATOM 1394 O PRO A 124 19.101 2.843 -4.505 1.00 0.00 O ATOM 1395 CB PRO A 124 18.772 5.398 -2.995 1.00 0.00 C ATOM 1396 CG PRO A 124 18.439 4.627 -1.716 1.00 0.00 C ATOM 1397 CD PRO A 124 16.942 4.336 -1.819 1.00 0.00 C ATOM 0 HA PRO A 124 17.526 5.634 -4.791 1.00 0.00 H new ATOM 0 HB2 PRO A 124 19.810 5.239 -3.288 1.00 0.00 H new ATOM 0 HB3 PRO A 124 18.642 6.470 -2.850 1.00 0.00 H new ATOM 0 HG2 PRO A 124 19.018 3.706 -1.646 1.00 0.00 H new ATOM 0 HG3 PRO A 124 18.668 5.215 -0.828 1.00 0.00 H new ATOM 0 HD2 PRO A 124 16.695 3.368 -1.384 1.00 0.00 H new ATOM 0 HD3 PRO A 124 16.355 5.084 -1.286 1.00 0.00 H new ATOM 1405 N GLN A 125 18.137 3.863 -6.296 1.00 0.00 N ATOM 1406 CA GLN A 125 18.476 2.849 -7.329 1.00 0.00 C ATOM 1407 C GLN A 125 17.875 1.443 -7.020 1.00 0.00 C ATOM 1408 O GLN A 125 18.545 0.594 -6.422 1.00 0.00 O ATOM 1409 CB GLN A 125 19.993 2.869 -7.682 1.00 0.00 C ATOM 1410 CG GLN A 125 20.369 2.328 -9.080 1.00 0.00 C ATOM 1411 CD GLN A 125 20.354 0.795 -9.228 1.00 0.00 C ATOM 1412 OE1 GLN A 125 21.162 0.086 -8.627 1.00 0.00 O ATOM 1413 NE2 GLN A 125 19.445 0.253 -10.023 1.00 0.00 N ATOM 0 H GLN A 125 17.647 4.670 -6.682 1.00 0.00 H new ATOM 0 HA GLN A 125 17.975 3.136 -8.254 1.00 0.00 H new ATOM 0 HB2 GLN A 125 20.351 3.896 -7.603 1.00 0.00 H new ATOM 0 HB3 GLN A 125 20.528 2.286 -6.932 1.00 0.00 H new ATOM 0 HG2 GLN A 125 19.681 2.752 -9.811 1.00 0.00 H new ATOM 0 HG3 GLN A 125 21.366 2.690 -9.334 1.00 0.00 H new ATOM 0 HE21 GLN A 125 18.780 0.848 -10.517 1.00 0.00 H new ATOM 0 HE22 GLN A 125 19.410 -0.759 -10.142 1.00 0.00 H new ATOM 1422 N GLY A 126 16.615 1.221 -7.431 1.00 0.00 N ATOM 1423 CA GLY A 126 15.929 -0.077 -7.247 1.00 0.00 C ATOM 1424 C GLY A 126 16.101 -0.992 -8.473 1.00 0.00 C ATOM 1425 O GLY A 126 17.047 -1.785 -8.524 1.00 0.00 O ATOM 0 H GLY A 126 16.044 1.927 -7.896 1.00 0.00 H new ATOM 0 HA2 GLY A 126 16.325 -0.576 -6.363 1.00 0.00 H new ATOM 0 HA3 GLY A 126 14.868 0.095 -7.067 1.00 0.00 H new ATOM 1429 N ARG A 127 15.181 -0.859 -9.441 1.00 0.00 N ATOM 1430 CA ARG A 127 15.190 -1.650 -10.703 1.00 0.00 C ATOM 1431 C ARG A 127 15.239 -0.688 -11.936 1.00 0.00 C ATOM 1432 O ARG A 127 14.217 -0.416 -12.577 1.00 0.00 O ATOM 1433 CB ARG A 127 13.950 -2.589 -10.625 1.00 0.00 C ATOM 1434 CG ARG A 127 13.747 -3.553 -11.819 1.00 0.00 C ATOM 1435 CD ARG A 127 12.422 -4.330 -11.707 1.00 0.00 C ATOM 1436 NE ARG A 127 12.265 -5.227 -12.885 1.00 0.00 N ATOM 1437 CZ ARG A 127 11.171 -5.928 -13.180 1.00 0.00 C ATOM 1438 NH1 ARG A 127 10.063 -5.878 -12.479 1.00 0.00 N ATOM 1439 NH2 ARG A 127 11.202 -6.709 -14.221 1.00 0.00 N ATOM 0 H ARG A 127 14.404 -0.201 -9.380 1.00 0.00 H new ATOM 0 HA ARG A 127 16.075 -2.273 -10.829 1.00 0.00 H new ATOM 0 HB2 ARG A 127 14.027 -3.183 -9.714 1.00 0.00 H new ATOM 0 HB3 ARG A 127 13.058 -1.971 -10.528 1.00 0.00 H new ATOM 0 HG2 ARG A 127 13.759 -2.986 -12.750 1.00 0.00 H new ATOM 0 HG3 ARG A 127 14.578 -4.256 -11.864 1.00 0.00 H new ATOM 0 HD2 ARG A 127 12.409 -4.916 -10.788 1.00 0.00 H new ATOM 0 HD3 ARG A 127 11.585 -3.634 -11.653 1.00 0.00 H new ATOM 0 HE ARG A 127 13.060 -5.312 -13.518 1.00 0.00 H new ATOM 0 HH11 ARG A 127 10.007 -5.277 -11.657 1.00 0.00 H new ATOM 0 HH12 ARG A 127 9.258 -6.440 -12.757 1.00 0.00 H new ATOM 0 HH21 ARG A 127 12.049 -6.772 -14.786 1.00 0.00 H new ATOM 0 HH22 ARG A 127 10.380 -7.258 -14.471 1.00 0.00 H new ATOM 1453 N SER A 128 16.450 -0.207 -12.278 1.00 0.00 N ATOM 1454 CA SER A 128 16.678 0.668 -13.465 1.00 0.00 C ATOM 1455 C SER A 128 16.594 -0.111 -14.827 1.00 0.00 C ATOM 1456 O SER A 128 16.998 -1.282 -14.847 1.00 0.00 O ATOM 1457 CB SER A 128 18.035 1.394 -13.304 1.00 0.00 C ATOM 1458 OG SER A 128 19.140 0.494 -13.317 1.00 0.00 O ATOM 0 H SER A 128 17.299 -0.407 -11.749 1.00 0.00 H new ATOM 0 HA SER A 128 15.874 1.403 -13.504 1.00 0.00 H new ATOM 0 HB2 SER A 128 18.153 2.120 -14.108 1.00 0.00 H new ATOM 0 HB3 SER A 128 18.036 1.952 -12.368 1.00 0.00 H new ATOM 0 HG SER A 128 19.974 0.998 -13.214 1.00 0.00 H new ATOM 1464 N PRO A 129 16.090 0.450 -15.969 1.00 0.00 N ATOM 1465 CA PRO A 129 15.752 1.897 -16.135 1.00 0.00 C ATOM 1466 C PRO A 129 14.382 2.432 -15.604 1.00 0.00 C ATOM 1467 O PRO A 129 14.242 3.652 -15.478 1.00 0.00 O ATOM 1468 CB PRO A 129 15.861 2.063 -17.666 1.00 0.00 C ATOM 1469 CG PRO A 129 15.466 0.706 -18.248 1.00 0.00 C ATOM 1470 CD PRO A 129 16.032 -0.297 -17.244 1.00 0.00 C ATOM 0 HA PRO A 129 16.419 2.493 -15.512 1.00 0.00 H new ATOM 0 HB2 PRO A 129 15.200 2.852 -18.024 1.00 0.00 H new ATOM 0 HB3 PRO A 129 16.874 2.338 -17.961 1.00 0.00 H new ATOM 0 HG2 PRO A 129 14.384 0.611 -18.343 1.00 0.00 H new ATOM 0 HG3 PRO A 129 15.888 0.559 -19.242 1.00 0.00 H new ATOM 0 HD2 PRO A 129 15.395 -1.177 -17.160 1.00 0.00 H new ATOM 0 HD3 PRO A 129 17.020 -0.646 -17.545 1.00 0.00 H new ATOM 1478 N TYR A 130 13.392 1.565 -15.310 1.00 0.00 N ATOM 1479 CA TYR A 130 12.019 1.989 -14.903 1.00 0.00 C ATOM 1480 C TYR A 130 11.912 2.769 -13.556 1.00 0.00 C ATOM 1481 O TYR A 130 11.165 3.748 -13.492 1.00 0.00 O ATOM 1482 CB TYR A 130 11.063 0.759 -14.890 1.00 0.00 C ATOM 1483 CG TYR A 130 10.785 0.101 -16.255 1.00 0.00 C ATOM 1484 CD1 TYR A 130 9.976 0.746 -17.199 1.00 0.00 C ATOM 1485 CD2 TYR A 130 11.335 -1.148 -16.562 1.00 0.00 C ATOM 1486 CE1 TYR A 130 9.716 0.146 -18.427 1.00 0.00 C ATOM 1487 CE2 TYR A 130 11.077 -1.745 -17.793 1.00 0.00 C ATOM 1488 CZ TYR A 130 10.264 -1.100 -18.724 1.00 0.00 C ATOM 1489 OH TYR A 130 10.005 -1.690 -19.933 1.00 0.00 O ATOM 0 H TYR A 130 13.512 0.553 -15.345 1.00 0.00 H new ATOM 0 HA TYR A 130 11.719 2.714 -15.660 1.00 0.00 H new ATOM 0 HB2 TYR A 130 11.484 0.005 -14.225 1.00 0.00 H new ATOM 0 HB3 TYR A 130 10.111 1.069 -14.459 1.00 0.00 H new ATOM 0 HD1 TYR A 130 9.552 1.713 -16.973 1.00 0.00 H new ATOM 0 HD2 TYR A 130 11.962 -1.651 -15.841 1.00 0.00 H new ATOM 0 HE1 TYR A 130 9.089 0.646 -19.150 1.00 0.00 H new ATOM 0 HE2 TYR A 130 11.507 -2.708 -18.027 1.00 0.00 H new ATOM 0 HH TYR A 130 10.464 -2.555 -19.980 1.00 0.00 H new ATOM 1499 N ILE A 131 12.631 2.338 -12.502 1.00 0.00 N ATOM 1500 CA ILE A 131 12.526 2.919 -11.137 1.00 0.00 C ATOM 1501 C ILE A 131 13.604 4.058 -11.021 1.00 0.00 C ATOM 1502 O ILE A 131 14.795 3.727 -11.080 1.00 0.00 O ATOM 1503 CB ILE A 131 12.669 1.774 -10.065 1.00 0.00 C ATOM 1504 CG1 ILE A 131 11.424 0.843 -9.915 1.00 0.00 C ATOM 1505 CG2 ILE A 131 13.005 2.293 -8.643 1.00 0.00 C ATOM 1506 CD1 ILE A 131 10.970 0.022 -11.127 1.00 0.00 C ATOM 0 H ILE A 131 13.305 1.575 -12.567 1.00 0.00 H new ATOM 0 HA ILE A 131 11.552 3.371 -10.949 1.00 0.00 H new ATOM 0 HB ILE A 131 13.499 1.199 -10.476 1.00 0.00 H new ATOM 0 HG12 ILE A 131 11.628 0.147 -9.101 1.00 0.00 H new ATOM 0 HG13 ILE A 131 10.584 1.462 -9.602 1.00 0.00 H new ATOM 0 HG21 ILE A 131 13.088 1.449 -7.958 1.00 0.00 H new ATOM 0 HG22 ILE A 131 13.950 2.835 -8.668 1.00 0.00 H new ATOM 0 HG23 ILE A 131 12.213 2.960 -8.303 1.00 0.00 H new ATOM 0 HD11 ILE A 131 10.095 -0.570 -10.858 1.00 0.00 H new ATOM 0 HD12 ILE A 131 10.716 0.694 -11.947 1.00 0.00 H new ATOM 0 HD13 ILE A 131 11.776 -0.642 -11.439 1.00 0.00 H new ATOM 1518 N PRO A 132 13.264 5.363 -10.790 1.00 0.00 N ATOM 1519 CA PRO A 132 14.270 6.418 -10.487 1.00 0.00 C ATOM 1520 C PRO A 132 14.793 6.400 -9.000 1.00 0.00 C ATOM 1521 O PRO A 132 14.139 5.787 -8.148 1.00 0.00 O ATOM 1522 CB PRO A 132 13.479 7.693 -10.835 1.00 0.00 C ATOM 1523 CG PRO A 132 12.020 7.370 -10.512 1.00 0.00 C ATOM 1524 CD PRO A 132 11.880 5.882 -10.836 1.00 0.00 C ATOM 0 HA PRO A 132 15.200 6.301 -11.044 1.00 0.00 H new ATOM 0 HB2 PRO A 132 13.831 8.544 -10.252 1.00 0.00 H new ATOM 0 HB3 PRO A 132 13.599 7.955 -11.886 1.00 0.00 H new ATOM 0 HG2 PRO A 132 11.790 7.572 -9.466 1.00 0.00 H new ATOM 0 HG3 PRO A 132 11.337 7.973 -11.111 1.00 0.00 H new ATOM 0 HD2 PRO A 132 11.242 5.376 -10.112 1.00 0.00 H new ATOM 0 HD3 PRO A 132 11.431 5.730 -11.818 1.00 0.00 H new ATOM 1532 N PRO A 133 15.934 7.057 -8.631 1.00 0.00 N ATOM 1533 CA PRO A 133 16.488 7.012 -7.249 1.00 0.00 C ATOM 1534 C PRO A 133 15.647 7.751 -6.165 1.00 0.00 C ATOM 1535 O PRO A 133 15.118 7.092 -5.269 1.00 0.00 O ATOM 1536 CB PRO A 133 17.940 7.498 -7.438 1.00 0.00 C ATOM 1537 CG PRO A 133 17.912 8.371 -8.694 1.00 0.00 C ATOM 1538 CD PRO A 133 16.837 7.738 -9.581 1.00 0.00 C ATOM 0 HA PRO A 133 16.452 6.012 -6.816 1.00 0.00 H new ATOM 0 HB2 PRO A 133 18.281 8.065 -6.572 1.00 0.00 H new ATOM 0 HB3 PRO A 133 18.624 6.658 -7.558 1.00 0.00 H new ATOM 0 HG2 PRO A 133 17.668 9.405 -8.452 1.00 0.00 H new ATOM 0 HG3 PRO A 133 18.882 8.380 -9.192 1.00 0.00 H new ATOM 0 HD2 PRO A 133 16.307 8.492 -10.163 1.00 0.00 H new ATOM 0 HD3 PRO A 133 17.271 7.034 -10.291 1.00 0.00 H new ATOM 1546 N HIS A 134 15.510 9.085 -6.259 1.00 0.00 N ATOM 1547 CA HIS A 134 14.561 9.870 -5.424 1.00 0.00 C ATOM 1548 C HIS A 134 13.865 10.876 -6.376 1.00 0.00 C ATOM 1549 O HIS A 134 14.377 11.969 -6.643 1.00 0.00 O ATOM 1550 CB HIS A 134 15.257 10.569 -4.221 1.00 0.00 C ATOM 1551 CG HIS A 134 15.520 9.655 -3.020 1.00 0.00 C ATOM 1552 ND1 HIS A 134 14.642 9.495 -1.964 1.00 0.00 N ATOM 1553 CD2 HIS A 134 16.653 8.847 -2.823 1.00 0.00 C ATOM 1554 CE1 HIS A 134 15.334 8.583 -1.216 1.00 0.00 C ATOM 1555 NE2 HIS A 134 16.556 8.126 -1.640 1.00 0.00 N ATOM 0 H HIS A 134 16.048 9.655 -6.911 1.00 0.00 H new ATOM 0 HA HIS A 134 13.827 9.211 -4.960 1.00 0.00 H new ATOM 0 HB2 HIS A 134 16.206 10.986 -4.559 1.00 0.00 H new ATOM 0 HB3 HIS A 134 14.639 11.406 -3.896 1.00 0.00 H new ATOM 0 HD1 HIS A 134 13.737 9.932 -1.792 1.00 0.00 H new ATOM 0 HD2 HIS A 134 17.490 8.794 -3.503 1.00 0.00 H new ATOM 0 HE1 HIS A 134 14.917 8.221 -0.288 1.00 0.00 H new ATOM 1563 N ALA A 135 12.689 10.473 -6.892 1.00 0.00 N ATOM 1564 CA ALA A 135 11.849 11.317 -7.775 1.00 0.00 C ATOM 1565 C ALA A 135 10.378 10.873 -7.590 1.00 0.00 C ATOM 1566 O ALA A 135 10.047 9.689 -7.739 1.00 0.00 O ATOM 1567 CB ALA A 135 12.274 11.199 -9.252 1.00 0.00 C ATOM 0 H ALA A 135 12.290 9.552 -6.711 1.00 0.00 H new ATOM 0 HA ALA A 135 11.971 12.365 -7.502 1.00 0.00 H new ATOM 0 HB1 ALA A 135 11.634 11.832 -9.866 1.00 0.00 H new ATOM 0 HB2 ALA A 135 13.311 11.518 -9.359 1.00 0.00 H new ATOM 0 HB3 ALA A 135 12.178 10.163 -9.577 1.00 0.00 H new ATOM 1573 N ALA A 136 9.502 11.840 -7.262 1.00 0.00 N ATOM 1574 CA ALA A 136 8.093 11.552 -6.905 1.00 0.00 C ATOM 1575 C ALA A 136 7.199 11.343 -8.153 1.00 0.00 C ATOM 1576 O ALA A 136 6.886 12.285 -8.890 1.00 0.00 O ATOM 1577 CB ALA A 136 7.566 12.658 -5.976 1.00 0.00 C ATOM 0 H ALA A 136 9.742 12.831 -7.236 1.00 0.00 H new ATOM 0 HA ALA A 136 8.055 10.605 -6.367 1.00 0.00 H new ATOM 0 HB1 ALA A 136 6.529 12.448 -5.712 1.00 0.00 H new ATOM 0 HB2 ALA A 136 8.171 12.692 -5.070 1.00 0.00 H new ATOM 0 HB3 ALA A 136 7.623 13.620 -6.486 1.00 0.00 H new ATOM 1583 N LEU A 137 6.811 10.075 -8.355 1.00 0.00 N ATOM 1584 CA LEU A 137 5.899 9.647 -9.441 1.00 0.00 C ATOM 1585 C LEU A 137 4.413 9.620 -8.970 1.00 0.00 C ATOM 1586 O LEU A 137 4.107 9.512 -7.777 1.00 0.00 O ATOM 1587 CB LEU A 137 6.400 8.310 -10.075 1.00 0.00 C ATOM 1588 CG LEU A 137 6.642 7.002 -9.261 1.00 0.00 C ATOM 1589 CD1 LEU A 137 7.965 6.989 -8.468 1.00 0.00 C ATOM 1590 CD2 LEU A 137 5.467 6.560 -8.372 1.00 0.00 C ATOM 0 H LEU A 137 7.122 9.304 -7.765 1.00 0.00 H new ATOM 0 HA LEU A 137 5.920 10.388 -10.240 1.00 0.00 H new ATOM 0 HB2 LEU A 137 5.684 8.055 -10.857 1.00 0.00 H new ATOM 0 HB3 LEU A 137 7.343 8.541 -10.570 1.00 0.00 H new ATOM 0 HG LEU A 137 6.727 6.252 -10.048 1.00 0.00 H new ATOM 0 HD11 LEU A 137 8.057 6.046 -7.930 1.00 0.00 H new ATOM 0 HD12 LEU A 137 8.803 7.097 -9.157 1.00 0.00 H new ATOM 0 HD13 LEU A 137 7.971 7.815 -7.756 1.00 0.00 H new ATOM 0 HD21 LEU A 137 5.733 5.642 -7.848 1.00 0.00 H new ATOM 0 HD22 LEU A 137 5.246 7.342 -7.646 1.00 0.00 H new ATOM 0 HD23 LEU A 137 4.588 6.382 -8.992 1.00 0.00 H new ATOM 1602 N CYS A 138 3.494 9.704 -9.946 1.00 0.00 N ATOM 1603 CA CYS A 138 2.032 9.649 -9.702 1.00 0.00 C ATOM 1604 C CYS A 138 1.504 8.213 -9.952 1.00 0.00 C ATOM 1605 O CYS A 138 1.377 7.786 -11.103 1.00 0.00 O ATOM 1606 CB CYS A 138 1.337 10.707 -10.587 1.00 0.00 C ATOM 1607 SG CYS A 138 1.662 10.467 -12.371 1.00 0.00 S ATOM 0 H CYS A 138 3.738 9.812 -10.930 1.00 0.00 H new ATOM 0 HA CYS A 138 1.806 9.885 -8.662 1.00 0.00 H new ATOM 0 HB2 CYS A 138 0.262 10.671 -10.411 1.00 0.00 H new ATOM 0 HB3 CYS A 138 1.676 11.700 -10.291 1.00 0.00 H new ATOM 0 HG CYS A 138 2.615 9.597 -12.525 1.00 0.00 H new ATOM 1613 N LEU A 139 1.208 7.469 -8.866 1.00 0.00 N ATOM 1614 CA LEU A 139 0.661 6.087 -8.963 1.00 0.00 C ATOM 1615 C LEU A 139 -0.855 6.094 -8.633 1.00 0.00 C ATOM 1616 O LEU A 139 -1.253 6.433 -7.516 1.00 0.00 O ATOM 1617 CB LEU A 139 1.519 5.054 -8.172 1.00 0.00 C ATOM 1618 CG LEU A 139 1.493 5.045 -6.614 1.00 0.00 C ATOM 1619 CD1 LEU A 139 0.475 4.032 -6.048 1.00 0.00 C ATOM 1620 CD2 LEU A 139 2.883 4.751 -6.017 1.00 0.00 C ATOM 0 H LEU A 139 1.336 7.797 -7.909 1.00 0.00 H new ATOM 0 HA LEU A 139 0.739 5.734 -9.991 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.219 4.061 -8.506 1.00 0.00 H new ATOM 0 HB3 LEU A 139 2.556 5.193 -8.477 1.00 0.00 H new ATOM 0 HG LEU A 139 1.184 6.048 -6.321 1.00 0.00 H new ATOM 0 HD11 LEU A 139 0.496 4.065 -4.959 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -0.525 4.286 -6.399 1.00 0.00 H new ATOM 0 HD13 LEU A 139 0.734 3.029 -6.386 1.00 0.00 H new ATOM 0 HD21 LEU A 139 2.820 4.754 -4.929 1.00 0.00 H new ATOM 0 HD22 LEU A 139 3.226 3.774 -6.358 1.00 0.00 H new ATOM 0 HD23 LEU A 139 3.588 5.517 -6.342 1.00 0.00 H new ATOM 1632 N GLU A 140 -1.693 5.686 -9.604 1.00 0.00 N ATOM 1633 CA GLU A 140 -3.149 5.453 -9.375 1.00 0.00 C ATOM 1634 C GLU A 140 -3.416 4.245 -8.413 1.00 0.00 C ATOM 1635 O GLU A 140 -2.641 3.284 -8.359 1.00 0.00 O ATOM 1636 CB GLU A 140 -3.816 5.281 -10.769 1.00 0.00 C ATOM 1637 CG GLU A 140 -5.369 5.281 -10.778 1.00 0.00 C ATOM 1638 CD GLU A 140 -5.983 5.134 -12.161 1.00 0.00 C ATOM 1639 OE1 GLU A 140 -6.161 3.984 -12.616 1.00 0.00 O ATOM 1640 OE2 GLU A 140 -6.299 6.164 -12.789 1.00 0.00 O ATOM 0 H GLU A 140 -1.394 5.507 -10.563 1.00 0.00 H new ATOM 0 HA GLU A 140 -3.592 6.307 -8.862 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.467 6.083 -11.419 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -3.469 4.344 -11.204 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -5.725 4.467 -10.146 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -5.724 6.210 -10.332 1.00 0.00 H new ATOM 1647 N VAL A 141 -4.511 4.322 -7.641 1.00 0.00 N ATOM 1648 CA VAL A 141 -5.002 3.182 -6.819 1.00 0.00 C ATOM 1649 C VAL A 141 -6.540 3.172 -7.054 1.00 0.00 C ATOM 1650 O VAL A 141 -7.276 3.953 -6.439 1.00 0.00 O ATOM 1651 CB VAL A 141 -4.606 3.271 -5.302 1.00 0.00 C ATOM 1652 CG1 VAL A 141 -5.080 2.031 -4.510 1.00 0.00 C ATOM 1653 CG2 VAL A 141 -3.088 3.427 -5.047 1.00 0.00 C ATOM 0 H VAL A 141 -5.083 5.163 -7.562 1.00 0.00 H new ATOM 0 HA VAL A 141 -4.535 2.245 -7.121 1.00 0.00 H new ATOM 0 HB VAL A 141 -5.109 4.174 -4.958 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -4.786 2.132 -3.465 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -6.165 1.950 -4.576 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -4.624 1.135 -4.930 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -2.903 3.481 -3.974 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -2.559 2.570 -5.464 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -2.731 4.340 -5.523 1.00 0.00 H new ATOM 1663 N THR A 142 -7.002 2.274 -7.942 1.00 0.00 N ATOM 1664 CA THR A 142 -8.448 2.084 -8.235 1.00 0.00 C ATOM 1665 C THR A 142 -8.889 0.801 -7.483 1.00 0.00 C ATOM 1666 O THR A 142 -8.507 -0.301 -7.882 1.00 0.00 O ATOM 1667 CB THR A 142 -8.684 2.018 -9.773 1.00 0.00 C ATOM 1668 OG1 THR A 142 -8.248 3.228 -10.383 1.00 0.00 O ATOM 1669 CG2 THR A 142 -10.152 1.805 -10.185 1.00 0.00 C ATOM 0 H THR A 142 -6.392 1.658 -8.479 1.00 0.00 H new ATOM 0 HA THR A 142 -9.054 2.922 -7.890 1.00 0.00 H new ATOM 0 HB THR A 142 -8.114 1.151 -10.108 1.00 0.00 H new ATOM 0 HG1 THR A 142 -7.573 3.026 -11.065 1.00 0.00 H new ATOM 0 HG21 THR A 142 -10.224 1.772 -11.272 1.00 0.00 H new ATOM 0 HG22 THR A 142 -10.514 0.865 -9.768 1.00 0.00 H new ATOM 0 HG23 THR A 142 -10.759 2.627 -9.807 1.00 0.00 H new ATOM 1677 N LEU A 143 -9.700 0.944 -6.415 1.00 0.00 N ATOM 1678 CA LEU A 143 -10.153 -0.214 -5.595 1.00 0.00 C ATOM 1679 C LEU A 143 -11.307 -0.954 -6.332 1.00 0.00 C ATOM 1680 O LEU A 143 -12.448 -0.484 -6.364 1.00 0.00 O ATOM 1681 CB LEU A 143 -10.526 0.261 -4.158 1.00 0.00 C ATOM 1682 CG LEU A 143 -10.564 -0.788 -3.006 1.00 0.00 C ATOM 1683 CD1 LEU A 143 -11.520 -1.979 -3.226 1.00 0.00 C ATOM 1684 CD2 LEU A 143 -9.166 -1.303 -2.613 1.00 0.00 C ATOM 0 H LEU A 143 -10.057 1.844 -6.095 1.00 0.00 H new ATOM 0 HA LEU A 143 -9.347 -0.937 -5.473 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -9.817 1.038 -3.873 1.00 0.00 H new ATOM 0 HB3 LEU A 143 -11.509 0.730 -4.210 1.00 0.00 H new ATOM 0 HG LEU A 143 -10.977 -0.215 -2.176 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -11.471 -2.649 -2.367 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -12.539 -1.611 -3.341 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -11.226 -2.520 -4.125 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -9.260 -2.030 -1.806 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -8.697 -1.776 -3.476 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -8.551 -0.467 -2.279 1.00 0.00 H new ATOM 1696 N LYS A 144 -10.976 -2.116 -6.926 1.00 0.00 N ATOM 1697 CA LYS A 144 -11.944 -2.931 -7.712 1.00 0.00 C ATOM 1698 C LYS A 144 -12.873 -3.822 -6.826 1.00 0.00 C ATOM 1699 O LYS A 144 -14.096 -3.698 -6.937 1.00 0.00 O ATOM 1700 CB LYS A 144 -11.207 -3.754 -8.811 1.00 0.00 C ATOM 1701 CG LYS A 144 -10.451 -2.928 -9.885 1.00 0.00 C ATOM 1702 CD LYS A 144 -10.102 -3.701 -11.176 1.00 0.00 C ATOM 1703 CE LYS A 144 -9.073 -4.839 -11.012 1.00 0.00 C ATOM 1704 NZ LYS A 144 -8.763 -5.412 -12.350 1.00 0.00 N ATOM 0 H LYS A 144 -10.041 -2.520 -6.880 1.00 0.00 H new ATOM 0 HA LYS A 144 -12.616 -2.230 -8.207 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -10.494 -4.418 -8.323 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -11.938 -4.386 -9.315 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -11.058 -2.063 -10.150 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -9.528 -2.548 -9.446 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -11.020 -4.121 -11.586 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -9.720 -2.992 -11.911 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -8.164 -4.459 -10.546 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -9.470 -5.613 -10.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -9.028 -6.417 -12.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -9.299 -4.900 -13.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -7.745 -5.320 -12.540 1.00 0.00 H new ATOM 1718 N THR A 145 -12.301 -4.725 -6.001 1.00 0.00 N ATOM 1719 CA THR A 145 -13.081 -5.696 -5.186 1.00 0.00 C ATOM 1720 C THR A 145 -12.475 -5.784 -3.756 1.00 0.00 C ATOM 1721 O THR A 145 -11.262 -5.942 -3.590 1.00 0.00 O ATOM 1722 CB THR A 145 -13.143 -7.114 -5.835 1.00 0.00 C ATOM 1723 OG1 THR A 145 -11.839 -7.648 -6.049 1.00 0.00 O ATOM 1724 CG2 THR A 145 -13.927 -7.191 -7.157 1.00 0.00 C ATOM 0 H THR A 145 -11.292 -4.806 -5.878 1.00 0.00 H new ATOM 0 HA THR A 145 -14.106 -5.329 -5.134 1.00 0.00 H new ATOM 0 HB THR A 145 -13.691 -7.710 -5.105 1.00 0.00 H new ATOM 0 HG1 THR A 145 -11.912 -8.537 -6.455 1.00 0.00 H new ATOM 0 HG21 THR A 145 -13.913 -8.215 -7.529 1.00 0.00 H new ATOM 0 HG22 THR A 145 -14.958 -6.881 -6.987 1.00 0.00 H new ATOM 0 HG23 THR A 145 -13.466 -6.532 -7.892 1.00 0.00 H new ATOM 1732 N ALA A 146 -13.354 -5.744 -2.738 1.00 0.00 N ATOM 1733 CA ALA A 146 -12.998 -6.095 -1.338 1.00 0.00 C ATOM 1734 C ALA A 146 -13.826 -7.344 -0.947 1.00 0.00 C ATOM 1735 O ALA A 146 -14.998 -7.235 -0.570 1.00 0.00 O ATOM 1736 CB ALA A 146 -13.278 -4.898 -0.412 1.00 0.00 C ATOM 0 H ALA A 146 -14.329 -5.469 -2.855 1.00 0.00 H new ATOM 0 HA ALA A 146 -11.937 -6.325 -1.241 1.00 0.00 H new ATOM 0 HB1 ALA A 146 -13.015 -5.161 0.613 1.00 0.00 H new ATOM 0 HB2 ALA A 146 -12.681 -4.043 -0.731 1.00 0.00 H new ATOM 0 HB3 ALA A 146 -14.336 -4.640 -0.460 1.00 0.00 H new ATOM 1742 N VAL A 147 -13.216 -8.532 -1.106 1.00 0.00 N ATOM 1743 CA VAL A 147 -13.944 -9.833 -1.055 1.00 0.00 C ATOM 1744 C VAL A 147 -13.219 -10.782 -0.064 1.00 0.00 C ATOM 1745 O VAL A 147 -12.027 -11.078 -0.212 1.00 0.00 O ATOM 1746 CB VAL A 147 -14.158 -10.486 -2.468 1.00 0.00 C ATOM 1747 CG1 VAL A 147 -15.268 -9.767 -3.267 1.00 0.00 C ATOM 1748 CG2 VAL A 147 -12.891 -10.643 -3.343 1.00 0.00 C ATOM 0 H VAL A 147 -12.214 -8.628 -1.272 1.00 0.00 H new ATOM 0 HA VAL A 147 -14.954 -9.642 -0.691 1.00 0.00 H new ATOM 0 HB VAL A 147 -14.467 -11.504 -2.229 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -15.386 -10.247 -4.238 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -16.207 -9.824 -2.717 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -14.994 -8.722 -3.410 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -13.160 -11.104 -4.293 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -12.452 -9.662 -3.527 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -12.167 -11.273 -2.826 1.00 0.00 H new ATOM 1758 N ASP A 148 -13.975 -11.272 0.933 1.00 0.00 N ATOM 1759 CA ASP A 148 -13.459 -12.208 1.966 1.00 0.00 C ATOM 1760 C ASP A 148 -13.530 -13.683 1.450 1.00 0.00 C ATOM 1761 O ASP A 148 -14.613 -14.221 1.181 1.00 0.00 O ATOM 1762 CB ASP A 148 -14.267 -11.953 3.267 1.00 0.00 C ATOM 1763 CG ASP A 148 -13.648 -12.517 4.548 1.00 0.00 C ATOM 1764 OD1 ASP A 148 -13.097 -13.639 4.526 1.00 0.00 O ATOM 1765 OD2 ASP A 148 -13.709 -11.828 5.589 1.00 0.00 O ATOM 0 H ASP A 148 -14.960 -11.036 1.052 1.00 0.00 H new ATOM 0 HA ASP A 148 -12.405 -12.036 2.182 1.00 0.00 H new ATOM 0 HB2 ASP A 148 -14.396 -10.878 3.389 1.00 0.00 H new ATOM 0 HB3 ASP A 148 -15.262 -12.381 3.146 1.00 0.00 H new ATOM 1770 N GLY A 149 -12.350 -14.300 1.290 1.00 0.00 N ATOM 1771 CA GLY A 149 -12.240 -15.680 0.771 1.00 0.00 C ATOM 1772 C GLY A 149 -10.808 -16.287 0.847 1.00 0.00 C ATOM 1773 O GLY A 149 -9.915 -15.661 1.430 1.00 0.00 O ATOM 0 H GLY A 149 -11.453 -13.867 1.512 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -12.922 -16.320 1.330 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -12.571 -15.691 -0.267 1.00 0.00 H new