USER MOD reduce.3.24.130724 H: found=0, std=0, add=1295, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1299 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 77 LYS NZ :NH3+ 149:sc= 0.221 (180deg=0) USER MOD Set 1.2: B 42 ASN :FLIP amide:sc= -1.9! C(o=-3.8!,f=-1.7!) USER MOD Set 2.1: A 60 ASN :FLIP amide:sc= -0.389 F(o=-10!,f=-0.39) USER MOD Set 2.2: A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 13 LYS NZ :NH3+ 150:sc= -0.954 (180deg=-1.58) USER MOD Single : A 21 LYS NZ :NH3+ -159:sc= -0.191 (180deg=-1.18) USER MOD Single : A 26 CYS SG : rot 180:sc= -0.217 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -51:sc= 0.75 USER MOD Single : A 41 GLN : amide:sc= -0.0379 K(o=-0.038,f=-1.8!) USER MOD Single : A 42 ASN : amide:sc= -0.129 X(o=-0.13,f=-0.13) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.0683 X(o=-0.068,f=-0.2) USER MOD Single : A 51 MET CE :methyl -118:sc=-0.000269 (180deg=-0.0237) USER MOD Single : A 53 SER OG : rot -12:sc= 0.168 USER MOD Single : A 70 SER OG : rot 81:sc= 0.282 USER MOD Single : A 72 MET CE :methyl 177:sc= -3.18 (180deg=-3.3) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 165:sc= -0.0102 (180deg=-0.356) USER MOD Single : A 79 THR OG1 : rot 68:sc= 0.458 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.012) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc=-0.00348 K(o=-0.0035,f=-0.55) USER MOD Single : A 97 ASN :FLIP amide:sc= -0.49 F(o=-9.5!,f=-0.49) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 81:sc= 0.598 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= -0.768 K(o=-0.77,f=-1.6) USER MOD Single : A 109 MET CE :methyl -178:sc= -0.0472 (180deg=-0.0508) USER MOD Single : A 111 ASN : amide:sc= -0.29 X(o=-0.29,f=-0.36) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.315 USER MOD Single : A 123 GLN : amide:sc=-9.65e-05 K(o=-9.6e-05,f=-1.6!) USER MOD Single : A 124 MET CE :methyl -157:sc= -0.539 (180deg=-1.33) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 137 ASN : amide:sc= -0.977 K(o=-0.98,f=-5.2!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ -150:sc= -0.245 (180deg=-1.38!) USER MOD Single : A 144 MET CE :methyl 147:sc=-0.00663 (180deg=-1.15) USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 21 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : B 25 SER OG : rot 180:sc=-0.00801 USER MOD Single : B 26 SER OG : rot -55:sc= 0.978 USER MOD Single : B 28 SER OG : rot -31:sc= -0.463 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 ASN :FLIP amide:sc=-0.00811 F(o=-1.5!,f=-0.0081) USER MOD Single : B 39 MET CE :methyl 165:sc= 0 (180deg=-0.178) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 63 N SER A 5 -2.994 -15.779 3.473 1.00 0.00 N ATOM 64 CA SER A 5 -2.205 -15.466 4.661 1.00 0.00 C ATOM 65 C SER A 5 -2.947 -14.479 5.554 1.00 0.00 C ATOM 66 O SER A 5 -3.675 -13.611 5.071 1.00 0.00 O ATOM 67 CB SER A 5 -0.860 -14.869 4.248 1.00 0.00 C ATOM 68 OG SER A 5 -0.109 -14.559 5.413 1.00 0.00 O ATOM 0 HA SER A 5 -2.040 -16.388 5.218 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.311 -15.575 3.624 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.015 -13.970 3.651 1.00 0.00 H new ATOM 0 HG SER A 5 0.755 -14.177 5.153 1.00 0.00 H new ATOM 74 N GLU A 6 -2.767 -14.626 6.862 1.00 0.00 N ATOM 75 CA GLU A 6 -3.433 -13.751 7.818 1.00 0.00 C ATOM 76 C GLU A 6 -3.140 -12.289 7.501 1.00 0.00 C ATOM 77 O GLU A 6 -3.893 -11.398 7.885 1.00 0.00 O ATOM 78 CB GLU A 6 -2.952 -14.069 9.235 1.00 0.00 C ATOM 79 CG GLU A 6 -3.333 -15.506 9.594 1.00 0.00 C ATOM 80 CD GLU A 6 -2.860 -15.834 11.007 1.00 0.00 C ATOM 81 OE1 GLU A 6 -2.345 -14.943 11.660 1.00 0.00 O ATOM 82 OE2 GLU A 6 -3.023 -16.973 11.415 1.00 0.00 O ATOM 0 H GLU A 6 -2.169 -15.338 7.282 1.00 0.00 H new ATOM 0 HA GLU A 6 -4.508 -13.919 7.749 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -1.872 -13.941 9.301 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -3.399 -13.375 9.946 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -4.413 -15.633 9.525 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -2.885 -16.199 8.882 1.00 0.00 H new ATOM 89 N GLU A 7 -2.043 -12.046 6.799 1.00 0.00 N ATOM 90 CA GLU A 7 -1.660 -10.683 6.437 1.00 0.00 C ATOM 91 C GLU A 7 -2.762 -10.017 5.617 1.00 0.00 C ATOM 92 O GLU A 7 -2.936 -8.794 5.658 1.00 0.00 O ATOM 93 CB GLU A 7 -0.365 -10.717 5.614 1.00 0.00 C ATOM 94 CG GLU A 7 0.099 -9.289 5.310 1.00 0.00 C ATOM 95 CD GLU A 7 1.399 -9.316 4.510 1.00 0.00 C ATOM 96 OE1 GLU A 7 1.996 -10.375 4.421 1.00 0.00 O ATOM 97 OE2 GLU A 7 1.771 -8.276 3.994 1.00 0.00 O ATOM 0 H GLU A 7 -1.403 -12.768 6.469 1.00 0.00 H new ATOM 0 HA GLU A 7 -1.505 -10.109 7.351 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.411 -11.251 6.163 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -0.530 -11.261 4.684 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -0.671 -8.760 4.748 1.00 0.00 H new ATOM 0 HG3 GLU A 7 0.247 -8.741 6.241 1.00 0.00 H new ATOM 104 N GLN A 8 -3.531 -10.826 4.898 1.00 0.00 N ATOM 105 CA GLN A 8 -4.625 -10.299 4.094 1.00 0.00 C ATOM 106 C GLN A 8 -5.820 -9.983 4.983 1.00 0.00 C ATOM 107 O GLN A 8 -6.340 -8.865 4.976 1.00 0.00 O ATOM 108 CB GLN A 8 -5.015 -11.317 3.014 1.00 0.00 C ATOM 109 CG GLN A 8 -3.890 -11.418 1.978 1.00 0.00 C ATOM 110 CD GLN A 8 -4.243 -12.452 0.912 1.00 0.00 C ATOM 111 OE1 GLN A 8 -5.331 -13.024 0.938 1.00 0.00 O ATOM 112 NE2 GLN A 8 -3.382 -12.723 -0.032 1.00 0.00 N ATOM 0 H GLN A 8 -3.419 -11.839 4.855 1.00 0.00 H new ATOM 0 HA GLN A 8 -4.301 -9.379 3.608 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.196 -12.292 3.466 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -5.943 -11.013 2.530 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -3.727 -10.446 1.512 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -2.958 -11.696 2.469 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -2.480 -12.247 -0.052 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.612 -13.410 -0.750 1.00 0.00 H new ATOM 121 N ILE A 9 -6.247 -10.975 5.752 1.00 0.00 N ATOM 122 CA ILE A 9 -7.380 -10.801 6.645 1.00 0.00 C ATOM 123 C ILE A 9 -7.062 -9.725 7.671 1.00 0.00 C ATOM 124 O ILE A 9 -7.918 -8.912 8.013 1.00 0.00 O ATOM 125 CB ILE A 9 -7.723 -12.127 7.341 1.00 0.00 C ATOM 126 CG1 ILE A 9 -8.223 -13.156 6.301 1.00 0.00 C ATOM 127 CG2 ILE A 9 -8.812 -11.885 8.400 1.00 0.00 C ATOM 128 CD1 ILE A 9 -9.721 -12.973 5.993 1.00 0.00 C ATOM 0 H ILE A 9 -5.827 -11.904 5.774 1.00 0.00 H new ATOM 0 HA ILE A 9 -8.248 -10.489 6.063 1.00 0.00 H new ATOM 0 HB ILE A 9 -6.829 -12.520 7.825 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -7.647 -13.053 5.381 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -8.049 -14.165 6.675 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -9.055 -12.826 8.894 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.449 -11.171 9.139 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -9.705 -11.486 7.919 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -10.035 -13.714 5.258 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -10.299 -13.102 6.908 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -9.891 -11.973 5.595 1.00 0.00 H new ATOM 140 N VAL A 10 -5.829 -9.726 8.162 1.00 0.00 N ATOM 141 CA VAL A 10 -5.424 -8.741 9.149 1.00 0.00 C ATOM 142 C VAL A 10 -5.609 -7.331 8.591 1.00 0.00 C ATOM 143 O VAL A 10 -6.196 -6.472 9.250 1.00 0.00 O ATOM 144 CB VAL A 10 -3.948 -8.967 9.519 1.00 0.00 C ATOM 145 CG1 VAL A 10 -3.383 -7.737 10.242 1.00 0.00 C ATOM 146 CG2 VAL A 10 -3.824 -10.194 10.434 1.00 0.00 C ATOM 0 H VAL A 10 -5.102 -10.390 7.895 1.00 0.00 H new ATOM 0 HA VAL A 10 -6.043 -8.849 10.039 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.382 -9.133 8.602 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -2.338 -7.913 10.497 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -3.456 -6.866 9.590 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.953 -7.557 11.153 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.777 -10.350 10.693 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -4.402 -10.030 11.343 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -4.205 -11.074 9.916 1.00 0.00 H new ATOM 156 N ASP A 11 -5.107 -7.086 7.384 1.00 0.00 N ATOM 157 CA ASP A 11 -5.241 -5.758 6.800 1.00 0.00 C ATOM 158 C ASP A 11 -6.709 -5.327 6.773 1.00 0.00 C ATOM 159 O ASP A 11 -7.077 -4.263 7.296 1.00 0.00 O ATOM 160 CB ASP A 11 -4.689 -5.780 5.374 1.00 0.00 C ATOM 161 CG ASP A 11 -3.171 -5.934 5.404 1.00 0.00 C ATOM 162 OD1 ASP A 11 -2.573 -5.542 6.392 1.00 0.00 O ATOM 163 OD2 ASP A 11 -2.628 -6.440 4.435 1.00 0.00 O ATOM 0 H ASP A 11 -4.617 -7.769 6.806 1.00 0.00 H new ATOM 0 HA ASP A 11 -4.681 -5.046 7.407 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -5.135 -6.603 4.815 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -4.959 -4.860 4.856 1.00 0.00 H new ATOM 168 N PHE A 12 -7.552 -6.167 6.188 1.00 0.00 N ATOM 169 CA PHE A 12 -8.972 -5.862 6.120 1.00 0.00 C ATOM 170 C PHE A 12 -9.571 -5.791 7.519 1.00 0.00 C ATOM 171 O PHE A 12 -10.378 -4.911 7.816 1.00 0.00 O ATOM 172 CB PHE A 12 -9.696 -6.933 5.295 1.00 0.00 C ATOM 173 CG PHE A 12 -9.549 -6.635 3.817 1.00 0.00 C ATOM 174 CD1 PHE A 12 -8.340 -6.899 3.162 1.00 0.00 C ATOM 175 CD2 PHE A 12 -10.624 -6.093 3.103 1.00 0.00 C ATOM 176 CE1 PHE A 12 -8.206 -6.621 1.796 1.00 0.00 C ATOM 177 CE2 PHE A 12 -10.491 -5.817 1.736 1.00 0.00 C ATOM 178 CZ PHE A 12 -9.281 -6.080 1.083 1.00 0.00 C ATOM 0 H PHE A 12 -7.282 -7.052 5.760 1.00 0.00 H new ATOM 0 HA PHE A 12 -9.097 -4.892 5.639 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -9.284 -7.917 5.519 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -10.751 -6.961 5.566 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -7.510 -7.318 3.711 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -11.557 -5.887 3.607 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -7.272 -6.824 1.293 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -11.322 -5.401 1.186 1.00 0.00 H new ATOM 0 HZ PHE A 12 -9.178 -5.865 0.030 1.00 0.00 H new ATOM 188 N LYS A 13 -9.176 -6.722 8.371 1.00 0.00 N ATOM 189 CA LYS A 13 -9.688 -6.753 9.731 1.00 0.00 C ATOM 190 C LYS A 13 -9.364 -5.452 10.446 1.00 0.00 C ATOM 191 O LYS A 13 -10.189 -4.919 11.187 1.00 0.00 O ATOM 192 CB LYS A 13 -9.083 -7.933 10.491 1.00 0.00 C ATOM 193 CG LYS A 13 -9.708 -8.029 11.885 1.00 0.00 C ATOM 194 CD LYS A 13 -9.365 -9.384 12.511 1.00 0.00 C ATOM 195 CE LYS A 13 -7.848 -9.580 12.533 1.00 0.00 C ATOM 196 NZ LYS A 13 -7.189 -8.317 12.972 1.00 0.00 N ATOM 0 H LYS A 13 -8.508 -7.460 8.148 1.00 0.00 H new ATOM 0 HA LYS A 13 -10.771 -6.872 9.695 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -9.255 -8.858 9.941 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -8.003 -7.808 10.575 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -9.338 -7.221 12.517 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -10.790 -7.911 11.818 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -9.762 -9.437 13.525 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -9.836 -10.186 11.943 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -7.586 -10.394 13.209 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -7.493 -9.862 11.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -6.301 -8.542 13.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -6.984 -7.726 12.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -7.822 -7.801 13.616 1.00 0.00 H new ATOM 210 N GLU A 14 -8.164 -4.934 10.214 1.00 0.00 N ATOM 211 CA GLU A 14 -7.758 -3.687 10.840 1.00 0.00 C ATOM 212 C GLU A 14 -8.764 -2.595 10.501 1.00 0.00 C ATOM 213 O GLU A 14 -9.276 -1.910 11.387 1.00 0.00 O ATOM 214 CB GLU A 14 -6.370 -3.285 10.340 1.00 0.00 C ATOM 215 CG GLU A 14 -5.831 -2.141 11.197 1.00 0.00 C ATOM 216 CD GLU A 14 -5.473 -2.657 12.586 1.00 0.00 C ATOM 217 OE1 GLU A 14 -5.530 -3.858 12.784 1.00 0.00 O ATOM 218 OE2 GLU A 14 -5.147 -1.840 13.433 1.00 0.00 O ATOM 0 H GLU A 14 -7.463 -5.354 9.603 1.00 0.00 H new ATOM 0 HA GLU A 14 -7.722 -3.821 11.921 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -5.694 -4.139 10.387 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -6.423 -2.977 9.296 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -4.952 -1.704 10.724 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -6.577 -1.350 11.274 1.00 0.00 H new ATOM 225 N ALA A 15 -9.053 -2.439 9.211 1.00 0.00 N ATOM 226 CA ALA A 15 -10.014 -1.421 8.783 1.00 0.00 C ATOM 227 C ALA A 15 -11.350 -1.615 9.510 1.00 0.00 C ATOM 228 O ALA A 15 -11.930 -0.667 10.053 1.00 0.00 O ATOM 229 CB ALA A 15 -10.226 -1.508 7.267 1.00 0.00 C ATOM 0 H ALA A 15 -8.646 -2.991 8.456 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.618 -0.436 9.032 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -10.942 -0.748 6.956 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.277 -1.343 6.757 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -10.610 -2.495 7.009 1.00 0.00 H new ATOM 235 N PHE A 16 -11.825 -2.853 9.532 1.00 0.00 N ATOM 236 CA PHE A 16 -13.077 -3.171 10.206 1.00 0.00 C ATOM 237 C PHE A 16 -12.982 -2.828 11.692 1.00 0.00 C ATOM 238 O PHE A 16 -13.887 -2.213 12.257 1.00 0.00 O ATOM 239 CB PHE A 16 -13.401 -4.664 10.026 1.00 0.00 C ATOM 240 CG PHE A 16 -14.412 -5.101 11.063 1.00 0.00 C ATOM 241 CD1 PHE A 16 -13.961 -5.561 12.306 1.00 0.00 C ATOM 242 CD2 PHE A 16 -15.787 -5.030 10.800 1.00 0.00 C ATOM 243 CE1 PHE A 16 -14.879 -5.946 13.284 1.00 0.00 C ATOM 244 CE2 PHE A 16 -16.706 -5.422 11.781 1.00 0.00 C ATOM 245 CZ PHE A 16 -16.250 -5.878 13.023 1.00 0.00 C ATOM 0 H PHE A 16 -11.365 -3.651 9.093 1.00 0.00 H new ATOM 0 HA PHE A 16 -13.877 -2.577 9.764 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -13.794 -4.841 9.025 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.491 -5.256 10.121 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -12.902 -5.618 12.508 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -16.137 -4.674 9.842 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -14.529 -6.297 14.244 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -17.766 -5.372 11.579 1.00 0.00 H new ATOM 0 HZ PHE A 16 -16.959 -6.178 13.781 1.00 0.00 H new ATOM 255 N GLY A 17 -11.889 -3.240 12.319 1.00 0.00 N ATOM 256 CA GLY A 17 -11.704 -2.986 13.737 1.00 0.00 C ATOM 257 C GLY A 17 -11.878 -1.509 14.047 1.00 0.00 C ATOM 258 O GLY A 17 -12.471 -1.143 15.062 1.00 0.00 O ATOM 0 H GLY A 17 -11.125 -3.747 11.872 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -12.422 -3.570 14.313 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -10.710 -3.312 14.043 1.00 0.00 H new ATOM 262 N LEU A 18 -11.364 -0.660 13.167 1.00 0.00 N ATOM 263 CA LEU A 18 -11.476 0.777 13.365 1.00 0.00 C ATOM 264 C LEU A 18 -12.941 1.200 13.353 1.00 0.00 C ATOM 265 O LEU A 18 -13.383 1.962 14.215 1.00 0.00 O ATOM 266 CB LEU A 18 -10.718 1.506 12.251 1.00 0.00 C ATOM 267 CG LEU A 18 -9.205 1.516 12.555 1.00 0.00 C ATOM 268 CD1 LEU A 18 -8.413 1.605 11.246 1.00 0.00 C ATOM 269 CD2 LEU A 18 -8.861 2.733 13.423 1.00 0.00 C ATOM 0 H LEU A 18 -10.871 -0.938 12.319 1.00 0.00 H new ATOM 0 HA LEU A 18 -11.044 1.037 14.332 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -10.901 1.015 11.295 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.085 2.528 12.160 1.00 0.00 H new ATOM 0 HG LEU A 18 -8.945 0.598 13.082 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.346 1.612 11.466 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -8.649 0.745 10.619 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -8.681 2.522 10.720 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -7.792 2.737 13.636 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -9.129 3.646 12.892 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -9.417 2.681 14.359 1.00 0.00 H new ATOM 281 N PHE A 19 -13.693 0.701 12.379 1.00 0.00 N ATOM 282 CA PHE A 19 -15.104 1.048 12.290 1.00 0.00 C ATOM 283 C PHE A 19 -15.856 0.557 13.526 1.00 0.00 C ATOM 284 O PHE A 19 -16.735 1.248 14.043 1.00 0.00 O ATOM 285 CB PHE A 19 -15.729 0.433 11.020 1.00 0.00 C ATOM 286 CG PHE A 19 -15.788 1.455 9.908 1.00 0.00 C ATOM 287 CD1 PHE A 19 -16.539 2.619 10.088 1.00 0.00 C ATOM 288 CD2 PHE A 19 -15.109 1.240 8.705 1.00 0.00 C ATOM 289 CE1 PHE A 19 -16.614 3.570 9.068 1.00 0.00 C ATOM 290 CE2 PHE A 19 -15.187 2.191 7.682 1.00 0.00 C ATOM 291 CZ PHE A 19 -15.942 3.356 7.863 1.00 0.00 C ATOM 0 H PHE A 19 -13.357 0.067 11.654 1.00 0.00 H new ATOM 0 HA PHE A 19 -15.186 2.134 12.237 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -15.142 -0.428 10.699 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -16.733 0.070 11.241 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -17.063 2.784 11.018 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -14.526 0.342 8.566 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.192 4.471 9.211 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -14.664 2.026 6.751 1.00 0.00 H new ATOM 0 HZ PHE A 19 -16.005 4.088 7.072 1.00 0.00 H new ATOM 301 N ASP A 20 -15.516 -0.637 13.986 1.00 0.00 N ATOM 302 CA ASP A 20 -16.176 -1.209 15.145 1.00 0.00 C ATOM 303 C ASP A 20 -15.529 -0.717 16.426 1.00 0.00 C ATOM 304 O ASP A 20 -14.843 -1.467 17.120 1.00 0.00 O ATOM 305 CB ASP A 20 -16.095 -2.730 15.076 1.00 0.00 C ATOM 306 CG ASP A 20 -17.062 -3.346 16.071 1.00 0.00 C ATOM 307 OD1 ASP A 20 -17.521 -2.631 16.947 1.00 0.00 O ATOM 308 OD2 ASP A 20 -17.330 -4.527 15.944 1.00 0.00 O ATOM 0 H ASP A 20 -14.790 -1.225 13.576 1.00 0.00 H new ATOM 0 HA ASP A 20 -17.220 -0.897 15.144 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -16.332 -3.070 14.068 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -15.079 -3.059 15.293 1.00 0.00 H new ATOM 313 N LYS A 21 -15.752 0.552 16.729 1.00 0.00 N ATOM 314 CA LYS A 21 -15.182 1.142 17.925 1.00 0.00 C ATOM 315 C LYS A 21 -15.646 0.392 19.162 1.00 0.00 C ATOM 316 O LYS A 21 -14.865 0.152 20.082 1.00 0.00 O ATOM 317 CB LYS A 21 -15.593 2.608 18.035 1.00 0.00 C ATOM 318 CG LYS A 21 -17.121 2.710 18.022 1.00 0.00 C ATOM 319 CD LYS A 21 -17.549 4.174 17.848 1.00 0.00 C ATOM 320 CE LYS A 21 -17.215 4.984 19.106 1.00 0.00 C ATOM 321 NZ LYS A 21 -17.713 4.266 20.314 1.00 0.00 N ATOM 0 H LYS A 21 -16.319 1.187 16.167 1.00 0.00 H new ATOM 0 HA LYS A 21 -14.096 1.075 17.856 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -15.196 3.040 18.954 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -15.172 3.178 17.207 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -17.527 2.105 17.211 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -17.528 2.312 18.951 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -17.043 4.607 16.985 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -18.619 4.225 17.649 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -16.138 5.133 19.178 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -17.670 5.972 19.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -17.815 4.939 21.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -18.636 3.835 20.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -17.036 3.523 20.580 1.00 0.00 H new ATOM 335 N ASP A 22 -16.922 0.027 19.183 1.00 0.00 N ATOM 336 CA ASP A 22 -17.486 -0.695 20.317 1.00 0.00 C ATOM 337 C ASP A 22 -17.392 -2.197 20.097 1.00 0.00 C ATOM 338 O ASP A 22 -18.271 -2.933 20.549 1.00 0.00 O ATOM 339 CB ASP A 22 -18.955 -0.315 20.509 1.00 0.00 C ATOM 340 CG ASP A 22 -19.749 -0.642 19.248 1.00 0.00 C ATOM 341 OD1 ASP A 22 -19.136 -1.045 18.271 1.00 0.00 O ATOM 342 OD2 ASP A 22 -20.957 -0.484 19.276 1.00 0.00 O ATOM 0 H ASP A 22 -17.584 0.218 18.431 1.00 0.00 H new ATOM 0 HA ASP A 22 -16.916 -0.423 21.205 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -19.370 -0.855 21.360 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -19.037 0.748 20.735 1.00 0.00 H new ATOM 347 N GLY A 23 -16.316 -2.644 19.418 1.00 0.00 N ATOM 348 CA GLY A 23 -16.082 -4.073 19.144 1.00 0.00 C ATOM 349 C GLY A 23 -17.349 -4.904 19.313 1.00 0.00 C ATOM 350 O GLY A 23 -17.388 -5.832 20.121 1.00 0.00 O ATOM 0 H GLY A 23 -15.591 -2.029 19.048 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -15.705 -4.190 18.128 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.310 -4.449 19.816 1.00 0.00 H new ATOM 354 N ASP A 24 -18.392 -4.548 18.566 1.00 0.00 N ATOM 355 CA ASP A 24 -19.667 -5.257 18.660 1.00 0.00 C ATOM 356 C ASP A 24 -19.686 -6.464 17.728 1.00 0.00 C ATOM 357 O ASP A 24 -20.409 -7.433 17.953 1.00 0.00 O ATOM 358 CB ASP A 24 -20.810 -4.300 18.303 1.00 0.00 C ATOM 359 CG ASP A 24 -20.814 -4.008 16.806 1.00 0.00 C ATOM 360 OD1 ASP A 24 -19.775 -4.175 16.187 1.00 0.00 O ATOM 361 OD2 ASP A 24 -21.852 -3.616 16.300 1.00 0.00 O ATOM 0 H ASP A 24 -18.381 -3.780 17.895 1.00 0.00 H new ATOM 0 HA ASP A 24 -19.795 -5.615 19.682 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -21.764 -4.738 18.597 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -20.701 -3.370 18.861 1.00 0.00 H new ATOM 366 N GLY A 25 -18.882 -6.377 16.674 1.00 0.00 N ATOM 367 CA GLY A 25 -18.783 -7.442 15.671 1.00 0.00 C ATOM 368 C GLY A 25 -19.330 -6.987 14.317 1.00 0.00 C ATOM 369 O GLY A 25 -18.913 -7.499 13.278 1.00 0.00 O ATOM 0 H GLY A 25 -18.282 -5.573 16.487 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -17.742 -7.745 15.561 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -19.335 -8.318 16.012 1.00 0.00 H new ATOM 373 N CYS A 26 -20.256 -6.027 14.323 1.00 0.00 N ATOM 374 CA CYS A 26 -20.841 -5.517 13.076 1.00 0.00 C ATOM 375 C CYS A 26 -20.761 -3.998 13.042 1.00 0.00 C ATOM 376 O CYS A 26 -20.339 -3.374 14.014 1.00 0.00 O ATOM 377 CB CYS A 26 -22.299 -5.961 12.961 1.00 0.00 C ATOM 378 SG CYS A 26 -22.422 -7.718 13.375 1.00 0.00 S ATOM 0 H CYS A 26 -20.617 -5.588 15.170 1.00 0.00 H new ATOM 0 HA CYS A 26 -20.278 -5.921 12.235 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -22.925 -5.373 13.632 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -22.666 -5.787 11.949 1.00 0.00 H new ATOM 0 HG CYS A 26 -23.661 -8.100 13.281 1.00 0.00 H new ATOM 384 N ILE A 27 -21.180 -3.409 11.925 1.00 0.00 N ATOM 385 CA ILE A 27 -21.166 -1.953 11.780 1.00 0.00 C ATOM 386 C ILE A 27 -22.581 -1.455 11.534 1.00 0.00 C ATOM 387 O ILE A 27 -23.250 -1.923 10.624 1.00 0.00 O ATOM 388 CB ILE A 27 -20.274 -1.558 10.609 1.00 0.00 C ATOM 389 CG1 ILE A 27 -18.861 -2.077 10.866 1.00 0.00 C ATOM 390 CG2 ILE A 27 -20.237 -0.034 10.489 1.00 0.00 C ATOM 391 CD1 ILE A 27 -18.024 -1.942 9.596 1.00 0.00 C ATOM 0 H ILE A 27 -21.532 -3.912 11.111 1.00 0.00 H new ATOM 0 HA ILE A 27 -20.776 -1.504 12.693 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.666 -1.986 9.686 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -18.399 -1.516 11.679 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -18.898 -3.120 11.180 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.599 0.250 9.652 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -21.246 0.342 10.320 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -19.839 0.394 11.409 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -17.016 -2.313 9.783 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -18.482 -2.523 8.795 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -17.976 -0.894 9.302 1.00 0.00 H new ATOM 403 N THR A 28 -23.024 -0.500 12.348 1.00 0.00 N ATOM 404 CA THR A 28 -24.375 0.056 12.216 1.00 0.00 C ATOM 405 C THR A 28 -24.338 1.420 11.537 1.00 0.00 C ATOM 406 O THR A 28 -23.339 2.137 11.611 1.00 0.00 O ATOM 407 CB THR A 28 -25.013 0.196 13.600 1.00 0.00 C ATOM 408 OG1 THR A 28 -24.822 -1.008 14.330 1.00 0.00 O ATOM 409 CG2 THR A 28 -26.512 0.470 13.456 1.00 0.00 C ATOM 0 H THR A 28 -22.473 -0.094 13.104 1.00 0.00 H new ATOM 0 HA THR A 28 -24.966 -0.624 11.602 1.00 0.00 H new ATOM 0 HB THR A 28 -24.545 1.026 14.130 1.00 0.00 H new ATOM 0 HG1 THR A 28 -25.228 -0.920 15.218 1.00 0.00 H new ATOM 0 HG21 THR A 28 -26.960 0.569 14.445 1.00 0.00 H new ATOM 0 HG22 THR A 28 -26.661 1.393 12.896 1.00 0.00 H new ATOM 0 HG23 THR A 28 -26.984 -0.357 12.925 1.00 0.00 H new ATOM 417 N VAL A 29 -25.433 1.765 10.869 1.00 0.00 N ATOM 418 CA VAL A 29 -25.521 3.038 10.167 1.00 0.00 C ATOM 419 C VAL A 29 -25.043 4.168 11.072 1.00 0.00 C ATOM 420 O VAL A 29 -24.291 5.044 10.643 1.00 0.00 O ATOM 421 CB VAL A 29 -26.968 3.298 9.737 1.00 0.00 C ATOM 422 CG1 VAL A 29 -27.037 4.587 8.916 1.00 0.00 C ATOM 423 CG2 VAL A 29 -27.472 2.126 8.891 1.00 0.00 C ATOM 0 H VAL A 29 -26.268 1.183 10.799 1.00 0.00 H new ATOM 0 HA VAL A 29 -24.886 2.997 9.282 1.00 0.00 H new ATOM 0 HB VAL A 29 -27.594 3.400 10.624 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -28.068 4.770 8.611 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -26.684 5.423 9.520 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -26.409 4.488 8.031 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -28.502 2.313 8.586 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -26.845 2.020 8.006 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -27.429 1.208 9.478 1.00 0.00 H new ATOM 433 N GLU A 30 -25.477 4.139 12.326 1.00 0.00 N ATOM 434 CA GLU A 30 -25.076 5.167 13.282 1.00 0.00 C ATOM 435 C GLU A 30 -23.559 5.164 13.466 1.00 0.00 C ATOM 436 O GLU A 30 -22.908 6.203 13.357 1.00 0.00 O ATOM 437 CB GLU A 30 -25.754 4.915 14.630 1.00 0.00 C ATOM 438 CG GLU A 30 -27.261 5.139 14.493 1.00 0.00 C ATOM 439 CD GLU A 30 -27.955 4.850 15.820 1.00 0.00 C ATOM 440 OE1 GLU A 30 -27.258 4.586 16.786 1.00 0.00 O ATOM 441 OE2 GLU A 30 -29.175 4.903 15.853 1.00 0.00 O ATOM 0 H GLU A 30 -26.099 3.424 12.703 1.00 0.00 H new ATOM 0 HA GLU A 30 -25.383 6.139 12.895 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -25.556 3.897 14.964 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -25.343 5.584 15.386 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -27.458 6.166 14.187 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -27.664 4.491 13.714 1.00 0.00 H new ATOM 448 N GLU A 31 -23.005 3.988 13.740 1.00 0.00 N ATOM 449 CA GLU A 31 -21.566 3.865 13.932 1.00 0.00 C ATOM 450 C GLU A 31 -20.828 4.448 12.733 1.00 0.00 C ATOM 451 O GLU A 31 -19.847 5.174 12.887 1.00 0.00 O ATOM 452 CB GLU A 31 -21.192 2.394 14.118 1.00 0.00 C ATOM 453 CG GLU A 31 -21.724 1.908 15.468 1.00 0.00 C ATOM 454 CD GLU A 31 -21.563 0.399 15.575 1.00 0.00 C ATOM 455 OE1 GLU A 31 -21.441 -0.237 14.542 1.00 0.00 O ATOM 456 OE2 GLU A 31 -21.550 -0.102 16.688 1.00 0.00 O ATOM 0 H GLU A 31 -23.525 3.115 13.833 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.276 4.419 14.825 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -21.612 1.794 13.311 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -20.110 2.273 14.075 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -21.185 2.398 16.279 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -22.775 2.179 15.574 1.00 0.00 H new ATOM 463 N LEU A 32 -21.314 4.130 11.541 1.00 0.00 N ATOM 464 CA LEU A 32 -20.706 4.635 10.315 1.00 0.00 C ATOM 465 C LEU A 32 -20.778 6.160 10.285 1.00 0.00 C ATOM 466 O LEU A 32 -19.828 6.830 9.884 1.00 0.00 O ATOM 467 CB LEU A 32 -21.439 4.024 9.091 1.00 0.00 C ATOM 468 CG LEU A 32 -20.522 3.045 8.337 1.00 0.00 C ATOM 469 CD1 LEU A 32 -21.368 2.134 7.449 1.00 0.00 C ATOM 470 CD2 LEU A 32 -19.533 3.819 7.465 1.00 0.00 C ATOM 0 H LEU A 32 -22.124 3.527 11.396 1.00 0.00 H new ATOM 0 HA LEU A 32 -19.656 4.345 10.279 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -22.338 3.505 9.422 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -21.759 4.820 8.419 1.00 0.00 H new ATOM 0 HG LEU A 32 -19.971 2.446 9.062 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -20.718 1.441 6.915 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -22.068 1.572 8.067 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -21.922 2.738 6.731 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -18.888 3.117 6.935 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -20.081 4.424 6.743 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -18.924 4.468 8.094 1.00 0.00 H new ATOM 482 N ALA A 33 -21.903 6.696 10.723 1.00 0.00 N ATOM 483 CA ALA A 33 -22.074 8.138 10.747 1.00 0.00 C ATOM 484 C ALA A 33 -21.056 8.788 11.683 1.00 0.00 C ATOM 485 O ALA A 33 -20.435 9.792 11.337 1.00 0.00 O ATOM 486 CB ALA A 33 -23.487 8.491 11.197 1.00 0.00 C ATOM 0 H ALA A 33 -22.703 6.163 11.063 1.00 0.00 H new ATOM 0 HA ALA A 33 -21.912 8.518 9.738 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -23.604 9.575 11.211 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -24.208 8.057 10.505 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -23.660 8.094 12.197 1.00 0.00 H new ATOM 492 N THR A 34 -20.900 8.217 12.875 1.00 0.00 N ATOM 493 CA THR A 34 -19.964 8.767 13.852 1.00 0.00 C ATOM 494 C THR A 34 -18.538 8.754 13.309 1.00 0.00 C ATOM 495 O THR A 34 -17.846 9.777 13.324 1.00 0.00 O ATOM 496 CB THR A 34 -20.018 7.935 15.137 1.00 0.00 C ATOM 497 OG1 THR A 34 -21.370 7.778 15.547 1.00 0.00 O ATOM 498 CG2 THR A 34 -19.221 8.635 16.238 1.00 0.00 C ATOM 0 H THR A 34 -21.402 7.385 13.185 1.00 0.00 H new ATOM 0 HA THR A 34 -20.251 9.798 14.058 1.00 0.00 H new ATOM 0 HB THR A 34 -19.583 6.953 14.950 1.00 0.00 H new ATOM 0 HG1 THR A 34 -21.403 7.244 16.368 1.00 0.00 H new ATOM 0 HG21 THR A 34 -19.262 8.040 17.151 1.00 0.00 H new ATOM 0 HG22 THR A 34 -18.184 8.745 15.922 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.649 9.619 16.427 1.00 0.00 H new ATOM 506 N VAL A 35 -18.102 7.596 12.827 1.00 0.00 N ATOM 507 CA VAL A 35 -16.754 7.468 12.291 1.00 0.00 C ATOM 508 C VAL A 35 -16.573 8.379 11.083 1.00 0.00 C ATOM 509 O VAL A 35 -15.583 9.097 10.986 1.00 0.00 O ATOM 510 CB VAL A 35 -16.491 6.017 11.880 1.00 0.00 C ATOM 511 CG1 VAL A 35 -15.134 5.917 11.182 1.00 0.00 C ATOM 512 CG2 VAL A 35 -16.493 5.121 13.123 1.00 0.00 C ATOM 0 H VAL A 35 -18.657 6.741 12.797 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.045 7.761 13.065 1.00 0.00 H new ATOM 0 HB VAL A 35 -17.275 5.690 11.196 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -14.950 4.883 10.891 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -15.134 6.549 10.294 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.349 6.247 11.863 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -16.306 4.089 12.828 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -15.713 5.449 13.810 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -17.462 5.187 13.617 1.00 0.00 H new ATOM 522 N ILE A 36 -17.541 8.351 10.171 1.00 0.00 N ATOM 523 CA ILE A 36 -17.473 9.184 8.974 1.00 0.00 C ATOM 524 C ILE A 36 -17.452 10.658 9.352 1.00 0.00 C ATOM 525 O ILE A 36 -16.693 11.444 8.785 1.00 0.00 O ATOM 526 CB ILE A 36 -18.677 8.894 8.067 1.00 0.00 C ATOM 527 CG1 ILE A 36 -18.527 7.500 7.443 1.00 0.00 C ATOM 528 CG2 ILE A 36 -18.770 9.951 6.959 1.00 0.00 C ATOM 529 CD1 ILE A 36 -19.865 7.033 6.855 1.00 0.00 C ATOM 0 H ILE A 36 -18.374 7.766 10.236 1.00 0.00 H new ATOM 0 HA ILE A 36 -16.554 8.949 8.437 1.00 0.00 H new ATOM 0 HB ILE A 36 -19.588 8.928 8.664 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -17.767 7.524 6.662 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.186 6.791 8.198 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -19.628 9.735 6.322 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -18.889 10.938 7.407 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -17.859 9.932 6.361 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -19.744 6.043 6.416 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -20.615 6.990 7.645 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -20.189 7.734 6.086 1.00 0.00 H new ATOM 541 N ARG A 37 -18.291 11.029 10.304 1.00 0.00 N ATOM 542 CA ARG A 37 -18.355 12.413 10.735 1.00 0.00 C ATOM 543 C ARG A 37 -16.978 12.888 11.176 1.00 0.00 C ATOM 544 O ARG A 37 -16.590 14.027 10.912 1.00 0.00 O ATOM 545 CB ARG A 37 -19.355 12.561 11.881 1.00 0.00 C ATOM 546 CG ARG A 37 -19.487 14.036 12.264 1.00 0.00 C ATOM 547 CD ARG A 37 -20.519 14.180 13.383 1.00 0.00 C ATOM 548 NE ARG A 37 -20.789 15.591 13.637 1.00 0.00 N ATOM 549 CZ ARG A 37 -21.375 15.985 14.762 1.00 0.00 C ATOM 550 NH1 ARG A 37 -21.716 15.105 15.664 1.00 0.00 N ATOM 551 NH2 ARG A 37 -21.612 17.252 14.965 1.00 0.00 N ATOM 0 H ARG A 37 -18.930 10.399 10.788 1.00 0.00 H new ATOM 0 HA ARG A 37 -18.687 13.027 9.898 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -20.326 12.165 11.583 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -19.024 11.980 12.742 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -18.523 14.426 12.591 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -19.790 14.623 11.397 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -21.441 13.669 13.106 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -20.151 13.703 14.291 1.00 0.00 H new ATOM 0 HE ARG A 37 -20.523 16.286 12.939 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -21.532 14.114 15.505 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -22.166 15.408 16.528 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -21.347 17.940 14.260 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -22.062 17.555 15.829 1.00 0.00 H new ATOM 565 N SER A 38 -16.238 12.005 11.837 1.00 0.00 N ATOM 566 CA SER A 38 -14.894 12.332 12.303 1.00 0.00 C ATOM 567 C SER A 38 -13.857 11.943 11.252 1.00 0.00 C ATOM 568 O SER A 38 -12.682 11.761 11.573 1.00 0.00 O ATOM 569 CB SER A 38 -14.595 11.591 13.606 1.00 0.00 C ATOM 570 OG SER A 38 -13.380 12.083 14.156 1.00 0.00 O ATOM 0 H SER A 38 -16.545 11.059 12.062 1.00 0.00 H new ATOM 0 HA SER A 38 -14.843 13.407 12.476 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.412 11.732 14.314 1.00 0.00 H new ATOM 0 HB3 SER A 38 -14.516 10.520 13.419 1.00 0.00 H new ATOM 0 HG SER A 38 -12.681 12.070 13.469 1.00 0.00 H new ATOM 576 N LEU A 39 -14.290 11.826 9.991 1.00 0.00 N ATOM 577 CA LEU A 39 -13.383 11.466 8.894 1.00 0.00 C ATOM 578 C LEU A 39 -13.490 12.475 7.749 1.00 0.00 C ATOM 579 O LEU A 39 -12.854 12.313 6.708 1.00 0.00 O ATOM 580 CB LEU A 39 -13.721 10.041 8.403 1.00 0.00 C ATOM 581 CG LEU A 39 -12.444 9.265 8.025 1.00 0.00 C ATOM 582 CD1 LEU A 39 -12.766 7.774 7.914 1.00 0.00 C ATOM 583 CD2 LEU A 39 -11.877 9.779 6.690 1.00 0.00 C ATOM 0 H LEU A 39 -15.258 11.974 9.706 1.00 0.00 H new ATOM 0 HA LEU A 39 -12.355 11.486 9.256 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -14.259 9.503 9.183 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -14.384 10.098 7.540 1.00 0.00 H new ATOM 0 HG LEU A 39 -11.695 9.419 8.802 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.863 7.226 7.647 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -13.141 7.411 8.871 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -13.524 7.622 7.145 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -10.976 9.220 6.438 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -12.619 9.644 5.903 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -11.634 10.838 6.781 1.00 0.00 H new ATOM 595 N ASP A 40 -14.295 13.509 7.938 1.00 0.00 N ATOM 596 CA ASP A 40 -14.462 14.518 6.900 1.00 0.00 C ATOM 597 C ASP A 40 -15.446 15.583 7.354 1.00 0.00 C ATOM 598 O ASP A 40 -15.052 16.660 7.802 1.00 0.00 O ATOM 599 CB ASP A 40 -14.966 13.858 5.608 1.00 0.00 C ATOM 600 CG ASP A 40 -15.985 12.770 5.936 1.00 0.00 C ATOM 601 OD1 ASP A 40 -15.568 11.662 6.224 1.00 0.00 O ATOM 602 OD2 ASP A 40 -17.170 13.064 5.894 1.00 0.00 O ATOM 0 H ASP A 40 -14.836 13.672 8.787 1.00 0.00 H new ATOM 0 HA ASP A 40 -13.498 14.990 6.710 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -15.420 14.608 4.961 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -14.128 13.428 5.059 1.00 0.00 H new ATOM 607 N GLN A 41 -16.732 15.274 7.237 1.00 0.00 N ATOM 608 CA GLN A 41 -17.768 16.213 7.639 1.00 0.00 C ATOM 609 C GLN A 41 -19.051 15.479 7.999 1.00 0.00 C ATOM 610 O GLN A 41 -19.268 15.136 9.159 1.00 0.00 O ATOM 611 CB GLN A 41 -18.032 17.208 6.509 1.00 0.00 C ATOM 612 CG GLN A 41 -19.098 18.207 6.953 1.00 0.00 C ATOM 613 CD GLN A 41 -19.207 19.340 5.939 1.00 0.00 C ATOM 614 OE1 GLN A 41 -18.301 19.537 5.130 1.00 0.00 O ATOM 615 NE2 GLN A 41 -20.267 20.101 5.933 1.00 0.00 N ATOM 0 H GLN A 41 -17.079 14.388 6.870 1.00 0.00 H new ATOM 0 HA GLN A 41 -17.424 16.753 8.521 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -17.112 17.732 6.249 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -18.362 16.680 5.614 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -20.060 17.704 7.053 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -18.845 18.609 7.934 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -21.017 19.936 6.604 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -20.346 20.861 5.257 1.00 0.00 H new ATOM 624 N ASN A 42 -19.894 15.243 7.001 1.00 0.00 N ATOM 625 CA ASN A 42 -21.157 14.549 7.225 1.00 0.00 C ATOM 626 C ASN A 42 -21.940 14.422 5.913 1.00 0.00 C ATOM 627 O ASN A 42 -22.763 15.280 5.600 1.00 0.00 O ATOM 628 CB ASN A 42 -22.009 15.311 8.251 1.00 0.00 C ATOM 629 CG ASN A 42 -23.421 14.731 8.301 1.00 0.00 C ATOM 630 OD1 ASN A 42 -23.600 13.557 8.628 1.00 0.00 O ATOM 631 ND2 ASN A 42 -24.435 15.487 7.986 1.00 0.00 N ATOM 0 H ASN A 42 -19.728 15.520 6.034 1.00 0.00 H new ATOM 0 HA ASN A 42 -20.934 13.553 7.607 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -21.547 15.248 9.236 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -22.051 16.367 7.986 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -25.381 15.107 8.010 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -24.282 16.459 7.716 1.00 0.00 H new ATOM 638 N PRO A 43 -21.703 13.380 5.151 1.00 0.00 N ATOM 639 CA PRO A 43 -22.424 13.140 3.859 1.00 0.00 C ATOM 640 C PRO A 43 -23.943 13.183 4.038 1.00 0.00 C ATOM 641 O PRO A 43 -24.460 13.860 4.927 1.00 0.00 O ATOM 642 CB PRO A 43 -21.952 11.737 3.433 1.00 0.00 C ATOM 643 CG PRO A 43 -20.632 11.551 4.109 1.00 0.00 C ATOM 644 CD PRO A 43 -20.724 12.315 5.429 1.00 0.00 C ATOM 0 HA PRO A 43 -22.206 13.906 3.115 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -22.664 10.971 3.740 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -21.854 11.666 2.350 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -20.428 10.494 4.283 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -19.820 11.935 3.492 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -21.055 11.670 6.243 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.758 12.726 5.721 1.00 0.00 H new ATOM 652 N THR A 44 -24.654 12.450 3.189 1.00 0.00 N ATOM 653 CA THR A 44 -26.109 12.399 3.252 1.00 0.00 C ATOM 654 C THR A 44 -26.563 11.033 3.758 1.00 0.00 C ATOM 655 O THR A 44 -26.030 10.000 3.354 1.00 0.00 O ATOM 656 CB THR A 44 -26.686 12.658 1.861 1.00 0.00 C ATOM 657 OG1 THR A 44 -26.394 13.992 1.468 1.00 0.00 O ATOM 658 CG2 THR A 44 -28.194 12.460 1.897 1.00 0.00 C ATOM 0 H THR A 44 -24.245 11.882 2.447 1.00 0.00 H new ATOM 0 HA THR A 44 -26.467 13.164 3.941 1.00 0.00 H new ATOM 0 HB THR A 44 -26.243 11.964 1.147 1.00 0.00 H new ATOM 0 HG1 THR A 44 -26.762 14.158 0.575 1.00 0.00 H new ATOM 0 HG21 THR A 44 -28.609 12.644 0.906 1.00 0.00 H new ATOM 0 HG22 THR A 44 -28.420 11.438 2.201 1.00 0.00 H new ATOM 0 HG23 THR A 44 -28.635 13.156 2.610 1.00 0.00 H new ATOM 666 N GLU A 45 -27.551 11.042 4.647 1.00 0.00 N ATOM 667 CA GLU A 45 -28.079 9.806 5.215 1.00 0.00 C ATOM 668 C GLU A 45 -28.623 8.897 4.112 1.00 0.00 C ATOM 669 O GLU A 45 -28.437 7.680 4.150 1.00 0.00 O ATOM 670 CB GLU A 45 -29.203 10.132 6.215 1.00 0.00 C ATOM 671 CG GLU A 45 -30.034 11.327 5.708 1.00 0.00 C ATOM 672 CD GLU A 45 -29.387 12.646 6.129 1.00 0.00 C ATOM 673 OE1 GLU A 45 -29.009 12.756 7.284 1.00 0.00 O ATOM 674 OE2 GLU A 45 -29.284 13.529 5.292 1.00 0.00 O ATOM 0 H GLU A 45 -28.002 11.890 4.990 1.00 0.00 H new ATOM 0 HA GLU A 45 -27.270 9.287 5.730 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -29.846 9.262 6.347 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -28.776 10.364 7.191 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -30.116 11.286 4.622 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -31.047 11.268 6.107 1.00 0.00 H new ATOM 681 N GLU A 46 -29.301 9.495 3.139 1.00 0.00 N ATOM 682 CA GLU A 46 -29.876 8.725 2.042 1.00 0.00 C ATOM 683 C GLU A 46 -28.781 7.982 1.282 1.00 0.00 C ATOM 684 O GLU A 46 -28.955 6.827 0.893 1.00 0.00 O ATOM 685 CB GLU A 46 -30.625 9.657 1.088 1.00 0.00 C ATOM 686 CG GLU A 46 -31.388 8.827 0.056 1.00 0.00 C ATOM 687 CD GLU A 46 -32.190 9.743 -0.862 1.00 0.00 C ATOM 688 OE1 GLU A 46 -32.345 10.903 -0.518 1.00 0.00 O ATOM 689 OE2 GLU A 46 -32.640 9.270 -1.893 1.00 0.00 O ATOM 0 H GLU A 46 -29.465 10.500 3.087 1.00 0.00 H new ATOM 0 HA GLU A 46 -30.573 7.996 2.456 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -31.317 10.287 1.647 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -29.922 10.323 0.587 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -30.690 8.231 -0.532 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -32.056 8.129 0.561 1.00 0.00 H new ATOM 696 N GLU A 47 -27.652 8.650 1.081 1.00 0.00 N ATOM 697 CA GLU A 47 -26.532 8.041 0.374 1.00 0.00 C ATOM 698 C GLU A 47 -25.949 6.888 1.188 1.00 0.00 C ATOM 699 O GLU A 47 -25.474 5.895 0.631 1.00 0.00 O ATOM 700 CB GLU A 47 -25.449 9.091 0.111 1.00 0.00 C ATOM 701 CG GLU A 47 -25.961 10.107 -0.913 1.00 0.00 C ATOM 702 CD GLU A 47 -24.937 11.222 -1.103 1.00 0.00 C ATOM 703 OE1 GLU A 47 -23.894 11.155 -0.473 1.00 0.00 O ATOM 704 OE2 GLU A 47 -25.211 12.126 -1.874 1.00 0.00 O ATOM 0 H GLU A 47 -27.488 9.607 1.395 1.00 0.00 H new ATOM 0 HA GLU A 47 -26.893 7.649 -0.577 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -25.184 9.597 1.040 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -24.544 8.610 -0.259 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -26.151 9.611 -1.865 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -26.909 10.527 -0.577 1.00 0.00 H new ATOM 711 N LEU A 48 -26.000 7.021 2.509 1.00 0.00 N ATOM 712 CA LEU A 48 -25.475 5.982 3.386 1.00 0.00 C ATOM 713 C LEU A 48 -26.412 4.783 3.421 1.00 0.00 C ATOM 714 O LEU A 48 -26.006 3.661 3.132 1.00 0.00 O ATOM 715 CB LEU A 48 -25.300 6.536 4.803 1.00 0.00 C ATOM 716 CG LEU A 48 -24.223 7.634 4.805 1.00 0.00 C ATOM 717 CD1 LEU A 48 -24.169 8.290 6.192 1.00 0.00 C ATOM 718 CD2 LEU A 48 -22.844 7.038 4.447 1.00 0.00 C ATOM 0 H LEU A 48 -26.395 7.828 2.991 1.00 0.00 H new ATOM 0 HA LEU A 48 -24.509 5.660 2.997 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -26.245 6.941 5.164 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -25.016 5.734 5.484 1.00 0.00 H new ATOM 0 HG LEU A 48 -24.477 8.385 4.057 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -23.406 9.069 6.197 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -25.139 8.730 6.424 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -23.923 7.537 6.941 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -22.093 7.828 4.453 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -22.575 6.277 5.180 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -22.889 6.587 3.455 1.00 0.00 H new ATOM 730 N GLN A 49 -27.668 5.025 3.766 1.00 0.00 N ATOM 731 CA GLN A 49 -28.645 3.949 3.828 1.00 0.00 C ATOM 732 C GLN A 49 -28.667 3.180 2.516 1.00 0.00 C ATOM 733 O GLN A 49 -28.804 1.956 2.506 1.00 0.00 O ATOM 734 CB GLN A 49 -30.033 4.521 4.119 1.00 0.00 C ATOM 735 CG GLN A 49 -30.071 5.068 5.548 1.00 0.00 C ATOM 736 CD GLN A 49 -31.439 5.674 5.838 1.00 0.00 C ATOM 737 OE1 GLN A 49 -32.465 5.054 5.558 1.00 0.00 O ATOM 738 NE2 GLN A 49 -31.518 6.855 6.387 1.00 0.00 N ATOM 0 H GLN A 49 -28.032 5.947 4.005 1.00 0.00 H new ATOM 0 HA GLN A 49 -28.364 3.267 4.630 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -30.267 5.314 3.409 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -30.790 3.747 3.994 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -29.861 4.268 6.258 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -29.295 5.822 5.678 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -30.667 7.368 6.619 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -32.431 7.266 6.585 1.00 0.00 H new ATOM 747 N ASP A 50 -28.524 3.899 1.412 1.00 0.00 N ATOM 748 CA ASP A 50 -28.521 3.266 0.102 1.00 0.00 C ATOM 749 C ASP A 50 -27.312 2.352 -0.058 1.00 0.00 C ATOM 750 O ASP A 50 -27.444 1.218 -0.515 1.00 0.00 O ATOM 751 CB ASP A 50 -28.495 4.330 -0.995 1.00 0.00 C ATOM 752 CG ASP A 50 -28.755 3.684 -2.353 1.00 0.00 C ATOM 753 OD1 ASP A 50 -29.683 2.897 -2.443 1.00 0.00 O ATOM 754 OD2 ASP A 50 -28.023 3.987 -3.279 1.00 0.00 O ATOM 0 H ASP A 50 -28.409 4.912 1.397 1.00 0.00 H new ATOM 0 HA ASP A 50 -29.429 2.669 0.015 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -29.250 5.090 -0.794 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -27.529 4.834 -1.002 1.00 0.00 H new ATOM 759 N MET A 51 -26.131 2.852 0.307 1.00 0.00 N ATOM 760 CA MET A 51 -24.907 2.065 0.175 1.00 0.00 C ATOM 761 C MET A 51 -25.013 0.770 0.973 1.00 0.00 C ATOM 762 O MET A 51 -24.676 -0.307 0.480 1.00 0.00 O ATOM 763 CB MET A 51 -23.713 2.875 0.691 1.00 0.00 C ATOM 764 CG MET A 51 -22.398 2.181 0.311 1.00 0.00 C ATOM 765 SD MET A 51 -21.080 2.728 1.428 1.00 0.00 S ATOM 766 CE MET A 51 -20.819 4.367 0.707 1.00 0.00 C ATOM 0 H MET A 51 -25.997 3.787 0.692 1.00 0.00 H new ATOM 0 HA MET A 51 -24.765 1.823 -0.878 1.00 0.00 H new ATOM 0 HB2 MET A 51 -23.737 3.880 0.270 1.00 0.00 H new ATOM 0 HB3 MET A 51 -23.777 2.981 1.774 1.00 0.00 H new ATOM 0 HG2 MET A 51 -22.515 1.099 0.372 1.00 0.00 H new ATOM 0 HG3 MET A 51 -22.136 2.416 -0.721 1.00 0.00 H new ATOM 0 HE1 MET A 51 -19.801 4.438 0.325 1.00 0.00 H new ATOM 0 HE2 MET A 51 -21.525 4.522 -0.109 1.00 0.00 H new ATOM 0 HE3 MET A 51 -20.974 5.129 1.471 1.00 0.00 H new ATOM 776 N ILE A 52 -25.487 0.882 2.206 1.00 0.00 N ATOM 777 CA ILE A 52 -25.642 -0.284 3.065 1.00 0.00 C ATOM 778 C ILE A 52 -26.683 -1.233 2.494 1.00 0.00 C ATOM 779 O ILE A 52 -26.506 -2.444 2.524 1.00 0.00 O ATOM 780 CB ILE A 52 -26.043 0.139 4.483 1.00 0.00 C ATOM 781 CG1 ILE A 52 -25.020 1.145 5.031 1.00 0.00 C ATOM 782 CG2 ILE A 52 -26.111 -1.086 5.400 1.00 0.00 C ATOM 783 CD1 ILE A 52 -23.604 0.551 5.015 1.00 0.00 C ATOM 0 H ILE A 52 -25.770 1.764 2.633 1.00 0.00 H new ATOM 0 HA ILE A 52 -24.683 -0.800 3.111 1.00 0.00 H new ATOM 0 HB ILE A 52 -27.027 0.607 4.449 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -25.043 2.056 4.433 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -25.289 1.426 6.049 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -26.397 -0.773 6.404 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -26.850 -1.788 5.015 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -25.135 -1.569 5.434 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -22.898 1.283 5.408 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -23.579 -0.346 5.634 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -23.329 0.294 3.992 1.00 0.00 H new ATOM 795 N SER A 53 -27.764 -0.673 1.969 1.00 0.00 N ATOM 796 CA SER A 53 -28.825 -1.491 1.391 1.00 0.00 C ATOM 797 C SER A 53 -28.464 -1.970 -0.013 1.00 0.00 C ATOM 798 O SER A 53 -29.005 -2.963 -0.498 1.00 0.00 O ATOM 799 CB SER A 53 -30.113 -0.688 1.327 1.00 0.00 C ATOM 800 OG SER A 53 -29.919 0.436 0.481 1.00 0.00 O ATOM 0 H SER A 53 -27.930 0.333 1.930 1.00 0.00 H new ATOM 0 HA SER A 53 -28.956 -2.365 2.029 1.00 0.00 H new ATOM 0 HB2 SER A 53 -30.924 -1.309 0.947 1.00 0.00 H new ATOM 0 HB3 SER A 53 -30.402 -0.361 2.326 1.00 0.00 H new ATOM 0 HG SER A 53 -28.963 0.546 0.297 1.00 0.00 H new ATOM 806 N GLU A 54 -27.557 -1.253 -0.666 1.00 0.00 N ATOM 807 CA GLU A 54 -27.149 -1.611 -2.025 1.00 0.00 C ATOM 808 C GLU A 54 -26.616 -3.038 -2.074 1.00 0.00 C ATOM 809 O GLU A 54 -26.950 -3.802 -2.978 1.00 0.00 O ATOM 810 CB GLU A 54 -26.055 -0.654 -2.514 1.00 0.00 C ATOM 811 CG GLU A 54 -25.769 -0.897 -4.001 1.00 0.00 C ATOM 812 CD GLU A 54 -26.944 -0.409 -4.840 1.00 0.00 C ATOM 813 OE1 GLU A 54 -27.839 0.197 -4.273 1.00 0.00 O ATOM 814 OE2 GLU A 54 -26.934 -0.649 -6.035 1.00 0.00 O ATOM 0 H GLU A 54 -27.093 -0.429 -0.284 1.00 0.00 H new ATOM 0 HA GLU A 54 -28.025 -1.536 -2.670 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -26.369 0.378 -2.360 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -25.145 -0.801 -1.932 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -24.859 -0.375 -4.296 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -25.599 -1.959 -4.179 1.00 0.00 H new ATOM 821 N VAL A 55 -25.776 -3.391 -1.101 1.00 0.00 N ATOM 822 CA VAL A 55 -25.187 -4.731 -1.053 1.00 0.00 C ATOM 823 C VAL A 55 -25.845 -5.586 0.023 1.00 0.00 C ATOM 824 O VAL A 55 -26.357 -6.665 -0.263 1.00 0.00 O ATOM 825 CB VAL A 55 -23.690 -4.627 -0.769 1.00 0.00 C ATOM 826 CG1 VAL A 55 -23.098 -6.030 -0.620 1.00 0.00 C ATOM 827 CG2 VAL A 55 -23.004 -3.896 -1.926 1.00 0.00 C ATOM 0 H VAL A 55 -25.489 -2.774 -0.341 1.00 0.00 H new ATOM 0 HA VAL A 55 -25.352 -5.206 -2.020 1.00 0.00 H new ATOM 0 HB VAL A 55 -23.531 -4.071 0.155 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -22.030 -5.954 -0.417 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -23.588 -6.546 0.205 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -23.254 -6.590 -1.542 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -21.935 -3.820 -1.726 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -23.162 -4.450 -2.851 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -23.426 -2.896 -2.026 1.00 0.00 H new ATOM 837 N ASP A 56 -25.814 -5.105 1.264 1.00 0.00 N ATOM 838 CA ASP A 56 -26.396 -5.849 2.378 1.00 0.00 C ATOM 839 C ASP A 56 -27.747 -6.443 1.985 1.00 0.00 C ATOM 840 O ASP A 56 -28.791 -5.816 2.166 1.00 0.00 O ATOM 841 CB ASP A 56 -26.576 -4.927 3.585 1.00 0.00 C ATOM 842 CG ASP A 56 -26.780 -5.750 4.849 1.00 0.00 C ATOM 843 OD1 ASP A 56 -27.125 -6.912 4.725 1.00 0.00 O ATOM 844 OD2 ASP A 56 -26.592 -5.203 5.925 1.00 0.00 O ATOM 0 H ASP A 56 -25.396 -4.211 1.522 1.00 0.00 H new ATOM 0 HA ASP A 56 -25.718 -6.662 2.637 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -25.701 -4.287 3.696 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -27.432 -4.272 3.427 1.00 0.00 H new ATOM 849 N ALA A 57 -27.712 -7.656 1.442 1.00 0.00 N ATOM 850 CA ALA A 57 -28.930 -8.334 1.020 1.00 0.00 C ATOM 851 C ALA A 57 -29.990 -8.238 2.104 1.00 0.00 C ATOM 852 O ALA A 57 -30.970 -7.507 1.964 1.00 0.00 O ATOM 853 CB ALA A 57 -28.633 -9.806 0.728 1.00 0.00 C ATOM 0 H ALA A 57 -26.856 -8.187 1.285 1.00 0.00 H new ATOM 0 HA ALA A 57 -29.300 -7.851 0.116 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -29.549 -10.306 0.413 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -27.889 -9.877 -0.066 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -28.249 -10.285 1.629 1.00 0.00 H new ATOM 859 N ASP A 58 -29.797 -8.992 3.178 1.00 0.00 N ATOM 860 CA ASP A 58 -30.749 -8.997 4.276 1.00 0.00 C ATOM 861 C ASP A 58 -30.898 -7.609 4.876 1.00 0.00 C ATOM 862 O ASP A 58 -31.659 -7.437 5.827 1.00 0.00 O ATOM 863 CB ASP A 58 -30.284 -9.957 5.372 1.00 0.00 C ATOM 864 CG ASP A 58 -28.831 -9.669 5.757 1.00 0.00 C ATOM 865 OD1 ASP A 58 -28.491 -8.504 5.914 1.00 0.00 O ATOM 866 OD2 ASP A 58 -28.082 -10.621 5.898 1.00 0.00 O ATOM 0 H ASP A 58 -28.993 -9.605 3.310 1.00 0.00 H new ATOM 0 HA ASP A 58 -31.711 -9.320 3.878 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -30.925 -9.856 6.248 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -30.377 -10.986 5.025 1.00 0.00 H new ATOM 871 N GLY A 59 -30.177 -6.627 4.301 1.00 0.00 N ATOM 872 CA GLY A 59 -30.225 -5.231 4.768 1.00 0.00 C ATOM 873 C GLY A 59 -30.823 -5.136 6.165 1.00 0.00 C ATOM 874 O GLY A 59 -31.861 -4.508 6.371 1.00 0.00 O ATOM 0 H GLY A 59 -29.552 -6.778 3.509 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -29.219 -4.811 4.771 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -30.817 -4.633 4.075 1.00 0.00 H new ATOM 878 N ASN A 60 -30.159 -5.784 7.113 1.00 0.00 N ATOM 879 CA ASN A 60 -30.626 -5.795 8.488 1.00 0.00 C ATOM 880 C ASN A 60 -30.331 -4.466 9.166 1.00 0.00 C ATOM 881 O ASN A 60 -30.812 -4.200 10.267 1.00 0.00 O ATOM 882 CB ASN A 60 -29.961 -6.944 9.259 1.00 0.00 C ATOM 883 CG ASN A 60 -28.482 -7.026 8.894 1.00 0.00 C ATOM 884 OD1 ASN A 60 -27.876 -5.969 8.439 1.00 0.00 O flip ATOM 885 ND2 ASN A 60 -27.865 -8.085 9.023 1.00 0.00 N flip ATOM 0 H ASN A 60 -29.298 -6.307 6.953 1.00 0.00 H new ATOM 0 HA ASN A 60 -31.705 -5.946 8.487 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -30.072 -6.786 10.332 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -30.456 -7.886 9.023 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -28.342 -8.913 9.380 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -26.877 -8.134 8.773 1.00 0.00 H new ATOM 892 N GLY A 61 -29.532 -3.633 8.505 1.00 0.00 N ATOM 893 CA GLY A 61 -29.163 -2.327 9.049 1.00 0.00 C ATOM 894 C GLY A 61 -27.745 -2.363 9.603 1.00 0.00 C ATOM 895 O GLY A 61 -27.249 -1.365 10.124 1.00 0.00 O ATOM 0 H GLY A 61 -29.127 -3.838 7.592 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -29.237 -1.568 8.270 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -29.861 -2.044 9.837 1.00 0.00 H new ATOM 899 N THR A 62 -27.086 -3.516 9.471 1.00 0.00 N ATOM 900 CA THR A 62 -25.713 -3.664 9.947 1.00 0.00 C ATOM 901 C THR A 62 -24.884 -4.478 8.958 1.00 0.00 C ATOM 902 O THR A 62 -25.402 -5.368 8.280 1.00 0.00 O ATOM 903 CB THR A 62 -25.699 -4.351 11.312 1.00 0.00 C ATOM 904 OG1 THR A 62 -26.239 -5.657 11.190 1.00 0.00 O ATOM 905 CG2 THR A 62 -26.534 -3.541 12.300 1.00 0.00 C ATOM 0 H THR A 62 -27.479 -4.354 9.042 1.00 0.00 H new ATOM 0 HA THR A 62 -25.276 -2.670 10.038 1.00 0.00 H new ATOM 0 HB THR A 62 -24.673 -4.416 11.675 1.00 0.00 H new ATOM 0 HG1 THR A 62 -26.229 -6.098 12.065 1.00 0.00 H new ATOM 0 HG21 THR A 62 -26.523 -4.032 13.273 1.00 0.00 H new ATOM 0 HG22 THR A 62 -26.115 -2.539 12.394 1.00 0.00 H new ATOM 0 HG23 THR A 62 -27.560 -3.473 11.939 1.00 0.00 H new ATOM 913 N ILE A 63 -23.588 -4.169 8.880 1.00 0.00 N ATOM 914 CA ILE A 63 -22.690 -4.873 7.964 1.00 0.00 C ATOM 915 C ILE A 63 -21.890 -5.923 8.725 1.00 0.00 C ATOM 916 O ILE A 63 -21.208 -5.604 9.702 1.00 0.00 O ATOM 917 CB ILE A 63 -21.712 -3.887 7.321 1.00 0.00 C ATOM 918 CG1 ILE A 63 -22.478 -2.678 6.768 1.00 0.00 C ATOM 919 CG2 ILE A 63 -20.979 -4.577 6.171 1.00 0.00 C ATOM 920 CD1 ILE A 63 -21.496 -1.624 6.219 1.00 0.00 C ATOM 0 H ILE A 63 -23.140 -3.441 9.436 1.00 0.00 H new ATOM 0 HA ILE A 63 -23.293 -5.351 7.192 1.00 0.00 H new ATOM 0 HB ILE A 63 -20.997 -3.553 8.073 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -23.156 -3.000 5.977 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -23.092 -2.238 7.554 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -20.282 -3.876 5.711 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -20.430 -5.437 6.554 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -21.702 -4.910 5.426 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -22.055 -0.773 5.831 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -20.836 -1.290 7.020 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -20.901 -2.063 5.418 1.00 0.00 H new ATOM 932 N GLU A 64 -21.978 -7.167 8.269 1.00 0.00 N ATOM 933 CA GLU A 64 -21.259 -8.266 8.905 1.00 0.00 C ATOM 934 C GLU A 64 -19.833 -8.344 8.366 1.00 0.00 C ATOM 935 O GLU A 64 -19.534 -7.804 7.302 1.00 0.00 O ATOM 936 CB GLU A 64 -21.993 -9.587 8.646 1.00 0.00 C ATOM 937 CG GLU A 64 -21.293 -10.724 9.395 1.00 0.00 C ATOM 938 CD GLU A 64 -22.131 -11.994 9.329 1.00 0.00 C ATOM 939 OE1 GLU A 64 -23.073 -12.020 8.556 1.00 0.00 O ATOM 940 OE2 GLU A 64 -21.815 -12.924 10.053 1.00 0.00 O ATOM 0 H GLU A 64 -22.539 -7.440 7.462 1.00 0.00 H new ATOM 0 HA GLU A 64 -21.217 -8.087 9.979 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -23.030 -9.508 8.973 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -22.011 -9.800 7.577 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -20.311 -10.905 8.959 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -21.133 -10.439 10.435 1.00 0.00 H new ATOM 947 N PHE A 65 -18.958 -9.015 9.104 1.00 0.00 N ATOM 948 CA PHE A 65 -17.568 -9.144 8.687 1.00 0.00 C ATOM 949 C PHE A 65 -17.497 -9.639 7.246 1.00 0.00 C ATOM 950 O PHE A 65 -16.775 -9.080 6.425 1.00 0.00 O ATOM 951 CB PHE A 65 -16.851 -10.139 9.603 1.00 0.00 C ATOM 952 CG PHE A 65 -15.378 -10.147 9.285 1.00 0.00 C ATOM 953 CD1 PHE A 65 -14.871 -11.027 8.322 1.00 0.00 C ATOM 954 CD2 PHE A 65 -14.517 -9.270 9.956 1.00 0.00 C ATOM 955 CE1 PHE A 65 -13.504 -11.029 8.029 1.00 0.00 C ATOM 956 CE2 PHE A 65 -13.150 -9.273 9.664 1.00 0.00 C ATOM 957 CZ PHE A 65 -12.643 -10.151 8.700 1.00 0.00 C ATOM 0 H PHE A 65 -19.183 -9.474 9.986 1.00 0.00 H new ATOM 0 HA PHE A 65 -17.085 -8.169 8.753 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -17.007 -9.866 10.647 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -17.268 -11.137 9.470 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -15.535 -11.704 7.806 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -14.909 -8.591 10.699 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -13.112 -11.707 7.286 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -12.485 -8.598 10.182 1.00 0.00 H new ATOM 0 HZ PHE A 65 -11.587 -10.152 8.473 1.00 0.00 H new ATOM 967 N ASP A 66 -18.252 -10.690 6.946 1.00 0.00 N ATOM 968 CA ASP A 66 -18.258 -11.245 5.595 1.00 0.00 C ATOM 969 C ASP A 66 -18.735 -10.198 4.593 1.00 0.00 C ATOM 970 O ASP A 66 -18.202 -10.096 3.488 1.00 0.00 O ATOM 971 CB ASP A 66 -19.172 -12.472 5.537 1.00 0.00 C ATOM 972 CG ASP A 66 -19.193 -13.057 4.127 1.00 0.00 C ATOM 973 OD1 ASP A 66 -18.624 -12.441 3.241 1.00 0.00 O ATOM 974 OD2 ASP A 66 -19.779 -14.114 3.956 1.00 0.00 O ATOM 0 H ASP A 66 -18.860 -11.170 7.609 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.242 -11.542 5.336 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -18.825 -13.225 6.244 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -20.182 -12.195 5.837 1.00 0.00 H new ATOM 979 N GLU A 67 -19.730 -9.413 4.993 1.00 0.00 N ATOM 980 CA GLU A 67 -20.261 -8.366 4.126 1.00 0.00 C ATOM 981 C GLU A 67 -19.232 -7.255 3.936 1.00 0.00 C ATOM 982 O GLU A 67 -18.906 -6.876 2.811 1.00 0.00 O ATOM 983 CB GLU A 67 -21.539 -7.784 4.737 1.00 0.00 C ATOM 984 CG GLU A 67 -22.649 -8.838 4.685 1.00 0.00 C ATOM 985 CD GLU A 67 -23.906 -8.333 5.390 1.00 0.00 C ATOM 986 OE1 GLU A 67 -23.878 -7.225 5.902 1.00 0.00 O ATOM 987 OE2 GLU A 67 -24.882 -9.064 5.408 1.00 0.00 O ATOM 0 H GLU A 67 -20.182 -9.480 5.905 1.00 0.00 H new ATOM 0 HA GLU A 67 -20.489 -8.803 3.154 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -21.358 -7.481 5.768 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -21.843 -6.891 4.191 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -22.880 -9.079 3.647 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -22.306 -9.758 5.157 1.00 0.00 H new ATOM 994 N PHE A 68 -18.723 -6.746 5.049 1.00 0.00 N ATOM 995 CA PHE A 68 -17.731 -5.681 5.003 1.00 0.00 C ATOM 996 C PHE A 68 -16.557 -6.117 4.147 1.00 0.00 C ATOM 997 O PHE A 68 -16.005 -5.326 3.381 1.00 0.00 O ATOM 998 CB PHE A 68 -17.243 -5.342 6.418 1.00 0.00 C ATOM 999 CG PHE A 68 -16.284 -4.170 6.360 1.00 0.00 C ATOM 1000 CD1 PHE A 68 -16.770 -2.878 6.119 1.00 0.00 C ATOM 1001 CD2 PHE A 68 -14.910 -4.372 6.553 1.00 0.00 C ATOM 1002 CE1 PHE A 68 -15.887 -1.793 6.066 1.00 0.00 C ATOM 1003 CE2 PHE A 68 -14.026 -3.284 6.500 1.00 0.00 C ATOM 1004 CZ PHE A 68 -14.516 -1.997 6.258 1.00 0.00 C ATOM 0 H PHE A 68 -18.978 -7.050 5.989 1.00 0.00 H new ATOM 0 HA PHE A 68 -18.189 -4.792 4.569 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.092 -5.099 7.057 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -16.749 -6.207 6.860 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.828 -2.719 5.974 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -14.532 -5.366 6.743 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.264 -0.799 5.877 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -12.967 -3.440 6.646 1.00 0.00 H new ATOM 0 HZ PHE A 68 -13.835 -1.159 6.219 1.00 0.00 H new ATOM 1014 N LEU A 69 -16.171 -7.377 4.284 1.00 0.00 N ATOM 1015 CA LEU A 69 -15.049 -7.900 3.518 1.00 0.00 C ATOM 1016 C LEU A 69 -15.324 -7.793 2.023 1.00 0.00 C ATOM 1017 O LEU A 69 -14.595 -7.125 1.292 1.00 0.00 O ATOM 1018 CB LEU A 69 -14.809 -9.378 3.887 1.00 0.00 C ATOM 1019 CG LEU A 69 -13.338 -9.761 3.656 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -12.945 -9.452 2.205 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -12.425 -8.981 4.630 1.00 0.00 C ATOM 0 H LEU A 69 -16.612 -8.050 4.911 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.164 -7.311 3.758 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -15.075 -9.546 4.931 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.456 -10.018 3.287 1.00 0.00 H new ATOM 0 HG LEU A 69 -13.215 -10.828 3.841 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.902 -9.725 2.045 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -13.578 -10.024 1.527 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -13.076 -8.387 2.012 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.386 -9.260 4.457 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -12.546 -7.911 4.463 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -12.699 -9.221 5.657 1.00 0.00 H new ATOM 1033 N SER A 70 -16.381 -8.455 1.575 1.00 0.00 N ATOM 1034 CA SER A 70 -16.727 -8.432 0.165 1.00 0.00 C ATOM 1035 C SER A 70 -16.811 -7.001 -0.333 1.00 0.00 C ATOM 1036 O SER A 70 -16.407 -6.697 -1.455 1.00 0.00 O ATOM 1037 CB SER A 70 -18.066 -9.130 -0.060 1.00 0.00 C ATOM 1038 OG SER A 70 -17.992 -10.457 0.439 1.00 0.00 O ATOM 0 H SER A 70 -17.006 -9.008 2.161 1.00 0.00 H new ATOM 0 HA SER A 70 -15.950 -8.958 -0.390 1.00 0.00 H new ATOM 0 HB2 SER A 70 -18.863 -8.584 0.444 1.00 0.00 H new ATOM 0 HB3 SER A 70 -18.309 -9.142 -1.122 1.00 0.00 H new ATOM 0 HG SER A 70 -18.130 -10.450 1.409 1.00 0.00 H new ATOM 1044 N LEU A 71 -17.365 -6.128 0.495 1.00 0.00 N ATOM 1045 CA LEU A 71 -17.519 -4.737 0.105 1.00 0.00 C ATOM 1046 C LEU A 71 -16.159 -4.113 -0.203 1.00 0.00 C ATOM 1047 O LEU A 71 -15.936 -3.597 -1.298 1.00 0.00 O ATOM 1048 CB LEU A 71 -18.202 -3.958 1.247 1.00 0.00 C ATOM 1049 CG LEU A 71 -18.982 -2.753 0.692 1.00 0.00 C ATOM 1050 CD1 LEU A 71 -18.046 -1.873 -0.149 1.00 0.00 C ATOM 1051 CD2 LEU A 71 -20.174 -3.237 -0.172 1.00 0.00 C ATOM 0 H LEU A 71 -17.711 -6.354 1.428 1.00 0.00 H new ATOM 0 HA LEU A 71 -18.134 -4.688 -0.793 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -18.879 -4.617 1.790 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -17.452 -3.615 1.960 1.00 0.00 H new ATOM 0 HG LEU A 71 -19.371 -2.168 1.526 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -18.602 -1.021 -0.540 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -17.225 -1.516 0.473 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -17.645 -2.456 -0.978 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -20.717 -2.375 -0.558 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -19.801 -3.834 -1.004 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -20.843 -3.844 0.438 1.00 0.00 H new ATOM 1063 N MET A 72 -15.259 -4.163 0.766 1.00 0.00 N ATOM 1064 CA MET A 72 -13.934 -3.590 0.582 1.00 0.00 C ATOM 1065 C MET A 72 -13.141 -4.368 -0.461 1.00 0.00 C ATOM 1066 O MET A 72 -12.454 -3.786 -1.301 1.00 0.00 O ATOM 1067 CB MET A 72 -13.184 -3.593 1.919 1.00 0.00 C ATOM 1068 CG MET A 72 -13.853 -2.616 2.922 1.00 0.00 C ATOM 1069 SD MET A 72 -12.790 -1.165 3.184 1.00 0.00 S ATOM 1070 CE MET A 72 -13.632 -0.033 2.046 1.00 0.00 C ATOM 0 H MET A 72 -15.418 -4.589 1.679 1.00 0.00 H new ATOM 0 HA MET A 72 -14.046 -2.566 0.227 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.175 -4.600 2.335 1.00 0.00 H new ATOM 0 HB3 MET A 72 -12.145 -3.305 1.760 1.00 0.00 H new ATOM 0 HG2 MET A 72 -14.825 -2.301 2.542 1.00 0.00 H new ATOM 0 HG3 MET A 72 -14.031 -3.122 3.871 1.00 0.00 H new ATOM 0 HE1 MET A 72 -13.162 0.949 2.095 1.00 0.00 H new ATOM 0 HE2 MET A 72 -13.560 -0.419 1.029 1.00 0.00 H new ATOM 0 HE3 MET A 72 -14.681 0.053 2.328 1.00 0.00 H new ATOM 1080 N ALA A 73 -13.244 -5.688 -0.405 1.00 0.00 N ATOM 1081 CA ALA A 73 -12.536 -6.540 -1.346 1.00 0.00 C ATOM 1082 C ALA A 73 -13.029 -6.286 -2.765 1.00 0.00 C ATOM 1083 O ALA A 73 -12.254 -6.333 -3.718 1.00 0.00 O ATOM 1084 CB ALA A 73 -12.743 -8.011 -0.972 1.00 0.00 C ATOM 0 H ALA A 73 -13.809 -6.190 0.280 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.472 -6.307 -1.301 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.210 -8.645 -1.681 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.360 -8.188 0.033 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.807 -8.248 -1.002 1.00 0.00 H new ATOM 1090 N LYS A 74 -14.322 -6.011 -2.901 1.00 0.00 N ATOM 1091 CA LYS A 74 -14.893 -5.749 -4.207 1.00 0.00 C ATOM 1092 C LYS A 74 -14.515 -4.364 -4.701 1.00 0.00 C ATOM 1093 O LYS A 74 -13.936 -4.215 -5.778 1.00 0.00 O ATOM 1094 CB LYS A 74 -16.415 -5.881 -4.132 1.00 0.00 C ATOM 1095 CG LYS A 74 -17.056 -5.500 -5.469 1.00 0.00 C ATOM 1096 CD LYS A 74 -16.516 -6.398 -6.588 1.00 0.00 C ATOM 1097 CE LYS A 74 -17.438 -6.325 -7.804 1.00 0.00 C ATOM 1098 NZ LYS A 74 -16.912 -7.223 -8.868 1.00 0.00 N ATOM 0 H LYS A 74 -14.985 -5.965 -2.127 1.00 0.00 H new ATOM 0 HA LYS A 74 -14.495 -6.478 -4.913 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -16.684 -6.905 -3.872 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -16.802 -5.239 -3.341 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -18.139 -5.600 -5.403 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -16.845 -4.455 -5.697 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -15.510 -6.084 -6.864 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -16.443 -7.427 -6.237 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -18.450 -6.622 -7.527 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -17.496 -5.300 -8.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -17.535 -7.178 -9.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -15.954 -6.919 -9.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -16.879 -8.200 -8.513 1.00 0.00 H new ATOM 1112 N LYS A 75 -14.856 -3.355 -3.917 1.00 0.00 N ATOM 1113 CA LYS A 75 -14.559 -1.987 -4.296 1.00 0.00 C ATOM 1114 C LYS A 75 -13.113 -1.661 -4.018 1.00 0.00 C ATOM 1115 O LYS A 75 -12.647 -1.757 -2.884 1.00 0.00 O ATOM 1116 CB LYS A 75 -15.458 -1.023 -3.514 1.00 0.00 C ATOM 1117 CG LYS A 75 -16.879 -1.037 -4.096 1.00 0.00 C ATOM 1118 CD LYS A 75 -17.005 -0.004 -5.227 1.00 0.00 C ATOM 1119 CE LYS A 75 -18.341 -0.197 -5.951 1.00 0.00 C ATOM 1120 NZ LYS A 75 -19.458 -0.040 -4.979 1.00 0.00 N ATOM 0 H LYS A 75 -15.335 -3.457 -3.022 1.00 0.00 H new ATOM 0 HA LYS A 75 -14.746 -1.877 -5.364 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -15.484 -1.310 -2.463 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -15.048 -0.014 -3.559 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -17.114 -2.032 -4.475 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -17.602 -0.816 -3.311 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -16.943 1.005 -4.820 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -16.179 -0.116 -5.930 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -18.440 0.532 -6.756 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -18.379 -1.185 -6.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -20.352 0.083 -5.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -19.518 -0.888 -4.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -19.285 0.794 -4.383 1.00 0.00 H new ATOM 1134 N VAL A 76 -12.404 -1.260 -5.057 1.00 0.00 N ATOM 1135 CA VAL A 76 -11.007 -0.894 -4.908 1.00 0.00 C ATOM 1136 C VAL A 76 -10.604 0.104 -5.976 1.00 0.00 C ATOM 1137 O VAL A 76 -9.979 -0.272 -6.962 1.00 0.00 O ATOM 1138 CB VAL A 76 -10.099 -2.134 -5.012 1.00 0.00 C ATOM 1139 CG1 VAL A 76 -8.610 -1.712 -5.149 1.00 0.00 C ATOM 1140 CG2 VAL A 76 -10.273 -3.003 -3.761 1.00 0.00 C ATOM 0 H VAL A 76 -12.768 -1.180 -6.006 1.00 0.00 H new ATOM 0 HA VAL A 76 -10.886 -0.444 -3.922 1.00 0.00 H new ATOM 0 HB VAL A 76 -10.383 -2.702 -5.898 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.985 -2.602 -5.221 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -8.485 -1.107 -6.047 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -8.315 -1.131 -4.275 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -9.630 -3.880 -3.835 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -10.000 -2.427 -2.877 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -11.313 -3.321 -3.680 1.00 0.00 H new ATOM 1150 N LYS A 77 -10.987 1.366 -5.785 1.00 0.00 N ATOM 1151 CA LYS A 77 -10.665 2.426 -6.745 1.00 0.00 C ATOM 1152 C LYS A 77 -9.382 2.112 -7.512 1.00 0.00 C ATOM 1153 O LYS A 77 -8.289 2.506 -7.104 1.00 0.00 O ATOM 1154 CB LYS A 77 -10.492 3.750 -6.002 1.00 0.00 C ATOM 1155 CG LYS A 77 -10.215 4.872 -7.007 1.00 0.00 C ATOM 1156 CD LYS A 77 -10.126 6.228 -6.282 1.00 0.00 C ATOM 1157 CE LYS A 77 -11.523 6.829 -6.108 1.00 0.00 C ATOM 1158 NZ LYS A 77 -11.415 8.121 -5.376 1.00 0.00 N ATOM 0 H LYS A 77 -11.521 1.681 -4.975 1.00 0.00 H new ATOM 0 HA LYS A 77 -11.485 2.496 -7.459 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -11.390 3.976 -5.428 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -9.670 3.674 -5.291 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -9.283 4.673 -7.537 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -11.007 4.903 -7.755 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -9.655 6.097 -5.308 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -9.497 6.912 -6.851 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -11.987 6.987 -7.081 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -12.163 6.139 -5.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -12.173 8.761 -5.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -11.505 7.950 -4.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -10.491 8.556 -5.574 1.00 0.00 H new ATOM 1172 N ASP A 78 -9.532 1.388 -8.617 1.00 0.00 N ATOM 1173 CA ASP A 78 -8.393 0.996 -9.444 1.00 0.00 C ATOM 1174 C ASP A 78 -8.501 1.592 -10.843 1.00 0.00 C ATOM 1175 O ASP A 78 -7.813 1.154 -11.765 1.00 0.00 O ATOM 1176 CB ASP A 78 -8.346 -0.527 -9.541 1.00 0.00 C ATOM 1177 CG ASP A 78 -7.084 -0.959 -10.279 1.00 0.00 C ATOM 1178 OD1 ASP A 78 -6.015 -0.529 -9.879 1.00 0.00 O ATOM 1179 OD2 ASP A 78 -7.205 -1.710 -11.232 1.00 0.00 O ATOM 0 H ASP A 78 -10.434 1.059 -8.962 1.00 0.00 H new ATOM 0 HA ASP A 78 -7.481 1.373 -8.982 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.362 -0.965 -8.543 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.228 -0.895 -10.065 1.00 0.00 H new ATOM 1184 N THR A 79 -9.368 2.589 -10.995 1.00 0.00 N ATOM 1185 CA THR A 79 -9.569 3.249 -12.290 1.00 0.00 C ATOM 1186 C THR A 79 -9.122 4.703 -12.217 1.00 0.00 C ATOM 1187 O THR A 79 -9.911 5.621 -12.438 1.00 0.00 O ATOM 1188 CB THR A 79 -11.046 3.187 -12.681 1.00 0.00 C ATOM 1189 OG1 THR A 79 -11.822 3.864 -11.701 1.00 0.00 O ATOM 1190 CG2 THR A 79 -11.489 1.726 -12.768 1.00 0.00 C ATOM 0 H THR A 79 -9.945 2.961 -10.240 1.00 0.00 H new ATOM 0 HA THR A 79 -8.973 2.732 -13.042 1.00 0.00 H new ATOM 0 HB THR A 79 -11.188 3.666 -13.650 1.00 0.00 H new ATOM 0 HG1 THR A 79 -11.621 4.823 -11.730 1.00 0.00 H new ATOM 0 HG21 THR A 79 -12.542 1.681 -13.047 1.00 0.00 H new ATOM 0 HG22 THR A 79 -10.892 1.209 -13.520 1.00 0.00 H new ATOM 0 HG23 THR A 79 -11.349 1.245 -11.800 1.00 0.00 H new ATOM 1198 N ASP A 80 -7.851 4.901 -11.891 1.00 0.00 N ATOM 1199 CA ASP A 80 -7.304 6.247 -11.774 1.00 0.00 C ATOM 1200 C ASP A 80 -5.778 6.215 -11.743 1.00 0.00 C ATOM 1201 O ASP A 80 -5.172 6.129 -10.679 1.00 0.00 O ATOM 1202 CB ASP A 80 -7.837 6.920 -10.501 1.00 0.00 C ATOM 1203 CG ASP A 80 -7.934 5.924 -9.345 1.00 0.00 C ATOM 1204 OD1 ASP A 80 -8.242 4.771 -9.592 1.00 0.00 O ATOM 1205 OD2 ASP A 80 -7.709 6.339 -8.220 1.00 0.00 O ATOM 0 H ASP A 80 -7.184 4.153 -11.704 1.00 0.00 H new ATOM 0 HA ASP A 80 -7.618 6.821 -12.646 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -7.180 7.743 -10.220 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -8.820 7.349 -10.698 1.00 0.00 H new ATOM 1210 N ALA A 81 -5.163 6.284 -12.911 1.00 0.00 N ATOM 1211 CA ALA A 81 -3.708 6.254 -12.991 1.00 0.00 C ATOM 1212 C ALA A 81 -3.071 7.363 -12.153 1.00 0.00 C ATOM 1213 O ALA A 81 -2.270 7.095 -11.256 1.00 0.00 O ATOM 1214 CB ALA A 81 -3.272 6.417 -14.444 1.00 0.00 C ATOM 0 H ALA A 81 -5.640 6.360 -13.810 1.00 0.00 H new ATOM 0 HA ALA A 81 -3.375 5.294 -12.598 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.184 6.394 -14.502 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.684 5.604 -15.041 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.636 7.370 -14.828 1.00 0.00 H new ATOM 1220 N GLU A 82 -3.421 8.607 -12.454 1.00 0.00 N ATOM 1221 CA GLU A 82 -2.854 9.737 -11.728 1.00 0.00 C ATOM 1222 C GLU A 82 -3.467 9.869 -10.339 1.00 0.00 C ATOM 1223 O GLU A 82 -2.780 9.700 -9.331 1.00 0.00 O ATOM 1224 CB GLU A 82 -3.081 11.026 -12.511 1.00 0.00 C ATOM 1225 CG GLU A 82 -2.397 12.189 -11.788 1.00 0.00 C ATOM 1226 CD GLU A 82 -2.556 13.467 -12.600 1.00 0.00 C ATOM 1227 OE1 GLU A 82 -3.338 13.454 -13.536 1.00 0.00 O ATOM 1228 OE2 GLU A 82 -1.897 14.439 -12.273 1.00 0.00 O ATOM 0 H GLU A 82 -4.086 8.858 -13.186 1.00 0.00 H new ATOM 0 HA GLU A 82 -1.785 9.559 -11.614 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -2.682 10.926 -13.520 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.149 11.222 -12.608 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -2.833 12.320 -10.798 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -1.339 11.968 -11.644 1.00 0.00 H new ATOM 1235 N GLU A 83 -4.762 10.197 -10.303 1.00 0.00 N ATOM 1236 CA GLU A 83 -5.478 10.380 -9.035 1.00 0.00 C ATOM 1237 C GLU A 83 -4.961 9.390 -7.983 1.00 0.00 C ATOM 1238 O GLU A 83 -4.660 9.771 -6.847 1.00 0.00 O ATOM 1239 CB GLU A 83 -7.007 10.195 -9.260 1.00 0.00 C ATOM 1240 CG GLU A 83 -7.779 11.450 -8.843 1.00 0.00 C ATOM 1241 CD GLU A 83 -7.569 11.703 -7.358 1.00 0.00 C ATOM 1242 OE1 GLU A 83 -7.960 10.855 -6.573 1.00 0.00 O ATOM 1243 OE2 GLU A 83 -7.017 12.737 -7.025 1.00 0.00 O ATOM 0 H GLU A 83 -5.335 10.341 -11.134 1.00 0.00 H new ATOM 0 HA GLU A 83 -5.299 11.391 -8.668 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -7.200 9.977 -10.311 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.362 9.338 -8.687 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -7.438 12.309 -9.421 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -8.841 11.324 -9.055 1.00 0.00 H new ATOM 1250 N GLU A 84 -4.844 8.124 -8.372 1.00 0.00 N ATOM 1251 CA GLU A 84 -4.349 7.109 -7.453 1.00 0.00 C ATOM 1252 C GLU A 84 -2.881 7.355 -7.134 1.00 0.00 C ATOM 1253 O GLU A 84 -2.476 7.326 -5.971 1.00 0.00 O ATOM 1254 CB GLU A 84 -4.502 5.723 -8.076 1.00 0.00 C ATOM 1255 CG GLU A 84 -4.250 4.654 -7.018 1.00 0.00 C ATOM 1256 CD GLU A 84 -5.413 4.629 -6.033 1.00 0.00 C ATOM 1257 OE1 GLU A 84 -6.396 5.305 -6.293 1.00 0.00 O ATOM 1258 OE2 GLU A 84 -5.307 3.933 -5.038 1.00 0.00 O ATOM 0 H GLU A 84 -5.081 7.782 -9.303 1.00 0.00 H new ATOM 0 HA GLU A 84 -4.931 7.163 -6.533 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -5.503 5.609 -8.491 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -3.799 5.605 -8.901 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -4.139 3.678 -7.491 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -3.318 4.861 -6.492 1.00 0.00 H new ATOM 1265 N LEU A 85 -2.082 7.600 -8.169 1.00 0.00 N ATOM 1266 CA LEU A 85 -0.658 7.846 -7.974 1.00 0.00 C ATOM 1267 C LEU A 85 -0.437 9.157 -7.225 1.00 0.00 C ATOM 1268 O LEU A 85 0.649 9.403 -6.687 1.00 0.00 O ATOM 1269 CB LEU A 85 0.050 7.905 -9.337 1.00 0.00 C ATOM 1270 CG LEU A 85 0.236 6.485 -9.894 1.00 0.00 C ATOM 1271 CD1 LEU A 85 0.720 6.567 -11.352 1.00 0.00 C ATOM 1272 CD2 LEU A 85 1.254 5.697 -9.031 1.00 0.00 C ATOM 0 H LEU A 85 -2.392 7.633 -9.140 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.243 7.031 -7.381 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -0.535 8.504 -10.034 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.019 8.393 -9.232 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.718 5.959 -9.862 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.852 5.560 -11.749 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -0.019 7.099 -11.951 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.670 7.100 -11.391 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.375 4.693 -9.438 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.215 6.211 -9.041 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.889 5.632 -8.006 1.00 0.00 H new ATOM 1284 N LYS A 86 -1.477 9.976 -7.148 1.00 0.00 N ATOM 1285 CA LYS A 86 -1.387 11.241 -6.437 1.00 0.00 C ATOM 1286 C LYS A 86 -1.555 11.030 -4.937 1.00 0.00 C ATOM 1287 O LYS A 86 -0.763 11.530 -4.138 1.00 0.00 O ATOM 1288 CB LYS A 86 -2.469 12.189 -6.953 1.00 0.00 C ATOM 1289 CG LYS A 86 -2.278 13.571 -6.336 1.00 0.00 C ATOM 1290 CD LYS A 86 -3.316 14.535 -6.911 1.00 0.00 C ATOM 1291 CE LYS A 86 -3.107 15.924 -6.307 1.00 0.00 C ATOM 1292 NZ LYS A 86 -4.093 16.874 -6.896 1.00 0.00 N ATOM 0 H LYS A 86 -2.388 9.787 -7.567 1.00 0.00 H new ATOM 0 HA LYS A 86 -0.403 11.675 -6.613 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -2.420 12.255 -8.040 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -3.456 11.801 -6.702 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.380 13.514 -5.252 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -1.272 13.937 -6.543 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.225 14.581 -7.996 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -4.322 14.178 -6.691 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -3.227 15.883 -5.224 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.092 16.269 -6.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.952 17.819 -6.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -3.958 16.920 -7.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -5.058 16.547 -6.687 1.00 0.00 H new ATOM 1306 N GLU A 87 -2.589 10.287 -4.554 1.00 0.00 N ATOM 1307 CA GLU A 87 -2.833 10.028 -3.140 1.00 0.00 C ATOM 1308 C GLU A 87 -1.702 9.182 -2.564 1.00 0.00 C ATOM 1309 O GLU A 87 -1.207 9.448 -1.467 1.00 0.00 O ATOM 1310 CB GLU A 87 -4.174 9.311 -2.962 1.00 0.00 C ATOM 1311 CG GLU A 87 -4.497 9.180 -1.473 1.00 0.00 C ATOM 1312 CD GLU A 87 -5.880 8.559 -1.292 1.00 0.00 C ATOM 1313 OE1 GLU A 87 -6.410 8.046 -2.263 1.00 0.00 O ATOM 1314 OE2 GLU A 87 -6.390 8.608 -0.183 1.00 0.00 O ATOM 0 H GLU A 87 -3.261 9.860 -5.191 1.00 0.00 H new ATOM 0 HA GLU A 87 -2.870 10.977 -2.606 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -4.964 9.867 -3.467 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -4.133 8.324 -3.423 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.745 8.562 -0.982 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -4.464 10.160 -0.998 1.00 0.00 H new ATOM 1321 N ALA A 88 -1.290 8.169 -3.321 1.00 0.00 N ATOM 1322 CA ALA A 88 -0.209 7.295 -2.887 1.00 0.00 C ATOM 1323 C ALA A 88 1.042 8.124 -2.616 1.00 0.00 C ATOM 1324 O ALA A 88 1.658 8.004 -1.556 1.00 0.00 O ATOM 1325 CB ALA A 88 0.079 6.231 -3.960 1.00 0.00 C ATOM 0 H ALA A 88 -1.686 7.935 -4.231 1.00 0.00 H new ATOM 0 HA ALA A 88 -0.507 6.788 -1.969 1.00 0.00 H new ATOM 0 HB1 ALA A 88 0.889 5.584 -3.623 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.816 5.633 -4.129 1.00 0.00 H new ATOM 0 HB3 ALA A 88 0.369 6.721 -4.890 1.00 0.00 H new ATOM 1331 N PHE A 89 1.407 8.982 -3.568 1.00 0.00 N ATOM 1332 CA PHE A 89 2.574 9.837 -3.400 1.00 0.00 C ATOM 1333 C PHE A 89 2.401 10.734 -2.178 1.00 0.00 C ATOM 1334 O PHE A 89 3.335 10.929 -1.402 1.00 0.00 O ATOM 1335 CB PHE A 89 2.779 10.695 -4.645 1.00 0.00 C ATOM 1336 CG PHE A 89 4.008 11.553 -4.469 1.00 0.00 C ATOM 1337 CD1 PHE A 89 5.261 11.077 -4.876 1.00 0.00 C ATOM 1338 CD2 PHE A 89 3.894 12.825 -3.899 1.00 0.00 C ATOM 1339 CE1 PHE A 89 6.399 11.874 -4.713 1.00 0.00 C ATOM 1340 CE2 PHE A 89 5.034 13.624 -3.736 1.00 0.00 C ATOM 1341 CZ PHE A 89 6.286 13.149 -4.143 1.00 0.00 C ATOM 0 H PHE A 89 0.915 9.101 -4.454 1.00 0.00 H new ATOM 0 HA PHE A 89 3.450 9.205 -3.254 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.889 10.059 -5.524 1.00 0.00 H new ATOM 0 HB3 PHE A 89 1.905 11.324 -4.814 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.348 10.094 -5.316 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.928 13.191 -3.585 1.00 0.00 H new ATOM 0 HE1 PHE A 89 7.365 11.506 -5.027 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.946 14.606 -3.296 1.00 0.00 H new ATOM 0 HZ PHE A 89 7.164 13.765 -4.018 1.00 0.00 H new ATOM 1351 N LYS A 90 1.198 11.277 -2.018 1.00 0.00 N ATOM 1352 CA LYS A 90 0.912 12.157 -0.892 1.00 0.00 C ATOM 1353 C LYS A 90 1.199 11.440 0.426 1.00 0.00 C ATOM 1354 O LYS A 90 1.639 12.060 1.392 1.00 0.00 O ATOM 1355 CB LYS A 90 -0.556 12.597 -0.929 1.00 0.00 C ATOM 1356 CG LYS A 90 -0.812 13.627 0.175 1.00 0.00 C ATOM 1357 CD LYS A 90 -2.268 14.101 0.107 1.00 0.00 C ATOM 1358 CE LYS A 90 -2.530 15.131 1.212 1.00 0.00 C ATOM 1359 NZ LYS A 90 -1.970 16.451 0.804 1.00 0.00 N ATOM 0 H LYS A 90 0.411 11.124 -2.649 1.00 0.00 H new ATOM 0 HA LYS A 90 1.553 13.036 -0.966 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -0.793 13.026 -1.903 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.208 11.734 -0.794 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -0.607 13.187 1.151 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.137 14.475 0.059 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -2.472 14.541 -0.869 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.942 13.252 0.221 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.601 15.219 1.395 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.073 14.803 2.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.192 17.162 1.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.938 16.373 0.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.389 16.740 -0.103 1.00 0.00 H new ATOM 1373 N VAL A 91 0.953 10.133 0.459 1.00 0.00 N ATOM 1374 CA VAL A 91 1.199 9.356 1.671 1.00 0.00 C ATOM 1375 C VAL A 91 2.698 9.155 1.886 1.00 0.00 C ATOM 1376 O VAL A 91 3.252 9.556 2.910 1.00 0.00 O ATOM 1377 CB VAL A 91 0.517 7.988 1.552 1.00 0.00 C ATOM 1378 CG1 VAL A 91 0.916 7.095 2.734 1.00 0.00 C ATOM 1379 CG2 VAL A 91 -1.003 8.177 1.544 1.00 0.00 C ATOM 0 H VAL A 91 0.589 9.595 -0.328 1.00 0.00 H new ATOM 0 HA VAL A 91 0.791 9.902 2.522 1.00 0.00 H new ATOM 0 HB VAL A 91 0.833 7.511 0.624 1.00 0.00 H new ATOM 0 HG11 VAL A 91 0.426 6.126 2.640 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.997 6.956 2.737 1.00 0.00 H new ATOM 0 HG13 VAL A 91 0.609 7.567 3.667 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.490 7.206 1.459 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.315 8.660 2.470 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.288 8.801 0.696 1.00 0.00 H new ATOM 1389 N PHE A 92 3.343 8.531 0.908 1.00 0.00 N ATOM 1390 CA PHE A 92 4.773 8.271 0.999 1.00 0.00 C ATOM 1391 C PHE A 92 5.505 9.570 1.261 1.00 0.00 C ATOM 1392 O PHE A 92 6.391 9.626 2.105 1.00 0.00 O ATOM 1393 CB PHE A 92 5.282 7.643 -0.303 1.00 0.00 C ATOM 1394 CG PHE A 92 4.314 6.576 -0.774 1.00 0.00 C ATOM 1395 CD1 PHE A 92 3.702 5.701 0.140 1.00 0.00 C ATOM 1396 CD2 PHE A 92 4.015 6.476 -2.139 1.00 0.00 C ATOM 1397 CE1 PHE A 92 2.801 4.734 -0.314 1.00 0.00 C ATOM 1398 CE2 PHE A 92 3.111 5.510 -2.587 1.00 0.00 C ATOM 1399 CZ PHE A 92 2.503 4.639 -1.675 1.00 0.00 C ATOM 0 H PHE A 92 2.903 8.198 0.050 1.00 0.00 H new ATOM 0 HA PHE A 92 4.957 7.576 1.818 1.00 0.00 H new ATOM 0 HB2 PHE A 92 5.391 8.411 -1.069 1.00 0.00 H new ATOM 0 HB3 PHE A 92 6.269 7.207 -0.145 1.00 0.00 H new ATOM 0 HD1 PHE A 92 3.928 5.776 1.193 1.00 0.00 H new ATOM 0 HD2 PHE A 92 4.483 7.146 -2.845 1.00 0.00 H new ATOM 0 HE1 PHE A 92 2.335 4.059 0.389 1.00 0.00 H new ATOM 0 HE2 PHE A 92 2.881 5.435 -3.639 1.00 0.00 H new ATOM 0 HZ PHE A 92 1.804 3.894 -2.024 1.00 0.00 H new ATOM 1409 N ASP A 93 5.130 10.615 0.549 1.00 0.00 N ATOM 1410 CA ASP A 93 5.768 11.907 0.739 1.00 0.00 C ATOM 1411 C ASP A 93 5.078 12.684 1.853 1.00 0.00 C ATOM 1412 O ASP A 93 4.458 13.712 1.602 1.00 0.00 O ATOM 1413 CB ASP A 93 5.704 12.720 -0.550 1.00 0.00 C ATOM 1414 CG ASP A 93 6.655 13.908 -0.463 1.00 0.00 C ATOM 1415 OD1 ASP A 93 7.343 14.027 0.543 1.00 0.00 O ATOM 1416 OD2 ASP A 93 6.688 14.684 -1.405 1.00 0.00 O ATOM 0 H ASP A 93 4.396 10.598 -0.159 1.00 0.00 H new ATOM 0 HA ASP A 93 6.809 11.735 1.012 1.00 0.00 H new ATOM 0 HB2 ASP A 93 5.970 12.092 -1.400 1.00 0.00 H new ATOM 0 HB3 ASP A 93 4.686 13.070 -0.719 1.00 0.00 H new ATOM 1421 N LYS A 94 5.141 12.162 3.076 1.00 0.00 N ATOM 1422 CA LYS A 94 4.490 12.815 4.208 1.00 0.00 C ATOM 1423 C LYS A 94 4.665 14.330 4.156 1.00 0.00 C ATOM 1424 O LYS A 94 3.687 15.080 4.173 1.00 0.00 O ATOM 1425 CB LYS A 94 5.101 12.300 5.516 1.00 0.00 C ATOM 1426 CG LYS A 94 4.164 12.611 6.701 1.00 0.00 C ATOM 1427 CD LYS A 94 3.145 11.470 6.889 1.00 0.00 C ATOM 1428 CE LYS A 94 3.743 10.380 7.784 1.00 0.00 C ATOM 1429 NZ LYS A 94 2.772 9.258 7.917 1.00 0.00 N ATOM 0 H LYS A 94 5.631 11.298 3.307 1.00 0.00 H new ATOM 0 HA LYS A 94 3.426 12.583 4.159 1.00 0.00 H new ATOM 0 HB2 LYS A 94 5.269 11.225 5.449 1.00 0.00 H new ATOM 0 HB3 LYS A 94 6.073 12.765 5.680 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.749 12.740 7.612 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.640 13.550 6.523 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.230 11.858 7.336 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.874 11.050 5.921 1.00 0.00 H new ATOM 0 HE2 LYS A 94 4.678 10.017 7.358 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.978 10.790 8.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 3.178 8.518 8.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 1.891 9.610 8.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.569 8.862 6.977 1.00 0.00 H new ATOM 1443 N ASP A 95 5.919 14.771 4.108 1.00 0.00 N ATOM 1444 CA ASP A 95 6.211 16.199 4.078 1.00 0.00 C ATOM 1445 C ASP A 95 5.655 16.820 2.806 1.00 0.00 C ATOM 1446 O ASP A 95 5.633 18.039 2.661 1.00 0.00 O ATOM 1447 CB ASP A 95 7.721 16.435 4.136 1.00 0.00 C ATOM 1448 CG ASP A 95 8.366 15.447 5.097 1.00 0.00 C ATOM 1449 OD1 ASP A 95 7.781 15.197 6.140 1.00 0.00 O ATOM 1450 OD2 ASP A 95 9.430 14.950 4.768 1.00 0.00 O ATOM 0 H ASP A 95 6.741 14.167 4.089 1.00 0.00 H new ATOM 0 HA ASP A 95 5.741 16.664 4.945 1.00 0.00 H new ATOM 0 HB2 ASP A 95 8.153 16.323 3.142 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.926 17.456 4.459 1.00 0.00 H new ATOM 1455 N GLN A 96 5.213 15.962 1.889 1.00 0.00 N ATOM 1456 CA GLN A 96 4.649 16.413 0.617 1.00 0.00 C ATOM 1457 C GLN A 96 5.480 17.543 0.028 1.00 0.00 C ATOM 1458 O GLN A 96 4.972 18.390 -0.706 1.00 0.00 O ATOM 1459 CB GLN A 96 3.190 16.872 0.803 1.00 0.00 C ATOM 1460 CG GLN A 96 3.110 18.071 1.765 1.00 0.00 C ATOM 1461 CD GLN A 96 1.725 18.693 1.728 1.00 0.00 C ATOM 1462 OE1 GLN A 96 1.155 18.899 0.657 1.00 0.00 O ATOM 1463 NE2 GLN A 96 1.153 19.009 2.854 1.00 0.00 N ATOM 0 H GLN A 96 5.234 14.949 2.003 1.00 0.00 H new ATOM 0 HA GLN A 96 4.666 15.572 -0.076 1.00 0.00 H new ATOM 0 HB2 GLN A 96 2.765 17.146 -0.162 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.592 16.048 1.192 1.00 0.00 H new ATOM 0 HG2 GLN A 96 3.342 17.747 2.779 1.00 0.00 H new ATOM 0 HG3 GLN A 96 3.857 18.816 1.490 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.633 18.834 3.737 1.00 0.00 H new ATOM 0 HE22 GLN A 96 0.224 19.431 2.853 1.00 0.00 H new ATOM 1472 N ASN A 97 6.759 17.558 0.369 1.00 0.00 N ATOM 1473 CA ASN A 97 7.653 18.600 -0.118 1.00 0.00 C ATOM 1474 C ASN A 97 7.965 18.394 -1.594 1.00 0.00 C ATOM 1475 O ASN A 97 8.734 19.150 -2.188 1.00 0.00 O ATOM 1476 CB ASN A 97 8.948 18.598 0.696 1.00 0.00 C ATOM 1477 CG ASN A 97 9.456 17.170 0.859 1.00 0.00 C ATOM 1478 OD1 ASN A 97 9.042 16.246 0.039 1.00 0.00 O flip ATOM 1479 ND2 ASN A 97 10.247 16.886 1.761 1.00 0.00 N flip ATOM 0 H ASN A 97 7.200 16.867 0.976 1.00 0.00 H new ATOM 0 HA ASN A 97 7.158 19.564 -0.002 1.00 0.00 H new ATOM 0 HB2 ASN A 97 9.702 19.207 0.197 1.00 0.00 H new ATOM 0 HB3 ASN A 97 8.773 19.045 1.675 1.00 0.00 H new ATOM 0 HD21 ASN A 97 10.570 17.610 2.402 1.00 0.00 H new ATOM 0 HD22 ASN A 97 10.578 15.927 1.866 1.00 0.00 H new ATOM 1486 N GLY A 98 7.356 17.366 -2.180 1.00 0.00 N ATOM 1487 CA GLY A 98 7.565 17.055 -3.590 1.00 0.00 C ATOM 1488 C GLY A 98 8.617 15.965 -3.752 1.00 0.00 C ATOM 1489 O GLY A 98 8.933 15.562 -4.871 1.00 0.00 O ATOM 0 H GLY A 98 6.714 16.735 -1.700 1.00 0.00 H new ATOM 0 HA2 GLY A 98 6.626 16.730 -4.039 1.00 0.00 H new ATOM 0 HA3 GLY A 98 7.879 17.953 -4.123 1.00 0.00 H new ATOM 1493 N TYR A 99 9.163 15.486 -2.629 1.00 0.00 N ATOM 1494 CA TYR A 99 10.184 14.440 -2.669 1.00 0.00 C ATOM 1495 C TYR A 99 9.929 13.412 -1.574 1.00 0.00 C ATOM 1496 O TYR A 99 9.498 13.758 -0.472 1.00 0.00 O ATOM 1497 CB TYR A 99 11.575 15.061 -2.480 1.00 0.00 C ATOM 1498 CG TYR A 99 11.619 16.414 -3.149 1.00 0.00 C ATOM 1499 CD1 TYR A 99 11.700 16.511 -4.543 1.00 0.00 C ATOM 1500 CD2 TYR A 99 11.576 17.576 -2.370 1.00 0.00 C ATOM 1501 CE1 TYR A 99 11.740 17.768 -5.156 1.00 0.00 C ATOM 1502 CE2 TYR A 99 11.617 18.833 -2.983 1.00 0.00 C ATOM 1503 CZ TYR A 99 11.698 18.928 -4.376 1.00 0.00 C ATOM 1504 OH TYR A 99 11.739 20.168 -4.981 1.00 0.00 O ATOM 0 H TYR A 99 8.917 15.804 -1.692 1.00 0.00 H new ATOM 0 HA TYR A 99 10.139 13.944 -3.638 1.00 0.00 H new ATOM 0 HB2 TYR A 99 11.799 15.161 -1.418 1.00 0.00 H new ATOM 0 HB3 TYR A 99 12.337 14.408 -2.906 1.00 0.00 H new ATOM 0 HD1 TYR A 99 11.732 15.615 -5.146 1.00 0.00 H new ATOM 0 HD2 TYR A 99 11.511 17.502 -1.294 1.00 0.00 H new ATOM 0 HE1 TYR A 99 11.803 17.842 -6.232 1.00 0.00 H new ATOM 0 HE2 TYR A 99 11.586 19.729 -2.381 1.00 0.00 H new ATOM 0 HH TYR A 99 11.700 20.868 -4.296 1.00 0.00 H new ATOM 1514 N ILE A 100 10.200 12.145 -1.881 1.00 0.00 N ATOM 1515 CA ILE A 100 9.999 11.077 -0.913 1.00 0.00 C ATOM 1516 C ILE A 100 11.315 10.773 -0.212 1.00 0.00 C ATOM 1517 O ILE A 100 12.263 10.278 -0.832 1.00 0.00 O ATOM 1518 CB ILE A 100 9.493 9.804 -1.616 1.00 0.00 C ATOM 1519 CG1 ILE A 100 8.482 10.181 -2.710 1.00 0.00 C ATOM 1520 CG2 ILE A 100 8.817 8.892 -0.590 1.00 0.00 C ATOM 1521 CD1 ILE A 100 7.855 8.914 -3.309 1.00 0.00 C ATOM 0 H ILE A 100 10.556 11.838 -2.786 1.00 0.00 H new ATOM 0 HA ILE A 100 9.256 11.400 -0.184 1.00 0.00 H new ATOM 0 HB ILE A 100 10.336 9.283 -2.070 1.00 0.00 H new ATOM 0 HG12 ILE A 100 7.703 10.819 -2.292 1.00 0.00 H new ATOM 0 HG13 ILE A 100 8.978 10.755 -3.492 1.00 0.00 H new ATOM 0 HG21 ILE A 100 8.458 7.990 -1.086 1.00 0.00 H new ATOM 0 HG22 ILE A 100 9.535 8.620 0.184 1.00 0.00 H new ATOM 0 HG23 ILE A 100 7.976 9.416 -0.136 1.00 0.00 H new ATOM 0 HD11 ILE A 100 7.140 9.193 -4.083 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.637 8.292 -3.744 1.00 0.00 H new ATOM 0 HD13 ILE A 100 7.342 8.356 -2.525 1.00 0.00 H new ATOM 1533 N SER A 101 11.360 11.079 1.081 1.00 0.00 N ATOM 1534 CA SER A 101 12.554 10.836 1.882 1.00 0.00 C ATOM 1535 C SER A 101 12.638 9.365 2.279 1.00 0.00 C ATOM 1536 O SER A 101 11.620 8.679 2.381 1.00 0.00 O ATOM 1537 CB SER A 101 12.530 11.699 3.146 1.00 0.00 C ATOM 1538 OG SER A 101 12.254 13.046 2.792 1.00 0.00 O ATOM 0 H SER A 101 10.584 11.495 1.596 1.00 0.00 H new ATOM 0 HA SER A 101 13.426 11.097 1.282 1.00 0.00 H new ATOM 0 HB2 SER A 101 11.772 11.330 3.837 1.00 0.00 H new ATOM 0 HB3 SER A 101 13.489 11.636 3.661 1.00 0.00 H new ATOM 0 HG SER A 101 11.290 13.158 2.657 1.00 0.00 H new ATOM 1544 N ALA A 102 13.858 8.886 2.503 1.00 0.00 N ATOM 1545 CA ALA A 102 14.062 7.494 2.888 1.00 0.00 C ATOM 1546 C ALA A 102 13.315 7.172 4.178 1.00 0.00 C ATOM 1547 O ALA A 102 12.673 6.131 4.287 1.00 0.00 O ATOM 1548 CB ALA A 102 15.554 7.219 3.083 1.00 0.00 C ATOM 0 H ALA A 102 14.714 9.436 2.425 1.00 0.00 H new ATOM 0 HA ALA A 102 13.673 6.861 2.091 1.00 0.00 H new ATOM 0 HB1 ALA A 102 15.697 6.177 3.370 1.00 0.00 H new ATOM 0 HB2 ALA A 102 16.085 7.415 2.151 1.00 0.00 H new ATOM 0 HB3 ALA A 102 15.944 7.869 3.866 1.00 0.00 H new ATOM 1554 N SER A 103 13.400 8.069 5.153 1.00 0.00 N ATOM 1555 CA SER A 103 12.728 7.858 6.428 1.00 0.00 C ATOM 1556 C SER A 103 11.222 7.716 6.229 1.00 0.00 C ATOM 1557 O SER A 103 10.576 6.880 6.857 1.00 0.00 O ATOM 1558 CB SER A 103 13.013 9.031 7.365 1.00 0.00 C ATOM 1559 OG SER A 103 14.413 9.122 7.588 1.00 0.00 O ATOM 0 H SER A 103 13.923 8.942 5.086 1.00 0.00 H new ATOM 0 HA SER A 103 13.109 6.937 6.869 1.00 0.00 H new ATOM 0 HB2 SER A 103 12.641 9.958 6.929 1.00 0.00 H new ATOM 0 HB3 SER A 103 12.490 8.891 8.311 1.00 0.00 H new ATOM 0 HG SER A 103 14.601 9.874 8.187 1.00 0.00 H new ATOM 1565 N GLU A 104 10.670 8.545 5.356 1.00 0.00 N ATOM 1566 CA GLU A 104 9.239 8.509 5.086 1.00 0.00 C ATOM 1567 C GLU A 104 8.839 7.181 4.453 1.00 0.00 C ATOM 1568 O GLU A 104 8.010 6.444 4.993 1.00 0.00 O ATOM 1569 CB GLU A 104 8.879 9.643 4.136 1.00 0.00 C ATOM 1570 CG GLU A 104 9.062 10.988 4.837 1.00 0.00 C ATOM 1571 CD GLU A 104 9.010 12.102 3.800 1.00 0.00 C ATOM 1572 OE1 GLU A 104 9.713 11.982 2.815 1.00 0.00 O ATOM 1573 OE2 GLU A 104 8.276 13.053 4.005 1.00 0.00 O ATOM 0 H GLU A 104 11.186 9.247 4.825 1.00 0.00 H new ATOM 0 HA GLU A 104 8.705 8.621 6.029 1.00 0.00 H new ATOM 0 HB2 GLU A 104 9.508 9.598 3.247 1.00 0.00 H new ATOM 0 HB3 GLU A 104 7.847 9.535 3.802 1.00 0.00 H new ATOM 0 HG2 GLU A 104 8.281 11.132 5.583 1.00 0.00 H new ATOM 0 HG3 GLU A 104 10.015 11.010 5.365 1.00 0.00 H new ATOM 1580 N LEU A 105 9.440 6.877 3.308 1.00 0.00 N ATOM 1581 CA LEU A 105 9.139 5.634 2.608 1.00 0.00 C ATOM 1582 C LEU A 105 9.491 4.442 3.480 1.00 0.00 C ATOM 1583 O LEU A 105 8.925 3.363 3.325 1.00 0.00 O ATOM 1584 CB LEU A 105 9.944 5.559 1.299 1.00 0.00 C ATOM 1585 CG LEU A 105 9.719 4.202 0.603 1.00 0.00 C ATOM 1586 CD1 LEU A 105 8.219 3.984 0.346 1.00 0.00 C ATOM 1587 CD2 LEU A 105 10.492 4.181 -0.727 1.00 0.00 C ATOM 0 H LEU A 105 10.132 7.468 2.848 1.00 0.00 H new ATOM 0 HA LEU A 105 8.073 5.613 2.382 1.00 0.00 H new ATOM 0 HB2 LEU A 105 9.645 6.369 0.634 1.00 0.00 H new ATOM 0 HB3 LEU A 105 11.005 5.695 1.509 1.00 0.00 H new ATOM 0 HG LEU A 105 10.081 3.399 1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.070 3.023 -0.146 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.682 3.993 1.295 1.00 0.00 H new ATOM 0 HD13 LEU A 105 7.840 4.781 -0.293 1.00 0.00 H new ATOM 0 HD21 LEU A 105 10.336 3.223 -1.223 1.00 0.00 H new ATOM 0 HD22 LEU A 105 10.133 4.985 -1.369 1.00 0.00 H new ATOM 0 HD23 LEU A 105 11.555 4.320 -0.532 1.00 0.00 H new ATOM 1599 N ARG A 106 10.401 4.654 4.420 1.00 0.00 N ATOM 1600 CA ARG A 106 10.804 3.586 5.327 1.00 0.00 C ATOM 1601 C ARG A 106 9.758 3.363 6.407 1.00 0.00 C ATOM 1602 O ARG A 106 9.337 2.226 6.651 1.00 0.00 O ATOM 1603 CB ARG A 106 12.158 3.929 5.964 1.00 0.00 C ATOM 1604 CG ARG A 106 12.570 2.838 6.957 1.00 0.00 C ATOM 1605 CD ARG A 106 13.940 3.175 7.541 1.00 0.00 C ATOM 1606 NE ARG A 106 14.395 2.084 8.392 1.00 0.00 N ATOM 1607 CZ ARG A 106 13.988 1.988 9.654 1.00 0.00 C ATOM 1608 NH1 ARG A 106 13.168 2.877 10.144 1.00 0.00 N ATOM 1609 NH2 ARG A 106 14.406 1.004 10.401 1.00 0.00 N ATOM 0 H ARG A 106 10.871 5.546 4.575 1.00 0.00 H new ATOM 0 HA ARG A 106 10.898 2.664 4.753 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.917 4.030 5.188 1.00 0.00 H new ATOM 0 HB3 ARG A 106 12.094 4.890 6.475 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.832 2.759 7.755 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.604 1.870 6.457 1.00 0.00 H new ATOM 0 HD2 ARG A 106 14.656 3.345 6.737 1.00 0.00 H new ATOM 0 HD3 ARG A 106 13.883 4.098 8.117 1.00 0.00 H new ATOM 0 HE ARG A 106 15.034 1.384 8.015 1.00 0.00 H new ATOM 0 HH11 ARG A 106 12.840 3.645 9.559 1.00 0.00 H new ATOM 0 HH12 ARG A 106 12.855 2.804 11.112 1.00 0.00 H new ATOM 0 HH21 ARG A 106 15.045 0.308 10.017 1.00 0.00 H new ATOM 0 HH22 ARG A 106 14.094 0.930 11.369 1.00 0.00 H new ATOM 1623 N HIS A 107 9.342 4.453 7.050 1.00 0.00 N ATOM 1624 CA HIS A 107 8.354 4.359 8.108 1.00 0.00 C ATOM 1625 C HIS A 107 7.130 3.629 7.608 1.00 0.00 C ATOM 1626 O HIS A 107 6.679 2.680 8.238 1.00 0.00 O ATOM 1627 CB HIS A 107 7.947 5.756 8.583 1.00 0.00 C ATOM 1628 CG HIS A 107 9.052 6.361 9.403 1.00 0.00 C ATOM 1629 ND1 HIS A 107 9.483 7.662 9.210 1.00 0.00 N ATOM 1630 CD2 HIS A 107 9.817 5.858 10.425 1.00 0.00 C ATOM 1631 CE1 HIS A 107 10.468 7.899 10.095 1.00 0.00 C ATOM 1632 NE2 HIS A 107 10.712 6.831 10.861 1.00 0.00 N ATOM 0 H HIS A 107 9.673 5.398 6.856 1.00 0.00 H new ATOM 0 HA HIS A 107 8.793 3.810 8.941 1.00 0.00 H new ATOM 0 HB2 HIS A 107 7.729 6.392 7.725 1.00 0.00 H new ATOM 0 HB3 HIS A 107 7.034 5.696 9.175 1.00 0.00 H new ATOM 0 HD2 HIS A 107 9.737 4.860 10.829 1.00 0.00 H new ATOM 0 HE1 HIS A 107 10.997 8.837 10.177 1.00 0.00 H new ATOM 0 HE2 HIS A 107 11.405 6.747 11.605 1.00 0.00 H new ATOM 1641 N VAL A 108 6.584 4.070 6.479 1.00 0.00 N ATOM 1642 CA VAL A 108 5.401 3.421 5.944 1.00 0.00 C ATOM 1643 C VAL A 108 5.692 1.954 5.674 1.00 0.00 C ATOM 1644 O VAL A 108 5.069 1.089 6.276 1.00 0.00 O ATOM 1645 CB VAL A 108 4.985 4.103 4.646 1.00 0.00 C ATOM 1646 CG1 VAL A 108 3.693 3.469 4.119 1.00 0.00 C ATOM 1647 CG2 VAL A 108 4.769 5.593 4.904 1.00 0.00 C ATOM 0 H VAL A 108 6.934 4.856 5.931 1.00 0.00 H new ATOM 0 HA VAL A 108 4.593 3.499 6.672 1.00 0.00 H new ATOM 0 HB VAL A 108 5.770 3.977 3.900 1.00 0.00 H new ATOM 0 HG11 VAL A 108 3.399 3.960 3.191 1.00 0.00 H new ATOM 0 HG12 VAL A 108 3.858 2.408 3.932 1.00 0.00 H new ATOM 0 HG13 VAL A 108 2.901 3.588 4.859 1.00 0.00 H new ATOM 0 HG21 VAL A 108 4.471 6.083 3.977 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.986 5.723 5.651 1.00 0.00 H new ATOM 0 HG23 VAL A 108 5.695 6.037 5.268 1.00 0.00 H new ATOM 1657 N MET A 109 6.609 1.684 4.738 1.00 0.00 N ATOM 1658 CA MET A 109 6.940 0.298 4.364 1.00 0.00 C ATOM 1659 C MET A 109 6.750 -0.644 5.554 1.00 0.00 C ATOM 1660 O MET A 109 5.844 -1.477 5.557 1.00 0.00 O ATOM 1661 CB MET A 109 8.390 0.226 3.871 1.00 0.00 C ATOM 1662 CG MET A 109 8.562 -0.964 2.935 1.00 0.00 C ATOM 1663 SD MET A 109 7.766 -0.592 1.351 1.00 0.00 S ATOM 1664 CE MET A 109 6.976 -2.200 1.103 1.00 0.00 C ATOM 0 H MET A 109 7.132 2.396 4.228 1.00 0.00 H new ATOM 0 HA MET A 109 6.268 -0.015 3.565 1.00 0.00 H new ATOM 0 HB2 MET A 109 8.653 1.148 3.353 1.00 0.00 H new ATOM 0 HB3 MET A 109 9.067 0.133 4.720 1.00 0.00 H new ATOM 0 HG2 MET A 109 9.621 -1.173 2.784 1.00 0.00 H new ATOM 0 HG3 MET A 109 8.120 -1.857 3.377 1.00 0.00 H new ATOM 0 HE1 MET A 109 6.450 -2.203 0.148 1.00 0.00 H new ATOM 0 HE2 MET A 109 7.735 -2.982 1.102 1.00 0.00 H new ATOM 0 HE3 MET A 109 6.266 -2.385 1.909 1.00 0.00 H new ATOM 1674 N ILE A 110 7.600 -0.517 6.560 1.00 0.00 N ATOM 1675 CA ILE A 110 7.482 -1.375 7.730 1.00 0.00 C ATOM 1676 C ILE A 110 6.094 -1.249 8.366 1.00 0.00 C ATOM 1677 O ILE A 110 5.554 -2.225 8.893 1.00 0.00 O ATOM 1678 CB ILE A 110 8.547 -0.995 8.748 1.00 0.00 C ATOM 1679 CG1 ILE A 110 8.470 -1.936 9.944 1.00 0.00 C ATOM 1680 CG2 ILE A 110 8.322 0.442 9.210 1.00 0.00 C ATOM 1681 CD1 ILE A 110 9.701 -1.723 10.822 1.00 0.00 C ATOM 0 H ILE A 110 8.365 0.157 6.593 1.00 0.00 H new ATOM 0 HA ILE A 110 7.622 -2.409 7.415 1.00 0.00 H new ATOM 0 HB ILE A 110 9.532 -1.077 8.289 1.00 0.00 H new ATOM 0 HG12 ILE A 110 7.562 -1.745 10.516 1.00 0.00 H new ATOM 0 HG13 ILE A 110 8.422 -2.971 9.606 1.00 0.00 H new ATOM 0 HG21 ILE A 110 9.085 0.713 9.939 1.00 0.00 H new ATOM 0 HG22 ILE A 110 8.383 1.113 8.353 1.00 0.00 H new ATOM 0 HG23 ILE A 110 7.336 0.527 9.668 1.00 0.00 H new ATOM 0 HD11 ILE A 110 9.655 -2.392 11.681 1.00 0.00 H new ATOM 0 HD12 ILE A 110 10.601 -1.935 10.245 1.00 0.00 H new ATOM 0 HD13 ILE A 110 9.727 -0.690 11.168 1.00 0.00 H new ATOM 1693 N ASN A 111 5.521 -0.045 8.323 1.00 0.00 N ATOM 1694 CA ASN A 111 4.201 0.185 8.907 1.00 0.00 C ATOM 1695 C ASN A 111 3.193 -0.824 8.375 1.00 0.00 C ATOM 1696 O ASN A 111 2.096 -0.963 8.919 1.00 0.00 O ATOM 1697 CB ASN A 111 3.711 1.612 8.591 1.00 0.00 C ATOM 1698 CG ASN A 111 2.634 2.038 9.572 1.00 0.00 C ATOM 1699 OD1 ASN A 111 2.873 2.886 10.431 1.00 0.00 O ATOM 1700 ND2 ASN A 111 1.452 1.505 9.481 1.00 0.00 N ATOM 0 H ASN A 111 5.946 0.777 7.894 1.00 0.00 H new ATOM 0 HA ASN A 111 4.288 0.066 9.987 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.548 2.308 8.637 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.320 1.651 7.574 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.714 1.789 10.125 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.263 0.803 8.766 1.00 0.00 H new ATOM 1707 N LEU A 112 3.565 -1.535 7.314 1.00 0.00 N ATOM 1708 CA LEU A 112 2.668 -2.530 6.728 1.00 0.00 C ATOM 1709 C LEU A 112 2.935 -3.903 7.330 1.00 0.00 C ATOM 1710 O LEU A 112 2.530 -4.183 8.456 1.00 0.00 O ATOM 1711 CB LEU A 112 2.837 -2.585 5.195 1.00 0.00 C ATOM 1712 CG LEU A 112 2.170 -1.372 4.502 1.00 0.00 C ATOM 1713 CD1 LEU A 112 0.678 -1.262 4.855 1.00 0.00 C ATOM 1714 CD2 LEU A 112 2.887 -0.088 4.902 1.00 0.00 C ATOM 0 H LEU A 112 4.467 -1.444 6.847 1.00 0.00 H new ATOM 0 HA LEU A 112 1.643 -2.237 6.953 1.00 0.00 H new ATOM 0 HB2 LEU A 112 3.898 -2.608 4.946 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.400 -3.508 4.813 1.00 0.00 H new ATOM 0 HG LEU A 112 2.249 -1.522 3.425 1.00 0.00 H new ATOM 0 HD11 LEU A 112 0.247 -0.398 4.349 1.00 0.00 H new ATOM 0 HD12 LEU A 112 0.161 -2.166 4.534 1.00 0.00 H new ATOM 0 HD13 LEU A 112 0.567 -1.144 5.933 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.413 0.762 4.411 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.830 0.039 5.983 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.932 -0.145 4.599 1.00 0.00 H new ATOM 1726 N GLY A 113 3.604 -4.758 6.576 1.00 0.00 N ATOM 1727 CA GLY A 113 3.895 -6.099 7.056 1.00 0.00 C ATOM 1728 C GLY A 113 5.126 -6.661 6.370 1.00 0.00 C ATOM 1729 O GLY A 113 5.031 -7.593 5.572 1.00 0.00 O ATOM 0 H GLY A 113 3.953 -4.552 5.640 1.00 0.00 H new ATOM 0 HA2 GLY A 113 4.052 -6.078 8.134 1.00 0.00 H new ATOM 0 HA3 GLY A 113 3.041 -6.750 6.871 1.00 0.00 H new ATOM 1733 N GLU A 114 6.280 -6.090 6.683 1.00 0.00 N ATOM 1734 CA GLU A 114 7.522 -6.543 6.090 1.00 0.00 C ATOM 1735 C GLU A 114 8.714 -5.918 6.804 1.00 0.00 C ATOM 1736 O GLU A 114 8.783 -4.701 6.958 1.00 0.00 O ATOM 1737 CB GLU A 114 7.559 -6.165 4.609 1.00 0.00 C ATOM 1738 CG GLU A 114 8.832 -6.727 3.980 1.00 0.00 C ATOM 1739 CD GLU A 114 8.850 -6.438 2.484 1.00 0.00 C ATOM 1740 OE1 GLU A 114 8.038 -5.642 2.044 1.00 0.00 O ATOM 1741 OE2 GLU A 114 9.678 -7.018 1.800 1.00 0.00 O ATOM 0 H GLU A 114 6.379 -5.317 7.341 1.00 0.00 H new ATOM 0 HA GLU A 114 7.579 -7.627 6.191 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.681 -6.561 4.098 1.00 0.00 H new ATOM 0 HB3 GLU A 114 7.531 -5.081 4.497 1.00 0.00 H new ATOM 0 HG2 GLU A 114 9.707 -6.283 4.454 1.00 0.00 H new ATOM 0 HG3 GLU A 114 8.887 -7.802 4.151 1.00 0.00 H new ATOM 1748 N LYS A 115 9.640 -6.757 7.244 1.00 0.00 N ATOM 1749 CA LYS A 115 10.824 -6.271 7.940 1.00 0.00 C ATOM 1750 C LYS A 115 11.796 -5.635 6.951 1.00 0.00 C ATOM 1751 O LYS A 115 12.279 -6.288 6.028 1.00 0.00 O ATOM 1752 CB LYS A 115 11.514 -7.436 8.667 1.00 0.00 C ATOM 1753 CG LYS A 115 10.883 -7.646 10.057 1.00 0.00 C ATOM 1754 CD LYS A 115 11.562 -6.725 11.088 1.00 0.00 C ATOM 1755 CE LYS A 115 12.829 -7.392 11.640 1.00 0.00 C ATOM 1756 NZ LYS A 115 12.447 -8.333 12.727 1.00 0.00 N ATOM 0 H LYS A 115 9.596 -7.770 7.133 1.00 0.00 H new ATOM 0 HA LYS A 115 10.519 -5.519 8.668 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.422 -8.348 8.077 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.579 -7.229 8.771 1.00 0.00 H new ATOM 0 HG2 LYS A 115 9.814 -7.435 10.016 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.990 -8.687 10.361 1.00 0.00 H new ATOM 0 HD2 LYS A 115 11.816 -5.772 10.624 1.00 0.00 H new ATOM 0 HD3 LYS A 115 10.872 -6.508 11.903 1.00 0.00 H new ATOM 0 HE2 LYS A 115 13.350 -7.926 10.845 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.517 -6.637 12.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 13.301 -8.790 13.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.967 -7.809 13.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.806 -9.059 12.348 1.00 0.00 H new ATOM 1770 N LEU A 116 12.083 -4.353 7.163 1.00 0.00 N ATOM 1771 CA LEU A 116 13.005 -3.619 6.296 1.00 0.00 C ATOM 1772 C LEU A 116 14.369 -3.483 6.963 1.00 0.00 C ATOM 1773 O LEU A 116 14.522 -3.737 8.158 1.00 0.00 O ATOM 1774 CB LEU A 116 12.428 -2.226 5.964 1.00 0.00 C ATOM 1775 CG LEU A 116 11.571 -2.282 4.686 1.00 0.00 C ATOM 1776 CD1 LEU A 116 12.438 -2.649 3.457 1.00 0.00 C ATOM 1777 CD2 LEU A 116 10.453 -3.310 4.886 1.00 0.00 C ATOM 0 H LEU A 116 11.692 -3.800 7.926 1.00 0.00 H new ATOM 0 HA LEU A 116 13.129 -4.177 5.368 1.00 0.00 H new ATOM 0 HB2 LEU A 116 11.823 -1.869 6.798 1.00 0.00 H new ATOM 0 HB3 LEU A 116 13.241 -1.512 5.832 1.00 0.00 H new ATOM 0 HG LEU A 116 11.136 -1.301 4.498 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.811 -2.683 2.566 1.00 0.00 H new ATOM 0 HD12 LEU A 116 13.217 -1.898 3.324 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.897 -3.625 3.614 1.00 0.00 H new ATOM 0 HD21 LEU A 116 9.839 -3.359 3.987 1.00 0.00 H new ATOM 0 HD22 LEU A 116 10.890 -4.289 5.081 1.00 0.00 H new ATOM 0 HD23 LEU A 116 9.834 -3.014 5.733 1.00 0.00 H new ATOM 1789 N THR A 117 15.351 -3.088 6.163 1.00 0.00 N ATOM 1790 CA THR A 117 16.720 -2.920 6.641 1.00 0.00 C ATOM 1791 C THR A 117 17.317 -1.636 6.091 1.00 0.00 C ATOM 1792 O THR A 117 16.683 -0.922 5.312 1.00 0.00 O ATOM 1793 CB THR A 117 17.574 -4.111 6.204 1.00 0.00 C ATOM 1794 OG1 THR A 117 17.842 -4.018 4.813 1.00 0.00 O ATOM 1795 CG2 THR A 117 16.827 -5.414 6.495 1.00 0.00 C ATOM 0 H THR A 117 15.225 -2.876 5.173 1.00 0.00 H new ATOM 0 HA THR A 117 16.705 -2.866 7.730 1.00 0.00 H new ATOM 0 HB THR A 117 18.514 -4.103 6.756 1.00 0.00 H new ATOM 0 HG1 THR A 117 18.391 -4.781 4.534 1.00 0.00 H new ATOM 0 HG21 THR A 117 17.438 -6.261 6.183 1.00 0.00 H new ATOM 0 HG22 THR A 117 16.625 -5.487 7.564 1.00 0.00 H new ATOM 0 HG23 THR A 117 15.885 -5.424 5.946 1.00 0.00 H new ATOM 1803 N ASP A 118 18.544 -1.347 6.500 1.00 0.00 N ATOM 1804 CA ASP A 118 19.225 -0.144 6.048 1.00 0.00 C ATOM 1805 C ASP A 118 19.634 -0.275 4.584 1.00 0.00 C ATOM 1806 O ASP A 118 19.627 0.703 3.838 1.00 0.00 O ATOM 1807 CB ASP A 118 20.465 0.102 6.914 1.00 0.00 C ATOM 1808 CG ASP A 118 21.346 -1.145 6.936 1.00 0.00 C ATOM 1809 OD1 ASP A 118 20.909 -2.163 6.425 1.00 0.00 O ATOM 1810 OD2 ASP A 118 22.440 -1.065 7.468 1.00 0.00 O ATOM 0 H ASP A 118 19.086 -1.927 7.141 1.00 0.00 H new ATOM 0 HA ASP A 118 18.542 0.700 6.142 1.00 0.00 H new ATOM 0 HB2 ASP A 118 21.029 0.948 6.523 1.00 0.00 H new ATOM 0 HB3 ASP A 118 20.164 0.362 7.929 1.00 0.00 H new ATOM 1815 N GLU A 119 19.980 -1.490 4.179 1.00 0.00 N ATOM 1816 CA GLU A 119 20.384 -1.732 2.801 1.00 0.00 C ATOM 1817 C GLU A 119 19.179 -1.697 1.869 1.00 0.00 C ATOM 1818 O GLU A 119 19.141 -0.918 0.921 1.00 0.00 O ATOM 1819 CB GLU A 119 21.074 -3.094 2.693 1.00 0.00 C ATOM 1820 CG GLU A 119 22.369 -3.083 3.509 1.00 0.00 C ATOM 1821 CD GLU A 119 23.372 -2.117 2.890 1.00 0.00 C ATOM 1822 OE1 GLU A 119 23.226 -1.813 1.716 1.00 0.00 O ATOM 1823 OE2 GLU A 119 24.276 -1.698 3.594 1.00 0.00 O ATOM 0 H GLU A 119 19.989 -2.315 4.778 1.00 0.00 H new ATOM 0 HA GLU A 119 21.077 -0.945 2.504 1.00 0.00 H new ATOM 0 HB2 GLU A 119 20.410 -3.878 3.057 1.00 0.00 H new ATOM 0 HB3 GLU A 119 21.292 -3.320 1.649 1.00 0.00 H new ATOM 0 HG2 GLU A 119 22.157 -2.790 4.537 1.00 0.00 H new ATOM 0 HG3 GLU A 119 22.794 -4.086 3.545 1.00 0.00 H new ATOM 1830 N GLU A 120 18.194 -2.543 2.147 1.00 0.00 N ATOM 1831 CA GLU A 120 16.999 -2.600 1.315 1.00 0.00 C ATOM 1832 C GLU A 120 16.416 -1.202 1.125 1.00 0.00 C ATOM 1833 O GLU A 120 16.051 -0.816 0.012 1.00 0.00 O ATOM 1834 CB GLU A 120 15.956 -3.507 1.974 1.00 0.00 C ATOM 1835 CG GLU A 120 14.798 -3.762 1.003 1.00 0.00 C ATOM 1836 CD GLU A 120 15.260 -4.680 -0.121 1.00 0.00 C ATOM 1837 OE1 GLU A 120 16.363 -5.192 -0.023 1.00 0.00 O ATOM 1838 OE2 GLU A 120 14.508 -4.856 -1.064 1.00 0.00 O ATOM 0 H GLU A 120 18.198 -3.192 2.934 1.00 0.00 H new ATOM 0 HA GLU A 120 17.269 -3.003 0.339 1.00 0.00 H new ATOM 0 HB2 GLU A 120 16.414 -4.453 2.263 1.00 0.00 H new ATOM 0 HB3 GLU A 120 15.582 -3.042 2.886 1.00 0.00 H new ATOM 0 HG2 GLU A 120 13.960 -4.214 1.533 1.00 0.00 H new ATOM 0 HG3 GLU A 120 14.442 -2.818 0.591 1.00 0.00 H new ATOM 1845 N VAL A 121 16.337 -0.444 2.214 1.00 0.00 N ATOM 1846 CA VAL A 121 15.801 0.909 2.144 1.00 0.00 C ATOM 1847 C VAL A 121 16.687 1.781 1.257 1.00 0.00 C ATOM 1848 O VAL A 121 16.195 2.516 0.399 1.00 0.00 O ATOM 1849 CB VAL A 121 15.716 1.503 3.555 1.00 0.00 C ATOM 1850 CG1 VAL A 121 15.364 2.993 3.472 1.00 0.00 C ATOM 1851 CG2 VAL A 121 14.634 0.766 4.356 1.00 0.00 C ATOM 0 H VAL A 121 16.633 -0.739 3.144 1.00 0.00 H new ATOM 0 HA VAL A 121 14.802 0.876 1.710 1.00 0.00 H new ATOM 0 HB VAL A 121 16.680 1.389 4.051 1.00 0.00 H new ATOM 0 HG11 VAL A 121 15.305 3.409 4.478 1.00 0.00 H new ATOM 0 HG12 VAL A 121 16.134 3.518 2.906 1.00 0.00 H new ATOM 0 HG13 VAL A 121 14.402 3.112 2.973 1.00 0.00 H new ATOM 0 HG21 VAL A 121 14.573 1.188 5.359 1.00 0.00 H new ATOM 0 HG22 VAL A 121 13.672 0.878 3.856 1.00 0.00 H new ATOM 0 HG23 VAL A 121 14.888 -0.292 4.422 1.00 0.00 H new ATOM 1861 N GLU A 122 17.995 1.691 1.471 1.00 0.00 N ATOM 1862 CA GLU A 122 18.941 2.474 0.688 1.00 0.00 C ATOM 1863 C GLU A 122 18.936 2.021 -0.769 1.00 0.00 C ATOM 1864 O GLU A 122 19.149 2.824 -1.675 1.00 0.00 O ATOM 1865 CB GLU A 122 20.348 2.332 1.271 1.00 0.00 C ATOM 1866 CG GLU A 122 21.313 3.238 0.501 1.00 0.00 C ATOM 1867 CD GLU A 122 22.700 3.173 1.128 1.00 0.00 C ATOM 1868 OE1 GLU A 122 22.922 2.291 1.940 1.00 0.00 O ATOM 1869 OE2 GLU A 122 23.522 4.008 0.787 1.00 0.00 O ATOM 0 H GLU A 122 18.421 1.088 2.175 1.00 0.00 H new ATOM 0 HA GLU A 122 18.640 3.521 0.729 1.00 0.00 H new ATOM 0 HB2 GLU A 122 20.344 2.601 2.327 1.00 0.00 H new ATOM 0 HB3 GLU A 122 20.677 1.295 1.207 1.00 0.00 H new ATOM 0 HG2 GLU A 122 21.362 2.928 -0.543 1.00 0.00 H new ATOM 0 HG3 GLU A 122 20.948 4.265 0.512 1.00 0.00 H new ATOM 1876 N GLN A 123 18.694 0.733 -0.984 1.00 0.00 N ATOM 1877 CA GLN A 123 18.667 0.190 -2.335 1.00 0.00 C ATOM 1878 C GLN A 123 17.573 0.848 -3.163 1.00 0.00 C ATOM 1879 O GLN A 123 17.853 1.522 -4.154 1.00 0.00 O ATOM 1880 CB GLN A 123 18.423 -1.325 -2.287 1.00 0.00 C ATOM 1881 CG GLN A 123 19.715 -2.050 -1.912 1.00 0.00 C ATOM 1882 CD GLN A 123 19.422 -3.522 -1.642 1.00 0.00 C ATOM 1883 OE1 GLN A 123 18.286 -3.971 -1.801 1.00 0.00 O ATOM 1884 NE2 GLN A 123 20.384 -4.300 -1.234 1.00 0.00 N ATOM 0 H GLN A 123 18.515 0.051 -0.247 1.00 0.00 H new ATOM 0 HA GLN A 123 19.631 0.394 -2.800 1.00 0.00 H new ATOM 0 HB2 GLN A 123 17.644 -1.553 -1.560 1.00 0.00 H new ATOM 0 HB3 GLN A 123 18.068 -1.675 -3.256 1.00 0.00 H new ATOM 0 HG2 GLN A 123 20.442 -1.957 -2.718 1.00 0.00 H new ATOM 0 HG3 GLN A 123 20.158 -1.590 -1.029 1.00 0.00 H new ATOM 0 HE21 GLN A 123 21.323 -3.924 -1.104 1.00 0.00 H new ATOM 0 HE22 GLN A 123 20.198 -5.285 -1.045 1.00 0.00 H new ATOM 1893 N MET A 124 16.323 0.641 -2.768 1.00 0.00 N ATOM 1894 CA MET A 124 15.210 1.209 -3.511 1.00 0.00 C ATOM 1895 C MET A 124 15.375 2.712 -3.651 1.00 0.00 C ATOM 1896 O MET A 124 15.124 3.278 -4.715 1.00 0.00 O ATOM 1897 CB MET A 124 13.894 0.908 -2.790 1.00 0.00 C ATOM 1898 CG MET A 124 12.694 1.447 -3.606 1.00 0.00 C ATOM 1899 SD MET A 124 11.412 0.167 -3.725 1.00 0.00 S ATOM 1900 CE MET A 124 10.408 0.703 -2.320 1.00 0.00 C ATOM 0 H MET A 124 16.059 0.092 -1.950 1.00 0.00 H new ATOM 0 HA MET A 124 15.194 0.760 -4.504 1.00 0.00 H new ATOM 0 HB2 MET A 124 13.789 -0.167 -2.645 1.00 0.00 H new ATOM 0 HB3 MET A 124 13.902 1.364 -1.800 1.00 0.00 H new ATOM 0 HG2 MET A 124 12.288 2.339 -3.128 1.00 0.00 H new ATOM 0 HG3 MET A 124 13.022 1.741 -4.603 1.00 0.00 H new ATOM 0 HE1 MET A 124 9.816 -0.136 -1.954 1.00 0.00 H new ATOM 0 HE2 MET A 124 11.059 1.062 -1.523 1.00 0.00 H new ATOM 0 HE3 MET A 124 9.742 1.507 -2.634 1.00 0.00 H new ATOM 1910 N ILE A 125 15.803 3.354 -2.576 1.00 0.00 N ATOM 1911 CA ILE A 125 15.994 4.798 -2.595 1.00 0.00 C ATOM 1912 C ILE A 125 17.064 5.163 -3.623 1.00 0.00 C ATOM 1913 O ILE A 125 16.921 6.135 -4.364 1.00 0.00 O ATOM 1914 CB ILE A 125 16.401 5.295 -1.188 1.00 0.00 C ATOM 1915 CG1 ILE A 125 15.152 5.386 -0.281 1.00 0.00 C ATOM 1916 CG2 ILE A 125 17.080 6.674 -1.280 1.00 0.00 C ATOM 1917 CD1 ILE A 125 14.415 6.721 -0.483 1.00 0.00 C ATOM 0 H ILE A 125 16.023 2.905 -1.687 1.00 0.00 H new ATOM 0 HA ILE A 125 15.059 5.282 -2.876 1.00 0.00 H new ATOM 0 HB ILE A 125 17.108 4.585 -0.759 1.00 0.00 H new ATOM 0 HG12 ILE A 125 14.478 4.558 -0.502 1.00 0.00 H new ATOM 0 HG13 ILE A 125 15.449 5.286 0.763 1.00 0.00 H new ATOM 0 HG21 ILE A 125 17.360 7.009 -0.281 1.00 0.00 H new ATOM 0 HG22 ILE A 125 17.973 6.599 -1.901 1.00 0.00 H new ATOM 0 HG23 ILE A 125 16.389 7.391 -1.723 1.00 0.00 H new ATOM 0 HD11 ILE A 125 13.541 6.756 0.168 1.00 0.00 H new ATOM 0 HD12 ILE A 125 15.084 7.546 -0.238 1.00 0.00 H new ATOM 0 HD13 ILE A 125 14.097 6.808 -1.522 1.00 0.00 H new ATOM 1929 N LYS A 126 18.130 4.381 -3.655 1.00 0.00 N ATOM 1930 CA LYS A 126 19.216 4.631 -4.592 1.00 0.00 C ATOM 1931 C LYS A 126 18.822 4.208 -6.006 1.00 0.00 C ATOM 1932 O LYS A 126 19.298 4.777 -6.988 1.00 0.00 O ATOM 1933 CB LYS A 126 20.467 3.880 -4.153 1.00 0.00 C ATOM 1934 CG LYS A 126 21.643 4.297 -5.034 1.00 0.00 C ATOM 1935 CD LYS A 126 22.911 3.589 -4.558 1.00 0.00 C ATOM 1936 CE LYS A 126 24.092 4.016 -5.429 1.00 0.00 C ATOM 1937 NZ LYS A 126 25.325 3.313 -4.973 1.00 0.00 N ATOM 0 H LYS A 126 18.268 3.573 -3.048 1.00 0.00 H new ATOM 0 HA LYS A 126 19.424 5.701 -4.599 1.00 0.00 H new ATOM 0 HB2 LYS A 126 20.687 4.096 -3.108 1.00 0.00 H new ATOM 0 HB3 LYS A 126 20.305 2.805 -4.229 1.00 0.00 H new ATOM 0 HG2 LYS A 126 21.440 4.043 -6.074 1.00 0.00 H new ATOM 0 HG3 LYS A 126 21.779 5.378 -4.991 1.00 0.00 H new ATOM 0 HD2 LYS A 126 23.108 3.835 -3.515 1.00 0.00 H new ATOM 0 HD3 LYS A 126 22.778 2.508 -4.611 1.00 0.00 H new ATOM 0 HE2 LYS A 126 23.891 3.780 -6.474 1.00 0.00 H new ATOM 0 HE3 LYS A 126 24.232 5.095 -5.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 26.129 3.603 -5.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 25.519 3.560 -3.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 25.189 2.285 -5.054 1.00 0.00 H new ATOM 1951 N GLU A 127 17.953 3.202 -6.101 1.00 0.00 N ATOM 1952 CA GLU A 127 17.500 2.704 -7.397 1.00 0.00 C ATOM 1953 C GLU A 127 16.335 3.537 -7.928 1.00 0.00 C ATOM 1954 O GLU A 127 16.465 4.217 -8.946 1.00 0.00 O ATOM 1955 CB GLU A 127 17.059 1.245 -7.265 1.00 0.00 C ATOM 1956 CG GLU A 127 18.274 0.350 -7.017 1.00 0.00 C ATOM 1957 CD GLU A 127 19.146 0.303 -8.268 1.00 0.00 C ATOM 1958 OE1 GLU A 127 18.626 0.580 -9.337 1.00 0.00 O ATOM 1959 OE2 GLU A 127 20.317 -0.010 -8.139 1.00 0.00 O ATOM 0 H GLU A 127 17.550 2.718 -5.298 1.00 0.00 H new ATOM 0 HA GLU A 127 18.331 2.779 -8.099 1.00 0.00 H new ATOM 0 HB2 GLU A 127 16.349 1.144 -6.444 1.00 0.00 H new ATOM 0 HB3 GLU A 127 16.544 0.929 -8.172 1.00 0.00 H new ATOM 0 HG2 GLU A 127 18.851 0.730 -6.174 1.00 0.00 H new ATOM 0 HG3 GLU A 127 17.948 -0.656 -6.752 1.00 0.00 H new ATOM 1966 N ALA A 128 15.197 3.476 -7.239 1.00 0.00 N ATOM 1967 CA ALA A 128 14.012 4.226 -7.660 1.00 0.00 C ATOM 1968 C ALA A 128 14.408 5.628 -8.120 1.00 0.00 C ATOM 1969 O ALA A 128 13.794 6.195 -9.025 1.00 0.00 O ATOM 1970 CB ALA A 128 13.003 4.315 -6.507 1.00 0.00 C ATOM 0 H ALA A 128 15.069 2.920 -6.393 1.00 0.00 H new ATOM 0 HA ALA A 128 13.547 3.702 -8.495 1.00 0.00 H new ATOM 0 HB1 ALA A 128 12.127 4.875 -6.833 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.702 3.311 -6.209 1.00 0.00 H new ATOM 0 HB3 ALA A 128 13.463 4.822 -5.659 1.00 0.00 H new ATOM 1976 N ASP A 129 15.447 6.175 -7.498 1.00 0.00 N ATOM 1977 CA ASP A 129 15.939 7.503 -7.854 1.00 0.00 C ATOM 1978 C ASP A 129 16.992 7.402 -8.957 1.00 0.00 C ATOM 1979 O ASP A 129 18.067 6.839 -8.752 1.00 0.00 O ATOM 1980 CB ASP A 129 16.545 8.177 -6.625 1.00 0.00 C ATOM 1981 CG ASP A 129 17.062 9.562 -6.998 1.00 0.00 C ATOM 1982 OD1 ASP A 129 17.022 9.891 -8.172 1.00 0.00 O ATOM 1983 OD2 ASP A 129 17.487 10.276 -6.106 1.00 0.00 O ATOM 0 H ASP A 129 15.965 5.721 -6.746 1.00 0.00 H new ATOM 0 HA ASP A 129 15.103 8.099 -8.219 1.00 0.00 H new ATOM 0 HB2 ASP A 129 15.796 8.258 -5.837 1.00 0.00 H new ATOM 0 HB3 ASP A 129 17.359 7.569 -6.230 1.00 0.00 H new ATOM 1988 N LEU A 130 16.667 7.939 -10.128 1.00 0.00 N ATOM 1989 CA LEU A 130 17.584 7.891 -11.263 1.00 0.00 C ATOM 1990 C LEU A 130 18.860 8.672 -10.977 1.00 0.00 C ATOM 1991 O LEU A 130 19.962 8.202 -11.264 1.00 0.00 O ATOM 1992 CB LEU A 130 16.902 8.488 -12.493 1.00 0.00 C ATOM 1993 CG LEU A 130 15.745 7.584 -12.948 1.00 0.00 C ATOM 1994 CD1 LEU A 130 14.892 8.339 -13.970 1.00 0.00 C ATOM 1995 CD2 LEU A 130 16.283 6.284 -13.582 1.00 0.00 C ATOM 0 H LEU A 130 15.782 8.410 -10.316 1.00 0.00 H new ATOM 0 HA LEU A 130 17.848 6.848 -11.441 1.00 0.00 H new ATOM 0 HB2 LEU A 130 16.526 9.484 -12.262 1.00 0.00 H new ATOM 0 HB3 LEU A 130 17.625 8.600 -13.301 1.00 0.00 H new ATOM 0 HG LEU A 130 15.142 7.319 -12.080 1.00 0.00 H new ATOM 0 HD11 LEU A 130 14.069 7.704 -14.297 1.00 0.00 H new ATOM 0 HD12 LEU A 130 14.492 9.244 -13.513 1.00 0.00 H new ATOM 0 HD13 LEU A 130 15.507 8.608 -14.829 1.00 0.00 H new ATOM 0 HD21 LEU A 130 15.447 5.660 -13.897 1.00 0.00 H new ATOM 0 HD22 LEU A 130 16.899 6.529 -14.447 1.00 0.00 H new ATOM 0 HD23 LEU A 130 16.884 5.744 -12.850 1.00 0.00 H new ATOM 2007 N ASP A 131 18.710 9.868 -10.418 1.00 0.00 N ATOM 2008 CA ASP A 131 19.866 10.704 -10.114 1.00 0.00 C ATOM 2009 C ASP A 131 20.437 10.347 -8.746 1.00 0.00 C ATOM 2010 O ASP A 131 21.442 10.912 -8.317 1.00 0.00 O ATOM 2011 CB ASP A 131 19.462 12.179 -10.129 1.00 0.00 C ATOM 2012 CG ASP A 131 18.325 12.416 -9.143 1.00 0.00 C ATOM 2013 OD1 ASP A 131 18.360 11.827 -8.078 1.00 0.00 O ATOM 2014 OD2 ASP A 131 17.439 13.191 -9.467 1.00 0.00 O ATOM 0 H ASP A 131 17.810 10.277 -10.168 1.00 0.00 H new ATOM 0 HA ASP A 131 20.628 10.528 -10.873 1.00 0.00 H new ATOM 0 HB2 ASP A 131 20.317 12.802 -9.867 1.00 0.00 H new ATOM 0 HB3 ASP A 131 19.151 12.470 -11.132 1.00 0.00 H new ATOM 2019 N GLY A 132 19.794 9.401 -8.065 1.00 0.00 N ATOM 2020 CA GLY A 132 20.258 8.975 -6.746 1.00 0.00 C ATOM 2021 C GLY A 132 20.700 10.171 -5.913 1.00 0.00 C ATOM 2022 O GLY A 132 21.728 10.120 -5.235 1.00 0.00 O ATOM 0 H GLY A 132 18.959 8.919 -8.399 1.00 0.00 H new ATOM 0 HA2 GLY A 132 19.459 8.442 -6.230 1.00 0.00 H new ATOM 0 HA3 GLY A 132 21.088 8.277 -6.856 1.00 0.00 H new ATOM 2026 N ASP A 133 19.925 11.248 -5.972 1.00 0.00 N ATOM 2027 CA ASP A 133 20.257 12.452 -5.223 1.00 0.00 C ATOM 2028 C ASP A 133 20.032 12.233 -3.730 1.00 0.00 C ATOM 2029 O ASP A 133 20.276 13.127 -2.921 1.00 0.00 O ATOM 2030 CB ASP A 133 19.402 13.628 -5.707 1.00 0.00 C ATOM 2031 CG ASP A 133 17.950 13.442 -5.277 1.00 0.00 C ATOM 2032 OD1 ASP A 133 17.590 12.325 -4.944 1.00 0.00 O ATOM 2033 OD2 ASP A 133 17.219 14.418 -5.289 1.00 0.00 O ATOM 0 H ASP A 133 19.071 11.312 -6.525 1.00 0.00 H new ATOM 0 HA ASP A 133 21.310 12.681 -5.390 1.00 0.00 H new ATOM 0 HB2 ASP A 133 19.792 14.561 -5.300 1.00 0.00 H new ATOM 0 HB3 ASP A 133 19.459 13.705 -6.793 1.00 0.00 H new ATOM 2038 N GLY A 134 19.566 11.035 -3.374 1.00 0.00 N ATOM 2039 CA GLY A 134 19.305 10.693 -1.973 1.00 0.00 C ATOM 2040 C GLY A 134 17.808 10.675 -1.683 1.00 0.00 C ATOM 2041 O GLY A 134 17.378 10.226 -0.620 1.00 0.00 O ATOM 0 H GLY A 134 19.361 10.285 -4.035 1.00 0.00 H new ATOM 0 HA2 GLY A 134 19.734 9.717 -1.748 1.00 0.00 H new ATOM 0 HA3 GLY A 134 19.796 11.415 -1.321 1.00 0.00 H new ATOM 2045 N GLN A 135 17.015 11.164 -2.632 1.00 0.00 N ATOM 2046 CA GLN A 135 15.559 11.203 -2.471 1.00 0.00 C ATOM 2047 C GLN A 135 14.871 10.941 -3.802 1.00 0.00 C ATOM 2048 O GLN A 135 15.512 10.950 -4.851 1.00 0.00 O ATOM 2049 CB GLN A 135 15.127 12.572 -1.938 1.00 0.00 C ATOM 2050 CG GLN A 135 15.580 13.669 -2.907 1.00 0.00 C ATOM 2051 CD GLN A 135 15.186 15.038 -2.363 1.00 0.00 C ATOM 2052 OE1 GLN A 135 15.142 15.235 -1.149 1.00 0.00 O ATOM 2053 NE2 GLN A 135 14.897 16.001 -3.196 1.00 0.00 N ATOM 0 H GLN A 135 17.352 11.538 -3.519 1.00 0.00 H new ATOM 0 HA GLN A 135 15.270 10.428 -1.761 1.00 0.00 H new ATOM 0 HB2 GLN A 135 14.044 12.602 -1.820 1.00 0.00 H new ATOM 0 HB3 GLN A 135 15.560 12.742 -0.952 1.00 0.00 H new ATOM 0 HG2 GLN A 135 16.660 13.620 -3.046 1.00 0.00 H new ATOM 0 HG3 GLN A 135 15.126 13.512 -3.885 1.00 0.00 H new ATOM 0 HE21 GLN A 135 14.935 15.834 -4.202 1.00 0.00 H new ATOM 0 HE22 GLN A 135 14.634 16.920 -2.841 1.00 0.00 H new ATOM 2062 N VAL A 136 13.556 10.711 -3.753 1.00 0.00 N ATOM 2063 CA VAL A 136 12.781 10.457 -4.970 1.00 0.00 C ATOM 2064 C VAL A 136 11.766 11.567 -5.203 1.00 0.00 C ATOM 2065 O VAL A 136 10.962 11.883 -4.331 1.00 0.00 O ATOM 2066 CB VAL A 136 12.056 9.111 -4.841 1.00 0.00 C ATOM 2067 CG1 VAL A 136 10.889 9.032 -5.825 1.00 0.00 C ATOM 2068 CG2 VAL A 136 13.033 7.982 -5.143 1.00 0.00 C ATOM 0 H VAL A 136 13.010 10.695 -2.892 1.00 0.00 H new ATOM 0 HA VAL A 136 13.462 10.429 -5.820 1.00 0.00 H new ATOM 0 HB VAL A 136 11.672 9.018 -3.825 1.00 0.00 H new ATOM 0 HG11 VAL A 136 10.388 8.070 -5.718 1.00 0.00 H new ATOM 0 HG12 VAL A 136 10.182 9.835 -5.616 1.00 0.00 H new ATOM 0 HG13 VAL A 136 11.264 9.134 -6.843 1.00 0.00 H new ATOM 0 HG21 VAL A 136 12.521 7.024 -5.052 1.00 0.00 H new ATOM 0 HG22 VAL A 136 13.416 8.094 -6.157 1.00 0.00 H new ATOM 0 HG23 VAL A 136 13.862 8.019 -4.436 1.00 0.00 H new ATOM 2078 N ASN A 137 11.814 12.148 -6.396 1.00 0.00 N ATOM 2079 CA ASN A 137 10.894 13.219 -6.759 1.00 0.00 C ATOM 2080 C ASN A 137 9.661 12.648 -7.445 1.00 0.00 C ATOM 2081 O ASN A 137 9.734 11.612 -8.106 1.00 0.00 O ATOM 2082 CB ASN A 137 11.585 14.214 -7.691 1.00 0.00 C ATOM 2083 CG ASN A 137 12.975 14.547 -7.160 1.00 0.00 C ATOM 2084 OD1 ASN A 137 13.331 14.141 -6.053 1.00 0.00 O ATOM 2085 ND2 ASN A 137 13.784 15.270 -7.884 1.00 0.00 N ATOM 0 H ASN A 137 12.479 11.896 -7.127 1.00 0.00 H new ATOM 0 HA ASN A 137 10.588 13.734 -5.848 1.00 0.00 H new ATOM 0 HB2 ASN A 137 11.661 13.793 -8.694 1.00 0.00 H new ATOM 0 HB3 ASN A 137 10.990 15.124 -7.771 1.00 0.00 H new ATOM 0 HD21 ASN A 137 14.714 15.500 -7.534 1.00 0.00 H new ATOM 0 HD22 ASN A 137 13.487 15.605 -8.800 1.00 0.00 H new ATOM 2092 N TYR A 138 8.529 13.323 -7.278 1.00 0.00 N ATOM 2093 CA TYR A 138 7.281 12.865 -7.881 1.00 0.00 C ATOM 2094 C TYR A 138 7.523 12.423 -9.321 1.00 0.00 C ATOM 2095 O TYR A 138 6.998 11.403 -9.765 1.00 0.00 O ATOM 2096 CB TYR A 138 6.247 13.996 -7.857 1.00 0.00 C ATOM 2097 CG TYR A 138 5.006 13.574 -8.610 1.00 0.00 C ATOM 2098 CD1 TYR A 138 4.031 12.789 -7.982 1.00 0.00 C ATOM 2099 CD2 TYR A 138 4.838 13.967 -9.943 1.00 0.00 C ATOM 2100 CE1 TYR A 138 2.889 12.395 -8.690 1.00 0.00 C ATOM 2101 CE2 TYR A 138 3.696 13.574 -10.650 1.00 0.00 C ATOM 2102 CZ TYR A 138 2.722 12.787 -10.023 1.00 0.00 C ATOM 2103 OH TYR A 138 1.597 12.397 -10.720 1.00 0.00 O ATOM 0 H TYR A 138 8.449 14.183 -6.735 1.00 0.00 H new ATOM 0 HA TYR A 138 6.904 12.018 -7.308 1.00 0.00 H new ATOM 0 HB2 TYR A 138 5.991 14.245 -6.827 1.00 0.00 H new ATOM 0 HB3 TYR A 138 6.668 14.895 -8.307 1.00 0.00 H new ATOM 0 HD1 TYR A 138 4.160 12.488 -6.953 1.00 0.00 H new ATOM 0 HD2 TYR A 138 5.590 14.574 -10.426 1.00 0.00 H new ATOM 0 HE1 TYR A 138 2.137 11.789 -8.207 1.00 0.00 H new ATOM 0 HE2 TYR A 138 3.566 13.877 -11.678 1.00 0.00 H new ATOM 0 HH TYR A 138 1.637 12.755 -11.632 1.00 0.00 H new ATOM 2113 N GLU A 139 8.321 13.198 -10.043 1.00 0.00 N ATOM 2114 CA GLU A 139 8.619 12.870 -11.428 1.00 0.00 C ATOM 2115 C GLU A 139 9.311 11.514 -11.517 1.00 0.00 C ATOM 2116 O GLU A 139 8.904 10.649 -12.294 1.00 0.00 O ATOM 2117 CB GLU A 139 9.529 13.935 -12.036 1.00 0.00 C ATOM 2118 CG GLU A 139 9.565 13.765 -13.557 1.00 0.00 C ATOM 2119 CD GLU A 139 8.283 14.311 -14.175 1.00 0.00 C ATOM 2120 OE1 GLU A 139 7.485 14.873 -13.442 1.00 0.00 O ATOM 2121 OE2 GLU A 139 8.116 14.157 -15.374 1.00 0.00 O ATOM 0 H GLU A 139 8.768 14.047 -9.697 1.00 0.00 H new ATOM 0 HA GLU A 139 7.680 12.832 -11.980 1.00 0.00 H new ATOM 0 HB2 GLU A 139 9.165 14.930 -11.779 1.00 0.00 H new ATOM 0 HB3 GLU A 139 10.535 13.847 -11.625 1.00 0.00 H new ATOM 0 HG2 GLU A 139 10.428 14.288 -13.969 1.00 0.00 H new ATOM 0 HG3 GLU A 139 9.680 12.711 -13.810 1.00 0.00 H new ATOM 2128 N GLU A 140 10.354 11.329 -10.715 1.00 0.00 N ATOM 2129 CA GLU A 140 11.088 10.071 -10.715 1.00 0.00 C ATOM 2130 C GLU A 140 10.173 8.929 -10.298 1.00 0.00 C ATOM 2131 O GLU A 140 10.195 7.854 -10.896 1.00 0.00 O ATOM 2132 CB GLU A 140 12.270 10.151 -9.741 1.00 0.00 C ATOM 2133 CG GLU A 140 13.320 11.121 -10.282 1.00 0.00 C ATOM 2134 CD GLU A 140 14.450 11.291 -9.271 1.00 0.00 C ATOM 2135 OE1 GLU A 140 14.417 10.618 -8.256 1.00 0.00 O ATOM 2136 OE2 GLU A 140 15.331 12.096 -9.528 1.00 0.00 O ATOM 0 H GLU A 140 10.707 12.028 -10.062 1.00 0.00 H new ATOM 0 HA GLU A 140 11.459 9.888 -11.723 1.00 0.00 H new ATOM 0 HB2 GLU A 140 11.925 10.483 -8.762 1.00 0.00 H new ATOM 0 HB3 GLU A 140 12.710 9.163 -9.606 1.00 0.00 H new ATOM 0 HG2 GLU A 140 13.719 10.748 -11.225 1.00 0.00 H new ATOM 0 HG3 GLU A 140 12.860 12.087 -10.491 1.00 0.00 H new ATOM 2143 N PHE A 141 9.367 9.169 -9.272 1.00 0.00 N ATOM 2144 CA PHE A 141 8.451 8.144 -8.795 1.00 0.00 C ATOM 2145 C PHE A 141 7.504 7.730 -9.914 1.00 0.00 C ATOM 2146 O PHE A 141 7.323 6.541 -10.188 1.00 0.00 O ATOM 2147 CB PHE A 141 7.654 8.680 -7.600 1.00 0.00 C ATOM 2148 CG PHE A 141 6.590 7.684 -7.199 1.00 0.00 C ATOM 2149 CD1 PHE A 141 6.960 6.392 -6.809 1.00 0.00 C ATOM 2150 CD2 PHE A 141 5.237 8.049 -7.211 1.00 0.00 C ATOM 2151 CE1 PHE A 141 5.984 5.470 -6.436 1.00 0.00 C ATOM 2152 CE2 PHE A 141 4.259 7.121 -6.833 1.00 0.00 C ATOM 2153 CZ PHE A 141 4.636 5.832 -6.445 1.00 0.00 C ATOM 0 H PHE A 141 9.329 10.051 -8.761 1.00 0.00 H new ATOM 0 HA PHE A 141 9.022 7.271 -8.479 1.00 0.00 H new ATOM 0 HB2 PHE A 141 8.323 8.867 -6.760 1.00 0.00 H new ATOM 0 HB3 PHE A 141 7.193 9.633 -7.858 1.00 0.00 H new ATOM 0 HD1 PHE A 141 8.002 6.109 -6.797 1.00 0.00 H new ATOM 0 HD2 PHE A 141 4.949 9.045 -7.512 1.00 0.00 H new ATOM 0 HE1 PHE A 141 6.271 4.472 -6.139 1.00 0.00 H new ATOM 0 HE2 PHE A 141 3.216 7.400 -6.841 1.00 0.00 H new ATOM 0 HZ PHE A 141 3.883 5.115 -6.152 1.00 0.00 H new ATOM 2163 N VAL A 142 6.896 8.721 -10.557 1.00 0.00 N ATOM 2164 CA VAL A 142 5.962 8.446 -11.634 1.00 0.00 C ATOM 2165 C VAL A 142 6.651 7.636 -12.720 1.00 0.00 C ATOM 2166 O VAL A 142 6.112 6.638 -13.193 1.00 0.00 O ATOM 2167 CB VAL A 142 5.446 9.773 -12.227 1.00 0.00 C ATOM 2168 CG1 VAL A 142 4.816 9.527 -13.608 1.00 0.00 C ATOM 2169 CG2 VAL A 142 4.386 10.376 -11.295 1.00 0.00 C ATOM 0 H VAL A 142 7.033 9.711 -10.352 1.00 0.00 H new ATOM 0 HA VAL A 142 5.121 7.876 -11.240 1.00 0.00 H new ATOM 0 HB VAL A 142 6.285 10.461 -12.330 1.00 0.00 H new ATOM 0 HG11 VAL A 142 4.455 10.471 -14.017 1.00 0.00 H new ATOM 0 HG12 VAL A 142 5.563 9.103 -14.279 1.00 0.00 H new ATOM 0 HG13 VAL A 142 3.982 8.832 -13.509 1.00 0.00 H new ATOM 0 HG21 VAL A 142 4.023 11.314 -11.716 1.00 0.00 H new ATOM 0 HG22 VAL A 142 3.555 9.679 -11.190 1.00 0.00 H new ATOM 0 HG23 VAL A 142 4.827 10.564 -10.316 1.00 0.00 H new ATOM 2179 N LYS A 143 7.838 8.064 -13.109 1.00 0.00 N ATOM 2180 CA LYS A 143 8.569 7.372 -14.146 1.00 0.00 C ATOM 2181 C LYS A 143 8.862 5.936 -13.735 1.00 0.00 C ATOM 2182 O LYS A 143 8.935 5.046 -14.579 1.00 0.00 O ATOM 2183 CB LYS A 143 9.876 8.108 -14.426 1.00 0.00 C ATOM 2184 CG LYS A 143 10.381 7.768 -15.833 1.00 0.00 C ATOM 2185 CD LYS A 143 11.618 8.621 -16.148 1.00 0.00 C ATOM 2186 CE LYS A 143 11.202 9.974 -16.735 1.00 0.00 C ATOM 2187 NZ LYS A 143 10.427 9.750 -17.989 1.00 0.00 N ATOM 0 H LYS A 143 8.311 8.882 -12.724 1.00 0.00 H new ATOM 0 HA LYS A 143 7.959 7.352 -15.049 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.723 9.183 -14.336 1.00 0.00 H new ATOM 0 HB3 LYS A 143 10.625 7.829 -13.685 1.00 0.00 H new ATOM 0 HG2 LYS A 143 10.630 6.709 -15.896 1.00 0.00 H new ATOM 0 HG3 LYS A 143 9.598 7.956 -16.568 1.00 0.00 H new ATOM 0 HD2 LYS A 143 12.201 8.776 -15.240 1.00 0.00 H new ATOM 0 HD3 LYS A 143 12.260 8.094 -16.853 1.00 0.00 H new ATOM 0 HE2 LYS A 143 10.598 10.526 -16.014 1.00 0.00 H new ATOM 0 HE3 LYS A 143 12.084 10.580 -16.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 10.573 10.552 -18.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 10.752 8.874 -18.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 9.415 9.668 -17.762 1.00 0.00 H new ATOM 2201 N MET A 144 9.043 5.713 -12.444 1.00 0.00 N ATOM 2202 CA MET A 144 9.336 4.377 -11.957 1.00 0.00 C ATOM 2203 C MET A 144 8.136 3.447 -12.156 1.00 0.00 C ATOM 2204 O MET A 144 8.295 2.268 -12.475 1.00 0.00 O ATOM 2205 CB MET A 144 9.711 4.450 -10.466 1.00 0.00 C ATOM 2206 CG MET A 144 10.788 3.411 -10.140 1.00 0.00 C ATOM 2207 SD MET A 144 10.210 1.763 -10.624 1.00 0.00 S ATOM 2208 CE MET A 144 9.271 1.375 -9.125 1.00 0.00 C ATOM 0 H MET A 144 8.993 6.432 -11.722 1.00 0.00 H new ATOM 0 HA MET A 144 10.173 3.971 -12.525 1.00 0.00 H new ATOM 0 HB2 MET A 144 10.074 5.449 -10.223 1.00 0.00 H new ATOM 0 HB3 MET A 144 8.828 4.274 -9.852 1.00 0.00 H new ATOM 0 HG2 MET A 144 11.712 3.652 -10.666 1.00 0.00 H new ATOM 0 HG3 MET A 144 11.014 3.429 -9.074 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.410 0.759 -9.384 1.00 0.00 H new ATOM 0 HE2 MET A 144 9.908 0.832 -8.427 1.00 0.00 H new ATOM 0 HE3 MET A 144 8.929 2.300 -8.660 1.00 0.00 H new ATOM 2218 N MET A 145 6.940 3.992 -11.948 1.00 0.00 N ATOM 2219 CA MET A 145 5.718 3.204 -12.087 1.00 0.00 C ATOM 2220 C MET A 145 5.249 3.155 -13.541 1.00 0.00 C ATOM 2221 O MET A 145 4.435 2.308 -13.910 1.00 0.00 O ATOM 2222 CB MET A 145 4.608 3.791 -11.205 1.00 0.00 C ATOM 2223 CG MET A 145 3.599 2.693 -10.860 1.00 0.00 C ATOM 2224 SD MET A 145 4.341 1.568 -9.648 1.00 0.00 S ATOM 2225 CE MET A 145 3.551 2.243 -8.166 1.00 0.00 C ATOM 0 H MET A 145 6.791 4.966 -11.685 1.00 0.00 H new ATOM 0 HA MET A 145 5.939 2.186 -11.765 1.00 0.00 H new ATOM 0 HB2 MET A 145 5.035 4.207 -10.293 1.00 0.00 H new ATOM 0 HB3 MET A 145 4.109 4.608 -11.725 1.00 0.00 H new ATOM 0 HG2 MET A 145 2.687 3.133 -10.456 1.00 0.00 H new ATOM 0 HG3 MET A 145 3.317 2.145 -11.759 1.00 0.00 H new ATOM 0 HE1 MET A 145 3.879 1.682 -7.291 1.00 0.00 H new ATOM 0 HE2 MET A 145 3.829 3.291 -8.050 1.00 0.00 H new ATOM 0 HE3 MET A 145 2.468 2.164 -8.263 1.00 0.00 H new ATOM 2235 N MET A 146 5.760 4.070 -14.355 1.00 0.00 N ATOM 2236 CA MET A 146 5.372 4.116 -15.757 1.00 0.00 C ATOM 2237 C MET A 146 5.529 2.747 -16.389 1.00 0.00 C ATOM 2238 O MET A 146 4.788 2.403 -17.305 1.00 0.00 O ATOM 2239 CB MET A 146 6.220 5.150 -16.519 1.00 0.00 C ATOM 2240 CG MET A 146 5.600 6.542 -16.376 1.00 0.00 C ATOM 2241 SD MET A 146 4.121 6.652 -17.414 1.00 0.00 S ATOM 2242 CE MET A 146 4.381 8.340 -18.011 1.00 0.00 C ATOM 0 H MET A 146 6.435 4.781 -14.073 1.00 0.00 H new ATOM 0 HA MET A 146 4.325 4.415 -15.815 1.00 0.00 H new ATOM 0 HB2 MET A 146 7.238 5.155 -16.131 1.00 0.00 H new ATOM 0 HB3 MET A 146 6.282 4.877 -17.572 1.00 0.00 H new ATOM 0 HG2 MET A 146 5.341 6.732 -15.334 1.00 0.00 H new ATOM 0 HG3 MET A 146 6.321 7.305 -16.669 1.00 0.00 H new ATOM 0 HE1 MET A 146 3.568 8.618 -18.681 1.00 0.00 H new ATOM 0 HE2 MET A 146 4.404 9.026 -17.164 1.00 0.00 H new ATOM 0 HE3 MET A 146 5.328 8.394 -18.548 1.00 0.00 H new ATOM 2308 N ALA B 19 13.009 -4.303 -6.995 1.00 0.00 N ATOM 2309 CA ALA B 19 12.555 -3.135 -6.187 1.00 0.00 C ATOM 2310 C ALA B 19 11.203 -2.653 -6.707 1.00 0.00 C ATOM 2311 O ALA B 19 10.441 -2.007 -5.985 1.00 0.00 O ATOM 2312 CB ALA B 19 13.589 -2.013 -6.296 1.00 0.00 C ATOM 0 HA ALA B 19 12.451 -3.426 -5.142 1.00 0.00 H new ATOM 0 HB1 ALA B 19 13.261 -1.157 -5.706 1.00 0.00 H new ATOM 0 HB2 ALA B 19 14.549 -2.366 -5.920 1.00 0.00 H new ATOM 0 HB3 ALA B 19 13.695 -1.716 -7.339 1.00 0.00 H new ATOM 2320 N ARG B 20 10.914 -2.975 -7.962 1.00 0.00 N ATOM 2321 CA ARG B 20 9.653 -2.572 -8.569 1.00 0.00 C ATOM 2322 C ARG B 20 8.479 -3.161 -7.801 1.00 0.00 C ATOM 2323 O ARG B 20 7.480 -2.484 -7.561 1.00 0.00 O ATOM 2324 CB ARG B 20 9.599 -3.037 -10.028 1.00 0.00 C ATOM 2325 CG ARG B 20 8.308 -2.532 -10.679 1.00 0.00 C ATOM 2326 CD ARG B 20 8.291 -2.927 -12.155 1.00 0.00 C ATOM 2327 NE ARG B 20 8.241 -4.380 -12.288 1.00 0.00 N ATOM 2328 CZ ARG B 20 7.085 -5.037 -12.259 1.00 0.00 C ATOM 2329 NH1 ARG B 20 5.966 -4.383 -12.104 1.00 0.00 N ATOM 2330 NH2 ARG B 20 7.069 -6.336 -12.384 1.00 0.00 N ATOM 0 H ARG B 20 11.530 -3.509 -8.574 1.00 0.00 H new ATOM 0 HA ARG B 20 9.587 -1.485 -8.535 1.00 0.00 H new ATOM 0 HB2 ARG B 20 10.465 -2.660 -10.573 1.00 0.00 H new ATOM 0 HB3 ARG B 20 9.641 -4.125 -10.076 1.00 0.00 H new ATOM 0 HG2 ARG B 20 7.442 -2.954 -10.169 1.00 0.00 H new ATOM 0 HG3 ARG B 20 8.239 -1.449 -10.581 1.00 0.00 H new ATOM 0 HD2 ARG B 20 7.428 -2.480 -12.649 1.00 0.00 H new ATOM 0 HD3 ARG B 20 9.180 -2.539 -12.653 1.00 0.00 H new ATOM 0 HE ARG B 20 9.110 -4.902 -12.405 1.00 0.00 H new ATOM 0 HH11 ARG B 20 5.978 -3.368 -12.005 1.00 0.00 H new ATOM 0 HH12 ARG B 20 5.080 -4.887 -12.082 1.00 0.00 H new ATOM 0 HH21 ARG B 20 7.943 -6.848 -12.504 1.00 0.00 H new ATOM 0 HH22 ARG B 20 6.182 -6.840 -12.362 1.00 0.00 H new ATOM 2344 N GLN B 21 8.603 -4.425 -7.421 1.00 0.00 N ATOM 2345 CA GLN B 21 7.540 -5.090 -6.685 1.00 0.00 C ATOM 2346 C GLN B 21 7.334 -4.425 -5.333 1.00 0.00 C ATOM 2347 O GLN B 21 6.202 -4.257 -4.883 1.00 0.00 O ATOM 2348 CB GLN B 21 7.885 -6.568 -6.485 1.00 0.00 C ATOM 2349 CG GLN B 21 6.717 -7.289 -5.804 1.00 0.00 C ATOM 2350 CD GLN B 21 7.051 -8.766 -5.621 1.00 0.00 C ATOM 2351 OE1 GLN B 21 8.162 -9.109 -5.217 1.00 0.00 O ATOM 2352 NE2 GLN B 21 6.147 -9.667 -5.895 1.00 0.00 N ATOM 0 H GLN B 21 9.421 -5.005 -7.608 1.00 0.00 H new ATOM 0 HA GLN B 21 6.618 -5.011 -7.261 1.00 0.00 H new ATOM 0 HB2 GLN B 21 8.100 -7.034 -7.447 1.00 0.00 H new ATOM 0 HB3 GLN B 21 8.785 -6.661 -5.877 1.00 0.00 H new ATOM 0 HG2 GLN B 21 6.511 -6.832 -4.836 1.00 0.00 H new ATOM 0 HG3 GLN B 21 5.814 -7.184 -6.405 1.00 0.00 H new ATOM 0 HE21 GLN B 21 5.227 -9.381 -6.230 1.00 0.00 H new ATOM 0 HE22 GLN B 21 6.361 -10.657 -5.774 1.00 0.00 H new ATOM 2361 N ARG B 22 8.427 -4.048 -4.686 1.00 0.00 N ATOM 2362 CA ARG B 22 8.340 -3.409 -3.379 1.00 0.00 C ATOM 2363 C ARG B 22 7.514 -2.135 -3.472 1.00 0.00 C ATOM 2364 O ARG B 22 6.650 -1.884 -2.632 1.00 0.00 O ATOM 2365 CB ARG B 22 9.754 -3.090 -2.863 1.00 0.00 C ATOM 2366 CG ARG B 22 9.765 -3.013 -1.323 1.00 0.00 C ATOM 2367 CD ARG B 22 9.984 -4.410 -0.732 1.00 0.00 C ATOM 2368 NE ARG B 22 11.293 -4.915 -1.122 1.00 0.00 N ATOM 2369 CZ ARG B 22 11.629 -6.182 -0.914 1.00 0.00 C ATOM 2370 NH1 ARG B 22 10.777 -6.998 -0.358 1.00 0.00 N ATOM 2371 NH2 ARG B 22 12.806 -6.613 -1.271 1.00 0.00 N ATOM 0 H ARG B 22 9.376 -4.171 -5.039 1.00 0.00 H new ATOM 0 HA ARG B 22 7.852 -4.089 -2.681 1.00 0.00 H new ATOM 0 HB2 ARG B 22 10.451 -3.857 -3.199 1.00 0.00 H new ATOM 0 HB3 ARG B 22 10.095 -2.143 -3.282 1.00 0.00 H new ATOM 0 HG2 ARG B 22 10.555 -2.340 -0.990 1.00 0.00 H new ATOM 0 HG3 ARG B 22 8.822 -2.601 -0.964 1.00 0.00 H new ATOM 0 HD2 ARG B 22 9.909 -4.370 0.355 1.00 0.00 H new ATOM 0 HD3 ARG B 22 9.205 -5.088 -1.081 1.00 0.00 H new ATOM 0 HE ARG B 22 11.963 -4.284 -1.562 1.00 0.00 H new ATOM 0 HH11 ARG B 22 9.854 -6.662 -0.084 1.00 0.00 H new ATOM 0 HH12 ARG B 22 11.034 -7.972 -0.198 1.00 0.00 H new ATOM 0 HH21 ARG B 22 13.470 -5.976 -1.711 1.00 0.00 H new ATOM 0 HH22 ARG B 22 13.063 -7.587 -1.110 1.00 0.00 H new ATOM 2385 N TRP B 23 7.775 -1.338 -4.492 1.00 0.00 N ATOM 2386 CA TRP B 23 7.033 -0.102 -4.670 1.00 0.00 C ATOM 2387 C TRP B 23 5.555 -0.403 -4.900 1.00 0.00 C ATOM 2388 O TRP B 23 4.679 0.202 -4.276 1.00 0.00 O ATOM 2389 CB TRP B 23 7.625 0.687 -5.863 1.00 0.00 C ATOM 2390 CG TRP B 23 8.576 1.744 -5.385 1.00 0.00 C ATOM 2391 CD1 TRP B 23 9.901 1.793 -5.653 1.00 0.00 C ATOM 2392 CD2 TRP B 23 8.286 2.905 -4.569 1.00 0.00 C ATOM 2393 NE1 TRP B 23 10.435 2.919 -5.051 1.00 0.00 N ATOM 2394 CE2 TRP B 23 9.476 3.637 -4.372 1.00 0.00 C ATOM 2395 CE3 TRP B 23 7.110 3.385 -3.986 1.00 0.00 C ATOM 2396 CZ2 TRP B 23 9.492 4.812 -3.623 1.00 0.00 C ATOM 2397 CZ3 TRP B 23 7.118 4.562 -3.229 1.00 0.00 C ATOM 2398 CH2 TRP B 23 8.307 5.273 -3.050 1.00 0.00 C ATOM 0 H TRP B 23 8.485 -1.520 -5.201 1.00 0.00 H new ATOM 0 HA TRP B 23 7.118 0.505 -3.769 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.143 0.003 -6.536 1.00 0.00 H new ATOM 0 HB3 TRP B 23 6.820 1.148 -6.435 1.00 0.00 H new ATOM 0 HD1 TRP B 23 10.451 1.072 -6.240 1.00 0.00 H new ATOM 0 HE1 TRP B 23 11.418 3.184 -5.104 1.00 0.00 H new ATOM 0 HE3 TRP B 23 6.186 2.842 -4.121 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 10.413 5.360 -3.488 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 6.203 4.921 -2.782 1.00 0.00 H new ATOM 0 HH2 TRP B 23 8.309 6.182 -2.467 1.00 0.00 H new ATOM 2409 N ARG B 24 5.286 -1.343 -5.788 1.00 0.00 N ATOM 2410 CA ARG B 24 3.916 -1.716 -6.083 1.00 0.00 C ATOM 2411 C ARG B 24 3.268 -2.346 -4.865 1.00 0.00 C ATOM 2412 O ARG B 24 2.084 -2.143 -4.607 1.00 0.00 O ATOM 2413 CB ARG B 24 3.889 -2.691 -7.260 1.00 0.00 C ATOM 2414 CG ARG B 24 4.248 -1.956 -8.570 1.00 0.00 C ATOM 2415 CD ARG B 24 2.980 -1.401 -9.224 1.00 0.00 C ATOM 2416 NE ARG B 24 2.095 -2.497 -9.595 1.00 0.00 N ATOM 2417 CZ ARG B 24 2.304 -3.200 -10.704 1.00 0.00 C ATOM 2418 NH1 ARG B 24 3.317 -2.912 -11.475 1.00 0.00 N ATOM 2419 NH2 ARG B 24 1.502 -4.181 -11.017 1.00 0.00 N ATOM 0 H ARG B 24 5.992 -1.858 -6.313 1.00 0.00 H new ATOM 0 HA ARG B 24 3.354 -0.821 -6.349 1.00 0.00 H new ATOM 0 HB2 ARG B 24 4.595 -3.503 -7.085 1.00 0.00 H new ATOM 0 HB3 ARG B 24 2.900 -3.141 -7.346 1.00 0.00 H new ATOM 0 HG2 ARG B 24 4.945 -1.144 -8.362 1.00 0.00 H new ATOM 0 HG3 ARG B 24 4.750 -2.640 -9.254 1.00 0.00 H new ATOM 0 HD2 ARG B 24 2.470 -0.727 -8.536 1.00 0.00 H new ATOM 0 HD3 ARG B 24 3.241 -0.817 -10.107 1.00 0.00 H new ATOM 0 HE ARG B 24 1.303 -2.729 -8.995 1.00 0.00 H new ATOM 0 HH11 ARG B 24 3.946 -2.149 -11.226 1.00 0.00 H new ATOM 0 HH12 ARG B 24 3.479 -3.450 -12.326 1.00 0.00 H new ATOM 0 HH21 ARG B 24 0.714 -4.409 -10.411 1.00 0.00 H new ATOM 0 HH22 ARG B 24 1.663 -4.720 -11.868 1.00 0.00 H new ATOM 2433 N SER B 25 4.049 -3.113 -4.118 1.00 0.00 N ATOM 2434 CA SER B 25 3.523 -3.761 -2.932 1.00 0.00 C ATOM 2435 C SER B 25 3.017 -2.726 -1.943 1.00 0.00 C ATOM 2436 O SER B 25 1.907 -2.841 -1.430 1.00 0.00 O ATOM 2437 CB SER B 25 4.613 -4.606 -2.271 1.00 0.00 C ATOM 2438 OG SER B 25 4.020 -5.508 -1.349 1.00 0.00 O ATOM 0 H SER B 25 5.033 -3.298 -4.310 1.00 0.00 H new ATOM 0 HA SER B 25 2.694 -4.404 -3.229 1.00 0.00 H new ATOM 0 HB2 SER B 25 5.170 -5.158 -3.029 1.00 0.00 H new ATOM 0 HB3 SER B 25 5.326 -3.961 -1.758 1.00 0.00 H new ATOM 0 HG SER B 25 4.718 -6.051 -0.927 1.00 0.00 H new ATOM 2444 N SER B 26 3.821 -1.708 -1.680 1.00 0.00 N ATOM 2445 CA SER B 26 3.395 -0.683 -0.741 1.00 0.00 C ATOM 2446 C SER B 26 2.126 -0.006 -1.245 1.00 0.00 C ATOM 2447 O SER B 26 1.193 0.230 -0.476 1.00 0.00 O ATOM 2448 CB SER B 26 4.499 0.352 -0.569 1.00 0.00 C ATOM 2449 OG SER B 26 4.717 1.004 -1.814 1.00 0.00 O ATOM 0 H SER B 26 4.745 -1.570 -2.089 1.00 0.00 H new ATOM 0 HA SER B 26 3.188 -1.150 0.222 1.00 0.00 H new ATOM 0 HB2 SER B 26 4.219 1.079 0.193 1.00 0.00 H new ATOM 0 HB3 SER B 26 5.417 -0.128 -0.229 1.00 0.00 H new ATOM 0 HG SER B 26 4.901 0.335 -2.506 1.00 0.00 H new ATOM 2455 N VAL B 27 2.087 0.297 -2.537 1.00 0.00 N ATOM 2456 CA VAL B 27 0.914 0.939 -3.111 1.00 0.00 C ATOM 2457 C VAL B 27 -0.282 -0.016 -3.112 1.00 0.00 C ATOM 2458 O VAL B 27 -1.405 0.376 -2.787 1.00 0.00 O ATOM 2459 CB VAL B 27 1.223 1.404 -4.539 1.00 0.00 C ATOM 2460 CG1 VAL B 27 -0.048 1.943 -5.199 1.00 0.00 C ATOM 2461 CG2 VAL B 27 2.295 2.505 -4.505 1.00 0.00 C ATOM 0 H VAL B 27 2.842 0.112 -3.197 1.00 0.00 H new ATOM 0 HA VAL B 27 0.657 1.805 -2.500 1.00 0.00 H new ATOM 0 HB VAL B 27 1.593 0.557 -5.117 1.00 0.00 H new ATOM 0 HG11 VAL B 27 0.180 2.271 -6.213 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -0.802 1.157 -5.233 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -0.428 2.786 -4.622 1.00 0.00 H new ATOM 0 HG21 VAL B 27 2.512 2.833 -5.522 1.00 0.00 H new ATOM 0 HG22 VAL B 27 1.930 3.350 -3.921 1.00 0.00 H new ATOM 0 HG23 VAL B 27 3.204 2.114 -4.048 1.00 0.00 H new ATOM 2471 N SER B 28 -0.036 -1.267 -3.492 1.00 0.00 N ATOM 2472 CA SER B 28 -1.104 -2.259 -3.551 1.00 0.00 C ATOM 2473 C SER B 28 -1.640 -2.577 -2.166 1.00 0.00 C ATOM 2474 O SER B 28 -2.852 -2.691 -1.971 1.00 0.00 O ATOM 2475 CB SER B 28 -0.574 -3.539 -4.193 1.00 0.00 C ATOM 2476 OG SER B 28 0.405 -4.112 -3.336 1.00 0.00 O ATOM 0 H SER B 28 0.884 -1.615 -3.761 1.00 0.00 H new ATOM 0 HA SER B 28 -1.918 -1.847 -4.147 1.00 0.00 H new ATOM 0 HB2 SER B 28 -1.389 -4.243 -4.358 1.00 0.00 H new ATOM 0 HB3 SER B 28 -0.140 -3.320 -5.168 1.00 0.00 H new ATOM 0 HG SER B 28 0.870 -3.400 -2.849 1.00 0.00 H new ATOM 2482 N ILE B 29 -0.741 -2.709 -1.206 1.00 0.00 N ATOM 2483 CA ILE B 29 -1.148 -3.008 0.155 1.00 0.00 C ATOM 2484 C ILE B 29 -1.993 -1.864 0.690 1.00 0.00 C ATOM 2485 O ILE B 29 -2.995 -2.086 1.366 1.00 0.00 O ATOM 2486 CB ILE B 29 0.083 -3.233 1.034 1.00 0.00 C ATOM 2487 CG1 ILE B 29 0.786 -4.531 0.609 1.00 0.00 C ATOM 2488 CG2 ILE B 29 -0.346 -3.360 2.500 1.00 0.00 C ATOM 2489 CD1 ILE B 29 2.221 -4.532 1.137 1.00 0.00 C ATOM 0 H ILE B 29 0.266 -2.615 -1.342 1.00 0.00 H new ATOM 0 HA ILE B 29 -1.743 -3.921 0.167 1.00 0.00 H new ATOM 0 HB ILE B 29 0.762 -2.388 0.920 1.00 0.00 H new ATOM 0 HG12 ILE B 29 0.244 -5.394 0.997 1.00 0.00 H new ATOM 0 HG13 ILE B 29 0.787 -4.617 -0.478 1.00 0.00 H new ATOM 0 HG21 ILE B 29 0.533 -3.520 3.124 1.00 0.00 H new ATOM 0 HG22 ILE B 29 -0.850 -2.446 2.812 1.00 0.00 H new ATOM 0 HG23 ILE B 29 -1.026 -4.205 2.608 1.00 0.00 H new ATOM 0 HD11 ILE B 29 2.719 -5.453 0.835 1.00 0.00 H new ATOM 0 HD12 ILE B 29 2.760 -3.677 0.728 1.00 0.00 H new ATOM 0 HD13 ILE B 29 2.208 -4.466 2.225 1.00 0.00 H new ATOM 2501 N VAL B 30 -1.585 -0.641 0.386 1.00 0.00 N ATOM 2502 CA VAL B 30 -2.323 0.525 0.848 1.00 0.00 C ATOM 2503 C VAL B 30 -3.752 0.482 0.322 1.00 0.00 C ATOM 2504 O VAL B 30 -4.695 0.742 1.064 1.00 0.00 O ATOM 2505 CB VAL B 30 -1.624 1.816 0.376 1.00 0.00 C ATOM 2506 CG1 VAL B 30 -2.558 3.024 0.551 1.00 0.00 C ATOM 2507 CG2 VAL B 30 -0.330 2.045 1.187 1.00 0.00 C ATOM 0 H VAL B 30 -0.757 -0.431 -0.172 1.00 0.00 H new ATOM 0 HA VAL B 30 -2.348 0.516 1.938 1.00 0.00 H new ATOM 0 HB VAL B 30 -1.375 1.708 -0.680 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -2.051 3.928 0.214 1.00 0.00 H new ATOM 0 HG12 VAL B 30 -3.462 2.873 -0.039 1.00 0.00 H new ATOM 0 HG13 VAL B 30 -2.824 3.129 1.603 1.00 0.00 H new ATOM 0 HG21 VAL B 30 0.156 2.959 0.846 1.00 0.00 H new ATOM 0 HG22 VAL B 30 -0.575 2.137 2.245 1.00 0.00 H new ATOM 0 HG23 VAL B 30 0.344 1.200 1.043 1.00 0.00 H new ATOM 2517 N LYS B 31 -3.921 0.152 -0.951 1.00 0.00 N ATOM 2518 CA LYS B 31 -5.263 0.086 -1.510 1.00 0.00 C ATOM 2519 C LYS B 31 -6.066 -1.015 -0.836 1.00 0.00 C ATOM 2520 O LYS B 31 -7.231 -0.823 -0.487 1.00 0.00 O ATOM 2521 CB LYS B 31 -5.176 -0.170 -3.010 1.00 0.00 C ATOM 2522 CG LYS B 31 -4.588 1.061 -3.709 1.00 0.00 C ATOM 2523 CD LYS B 31 -4.699 0.898 -5.231 1.00 0.00 C ATOM 2524 CE LYS B 31 -3.728 -0.181 -5.722 1.00 0.00 C ATOM 2525 NZ LYS B 31 -3.635 -0.120 -7.209 1.00 0.00 N ATOM 0 H LYS B 31 -3.167 -0.069 -1.601 1.00 0.00 H new ATOM 0 HA LYS B 31 -5.769 1.035 -1.334 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -4.553 -1.043 -3.204 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -6.166 -0.389 -3.410 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -5.118 1.959 -3.391 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -3.544 1.189 -3.423 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -5.720 0.628 -5.501 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -4.479 1.846 -5.722 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -2.744 -0.030 -5.278 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -4.072 -1.166 -5.408 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -2.977 -0.851 -7.546 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -4.575 -0.283 -7.623 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -3.288 0.817 -7.497 1.00 0.00 H new ATOM 2539 N ASN B 32 -5.436 -2.163 -0.651 1.00 0.00 N ATOM 2540 CA ASN B 32 -6.102 -3.281 -0.010 1.00 0.00 C ATOM 2541 C ASN B 32 -6.360 -2.979 1.462 1.00 0.00 C ATOM 2542 O ASN B 32 -7.423 -3.301 1.995 1.00 0.00 O ATOM 2543 CB ASN B 32 -5.242 -4.537 -0.137 1.00 0.00 C ATOM 2544 CG ASN B 32 -5.186 -4.990 -1.594 1.00 0.00 C ATOM 2545 OD1 ASN B 32 -6.005 -4.466 -2.468 1.00 0.00 O flip ATOM 2546 ND2 ASN B 32 -4.367 -5.837 -1.948 1.00 0.00 N flip ATOM 0 H ASN B 32 -4.473 -2.343 -0.933 1.00 0.00 H new ATOM 0 HA ASN B 32 -7.059 -3.445 -0.504 1.00 0.00 H new ATOM 0 HB2 ASN B 32 -4.235 -4.336 0.228 1.00 0.00 H new ATOM 0 HB3 ASN B 32 -5.653 -5.333 0.484 1.00 0.00 H new ATOM 0 HD21 ASN B 32 -3.728 -6.245 -1.266 1.00 0.00 H new ATOM 0 HD22 ASN B 32 -4.327 -6.131 -2.924 1.00 0.00 H new ATOM 2553 N ARG B 33 -5.375 -2.370 2.120 1.00 0.00 N ATOM 2554 CA ARG B 33 -5.505 -2.044 3.532 1.00 0.00 C ATOM 2555 C ARG B 33 -6.431 -0.851 3.734 1.00 0.00 C ATOM 2556 O ARG B 33 -7.286 -0.869 4.618 1.00 0.00 O ATOM 2557 CB ARG B 33 -4.128 -1.742 4.128 1.00 0.00 C ATOM 2558 CG ARG B 33 -4.261 -1.525 5.634 1.00 0.00 C ATOM 2559 CD ARG B 33 -2.869 -1.397 6.253 1.00 0.00 C ATOM 2560 NE ARG B 33 -2.959 -1.398 7.709 1.00 0.00 N ATOM 2561 CZ ARG B 33 -1.870 -1.479 8.464 1.00 0.00 C ATOM 2562 NH1 ARG B 33 -0.693 -1.561 7.905 1.00 0.00 N ATOM 2563 NH2 ARG B 33 -1.975 -1.476 9.765 1.00 0.00 N ATOM 0 H ARG B 33 -4.487 -2.096 1.699 1.00 0.00 H new ATOM 0 HA ARG B 33 -5.939 -2.904 4.042 1.00 0.00 H new ATOM 0 HB2 ARG B 33 -3.444 -2.567 3.928 1.00 0.00 H new ATOM 0 HB3 ARG B 33 -3.703 -0.855 3.658 1.00 0.00 H new ATOM 0 HG2 ARG B 33 -4.844 -0.626 5.833 1.00 0.00 H new ATOM 0 HG3 ARG B 33 -4.797 -2.359 6.087 1.00 0.00 H new ATOM 0 HD2 ARG B 33 -2.239 -2.222 5.920 1.00 0.00 H new ATOM 0 HD3 ARG B 33 -2.395 -0.476 5.912 1.00 0.00 H new ATOM 0 HE ARG B 33 -3.874 -1.335 8.155 1.00 0.00 H new ATOM 0 HH11 ARG B 33 -0.610 -1.563 6.888 1.00 0.00 H new ATOM 0 HH12 ARG B 33 0.144 -1.623 8.485 1.00 0.00 H new ATOM 0 HH21 ARG B 33 -2.894 -1.411 10.202 1.00 0.00 H new ATOM 0 HH22 ARG B 33 -1.138 -1.538 10.344 1.00 0.00 H new ATOM 2577 N ALA B 34 -6.247 0.183 2.912 1.00 0.00 N ATOM 2578 CA ALA B 34 -7.060 1.393 3.012 1.00 0.00 C ATOM 2579 C ALA B 34 -6.839 2.065 4.355 1.00 0.00 C ATOM 2580 O ALA B 34 -6.301 3.168 4.415 1.00 0.00 O ATOM 2581 CB ALA B 34 -8.536 1.051 2.824 1.00 0.00 C ATOM 0 H ALA B 34 -5.545 0.206 2.173 1.00 0.00 H new ATOM 0 HA ALA B 34 -6.759 2.085 2.225 1.00 0.00 H new ATOM 0 HB1 ALA B 34 -9.133 1.960 2.900 1.00 0.00 H new ATOM 0 HB2 ALA B 34 -8.683 0.602 1.842 1.00 0.00 H new ATOM 0 HB3 ALA B 34 -8.847 0.347 3.595 1.00 0.00 H new ATOM 2587 N ARG B 35 -7.255 1.398 5.420 1.00 0.00 N ATOM 2588 CA ARG B 35 -7.097 1.932 6.766 1.00 0.00 C ATOM 2589 C ARG B 35 -8.029 3.117 6.977 1.00 0.00 C ATOM 2590 O ARG B 35 -8.584 3.291 8.062 1.00 0.00 O ATOM 2591 CB ARG B 35 -5.647 2.385 6.995 1.00 0.00 C ATOM 2592 CG ARG B 35 -5.367 2.485 8.497 1.00 0.00 C ATOM 2593 CD ARG B 35 -4.071 3.270 8.715 1.00 0.00 C ATOM 2594 NE ARG B 35 -2.957 2.607 8.043 1.00 0.00 N ATOM 2595 CZ ARG B 35 -2.262 1.645 8.641 1.00 0.00 C ATOM 2596 NH1 ARG B 35 -2.573 1.269 9.850 1.00 0.00 N ATOM 2597 NH2 ARG B 35 -1.268 1.077 8.015 1.00 0.00 N ATOM 0 H ARG B 35 -7.706 0.484 5.379 1.00 0.00 H new ATOM 0 HA ARG B 35 -7.346 1.143 7.476 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -4.958 1.678 6.533 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -5.478 3.351 6.519 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -6.196 2.981 9.002 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -5.280 1.489 8.930 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -4.184 4.284 8.332 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -3.863 3.353 9.782 1.00 0.00 H new ATOM 0 HE ARG B 35 -2.707 2.888 7.095 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -3.351 1.713 10.338 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -2.039 0.530 10.308 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -1.026 1.372 7.069 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -0.733 0.338 8.472 1.00 0.00 H new ATOM 2611 N ARG B 36 -8.187 3.938 5.937 1.00 0.00 N ATOM 2612 CA ARG B 36 -9.050 5.120 6.028 1.00 0.00 C ATOM 2613 C ARG B 36 -10.347 4.898 5.258 1.00 0.00 C ATOM 2614 O ARG B 36 -11.222 5.760 5.233 1.00 0.00 O ATOM 2615 CB ARG B 36 -8.301 6.343 5.483 1.00 0.00 C ATOM 2616 CG ARG B 36 -9.131 7.607 5.710 1.00 0.00 C ATOM 2617 CD ARG B 36 -8.249 8.846 5.551 1.00 0.00 C ATOM 2618 NE ARG B 36 -7.319 8.941 6.669 1.00 0.00 N ATOM 2619 CZ ARG B 36 -6.539 10.004 6.824 1.00 0.00 C ATOM 2620 NH1 ARG B 36 -6.605 10.989 5.973 1.00 0.00 N ATOM 2621 NH2 ARG B 36 -5.713 10.064 7.832 1.00 0.00 N ATOM 0 H ARG B 36 -7.735 3.810 5.032 1.00 0.00 H new ATOM 0 HA ARG B 36 -9.306 5.295 7.073 1.00 0.00 H new ATOM 0 HB2 ARG B 36 -7.335 6.439 5.978 1.00 0.00 H new ATOM 0 HB3 ARG B 36 -8.103 6.214 4.419 1.00 0.00 H new ATOM 0 HG2 ARG B 36 -9.956 7.643 4.998 1.00 0.00 H new ATOM 0 HG3 ARG B 36 -9.571 7.589 6.707 1.00 0.00 H new ATOM 0 HD2 ARG B 36 -7.698 8.792 4.612 1.00 0.00 H new ATOM 0 HD3 ARG B 36 -8.869 9.741 5.506 1.00 0.00 H new ATOM 0 HE ARG B 36 -7.267 8.178 7.344 1.00 0.00 H new ATOM 0 HH11 ARG B 36 -7.256 10.943 5.189 1.00 0.00 H new ATOM 0 HH12 ARG B 36 -6.006 11.806 6.091 1.00 0.00 H new ATOM 0 HH21 ARG B 36 -5.667 9.295 8.500 1.00 0.00 H new ATOM 0 HH22 ARG B 36 -5.113 10.880 7.952 1.00 0.00 H new ATOM 2635 N PHE B 37 -10.477 3.728 4.642 1.00 0.00 N ATOM 2636 CA PHE B 37 -11.689 3.413 3.890 1.00 0.00 C ATOM 2637 C PHE B 37 -11.805 4.339 2.683 1.00 0.00 C ATOM 2638 O PHE B 37 -12.747 5.116 2.570 1.00 0.00 O ATOM 2639 CB PHE B 37 -12.927 3.557 4.801 1.00 0.00 C ATOM 2640 CG PHE B 37 -12.525 3.341 6.242 1.00 0.00 C ATOM 2641 CD1 PHE B 37 -12.099 2.078 6.667 1.00 0.00 C ATOM 2642 CD2 PHE B 37 -12.575 4.404 7.149 1.00 0.00 C ATOM 2643 CE1 PHE B 37 -11.727 1.878 7.999 1.00 0.00 C ATOM 2644 CE2 PHE B 37 -12.200 4.208 8.479 1.00 0.00 C ATOM 2645 CZ PHE B 37 -11.779 2.944 8.905 1.00 0.00 C ATOM 0 H PHE B 37 -9.771 2.992 4.647 1.00 0.00 H new ATOM 0 HA PHE B 37 -11.635 2.383 3.537 1.00 0.00 H new ATOM 0 HB2 PHE B 37 -13.367 4.547 4.680 1.00 0.00 H new ATOM 0 HB3 PHE B 37 -13.689 2.833 4.513 1.00 0.00 H new ATOM 0 HD1 PHE B 37 -12.058 1.258 5.966 1.00 0.00 H new ATOM 0 HD2 PHE B 37 -12.904 5.378 6.820 1.00 0.00 H new ATOM 0 HE1 PHE B 37 -11.400 0.903 8.329 1.00 0.00 H new ATOM 0 HE2 PHE B 37 -12.235 5.031 9.178 1.00 0.00 H new ATOM 0 HZ PHE B 37 -11.493 2.790 9.935 1.00 0.00 H new ATOM 2655 N ARG B 38 -10.842 4.251 1.785 1.00 0.00 N ATOM 2656 CA ARG B 38 -10.850 5.096 0.603 1.00 0.00 C ATOM 2657 C ARG B 38 -12.152 4.913 -0.164 1.00 0.00 C ATOM 2658 O ARG B 38 -12.657 5.849 -0.779 1.00 0.00 O ATOM 2659 CB ARG B 38 -9.676 4.737 -0.311 1.00 0.00 C ATOM 2660 CG ARG B 38 -8.410 4.564 0.531 1.00 0.00 C ATOM 2661 CD ARG B 38 -7.175 4.319 -0.366 1.00 0.00 C ATOM 2662 NE ARG B 38 -6.299 5.480 -0.333 1.00 0.00 N ATOM 2663 CZ ARG B 38 -5.555 5.745 0.737 1.00 0.00 C ATOM 2664 NH1 ARG B 38 -5.614 4.964 1.782 1.00 0.00 N ATOM 2665 NH2 ARG B 38 -4.768 6.782 0.742 1.00 0.00 N ATOM 0 H ARG B 38 -10.051 3.610 1.849 1.00 0.00 H new ATOM 0 HA ARG B 38 -10.758 6.134 0.922 1.00 0.00 H new ATOM 0 HB2 ARG B 38 -9.892 3.818 -0.855 1.00 0.00 H new ATOM 0 HB3 ARG B 38 -9.527 5.520 -1.055 1.00 0.00 H new ATOM 0 HG2 ARG B 38 -8.250 5.454 1.140 1.00 0.00 H new ATOM 0 HG3 ARG B 38 -8.537 3.726 1.217 1.00 0.00 H new ATOM 0 HD2 ARG B 38 -6.636 3.436 -0.023 1.00 0.00 H new ATOM 0 HD3 ARG B 38 -7.492 4.121 -1.390 1.00 0.00 H new ATOM 0 HE ARG B 38 -6.255 6.100 -1.142 1.00 0.00 H new ATOM 0 HH11 ARG B 38 -6.230 4.151 1.777 1.00 0.00 H new ATOM 0 HH12 ARG B 38 -5.044 5.167 2.603 1.00 0.00 H new ATOM 0 HH21 ARG B 38 -4.722 7.391 -0.075 1.00 0.00 H new ATOM 0 HH22 ARG B 38 -4.197 6.985 1.563 1.00 0.00 H new ATOM 2679 N MET B 39 -12.683 3.700 -0.133 1.00 0.00 N ATOM 2680 CA MET B 39 -13.916 3.408 -0.847 1.00 0.00 C ATOM 2681 C MET B 39 -15.106 4.105 -0.198 1.00 0.00 C ATOM 2682 O MET B 39 -15.748 4.961 -0.807 1.00 0.00 O ATOM 2683 CB MET B 39 -14.164 1.903 -0.873 1.00 0.00 C ATOM 2684 CG MET B 39 -12.937 1.186 -1.442 1.00 0.00 C ATOM 2685 SD MET B 39 -11.675 1.025 -0.154 1.00 0.00 S ATOM 2686 CE MET B 39 -10.329 0.451 -1.215 1.00 0.00 C ATOM 0 H MET B 39 -12.284 2.909 0.373 1.00 0.00 H new ATOM 0 HA MET B 39 -13.808 3.780 -1.866 1.00 0.00 H new ATOM 0 HB2 MET B 39 -14.373 1.542 0.134 1.00 0.00 H new ATOM 0 HB3 MET B 39 -15.041 1.680 -1.480 1.00 0.00 H new ATOM 0 HG2 MET B 39 -13.219 0.201 -1.814 1.00 0.00 H new ATOM 0 HG3 MET B 39 -12.537 1.744 -2.289 1.00 0.00 H new ATOM 0 HE1 MET B 39 -9.382 0.540 -0.682 1.00 0.00 H new ATOM 0 HE2 MET B 39 -10.498 -0.592 -1.485 1.00 0.00 H new ATOM 0 HE3 MET B 39 -10.294 1.058 -2.119 1.00 0.00 H new ATOM 2696 N ILE B 40 -15.392 3.732 1.046 1.00 0.00 N ATOM 2697 CA ILE B 40 -16.505 4.322 1.779 1.00 0.00 C ATOM 2698 C ILE B 40 -16.270 5.816 1.975 1.00 0.00 C ATOM 2699 O ILE B 40 -17.188 6.623 1.830 1.00 0.00 O ATOM 2700 CB ILE B 40 -16.668 3.636 3.143 1.00 0.00 C ATOM 2701 CG1 ILE B 40 -17.151 2.192 2.933 1.00 0.00 C ATOM 2702 CG2 ILE B 40 -17.697 4.402 3.987 1.00 0.00 C ATOM 2703 CD1 ILE B 40 -17.139 1.436 4.266 1.00 0.00 C ATOM 0 H ILE B 40 -14.870 3.026 1.565 1.00 0.00 H new ATOM 0 HA ILE B 40 -17.418 4.178 1.201 1.00 0.00 H new ATOM 0 HB ILE B 40 -15.709 3.629 3.662 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -18.158 2.194 2.516 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -16.508 1.686 2.213 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -17.811 3.913 4.954 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -17.355 5.426 4.136 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -18.657 4.411 3.470 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -17.483 0.414 4.108 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -16.125 1.420 4.666 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -17.801 1.936 4.974 1.00 0.00 H new ATOM 2715 N SER B 41 -15.037 6.177 2.310 1.00 0.00 N ATOM 2716 CA SER B 41 -14.699 7.576 2.530 1.00 0.00 C ATOM 2717 C SER B 41 -15.044 8.402 1.300 1.00 0.00 C ATOM 2718 O SER B 41 -15.594 9.496 1.413 1.00 0.00 O ATOM 2719 CB SER B 41 -13.208 7.720 2.822 1.00 0.00 C ATOM 2720 OG SER B 41 -12.909 9.090 3.052 1.00 0.00 O ATOM 0 H SER B 41 -14.261 5.526 2.434 1.00 0.00 H new ATOM 0 HA SER B 41 -15.274 7.935 3.383 1.00 0.00 H new ATOM 0 HB2 SER B 41 -12.936 7.124 3.694 1.00 0.00 H new ATOM 0 HB3 SER B 41 -12.623 7.343 1.983 1.00 0.00 H new ATOM 0 HG SER B 41 -11.953 9.189 3.242 1.00 0.00 H new ATOM 2726 N ASN B 42 -14.717 7.873 0.121 1.00 0.00 N ATOM 2727 CA ASN B 42 -15.004 8.578 -1.127 1.00 0.00 C ATOM 2728 C ASN B 42 -16.334 8.126 -1.714 1.00 0.00 C ATOM 2729 O ASN B 42 -16.768 8.656 -2.734 1.00 0.00 O ATOM 2730 CB ASN B 42 -13.905 8.317 -2.150 1.00 0.00 C ATOM 2731 CG ASN B 42 -12.613 8.979 -1.693 1.00 0.00 C ATOM 2732 OD1 ASN B 42 -11.537 8.856 -2.416 1.00 0.00 O flip ATOM 2733 ND2 ASN B 42 -12.588 9.641 -0.655 1.00 0.00 N flip ATOM 0 H ASN B 42 -14.259 6.969 0.004 1.00 0.00 H new ATOM 0 HA ASN B 42 -15.053 9.643 -0.899 1.00 0.00 H new ATOM 0 HB2 ASN B 42 -13.753 7.244 -2.270 1.00 0.00 H new ATOM 0 HB3 ASN B 42 -14.201 8.708 -3.124 1.00 0.00 H new ATOM 0 HD21 ASN B 42 -13.432 9.736 -0.090 1.00 0.00 H new ATOM 0 HD22 ASN B 42 -11.723 10.094 -0.360 1.00 0.00 H new ATOM 2740 N LEU B 43 -16.966 7.145 -1.056 1.00 0.00 N ATOM 2741 CA LEU B 43 -18.259 6.601 -1.495 1.00 0.00 C ATOM 2742 C LEU B 43 -18.504 6.838 -2.986 1.00 0.00 C ATOM 2743 O LEU B 43 -19.557 7.357 -3.316 1.00 0.00 O ATOM 2744 CB LEU B 43 -19.400 7.237 -0.690 1.00 0.00 C ATOM 2745 CG LEU B 43 -19.287 8.782 -0.723 1.00 0.00 C ATOM 2746 CD1 LEU B 43 -20.685 9.417 -0.697 1.00 0.00 C ATOM 2747 CD2 LEU B 43 -18.492 9.284 0.494 1.00 0.00 C ATOM 2748 OXT LEU B 43 -17.640 6.487 -3.772 1.00 0.00 O ATOM 0 H LEU B 43 -16.599 6.708 -0.210 1.00 0.00 H new ATOM 0 HA LEU B 43 -18.231 5.525 -1.321 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -20.361 6.927 -1.101 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -19.366 6.885 0.341 1.00 0.00 H new ATOM 0 HG LEU B 43 -18.771 9.066 -1.640 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -20.592 10.503 -0.721 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -21.253 9.083 -1.565 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -21.204 9.117 0.213 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -18.420 10.371 0.458 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -19.001 8.984 1.410 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -17.491 8.853 0.477 1.00 0.00 H new