USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 902 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 135 ASN : amide:sc= -1.26 K(o=-1.3,f=-5.9!) USER MOD Set 1.2: A 146 HIS : no HE2:sc= 0 K(o=-1.3,f=-2.4) USER MOD Set 2.1: A 96 THR OG1 : rot -128:sc= 1.31 USER MOD Set 2.2: A 114 HIS : no HD1:sc= 1.09 K(o=2.4,f=-5!) USER MOD Set 3.1: A 78 ASN : amide:sc= -0.938! C(o=-5.8!,f=-8.9!) USER MOD Set 3.2: A 80 ASN : amide:sc= -4.84! C(o=-5.8!,f=-11!) USER MOD Set 4.1: A 63 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot -91:sc= 0.818 USER MOD Single : A 52 CYS SG : rot -160:sc= -1.54 USER MOD Single : A 55 SER OG : rot 130:sc= 0.513 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.0857 K(o=-0.086,f=-2.2!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -2.11! C(o=-2.1!,f=-5.5!) USER MOD Single : A 68 CYS SG : rot 178:sc= 1.01 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -0.394 K(o=-0.39,f=-1.4) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 ASN :FLIP amide:sc= -0.13 F(o=-1.5,f=-0.13) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.0428 K(o=-0.043,f=-4.8!) USER MOD Single : A 89 GLN : amide:sc= -7.32! C(o=-7.3!,f=-7.3!) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.0157 X(o=-0.016,f=-0.28) USER MOD Single : A 97 CYS SG : rot 117:sc= 0.297 USER MOD Single : A 99 ASN : amide:sc= -0.0371 X(o=-0.037,f=0) USER MOD Single : A 109 GLN : amide:sc= -0.194 K(o=-0.19,f=-2.1!) USER MOD Single : A 110 SER OG : rot 27:sc= 0.544 USER MOD Single : A 111 LYS NZ :NH3+ -127:sc= -0.25 (180deg=-1.62!) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -143:sc= 0 (180deg=-0.608) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot -64:sc= 0.899 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.0258 K(o=-0.026,f=-1.8) USER MOD Single : A 142 HIS : no HE2:sc= -3.48! C(o=-3.5!,f=-7.5!) USER MOD Single : A 145 SER OG : rot -170:sc= -0.348 USER MOD Single : A 149 LYS NZ :NH3+ -179:sc= 0.132 (180deg=0.131) USER MOD Single : A 150 TYR OH : rot 180:sc= -0.109 USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.306 USER MOD Single : A 156 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD ----------------------------------------------------------------- ATOM 137 N ILE A 45 -4.300 3.560 -13.403 1.00 0.00 N ATOM 138 CA ILE A 45 -4.691 2.331 -12.725 1.00 0.00 C ATOM 139 C ILE A 45 -3.686 1.957 -11.641 1.00 0.00 C ATOM 140 O ILE A 45 -2.517 2.340 -11.706 1.00 0.00 O ATOM 141 CB ILE A 45 -4.821 1.159 -13.715 1.00 0.00 C ATOM 142 CG1 ILE A 45 -5.832 1.499 -14.813 1.00 0.00 C ATOM 143 CG2 ILE A 45 -5.234 -0.110 -12.983 1.00 0.00 C ATOM 144 CD1 ILE A 45 -7.240 1.699 -14.297 1.00 0.00 C ATOM 0 HA ILE A 45 -5.662 2.519 -12.267 1.00 0.00 H new ATOM 0 HB ILE A 45 -3.851 0.988 -14.181 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -5.509 2.406 -15.325 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -5.835 0.699 -15.553 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -5.322 -0.929 -13.696 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -4.482 -0.359 -12.235 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -6.195 0.049 -12.493 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -7.902 1.937 -15.129 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -7.582 0.786 -13.810 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -7.251 2.519 -13.579 1.00 0.00 H new ATOM 156 N ILE A 46 -4.147 1.206 -10.647 1.00 0.00 N ATOM 157 CA ILE A 46 -3.287 0.778 -9.551 1.00 0.00 C ATOM 158 C ILE A 46 -3.375 -0.729 -9.340 1.00 0.00 C ATOM 159 O ILE A 46 -4.459 -1.312 -9.393 1.00 0.00 O ATOM 160 CB ILE A 46 -3.654 1.492 -8.236 1.00 0.00 C ATOM 161 CG1 ILE A 46 -3.561 3.009 -8.411 1.00 0.00 C ATOM 162 CG2 ILE A 46 -2.744 1.026 -7.109 1.00 0.00 C ATOM 163 CD1 ILE A 46 -2.154 3.503 -8.666 1.00 0.00 C ATOM 0 H ILE A 46 -5.111 0.881 -10.578 1.00 0.00 H new ATOM 0 HA ILE A 46 -2.267 1.045 -9.827 1.00 0.00 H new ATOM 0 HB ILE A 46 -4.681 1.238 -7.976 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -4.199 3.311 -9.241 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -3.951 3.494 -7.516 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -3.015 1.539 -6.186 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.856 -0.050 -6.972 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -1.708 1.254 -7.360 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.164 4.587 -8.780 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.515 3.233 -7.825 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.767 3.046 -9.577 1.00 0.00 H new ATOM 175 N ARG A 47 -2.228 -1.355 -9.098 1.00 0.00 N ATOM 176 CA ARG A 47 -2.175 -2.795 -8.878 1.00 0.00 C ATOM 177 C ARG A 47 -1.759 -3.111 -7.444 1.00 0.00 C ATOM 178 O ARG A 47 -0.754 -2.600 -6.951 1.00 0.00 O ATOM 179 CB ARG A 47 -1.199 -3.447 -9.858 1.00 0.00 C ATOM 180 CG ARG A 47 -1.845 -3.877 -11.166 1.00 0.00 C ATOM 181 CD ARG A 47 -2.802 -5.040 -10.958 1.00 0.00 C ATOM 182 NE ARG A 47 -2.111 -6.242 -10.500 1.00 0.00 N ATOM 183 CZ ARG A 47 -1.487 -7.087 -11.314 1.00 0.00 C ATOM 184 NH1 ARG A 47 -1.468 -6.861 -12.620 1.00 0.00 N ATOM 185 NH2 ARG A 47 -0.881 -8.159 -10.821 1.00 0.00 N ATOM 0 H ARG A 47 -1.323 -0.887 -9.049 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.173 -3.199 -9.047 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -0.392 -2.747 -10.074 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -0.747 -4.317 -9.382 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -2.383 -3.035 -11.602 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -1.071 -4.164 -11.878 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -3.562 -4.758 -10.229 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -3.321 -5.254 -11.892 1.00 0.00 H new ATOM 0 HE ARG A 47 -2.107 -6.444 -9.500 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -1.933 -6.037 -13.002 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -0.988 -7.511 -13.243 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -0.894 -8.335 -9.816 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -0.402 -8.807 -11.446 1.00 0.00 H new ATOM 199 N VAL A 48 -2.540 -3.957 -6.779 1.00 0.00 N ATOM 200 CA VAL A 48 -2.253 -4.342 -5.402 1.00 0.00 C ATOM 201 C VAL A 48 -0.891 -5.017 -5.293 1.00 0.00 C ATOM 202 O VAL A 48 -0.646 -6.048 -5.919 1.00 0.00 O ATOM 203 CB VAL A 48 -3.331 -5.292 -4.849 1.00 0.00 C ATOM 204 CG1 VAL A 48 -2.989 -5.720 -3.430 1.00 0.00 C ATOM 205 CG2 VAL A 48 -4.700 -4.632 -4.900 1.00 0.00 C ATOM 0 H VAL A 48 -3.376 -4.389 -7.172 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.249 -3.426 -4.811 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.360 -6.184 -5.475 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.762 -6.391 -3.056 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.029 -6.236 -3.427 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.931 -4.841 -2.789 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.450 -5.318 -4.505 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.688 -3.723 -4.299 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.945 -4.382 -5.932 1.00 0.00 H new ATOM 215 N ASP A 49 -0.008 -4.429 -4.494 1.00 0.00 N ATOM 216 CA ASP A 49 1.331 -4.975 -4.300 1.00 0.00 C ATOM 217 C ASP A 49 1.289 -6.497 -4.206 1.00 0.00 C ATOM 218 O ASP A 49 0.370 -7.083 -3.633 1.00 0.00 O ATOM 219 CB ASP A 49 1.965 -4.391 -3.037 1.00 0.00 C ATOM 220 CG ASP A 49 3.465 -4.211 -3.173 1.00 0.00 C ATOM 221 OD1 ASP A 49 3.888 -3.301 -3.914 1.00 0.00 O ATOM 222 OD2 ASP A 49 4.215 -4.982 -2.538 1.00 0.00 O ATOM 0 H ASP A 49 -0.195 -3.574 -3.970 1.00 0.00 H new ATOM 0 HA ASP A 49 1.938 -4.699 -5.163 1.00 0.00 H new ATOM 0 HB2 ASP A 49 1.505 -3.428 -2.815 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.756 -5.047 -2.192 1.00 0.00 H new ATOM 227 N PRO A 50 2.305 -7.154 -4.784 1.00 0.00 N ATOM 228 CA PRO A 50 2.407 -8.617 -4.779 1.00 0.00 C ATOM 229 C PRO A 50 2.707 -9.172 -3.391 1.00 0.00 C ATOM 230 O PRO A 50 2.256 -10.262 -3.036 1.00 0.00 O ATOM 231 CB PRO A 50 3.574 -8.894 -5.731 1.00 0.00 C ATOM 232 CG PRO A 50 4.400 -7.655 -5.688 1.00 0.00 C ATOM 233 CD PRO A 50 3.434 -6.520 -5.486 1.00 0.00 C ATOM 0 HA PRO A 50 1.473 -9.092 -5.079 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.148 -9.764 -5.411 1.00 0.00 H new ATOM 0 HB3 PRO A 50 3.221 -9.099 -6.741 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.126 -7.698 -4.877 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.963 -7.529 -6.613 1.00 0.00 H new ATOM 0 HD2 PRO A 50 3.875 -5.717 -4.895 1.00 0.00 H new ATOM 0 HD3 PRO A 50 3.123 -6.083 -6.435 1.00 0.00 H new ATOM 241 N THR A 51 3.473 -8.417 -2.609 1.00 0.00 N ATOM 242 CA THR A 51 3.834 -8.835 -1.261 1.00 0.00 C ATOM 243 C THR A 51 2.594 -9.031 -0.395 1.00 0.00 C ATOM 244 O THR A 51 2.535 -9.952 0.421 1.00 0.00 O ATOM 245 CB THR A 51 4.761 -7.807 -0.584 1.00 0.00 C ATOM 246 OG1 THR A 51 4.168 -6.505 -0.633 1.00 0.00 O ATOM 247 CG2 THR A 51 6.122 -7.776 -1.263 1.00 0.00 C ATOM 0 H THR A 51 3.855 -7.513 -2.887 1.00 0.00 H new ATOM 0 HA THR A 51 4.362 -9.784 -1.355 1.00 0.00 H new ATOM 0 HB THR A 51 4.898 -8.104 0.456 1.00 0.00 H new ATOM 0 HG1 THR A 51 4.464 -6.041 -1.444 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.759 -7.043 -0.768 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.584 -8.761 -1.198 1.00 0.00 H new ATOM 0 HG23 THR A 51 6.000 -7.501 -2.311 1.00 0.00 H new ATOM 255 N CYS A 52 1.607 -8.161 -0.579 1.00 0.00 N ATOM 256 CA CYS A 52 0.367 -8.239 0.186 1.00 0.00 C ATOM 257 C CYS A 52 -0.411 -9.503 -0.167 1.00 0.00 C ATOM 258 O CYS A 52 -0.512 -9.895 -1.330 1.00 0.00 O ATOM 259 CB CYS A 52 -0.496 -7.004 -0.075 1.00 0.00 C ATOM 260 SG CYS A 52 -2.170 -7.118 0.599 1.00 0.00 S ATOM 0 H CYS A 52 1.641 -7.394 -1.251 1.00 0.00 H new ATOM 0 HA CYS A 52 0.624 -8.276 1.245 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -0.002 -6.132 0.353 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -0.559 -6.839 -1.151 1.00 0.00 H new ATOM 0 HG CYS A 52 -2.940 -6.262 -0.004 1.00 0.00 H new ATOM 266 N PRO A 53 -0.974 -10.158 0.860 1.00 0.00 N ATOM 267 CA PRO A 53 -1.752 -11.387 0.683 1.00 0.00 C ATOM 268 C PRO A 53 -3.084 -11.135 -0.015 1.00 0.00 C ATOM 269 O PRO A 53 -3.420 -11.803 -0.994 1.00 0.00 O ATOM 270 CB PRO A 53 -1.982 -11.871 2.117 1.00 0.00 C ATOM 271 CG PRO A 53 -1.898 -10.639 2.950 1.00 0.00 C ATOM 272 CD PRO A 53 -0.894 -9.748 2.272 1.00 0.00 C ATOM 0 HA PRO A 53 -1.234 -12.110 0.053 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -2.954 -12.354 2.221 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -1.230 -12.602 2.414 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -2.869 -10.149 3.021 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -1.585 -10.876 3.967 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -1.141 -8.694 2.399 1.00 0.00 H new ATOM 0 HD3 PRO A 53 0.108 -9.891 2.676 1.00 0.00 H new ATOM 280 N LEU A 54 -3.839 -10.168 0.495 1.00 0.00 N ATOM 281 CA LEU A 54 -5.136 -9.827 -0.080 1.00 0.00 C ATOM 282 C LEU A 54 -5.060 -9.773 -1.602 1.00 0.00 C ATOM 283 O LEU A 54 -6.010 -10.137 -2.295 1.00 0.00 O ATOM 284 CB LEU A 54 -5.620 -8.483 0.466 1.00 0.00 C ATOM 285 CG LEU A 54 -5.792 -8.398 1.983 1.00 0.00 C ATOM 286 CD1 LEU A 54 -6.055 -6.962 2.411 1.00 0.00 C ATOM 287 CD2 LEU A 54 -6.921 -9.308 2.444 1.00 0.00 C ATOM 0 H LEU A 54 -3.576 -9.607 1.305 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.846 -10.604 0.202 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.914 -7.712 0.157 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.576 -8.246 -0.002 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.867 -8.733 2.453 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.175 -6.921 3.494 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.214 -6.334 2.115 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.965 -6.600 1.931 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -7.029 -9.234 3.526 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -7.852 -9.004 1.965 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.692 -10.338 2.171 1.00 0.00 H new ATOM 299 N SER A 55 -3.922 -9.317 -2.117 1.00 0.00 N ATOM 300 CA SER A 55 -3.721 -9.214 -3.557 1.00 0.00 C ATOM 301 C SER A 55 -4.342 -10.406 -4.279 1.00 0.00 C ATOM 302 O SER A 55 -5.102 -10.241 -5.234 1.00 0.00 O ATOM 303 CB SER A 55 -2.229 -9.128 -3.881 1.00 0.00 C ATOM 304 OG SER A 55 -2.006 -8.388 -5.069 1.00 0.00 O ATOM 0 H SER A 55 -3.125 -9.013 -1.557 1.00 0.00 H new ATOM 0 HA SER A 55 -4.213 -8.305 -3.903 1.00 0.00 H new ATOM 0 HB2 SER A 55 -1.700 -8.658 -3.052 1.00 0.00 H new ATOM 0 HB3 SER A 55 -1.820 -10.132 -3.992 1.00 0.00 H new ATOM 0 HG SER A 55 -1.328 -7.700 -4.903 1.00 0.00 H new ATOM 310 N SER A 56 -4.014 -11.607 -3.815 1.00 0.00 N ATOM 311 CA SER A 56 -4.535 -12.828 -4.418 1.00 0.00 C ATOM 312 C SER A 56 -6.060 -12.849 -4.371 1.00 0.00 C ATOM 313 O SER A 56 -6.718 -13.157 -5.364 1.00 0.00 O ATOM 314 CB SER A 56 -3.975 -14.057 -3.699 1.00 0.00 C ATOM 315 OG SER A 56 -2.563 -14.112 -3.808 1.00 0.00 O ATOM 0 H SER A 56 -3.390 -11.761 -3.023 1.00 0.00 H new ATOM 0 HA SER A 56 -4.220 -12.851 -5.461 1.00 0.00 H new ATOM 0 HB2 SER A 56 -4.261 -14.029 -2.648 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.411 -14.961 -4.124 1.00 0.00 H new ATOM 0 HG SER A 56 -2.229 -14.905 -3.339 1.00 0.00 H new ATOM 321 N ASN A 57 -6.614 -12.519 -3.209 1.00 0.00 N ATOM 322 CA ASN A 57 -8.062 -12.500 -3.031 1.00 0.00 C ATOM 323 C ASN A 57 -8.730 -11.643 -4.102 1.00 0.00 C ATOM 324 O ASN A 57 -8.406 -10.470 -4.286 1.00 0.00 O ATOM 325 CB ASN A 57 -8.418 -11.968 -1.641 1.00 0.00 C ATOM 326 CG ASN A 57 -8.343 -13.043 -0.574 1.00 0.00 C ATOM 327 OD1 ASN A 57 -8.194 -14.227 -0.879 1.00 0.00 O ATOM 328 ND2 ASN A 57 -8.446 -12.635 0.685 1.00 0.00 N ATOM 0 H ASN A 57 -6.083 -12.261 -2.377 1.00 0.00 H new ATOM 0 HA ASN A 57 -8.429 -13.522 -3.127 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -7.740 -11.155 -1.382 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -9.424 -11.550 -1.662 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -8.403 -13.313 1.446 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -8.569 -11.644 0.891 1.00 0.00 H new ATOM 335 N PRO A 58 -9.688 -12.242 -4.826 1.00 0.00 N ATOM 336 CA PRO A 58 -10.424 -11.553 -5.890 1.00 0.00 C ATOM 337 C PRO A 58 -11.366 -10.485 -5.345 1.00 0.00 C ATOM 338 O PRO A 58 -12.131 -10.734 -4.415 1.00 0.00 O ATOM 339 CB PRO A 58 -11.219 -12.677 -6.557 1.00 0.00 C ATOM 340 CG PRO A 58 -11.374 -13.713 -5.497 1.00 0.00 C ATOM 341 CD PRO A 58 -10.127 -13.638 -4.660 1.00 0.00 C ATOM 0 HA PRO A 58 -9.757 -11.023 -6.570 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -12.188 -12.322 -6.908 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.692 -13.074 -7.424 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -12.261 -13.524 -4.893 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -11.492 -14.704 -5.934 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -10.329 -13.874 -3.615 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -9.369 -14.341 -5.005 1.00 0.00 H new ATOM 349 N GLY A 59 -11.306 -9.293 -5.932 1.00 0.00 N ATOM 350 CA GLY A 59 -12.159 -8.205 -5.492 1.00 0.00 C ATOM 351 C GLY A 59 -11.386 -7.113 -4.779 1.00 0.00 C ATOM 352 O GLY A 59 -11.682 -5.928 -4.936 1.00 0.00 O ATOM 0 H GLY A 59 -10.681 -9.062 -6.705 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.672 -7.779 -6.354 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.927 -8.597 -4.825 1.00 0.00 H new ATOM 356 N THR A 60 -10.392 -7.511 -3.992 1.00 0.00 N ATOM 357 CA THR A 60 -9.576 -6.559 -3.250 1.00 0.00 C ATOM 358 C THR A 60 -8.769 -5.674 -4.194 1.00 0.00 C ATOM 359 O THR A 60 -7.809 -6.128 -4.815 1.00 0.00 O ATOM 360 CB THR A 60 -8.611 -7.275 -2.287 1.00 0.00 C ATOM 361 OG1 THR A 60 -9.349 -8.092 -1.372 1.00 0.00 O ATOM 362 CG2 THR A 60 -7.772 -6.270 -1.514 1.00 0.00 C ATOM 0 H THR A 60 -10.133 -8.487 -3.852 1.00 0.00 H new ATOM 0 HA THR A 60 -10.262 -5.940 -2.671 1.00 0.00 H new ATOM 0 HB THR A 60 -7.944 -7.903 -2.877 1.00 0.00 H new ATOM 0 HG1 THR A 60 -8.728 -8.545 -0.764 1.00 0.00 H new ATOM 0 HG21 THR A 60 -7.098 -6.800 -0.841 1.00 0.00 H new ATOM 0 HG22 THR A 60 -7.189 -5.669 -2.212 1.00 0.00 H new ATOM 0 HG23 THR A 60 -8.426 -5.619 -0.934 1.00 0.00 H new ATOM 370 N GLN A 61 -9.166 -4.409 -4.296 1.00 0.00 N ATOM 371 CA GLN A 61 -8.479 -3.461 -5.165 1.00 0.00 C ATOM 372 C GLN A 61 -8.012 -2.241 -4.378 1.00 0.00 C ATOM 373 O GLN A 61 -8.583 -1.903 -3.342 1.00 0.00 O ATOM 374 CB GLN A 61 -9.399 -3.025 -6.307 1.00 0.00 C ATOM 375 CG GLN A 61 -9.458 -4.021 -7.454 1.00 0.00 C ATOM 376 CD GLN A 61 -9.779 -3.364 -8.782 1.00 0.00 C ATOM 377 OE1 GLN A 61 -9.093 -2.434 -9.209 1.00 0.00 O ATOM 378 NE2 GLN A 61 -10.825 -3.844 -9.444 1.00 0.00 N ATOM 0 H GLN A 61 -9.959 -4.018 -3.788 1.00 0.00 H new ATOM 0 HA GLN A 61 -7.603 -3.958 -5.583 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -10.405 -2.875 -5.915 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -9.059 -2.063 -6.689 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -8.501 -4.538 -7.531 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -10.212 -4.777 -7.235 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -11.366 -4.616 -9.053 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -11.088 -3.441 -10.343 1.00 0.00 H new ATOM 387 N VAL A 62 -6.970 -1.585 -4.878 1.00 0.00 N ATOM 388 CA VAL A 62 -6.426 -0.401 -4.222 1.00 0.00 C ATOM 389 C VAL A 62 -7.397 0.771 -4.310 1.00 0.00 C ATOM 390 O VAL A 62 -7.627 1.321 -5.387 1.00 0.00 O ATOM 391 CB VAL A 62 -5.079 0.015 -4.841 1.00 0.00 C ATOM 392 CG1 VAL A 62 -4.559 1.285 -4.186 1.00 0.00 C ATOM 393 CG2 VAL A 62 -4.065 -1.113 -4.717 1.00 0.00 C ATOM 0 H VAL A 62 -6.486 -1.853 -5.735 1.00 0.00 H new ATOM 0 HA VAL A 62 -6.271 -0.663 -3.175 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.234 0.219 -5.900 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.606 1.563 -4.637 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.279 2.091 -4.332 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.419 1.113 -3.119 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -3.119 -0.802 -5.160 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.912 -1.351 -3.664 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -4.437 -1.995 -5.238 1.00 0.00 H new ATOM 403 N TYR A 63 -7.965 1.148 -3.170 1.00 0.00 N ATOM 404 CA TYR A 63 -8.914 2.255 -3.118 1.00 0.00 C ATOM 405 C TYR A 63 -8.358 3.482 -3.833 1.00 0.00 C ATOM 406 O TYR A 63 -7.290 3.985 -3.487 1.00 0.00 O ATOM 407 CB TYR A 63 -9.244 2.603 -1.666 1.00 0.00 C ATOM 408 CG TYR A 63 -10.254 3.719 -1.526 1.00 0.00 C ATOM 409 CD1 TYR A 63 -11.579 3.534 -1.900 1.00 0.00 C ATOM 410 CD2 TYR A 63 -9.883 4.959 -1.020 1.00 0.00 C ATOM 411 CE1 TYR A 63 -12.506 4.552 -1.774 1.00 0.00 C ATOM 412 CE2 TYR A 63 -10.803 5.981 -0.889 1.00 0.00 C ATOM 413 CZ TYR A 63 -12.113 5.773 -1.268 1.00 0.00 C ATOM 414 OH TYR A 63 -13.031 6.789 -1.141 1.00 0.00 O ATOM 0 H TYR A 63 -7.785 0.704 -2.270 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.826 1.943 -3.626 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.626 1.713 -1.166 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -8.326 2.888 -1.152 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -11.890 2.579 -2.296 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -8.858 5.126 -0.724 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -13.532 4.392 -2.070 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -10.498 6.938 -0.492 1.00 0.00 H new ATOM 0 HH TYR A 63 -12.592 7.582 -0.768 1.00 0.00 H new ATOM 424 N GLU A 64 -9.093 3.959 -4.834 1.00 0.00 N ATOM 425 CA GLU A 64 -8.674 5.128 -5.598 1.00 0.00 C ATOM 426 C GLU A 64 -7.207 5.016 -6.004 1.00 0.00 C ATOM 427 O GLU A 64 -6.719 3.928 -6.313 1.00 0.00 O ATOM 428 CB GLU A 64 -8.893 6.404 -4.783 1.00 0.00 C ATOM 429 CG GLU A 64 -10.250 6.467 -4.103 1.00 0.00 C ATOM 430 CD GLU A 64 -10.716 7.889 -3.860 1.00 0.00 C ATOM 431 OE1 GLU A 64 -11.357 8.466 -4.763 1.00 0.00 O ATOM 432 OE2 GLU A 64 -10.439 8.425 -2.766 1.00 0.00 O ATOM 0 H GLU A 64 -9.980 3.554 -5.134 1.00 0.00 H new ATOM 0 HA GLU A 64 -9.281 5.175 -6.502 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -8.113 6.480 -4.026 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -8.785 7.267 -5.440 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -10.985 5.948 -4.718 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -10.200 5.937 -3.152 1.00 0.00 H new ATOM 439 N ASP A 65 -6.511 6.147 -6.002 1.00 0.00 N ATOM 440 CA ASP A 65 -5.100 6.177 -6.369 1.00 0.00 C ATOM 441 C ASP A 65 -4.225 6.427 -5.145 1.00 0.00 C ATOM 442 O ASP A 65 -3.246 7.171 -5.211 1.00 0.00 O ATOM 443 CB ASP A 65 -4.848 7.257 -7.422 1.00 0.00 C ATOM 444 CG ASP A 65 -5.588 8.545 -7.118 1.00 0.00 C ATOM 445 OD1 ASP A 65 -5.094 9.331 -6.283 1.00 0.00 O ATOM 446 OD2 ASP A 65 -6.663 8.767 -7.715 1.00 0.00 O ATOM 0 H ASP A 65 -6.901 7.055 -5.750 1.00 0.00 H new ATOM 0 HA ASP A 65 -4.838 5.205 -6.787 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.779 7.461 -7.481 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -5.156 6.886 -8.400 1.00 0.00 H new ATOM 451 N TYR A 66 -4.585 5.803 -4.029 1.00 0.00 N ATOM 452 CA TYR A 66 -3.835 5.961 -2.789 1.00 0.00 C ATOM 453 C TYR A 66 -2.633 5.023 -2.756 1.00 0.00 C ATOM 454 O TYR A 66 -2.661 3.981 -2.102 1.00 0.00 O ATOM 455 CB TYR A 66 -4.739 5.692 -1.584 1.00 0.00 C ATOM 456 CG TYR A 66 -5.577 6.883 -1.178 1.00 0.00 C ATOM 457 CD1 TYR A 66 -5.022 7.935 -0.460 1.00 0.00 C ATOM 458 CD2 TYR A 66 -6.924 6.956 -1.513 1.00 0.00 C ATOM 459 CE1 TYR A 66 -5.784 9.025 -0.086 1.00 0.00 C ATOM 460 CE2 TYR A 66 -7.693 8.043 -1.144 1.00 0.00 C ATOM 461 CZ TYR A 66 -7.119 9.075 -0.431 1.00 0.00 C ATOM 462 OH TYR A 66 -7.882 10.158 -0.061 1.00 0.00 O ATOM 0 H TYR A 66 -5.392 5.183 -3.958 1.00 0.00 H new ATOM 0 HA TYR A 66 -3.473 6.988 -2.742 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -5.399 4.856 -1.815 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -4.122 5.387 -0.739 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -3.977 7.900 -0.190 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -7.377 6.150 -2.071 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -5.337 9.834 0.473 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -8.738 8.084 -1.412 1.00 0.00 H new ATOM 0 HH TYR A 66 -8.800 10.037 -0.383 1.00 0.00 H new ATOM 472 N ASN A 67 -1.576 5.401 -3.468 1.00 0.00 N ATOM 473 CA ASN A 67 -0.362 4.594 -3.521 1.00 0.00 C ATOM 474 C ASN A 67 0.856 5.463 -3.820 1.00 0.00 C ATOM 475 O ASN A 67 1.087 5.854 -4.965 1.00 0.00 O ATOM 476 CB ASN A 67 -0.496 3.502 -4.585 1.00 0.00 C ATOM 477 CG ASN A 67 0.847 2.949 -5.018 1.00 0.00 C ATOM 478 OD1 ASN A 67 1.868 3.189 -4.373 1.00 0.00 O ATOM 479 ND2 ASN A 67 0.853 2.203 -6.117 1.00 0.00 N ATOM 0 H ASN A 67 -1.536 6.260 -4.016 1.00 0.00 H new ATOM 0 HA ASN A 67 -0.223 4.127 -2.546 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -1.111 2.691 -4.194 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -1.016 3.906 -5.453 1.00 0.00 H new ATOM 0 HD21 ASN A 67 1.728 1.803 -6.457 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -0.017 2.030 -6.621 1.00 0.00 H new ATOM 486 N CYS A 68 1.632 5.762 -2.784 1.00 0.00 N ATOM 487 CA CYS A 68 2.826 6.585 -2.935 1.00 0.00 C ATOM 488 C CYS A 68 4.057 5.860 -2.399 1.00 0.00 C ATOM 489 O CYS A 68 3.968 5.077 -1.453 1.00 0.00 O ATOM 490 CB CYS A 68 2.647 7.918 -2.207 1.00 0.00 C ATOM 491 SG CYS A 68 2.094 7.756 -0.494 1.00 0.00 S ATOM 0 H CYS A 68 1.455 5.447 -1.830 1.00 0.00 H new ATOM 0 HA CYS A 68 2.974 6.777 -3.998 1.00 0.00 H new ATOM 0 HB2 CYS A 68 3.594 8.458 -2.222 1.00 0.00 H new ATOM 0 HB3 CYS A 68 1.926 8.525 -2.754 1.00 0.00 H new ATOM 0 HG CYS A 68 2.017 8.934 0.050 1.00 0.00 H new ATOM 497 N THR A 69 5.207 6.125 -3.012 1.00 0.00 N ATOM 498 CA THR A 69 6.455 5.497 -2.599 1.00 0.00 C ATOM 499 C THR A 69 7.371 6.498 -1.904 1.00 0.00 C ATOM 500 O THR A 69 7.553 7.621 -2.377 1.00 0.00 O ATOM 501 CB THR A 69 7.200 4.885 -3.800 1.00 0.00 C ATOM 502 OG1 THR A 69 6.368 3.918 -4.452 1.00 0.00 O ATOM 503 CG2 THR A 69 8.497 4.227 -3.355 1.00 0.00 C ATOM 0 H THR A 69 5.299 6.771 -3.796 1.00 0.00 H new ATOM 0 HA THR A 69 6.193 4.703 -1.900 1.00 0.00 H new ATOM 0 HB THR A 69 7.439 5.688 -4.498 1.00 0.00 H new ATOM 0 HG1 THR A 69 6.848 3.535 -5.215 1.00 0.00 H new ATOM 0 HG21 THR A 69 9.005 3.802 -4.221 1.00 0.00 H new ATOM 0 HG22 THR A 69 9.140 4.971 -2.886 1.00 0.00 H new ATOM 0 HG23 THR A 69 8.276 3.435 -2.639 1.00 0.00 H new ATOM 511 N LEU A 70 7.947 6.085 -0.780 1.00 0.00 N ATOM 512 CA LEU A 70 8.845 6.946 -0.020 1.00 0.00 C ATOM 513 C LEU A 70 10.219 6.300 0.133 1.00 0.00 C ATOM 514 O LEU A 70 10.328 5.129 0.490 1.00 0.00 O ATOM 515 CB LEU A 70 8.253 7.244 1.359 1.00 0.00 C ATOM 516 CG LEU A 70 6.778 7.645 1.383 1.00 0.00 C ATOM 517 CD1 LEU A 70 6.319 7.905 2.810 1.00 0.00 C ATOM 518 CD2 LEU A 70 6.545 8.872 0.514 1.00 0.00 C ATOM 0 H LEU A 70 7.808 5.159 -0.375 1.00 0.00 H new ATOM 0 HA LEU A 70 8.962 7.881 -0.568 1.00 0.00 H new ATOM 0 HB2 LEU A 70 8.379 6.361 1.985 1.00 0.00 H new ATOM 0 HB3 LEU A 70 8.834 8.045 1.817 1.00 0.00 H new ATOM 0 HG LEU A 70 6.190 6.821 0.978 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.267 8.189 2.808 1.00 0.00 H new ATOM 0 HD12 LEU A 70 6.449 7.001 3.405 1.00 0.00 H new ATOM 0 HD13 LEU A 70 6.912 8.712 3.242 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.490 9.143 0.543 1.00 0.00 H new ATOM 0 HD22 LEU A 70 7.143 9.702 0.889 1.00 0.00 H new ATOM 0 HD23 LEU A 70 6.835 8.651 -0.513 1.00 0.00 H new ATOM 530 N ASN A 71 11.265 7.074 -0.140 1.00 0.00 N ATOM 531 CA ASN A 71 12.632 6.578 -0.031 1.00 0.00 C ATOM 532 C ASN A 71 13.370 7.265 1.114 1.00 0.00 C ATOM 533 O ASN A 71 13.076 8.409 1.456 1.00 0.00 O ATOM 534 CB ASN A 71 13.383 6.802 -1.345 1.00 0.00 C ATOM 535 CG ASN A 71 13.163 5.675 -2.336 1.00 0.00 C ATOM 536 OD1 ASN A 71 12.794 5.910 -3.487 1.00 0.00 O ATOM 537 ND2 ASN A 71 13.388 4.444 -1.892 1.00 0.00 N ATOM 0 H ASN A 71 11.192 8.047 -0.438 1.00 0.00 H new ATOM 0 HA ASN A 71 12.590 5.509 0.178 1.00 0.00 H new ATOM 0 HB2 ASN A 71 13.058 7.742 -1.790 1.00 0.00 H new ATOM 0 HB3 ASN A 71 14.449 6.898 -1.139 1.00 0.00 H new ATOM 0 HD21 ASN A 71 13.256 3.646 -2.513 1.00 0.00 H new ATOM 0 HD22 ASN A 71 13.693 4.297 -0.930 1.00 0.00 H new ATOM 544 N GLN A 72 14.331 6.557 1.700 1.00 0.00 N ATOM 545 CA GLN A 72 15.111 7.099 2.806 1.00 0.00 C ATOM 546 C GLN A 72 16.499 6.469 2.852 1.00 0.00 C ATOM 547 O GLN A 72 16.653 5.304 3.221 1.00 0.00 O ATOM 548 CB GLN A 72 14.387 6.863 4.133 1.00 0.00 C ATOM 549 CG GLN A 72 14.729 7.887 5.203 1.00 0.00 C ATOM 550 CD GLN A 72 14.240 7.479 6.578 1.00 0.00 C ATOM 551 OE1 GLN A 72 13.208 7.957 7.050 1.00 0.00 O ATOM 552 NE2 GLN A 72 14.980 6.590 7.230 1.00 0.00 N ATOM 0 H GLN A 72 14.587 5.608 1.427 1.00 0.00 H new ATOM 0 HA GLN A 72 15.223 8.172 2.647 1.00 0.00 H new ATOM 0 HB2 GLN A 72 13.311 6.878 3.958 1.00 0.00 H new ATOM 0 HB3 GLN A 72 14.636 5.868 4.501 1.00 0.00 H new ATOM 0 HG2 GLN A 72 15.809 8.029 5.233 1.00 0.00 H new ATOM 0 HG3 GLN A 72 14.289 8.848 4.935 1.00 0.00 H new ATOM 0 HE21 GLN A 72 15.828 6.220 6.801 1.00 0.00 H new ATOM 0 HE22 GLN A 72 14.700 6.277 8.160 1.00 0.00 H new ATOM 561 N THR A 73 17.510 7.247 2.475 1.00 0.00 N ATOM 562 CA THR A 73 18.885 6.765 2.472 1.00 0.00 C ATOM 563 C THR A 73 19.747 7.557 3.448 1.00 0.00 C ATOM 564 O THR A 73 19.423 8.691 3.798 1.00 0.00 O ATOM 565 CB THR A 73 19.508 6.854 1.066 1.00 0.00 C ATOM 566 OG1 THR A 73 19.143 8.092 0.446 1.00 0.00 O ATOM 567 CG2 THR A 73 19.051 5.692 0.197 1.00 0.00 C ATOM 0 H THR A 73 17.401 8.214 2.168 1.00 0.00 H new ATOM 0 HA THR A 73 18.855 5.721 2.783 1.00 0.00 H new ATOM 0 HB THR A 73 20.592 6.805 1.169 1.00 0.00 H new ATOM 0 HG1 THR A 73 19.544 8.142 -0.447 1.00 0.00 H new ATOM 0 HG21 THR A 73 19.504 5.776 -0.791 1.00 0.00 H new ATOM 0 HG22 THR A 73 19.356 4.752 0.657 1.00 0.00 H new ATOM 0 HG23 THR A 73 17.965 5.714 0.102 1.00 0.00 H new ATOM 575 N ASN A 74 20.848 6.953 3.883 1.00 0.00 N ATOM 576 CA ASN A 74 21.757 7.603 4.820 1.00 0.00 C ATOM 577 C ASN A 74 23.210 7.289 4.474 1.00 0.00 C ATOM 578 O ASN A 74 23.497 6.306 3.791 1.00 0.00 O ATOM 579 CB ASN A 74 21.454 7.155 6.251 1.00 0.00 C ATOM 580 CG ASN A 74 20.245 7.861 6.834 1.00 0.00 C ATOM 581 OD1 ASN A 74 20.356 8.963 7.372 1.00 0.00 O ATOM 582 ND2 ASN A 74 19.083 7.228 6.728 1.00 0.00 N ATOM 0 H ASN A 74 21.132 6.015 3.602 1.00 0.00 H new ATOM 0 HA ASN A 74 21.608 8.680 4.744 1.00 0.00 H new ATOM 0 HB2 ASN A 74 21.284 6.078 6.263 1.00 0.00 H new ATOM 0 HB3 ASN A 74 22.323 7.348 6.881 1.00 0.00 H new ATOM 0 HD21 ASN A 74 18.234 7.654 7.101 1.00 0.00 H new ATOM 0 HD22 ASN A 74 19.039 6.316 6.274 1.00 0.00 H new ATOM 589 N ILE A 75 24.121 8.131 4.950 1.00 0.00 N ATOM 590 CA ILE A 75 25.543 7.943 4.693 1.00 0.00 C ATOM 591 C ILE A 75 26.157 6.963 5.687 1.00 0.00 C ATOM 592 O ILE A 75 27.149 7.272 6.346 1.00 0.00 O ATOM 593 CB ILE A 75 26.310 9.277 4.765 1.00 0.00 C ATOM 594 CG1 ILE A 75 27.720 9.111 4.194 1.00 0.00 C ATOM 595 CG2 ILE A 75 26.369 9.777 6.200 1.00 0.00 C ATOM 596 CD1 ILE A 75 28.385 10.422 3.838 1.00 0.00 C ATOM 0 H ILE A 75 23.899 8.950 5.516 1.00 0.00 H new ATOM 0 HA ILE A 75 25.630 7.537 3.685 1.00 0.00 H new ATOM 0 HB ILE A 75 25.780 10.017 4.165 1.00 0.00 H new ATOM 0 HG12 ILE A 75 28.338 8.585 4.921 1.00 0.00 H new ATOM 0 HG13 ILE A 75 27.671 8.484 3.304 1.00 0.00 H new ATOM 0 HG21 ILE A 75 26.914 10.720 6.235 1.00 0.00 H new ATOM 0 HG22 ILE A 75 25.357 9.929 6.574 1.00 0.00 H new ATOM 0 HG23 ILE A 75 26.879 9.041 6.821 1.00 0.00 H new ATOM 0 HD11 ILE A 75 29.381 10.228 3.439 1.00 0.00 H new ATOM 0 HD12 ILE A 75 27.788 10.941 3.088 1.00 0.00 H new ATOM 0 HD13 ILE A 75 28.466 11.043 4.730 1.00 0.00 H new ATOM 608 N GLU A 76 25.560 5.779 5.788 1.00 0.00 N ATOM 609 CA GLU A 76 26.049 4.753 6.701 1.00 0.00 C ATOM 610 C GLU A 76 25.973 3.371 6.058 1.00 0.00 C ATOM 611 O GLU A 76 24.888 2.840 5.830 1.00 0.00 O ATOM 612 CB GLU A 76 25.241 4.768 8.000 1.00 0.00 C ATOM 613 CG GLU A 76 23.832 5.314 7.835 1.00 0.00 C ATOM 614 CD GLU A 76 23.075 5.382 9.146 1.00 0.00 C ATOM 615 OE1 GLU A 76 22.770 4.311 9.711 1.00 0.00 O ATOM 616 OE2 GLU A 76 22.788 6.506 9.609 1.00 0.00 O ATOM 0 H GLU A 76 24.738 5.507 5.249 1.00 0.00 H new ATOM 0 HA GLU A 76 27.092 4.972 6.928 1.00 0.00 H new ATOM 0 HB2 GLU A 76 25.184 3.753 8.394 1.00 0.00 H new ATOM 0 HB3 GLU A 76 25.770 5.369 8.740 1.00 0.00 H new ATOM 0 HG2 GLU A 76 23.882 6.311 7.397 1.00 0.00 H new ATOM 0 HG3 GLU A 76 23.282 4.685 7.135 1.00 0.00 H new ATOM 623 N ASN A 77 27.136 2.796 5.767 1.00 0.00 N ATOM 624 CA ASN A 77 27.202 1.477 5.149 1.00 0.00 C ATOM 625 C ASN A 77 26.167 1.345 4.036 1.00 0.00 C ATOM 626 O ASN A 77 25.529 0.304 3.888 1.00 0.00 O ATOM 627 CB ASN A 77 26.979 0.387 6.199 1.00 0.00 C ATOM 628 CG ASN A 77 28.177 0.211 7.113 1.00 0.00 C ATOM 629 OD1 ASN A 77 28.291 0.880 8.140 1.00 0.00 O ATOM 630 ND2 ASN A 77 29.077 -0.692 6.741 1.00 0.00 N ATOM 0 H ASN A 77 28.044 3.223 5.949 1.00 0.00 H new ATOM 0 HA ASN A 77 28.194 1.356 4.715 1.00 0.00 H new ATOM 0 HB2 ASN A 77 26.103 0.636 6.797 1.00 0.00 H new ATOM 0 HB3 ASN A 77 26.765 -0.557 5.699 1.00 0.00 H new ATOM 0 HD21 ASN A 77 29.904 -0.854 7.315 1.00 0.00 H new ATOM 0 HD22 ASN A 77 28.941 -1.224 5.881 1.00 0.00 H new ATOM 637 N ASN A 78 26.007 2.409 3.255 1.00 0.00 N ATOM 638 CA ASN A 78 25.050 2.412 2.154 1.00 0.00 C ATOM 639 C ASN A 78 23.694 1.885 2.612 1.00 0.00 C ATOM 640 O ASN A 78 23.153 0.945 2.030 1.00 0.00 O ATOM 641 CB ASN A 78 25.574 1.565 0.993 1.00 0.00 C ATOM 642 CG ASN A 78 24.561 1.432 -0.128 1.00 0.00 C ATOM 643 OD1 ASN A 78 23.912 2.405 -0.512 1.00 0.00 O ATOM 644 ND2 ASN A 78 24.422 0.223 -0.659 1.00 0.00 N ATOM 0 H ASN A 78 26.527 3.280 3.364 1.00 0.00 H new ATOM 0 HA ASN A 78 24.925 3.441 1.816 1.00 0.00 H new ATOM 0 HB2 ASN A 78 26.487 2.014 0.603 1.00 0.00 H new ATOM 0 HB3 ASN A 78 25.838 0.573 1.360 1.00 0.00 H new ATOM 0 HD21 ASN A 78 23.756 0.072 -1.417 1.00 0.00 H new ATOM 0 HD22 ASN A 78 24.981 -0.555 -0.309 1.00 0.00 H new ATOM 651 N ASN A 79 23.149 2.497 3.658 1.00 0.00 N ATOM 652 CA ASN A 79 21.855 2.090 4.194 1.00 0.00 C ATOM 653 C ASN A 79 20.715 2.726 3.405 1.00 0.00 C ATOM 654 O ASN A 79 20.547 3.945 3.411 1.00 0.00 O ATOM 655 CB ASN A 79 21.747 2.476 5.670 1.00 0.00 C ATOM 656 CG ASN A 79 20.665 1.697 6.394 1.00 0.00 C ATOM 657 OD1 ASN A 79 19.424 1.857 5.950 1.00 0.00 O flip ATOM 658 ND2 ASN A 79 20.943 0.960 7.340 1.00 0.00 N flip ATOM 0 H ASN A 79 23.583 3.277 4.152 1.00 0.00 H new ATOM 0 HA ASN A 79 21.776 1.007 4.102 1.00 0.00 H new ATOM 0 HB2 ASN A 79 22.705 2.302 6.159 1.00 0.00 H new ATOM 0 HB3 ASN A 79 21.538 3.543 5.749 1.00 0.00 H new ATOM 0 HD21 ASN A 79 21.911 0.868 7.647 1.00 0.00 H new ATOM 0 HD22 ASN A 79 20.205 0.442 7.817 1.00 0.00 H new ATOM 665 N ASN A 80 19.933 1.892 2.728 1.00 0.00 N ATOM 666 CA ASN A 80 18.808 2.373 1.935 1.00 0.00 C ATOM 667 C ASN A 80 17.534 1.605 2.275 1.00 0.00 C ATOM 668 O ASN A 80 17.501 0.376 2.209 1.00 0.00 O ATOM 669 CB ASN A 80 19.115 2.238 0.442 1.00 0.00 C ATOM 670 CG ASN A 80 20.493 2.760 0.086 1.00 0.00 C ATOM 671 OD1 ASN A 80 21.178 3.354 0.918 1.00 0.00 O ATOM 672 ND2 ASN A 80 20.906 2.540 -1.157 1.00 0.00 N ATOM 0 H ASN A 80 20.058 0.880 2.713 1.00 0.00 H new ATOM 0 HA ASN A 80 18.651 3.425 2.174 1.00 0.00 H new ATOM 0 HB2 ASN A 80 19.040 1.190 0.152 1.00 0.00 H new ATOM 0 HB3 ASN A 80 18.364 2.782 -0.131 1.00 0.00 H new ATOM 0 HD21 ASN A 80 21.825 2.868 -1.455 1.00 0.00 H new ATOM 0 HD22 ASN A 80 20.304 2.043 -1.814 1.00 0.00 H new ATOM 679 N LYS A 81 16.487 2.337 2.638 1.00 0.00 N ATOM 680 CA LYS A 81 15.210 1.727 2.987 1.00 0.00 C ATOM 681 C LYS A 81 14.121 2.142 2.003 1.00 0.00 C ATOM 682 O LYS A 81 14.361 2.942 1.098 1.00 0.00 O ATOM 683 CB LYS A 81 14.804 2.122 4.409 1.00 0.00 C ATOM 684 CG LYS A 81 15.643 1.459 5.488 1.00 0.00 C ATOM 685 CD LYS A 81 15.015 1.623 6.862 1.00 0.00 C ATOM 686 CE LYS A 81 16.052 1.493 7.967 1.00 0.00 C ATOM 687 NZ LYS A 81 16.423 0.073 8.216 1.00 0.00 N ATOM 0 H LYS A 81 16.498 3.355 2.698 1.00 0.00 H new ATOM 0 HA LYS A 81 15.328 0.645 2.936 1.00 0.00 H new ATOM 0 HB2 LYS A 81 14.883 3.204 4.513 1.00 0.00 H new ATOM 0 HB3 LYS A 81 13.757 1.862 4.564 1.00 0.00 H new ATOM 0 HG2 LYS A 81 15.755 0.399 5.263 1.00 0.00 H new ATOM 0 HG3 LYS A 81 16.643 1.892 5.490 1.00 0.00 H new ATOM 0 HD2 LYS A 81 14.531 2.597 6.928 1.00 0.00 H new ATOM 0 HD3 LYS A 81 14.238 0.871 7.000 1.00 0.00 H new ATOM 0 HE2 LYS A 81 16.943 2.059 7.697 1.00 0.00 H new ATOM 0 HE3 LYS A 81 15.661 1.932 8.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 17.132 0.027 8.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 15.577 -0.462 8.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 16.820 -0.340 7.348 1.00 0.00 H new ATOM 701 N PHE A 82 12.924 1.594 2.185 1.00 0.00 N ATOM 702 CA PHE A 82 11.799 1.908 1.313 1.00 0.00 C ATOM 703 C PHE A 82 10.474 1.737 2.051 1.00 0.00 C ATOM 704 O PHE A 82 10.202 0.681 2.623 1.00 0.00 O ATOM 705 CB PHE A 82 11.823 1.014 0.071 1.00 0.00 C ATOM 706 CG PHE A 82 11.473 -0.418 0.357 1.00 0.00 C ATOM 707 CD1 PHE A 82 12.423 -1.289 0.867 1.00 0.00 C ATOM 708 CD2 PHE A 82 10.195 -0.894 0.116 1.00 0.00 C ATOM 709 CE1 PHE A 82 12.105 -2.607 1.132 1.00 0.00 C ATOM 710 CE2 PHE A 82 9.870 -2.212 0.379 1.00 0.00 C ATOM 711 CZ PHE A 82 10.827 -3.070 0.886 1.00 0.00 C ATOM 0 H PHE A 82 12.708 0.930 2.929 1.00 0.00 H new ATOM 0 HA PHE A 82 11.891 2.949 1.004 1.00 0.00 H new ATOM 0 HB2 PHE A 82 11.124 1.410 -0.666 1.00 0.00 H new ATOM 0 HB3 PHE A 82 12.816 1.055 -0.377 1.00 0.00 H new ATOM 0 HD1 PHE A 82 13.424 -0.933 1.060 1.00 0.00 H new ATOM 0 HD2 PHE A 82 9.444 -0.228 -0.282 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.855 -3.274 1.531 1.00 0.00 H new ATOM 0 HE2 PHE A 82 8.869 -2.570 0.188 1.00 0.00 H new ATOM 0 HZ PHE A 82 10.576 -4.101 1.090 1.00 0.00 H new ATOM 721 N TYR A 83 9.655 2.782 2.034 1.00 0.00 N ATOM 722 CA TYR A 83 8.360 2.750 2.703 1.00 0.00 C ATOM 723 C TYR A 83 7.221 2.797 1.690 1.00 0.00 C ATOM 724 O TYR A 83 7.259 3.571 0.733 1.00 0.00 O ATOM 725 CB TYR A 83 8.238 3.921 3.680 1.00 0.00 C ATOM 726 CG TYR A 83 7.345 3.630 4.865 1.00 0.00 C ATOM 727 CD1 TYR A 83 5.964 3.747 4.764 1.00 0.00 C ATOM 728 CD2 TYR A 83 7.882 3.238 6.085 1.00 0.00 C ATOM 729 CE1 TYR A 83 5.144 3.483 5.844 1.00 0.00 C ATOM 730 CE2 TYR A 83 7.070 2.970 7.170 1.00 0.00 C ATOM 731 CZ TYR A 83 5.702 3.095 7.045 1.00 0.00 C ATOM 732 OH TYR A 83 4.888 2.830 8.123 1.00 0.00 O ATOM 0 H TYR A 83 9.865 3.663 1.564 1.00 0.00 H new ATOM 0 HA TYR A 83 8.290 1.814 3.257 1.00 0.00 H new ATOM 0 HB2 TYR A 83 9.231 4.187 4.041 1.00 0.00 H new ATOM 0 HB3 TYR A 83 7.849 4.789 3.147 1.00 0.00 H new ATOM 0 HD1 TYR A 83 5.524 4.049 3.825 1.00 0.00 H new ATOM 0 HD2 TYR A 83 8.953 3.141 6.187 1.00 0.00 H new ATOM 0 HE1 TYR A 83 4.073 3.580 5.749 1.00 0.00 H new ATOM 0 HE2 TYR A 83 7.504 2.664 8.111 1.00 0.00 H new ATOM 0 HH TYR A 83 5.437 2.568 8.891 1.00 0.00 H new ATOM 742 N ILE A 84 6.209 1.965 1.907 1.00 0.00 N ATOM 743 CA ILE A 84 5.058 1.913 1.015 1.00 0.00 C ATOM 744 C ILE A 84 3.752 2.019 1.795 1.00 0.00 C ATOM 745 O ILE A 84 3.567 1.346 2.810 1.00 0.00 O ATOM 746 CB ILE A 84 5.045 0.614 0.188 1.00 0.00 C ATOM 747 CG1 ILE A 84 6.281 0.543 -0.711 1.00 0.00 C ATOM 748 CG2 ILE A 84 3.773 0.527 -0.643 1.00 0.00 C ATOM 749 CD1 ILE A 84 6.552 -0.841 -1.258 1.00 0.00 C ATOM 0 H ILE A 84 6.163 1.317 2.693 1.00 0.00 H new ATOM 0 HA ILE A 84 5.144 2.764 0.339 1.00 0.00 H new ATOM 0 HB ILE A 84 5.067 -0.234 0.872 1.00 0.00 H new ATOM 0 HG12 ILE A 84 6.155 1.235 -1.543 1.00 0.00 H new ATOM 0 HG13 ILE A 84 7.151 0.878 -0.146 1.00 0.00 H new ATOM 0 HG21 ILE A 84 3.779 -0.397 -1.222 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.906 0.536 0.017 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.722 1.379 -1.320 1.00 0.00 H new ATOM 0 HD11 ILE A 84 7.442 -0.816 -1.886 1.00 0.00 H new ATOM 0 HD12 ILE A 84 6.710 -1.534 -0.432 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.699 -1.171 -1.851 1.00 0.00 H new ATOM 761 N ILE A 85 2.848 2.866 1.314 1.00 0.00 N ATOM 762 CA ILE A 85 1.558 3.057 1.965 1.00 0.00 C ATOM 763 C ILE A 85 0.427 3.097 0.942 1.00 0.00 C ATOM 764 O ILE A 85 0.293 4.061 0.189 1.00 0.00 O ATOM 765 CB ILE A 85 1.532 4.356 2.792 1.00 0.00 C ATOM 766 CG1 ILE A 85 2.647 4.340 3.840 1.00 0.00 C ATOM 767 CG2 ILE A 85 0.175 4.533 3.458 1.00 0.00 C ATOM 768 CD1 ILE A 85 2.883 5.685 4.491 1.00 0.00 C ATOM 0 H ILE A 85 2.985 3.431 0.476 1.00 0.00 H new ATOM 0 HA ILE A 85 1.412 2.208 2.632 1.00 0.00 H new ATOM 0 HB ILE A 85 1.699 5.200 2.122 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.399 3.611 4.611 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.572 4.006 3.370 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.172 5.455 4.039 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -0.601 4.583 2.694 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -0.019 3.688 4.118 1.00 0.00 H new ATOM 0 HD11 ILE A 85 3.686 5.599 5.223 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.162 6.414 3.730 1.00 0.00 H new ATOM 0 HD13 ILE A 85 1.971 6.013 4.990 1.00 0.00 H new ATOM 780 N GLN A 86 -0.383 2.044 0.924 1.00 0.00 N ATOM 781 CA GLN A 86 -1.504 1.959 -0.005 1.00 0.00 C ATOM 782 C GLN A 86 -2.810 1.701 0.739 1.00 0.00 C ATOM 783 O GLN A 86 -2.811 1.141 1.836 1.00 0.00 O ATOM 784 CB GLN A 86 -1.260 0.852 -1.032 1.00 0.00 C ATOM 785 CG GLN A 86 0.014 1.040 -1.840 1.00 0.00 C ATOM 786 CD GLN A 86 0.458 -0.232 -2.534 1.00 0.00 C ATOM 787 OE1 GLN A 86 1.500 -0.800 -2.208 1.00 0.00 O ATOM 788 NE2 GLN A 86 -0.333 -0.687 -3.499 1.00 0.00 N ATOM 0 H GLN A 86 -0.284 1.238 1.542 1.00 0.00 H new ATOM 0 HA GLN A 86 -1.586 2.914 -0.524 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -1.215 -0.107 -0.516 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -2.109 0.807 -1.714 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -0.145 1.819 -2.585 1.00 0.00 H new ATOM 0 HG3 GLN A 86 0.810 1.386 -1.181 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -1.188 -0.184 -3.737 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -0.085 -1.539 -4.002 1.00 0.00 H new ATOM 797 N LEU A 87 -3.920 2.112 0.135 1.00 0.00 N ATOM 798 CA LEU A 87 -5.234 1.926 0.741 1.00 0.00 C ATOM 799 C LEU A 87 -6.072 0.942 -0.069 1.00 0.00 C ATOM 800 O LEU A 87 -6.514 1.251 -1.177 1.00 0.00 O ATOM 801 CB LEU A 87 -5.962 3.266 0.849 1.00 0.00 C ATOM 802 CG LEU A 87 -6.934 3.410 2.021 1.00 0.00 C ATOM 803 CD1 LEU A 87 -7.007 4.858 2.480 1.00 0.00 C ATOM 804 CD2 LEU A 87 -8.315 2.901 1.633 1.00 0.00 C ATOM 0 H LEU A 87 -3.936 2.576 -0.773 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.091 1.516 1.741 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.216 4.057 0.923 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.513 3.433 -0.077 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.565 2.806 2.850 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -7.703 4.941 3.314 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.018 5.189 2.798 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -7.351 5.484 1.657 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.994 3.011 2.479 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.691 3.478 0.788 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.250 1.849 1.354 1.00 0.00 H new ATOM 816 N LEU A 88 -6.289 -0.243 0.491 1.00 0.00 N ATOM 817 CA LEU A 88 -7.077 -1.272 -0.179 1.00 0.00 C ATOM 818 C LEU A 88 -8.533 -1.225 0.276 1.00 0.00 C ATOM 819 O LEU A 88 -8.853 -0.626 1.302 1.00 0.00 O ATOM 820 CB LEU A 88 -6.488 -2.656 0.101 1.00 0.00 C ATOM 821 CG LEU A 88 -4.975 -2.788 -0.072 1.00 0.00 C ATOM 822 CD1 LEU A 88 -4.485 -4.107 0.505 1.00 0.00 C ATOM 823 CD2 LEU A 88 -4.594 -2.672 -1.541 1.00 0.00 C ATOM 0 H LEU A 88 -5.931 -0.515 1.406 1.00 0.00 H new ATOM 0 HA LEU A 88 -7.044 -1.080 -1.251 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -6.743 -2.937 1.123 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -6.973 -3.376 -0.558 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.494 -1.976 0.473 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.406 -4.183 0.373 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.724 -4.151 1.567 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.973 -4.934 -0.011 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.513 -2.768 -1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.085 -3.463 -2.108 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -4.910 -1.702 -1.923 1.00 0.00 H new ATOM 835 N GLN A 89 -9.409 -1.863 -0.494 1.00 0.00 N ATOM 836 CA GLN A 89 -10.830 -1.894 -0.169 1.00 0.00 C ATOM 837 C GLN A 89 -11.414 -3.282 -0.417 1.00 0.00 C ATOM 838 O GLN A 89 -11.401 -3.779 -1.542 1.00 0.00 O ATOM 839 CB GLN A 89 -11.587 -0.854 -0.997 1.00 0.00 C ATOM 840 CG GLN A 89 -13.098 -0.996 -0.916 1.00 0.00 C ATOM 841 CD GLN A 89 -13.689 -0.274 0.279 1.00 0.00 C ATOM 842 OE1 GLN A 89 -14.177 0.850 0.161 1.00 0.00 O ATOM 843 NE2 GLN A 89 -13.649 -0.918 1.440 1.00 0.00 N ATOM 0 H GLN A 89 -9.160 -2.365 -1.346 1.00 0.00 H new ATOM 0 HA GLN A 89 -10.941 -1.656 0.889 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -11.305 0.143 -0.658 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -11.278 -0.936 -2.039 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -13.545 -0.605 -1.830 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -13.357 -2.053 -0.862 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -13.235 -1.849 1.493 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -14.032 -0.482 2.279 1.00 0.00 H new ATOM 852 N ASP A 90 -11.925 -3.900 0.642 1.00 0.00 N ATOM 853 CA ASP A 90 -12.514 -5.230 0.540 1.00 0.00 C ATOM 854 C ASP A 90 -14.000 -5.141 0.207 1.00 0.00 C ATOM 855 O ASP A 90 -14.602 -4.070 0.287 1.00 0.00 O ATOM 856 CB ASP A 90 -12.317 -6.000 1.847 1.00 0.00 C ATOM 857 CG ASP A 90 -13.048 -7.328 1.852 1.00 0.00 C ATOM 858 OD1 ASP A 90 -12.808 -8.142 0.935 1.00 0.00 O ATOM 859 OD2 ASP A 90 -13.860 -7.555 2.773 1.00 0.00 O ATOM 0 H ASP A 90 -11.943 -3.501 1.581 1.00 0.00 H new ATOM 0 HA ASP A 90 -12.010 -5.763 -0.266 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -11.253 -6.174 2.006 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -12.669 -5.392 2.680 1.00 0.00 H new ATOM 864 N SER A 91 -14.586 -6.274 -0.169 1.00 0.00 N ATOM 865 CA SER A 91 -16.000 -6.323 -0.520 1.00 0.00 C ATOM 866 C SER A 91 -16.871 -5.984 0.685 1.00 0.00 C ATOM 867 O SER A 91 -17.973 -5.457 0.540 1.00 0.00 O ATOM 868 CB SER A 91 -16.367 -7.709 -1.054 1.00 0.00 C ATOM 869 OG SER A 91 -17.543 -7.657 -1.843 1.00 0.00 O ATOM 0 H SER A 91 -14.103 -7.170 -0.238 1.00 0.00 H new ATOM 0 HA SER A 91 -16.181 -5.581 -1.298 1.00 0.00 H new ATOM 0 HB2 SER A 91 -15.543 -8.103 -1.649 1.00 0.00 H new ATOM 0 HB3 SER A 91 -16.515 -8.396 -0.221 1.00 0.00 H new ATOM 0 HG SER A 91 -17.755 -8.555 -2.173 1.00 0.00 H new ATOM 875 N ASN A 92 -16.367 -6.290 1.877 1.00 0.00 N ATOM 876 CA ASN A 92 -17.098 -6.018 3.109 1.00 0.00 C ATOM 877 C ASN A 92 -16.849 -4.590 3.586 1.00 0.00 C ATOM 878 O ASN A 92 -16.531 -4.361 4.753 1.00 0.00 O ATOM 879 CB ASN A 92 -16.689 -7.010 4.199 1.00 0.00 C ATOM 880 CG ASN A 92 -17.442 -8.323 4.099 1.00 0.00 C ATOM 881 OD1 ASN A 92 -18.670 -8.341 4.007 1.00 0.00 O ATOM 882 ND2 ASN A 92 -16.708 -9.429 4.115 1.00 0.00 N ATOM 0 H ASN A 92 -15.455 -6.726 2.015 1.00 0.00 H new ATOM 0 HA ASN A 92 -18.162 -6.133 2.903 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -15.618 -7.202 4.128 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -16.869 -6.565 5.178 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -17.159 -10.341 4.050 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -15.693 -9.366 4.193 1.00 0.00 H new ATOM 889 N ARG A 93 -16.996 -3.634 2.675 1.00 0.00 N ATOM 890 CA ARG A 93 -16.786 -2.229 3.002 1.00 0.00 C ATOM 891 C ARG A 93 -15.722 -2.075 4.084 1.00 0.00 C ATOM 892 O ARG A 93 -15.828 -1.212 4.956 1.00 0.00 O ATOM 893 CB ARG A 93 -18.097 -1.590 3.466 1.00 0.00 C ATOM 894 CG ARG A 93 -18.827 -2.399 4.525 1.00 0.00 C ATOM 895 CD ARG A 93 -19.739 -3.443 3.899 1.00 0.00 C ATOM 896 NE ARG A 93 -20.895 -3.736 4.741 1.00 0.00 N ATOM 897 CZ ARG A 93 -22.025 -4.261 4.281 1.00 0.00 C ATOM 898 NH1 ARG A 93 -22.149 -4.551 2.993 1.00 0.00 N ATOM 899 NH2 ARG A 93 -23.033 -4.499 5.111 1.00 0.00 N ATOM 0 H ARG A 93 -17.260 -3.807 1.705 1.00 0.00 H new ATOM 0 HA ARG A 93 -16.440 -1.721 2.102 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -17.887 -0.596 3.861 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -18.752 -1.459 2.605 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -18.101 -2.890 5.173 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -19.415 -1.731 5.154 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -20.080 -3.090 2.926 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -19.175 -4.360 3.726 1.00 0.00 H new ATOM 0 HE ARG A 93 -20.831 -3.526 5.737 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -21.375 -4.371 2.353 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -23.018 -4.954 2.642 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -22.940 -4.279 6.103 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -23.901 -4.902 4.757 1.00 0.00 H new ATOM 913 N PHE A 94 -14.697 -2.919 4.023 1.00 0.00 N ATOM 914 CA PHE A 94 -13.614 -2.878 4.999 1.00 0.00 C ATOM 915 C PHE A 94 -12.281 -2.579 4.320 1.00 0.00 C ATOM 916 O PHE A 94 -11.829 -3.330 3.455 1.00 0.00 O ATOM 917 CB PHE A 94 -13.528 -4.207 5.752 1.00 0.00 C ATOM 918 CG PHE A 94 -14.712 -4.473 6.638 1.00 0.00 C ATOM 919 CD1 PHE A 94 -15.240 -3.467 7.431 1.00 0.00 C ATOM 920 CD2 PHE A 94 -15.297 -5.728 6.677 1.00 0.00 C ATOM 921 CE1 PHE A 94 -16.329 -3.707 8.247 1.00 0.00 C ATOM 922 CE2 PHE A 94 -16.387 -5.974 7.490 1.00 0.00 C ATOM 923 CZ PHE A 94 -16.903 -4.963 8.277 1.00 0.00 C ATOM 0 H PHE A 94 -14.594 -3.639 3.308 1.00 0.00 H new ATOM 0 HA PHE A 94 -13.828 -2.079 5.709 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -13.435 -5.019 5.030 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -12.622 -4.214 6.358 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -14.795 -2.483 7.411 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -14.897 -6.523 6.065 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -16.731 -2.914 8.860 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -16.835 -6.956 7.510 1.00 0.00 H new ATOM 0 HZ PHE A 94 -17.754 -5.154 8.915 1.00 0.00 H new ATOM 933 N PHE A 95 -11.657 -1.475 4.717 1.00 0.00 N ATOM 934 CA PHE A 95 -10.376 -1.074 4.147 1.00 0.00 C ATOM 935 C PHE A 95 -9.217 -1.634 4.965 1.00 0.00 C ATOM 936 O PHE A 95 -9.387 -2.020 6.122 1.00 0.00 O ATOM 937 CB PHE A 95 -10.278 0.452 4.082 1.00 0.00 C ATOM 938 CG PHE A 95 -11.462 1.101 3.422 1.00 0.00 C ATOM 939 CD1 PHE A 95 -12.658 1.248 4.106 1.00 0.00 C ATOM 940 CD2 PHE A 95 -11.378 1.563 2.119 1.00 0.00 C ATOM 941 CE1 PHE A 95 -13.749 1.845 3.502 1.00 0.00 C ATOM 942 CE2 PHE A 95 -12.465 2.162 1.510 1.00 0.00 C ATOM 943 CZ PHE A 95 -13.652 2.301 2.202 1.00 0.00 C ATOM 0 H PHE A 95 -12.018 -0.842 5.431 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.314 -1.479 3.137 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.175 0.845 5.093 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.374 0.727 3.540 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -12.739 0.892 5.122 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.453 1.454 1.573 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -14.676 1.955 4.046 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -12.386 2.521 0.494 1.00 0.00 H new ATOM 0 HZ PHE A 95 -14.503 2.766 1.727 1.00 0.00 H new ATOM 953 N THR A 96 -8.036 -1.677 4.355 1.00 0.00 N ATOM 954 CA THR A 96 -6.848 -2.192 5.024 1.00 0.00 C ATOM 955 C THR A 96 -5.607 -1.400 4.629 1.00 0.00 C ATOM 956 O THR A 96 -5.296 -1.266 3.445 1.00 0.00 O ATOM 957 CB THR A 96 -6.619 -3.680 4.697 1.00 0.00 C ATOM 958 OG1 THR A 96 -7.727 -4.460 5.160 1.00 0.00 O ATOM 959 CG2 THR A 96 -5.335 -4.183 5.337 1.00 0.00 C ATOM 0 H THR A 96 -7.877 -1.361 3.398 1.00 0.00 H new ATOM 0 HA THR A 96 -7.018 -2.085 6.095 1.00 0.00 H new ATOM 0 HB THR A 96 -6.531 -3.782 3.615 1.00 0.00 H new ATOM 0 HG1 THR A 96 -7.398 -5.199 5.713 1.00 0.00 H new ATOM 0 HG21 THR A 96 -5.195 -5.236 5.092 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.490 -3.607 4.959 1.00 0.00 H new ATOM 0 HG23 THR A 96 -5.398 -4.067 6.419 1.00 0.00 H new ATOM 967 N CYS A 97 -4.903 -0.877 5.626 1.00 0.00 N ATOM 968 CA CYS A 97 -3.695 -0.097 5.382 1.00 0.00 C ATOM 969 C CYS A 97 -2.471 -1.003 5.292 1.00 0.00 C ATOM 970 O CYS A 97 -1.944 -1.452 6.309 1.00 0.00 O ATOM 971 CB CYS A 97 -3.498 0.938 6.490 1.00 0.00 C ATOM 972 SG CYS A 97 -4.489 2.436 6.287 1.00 0.00 S ATOM 0 H CYS A 97 -5.148 -0.979 6.611 1.00 0.00 H new ATOM 0 HA CYS A 97 -3.813 0.420 4.429 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -3.744 0.480 7.448 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.445 1.215 6.530 1.00 0.00 H new ATOM 0 HG CYS A 97 -5.317 2.547 7.283 1.00 0.00 H new ATOM 978 N TRP A 98 -2.027 -1.268 4.069 1.00 0.00 N ATOM 979 CA TRP A 98 -0.866 -2.123 3.846 1.00 0.00 C ATOM 980 C TRP A 98 0.424 -1.311 3.887 1.00 0.00 C ATOM 981 O TRP A 98 0.647 -0.441 3.047 1.00 0.00 O ATOM 982 CB TRP A 98 -0.988 -2.843 2.502 1.00 0.00 C ATOM 983 CG TRP A 98 0.287 -3.498 2.062 1.00 0.00 C ATOM 984 CD1 TRP A 98 1.156 -3.045 1.112 1.00 0.00 C ATOM 985 CD2 TRP A 98 0.833 -4.727 2.555 1.00 0.00 C ATOM 986 NE1 TRP A 98 2.210 -3.917 0.984 1.00 0.00 N ATOM 987 CE2 TRP A 98 2.035 -4.957 1.858 1.00 0.00 C ATOM 988 CE3 TRP A 98 0.424 -5.654 3.517 1.00 0.00 C ATOM 989 CZ2 TRP A 98 2.830 -6.075 2.095 1.00 0.00 C ATOM 990 CZ3 TRP A 98 1.214 -6.764 3.750 1.00 0.00 C ATOM 991 CH2 TRP A 98 2.406 -6.967 3.042 1.00 0.00 C ATOM 0 H TRP A 98 -2.453 -0.904 3.217 1.00 0.00 H new ATOM 0 HA TRP A 98 -0.832 -2.864 4.645 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -1.771 -3.598 2.572 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -1.302 -2.128 1.742 1.00 0.00 H new ATOM 0 HD1 TRP A 98 1.033 -2.135 0.544 1.00 0.00 H new ATOM 0 HE1 TRP A 98 2.995 -3.808 0.342 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -0.493 -5.506 4.068 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 3.749 -6.233 1.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 0.907 -7.488 4.491 1.00 0.00 H new ATOM 0 HH2 TRP A 98 3.001 -7.844 3.248 1.00 0.00 H new ATOM 1002 N ASN A 99 1.270 -1.602 4.870 1.00 0.00 N ATOM 1003 CA ASN A 99 2.538 -0.897 5.020 1.00 0.00 C ATOM 1004 C ASN A 99 3.712 -1.868 4.942 1.00 0.00 C ATOM 1005 O ASN A 99 3.836 -2.776 5.765 1.00 0.00 O ATOM 1006 CB ASN A 99 2.572 -0.143 6.351 1.00 0.00 C ATOM 1007 CG ASN A 99 1.234 0.482 6.696 1.00 0.00 C ATOM 1008 OD1 ASN A 99 0.700 0.271 7.785 1.00 0.00 O ATOM 1009 ND2 ASN A 99 0.686 1.256 5.767 1.00 0.00 N ATOM 0 H ASN A 99 1.101 -2.320 5.574 1.00 0.00 H new ATOM 0 HA ASN A 99 2.627 -0.181 4.203 1.00 0.00 H new ATOM 0 HB2 ASN A 99 2.866 -0.828 7.146 1.00 0.00 H new ATOM 0 HB3 ASN A 99 3.333 0.636 6.305 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -0.214 1.704 5.942 1.00 0.00 H new ATOM 0 HD22 ASN A 99 1.165 1.403 4.878 1.00 0.00 H new ATOM 1016 N ARG A 100 4.572 -1.670 3.949 1.00 0.00 N ATOM 1017 CA ARG A 100 5.736 -2.528 3.763 1.00 0.00 C ATOM 1018 C ARG A 100 7.026 -1.714 3.820 1.00 0.00 C ATOM 1019 O ARG A 100 7.192 -0.744 3.081 1.00 0.00 O ATOM 1020 CB ARG A 100 5.644 -3.265 2.426 1.00 0.00 C ATOM 1021 CG ARG A 100 6.865 -4.115 2.114 1.00 0.00 C ATOM 1022 CD ARG A 100 6.570 -5.136 1.027 1.00 0.00 C ATOM 1023 NE ARG A 100 6.690 -4.562 -0.311 1.00 0.00 N ATOM 1024 CZ ARG A 100 7.840 -4.465 -0.968 1.00 0.00 C ATOM 1025 NH1 ARG A 100 8.963 -4.904 -0.415 1.00 0.00 N ATOM 1026 NH2 ARG A 100 7.869 -3.930 -2.182 1.00 0.00 N ATOM 0 H ARG A 100 4.485 -0.923 3.260 1.00 0.00 H new ATOM 0 HA ARG A 100 5.751 -3.258 4.572 1.00 0.00 H new ATOM 0 HB2 ARG A 100 4.760 -3.903 2.432 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.506 -2.536 1.628 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.686 -3.472 1.797 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.193 -4.629 3.018 1.00 0.00 H new ATOM 0 HD2 ARG A 100 7.257 -5.977 1.124 1.00 0.00 H new ATOM 0 HD3 ARG A 100 5.563 -5.530 1.163 1.00 0.00 H new ATOM 0 HE ARG A 100 5.844 -4.217 -0.765 1.00 0.00 H new ATOM 0 HH11 ARG A 100 8.945 -5.317 0.517 1.00 0.00 H new ATOM 0 HH12 ARG A 100 9.845 -4.828 -0.922 1.00 0.00 H new ATOM 0 HH21 ARG A 100 7.007 -3.593 -2.611 1.00 0.00 H new ATOM 0 HH22 ARG A 100 8.753 -3.856 -2.686 1.00 0.00 H new ATOM 1040 N TRP A 101 7.933 -2.116 4.703 1.00 0.00 N ATOM 1041 CA TRP A 101 9.208 -1.424 4.857 1.00 0.00 C ATOM 1042 C TRP A 101 10.338 -2.415 5.115 1.00 0.00 C ATOM 1043 O TRP A 101 10.098 -3.603 5.328 1.00 0.00 O ATOM 1044 CB TRP A 101 9.128 -0.414 6.002 1.00 0.00 C ATOM 1045 CG TRP A 101 9.053 -1.054 7.355 1.00 0.00 C ATOM 1046 CD1 TRP A 101 10.092 -1.570 8.076 1.00 0.00 C ATOM 1047 CD2 TRP A 101 7.876 -1.248 8.148 1.00 0.00 C ATOM 1048 NE1 TRP A 101 9.632 -2.073 9.269 1.00 0.00 N ATOM 1049 CE2 TRP A 101 8.276 -1.887 9.338 1.00 0.00 C ATOM 1050 CE3 TRP A 101 6.524 -0.943 7.969 1.00 0.00 C ATOM 1051 CZ2 TRP A 101 7.372 -2.226 10.341 1.00 0.00 C ATOM 1052 CZ3 TRP A 101 5.628 -1.280 8.965 1.00 0.00 C ATOM 1053 CH2 TRP A 101 6.054 -1.915 10.139 1.00 0.00 C ATOM 0 H TRP A 101 7.810 -2.917 5.323 1.00 0.00 H new ATOM 0 HA TRP A 101 9.420 -0.894 3.928 1.00 0.00 H new ATOM 0 HB2 TRP A 101 10.001 0.237 5.964 1.00 0.00 H new ATOM 0 HB3 TRP A 101 8.252 0.219 5.858 1.00 0.00 H new ATOM 0 HD1 TRP A 101 11.123 -1.581 7.756 1.00 0.00 H new ATOM 0 HE1 TRP A 101 10.207 -2.514 9.987 1.00 0.00 H new ATOM 0 HE3 TRP A 101 6.186 -0.453 7.068 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 7.699 -2.717 11.246 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 4.581 -1.050 8.836 1.00 0.00 H new ATOM 0 HH2 TRP A 101 5.329 -2.164 10.899 1.00 0.00 H new ATOM 1064 N GLY A 102 11.571 -1.919 5.094 1.00 0.00 N ATOM 1065 CA GLY A 102 12.719 -2.775 5.328 1.00 0.00 C ATOM 1066 C GLY A 102 13.944 -2.325 4.556 1.00 0.00 C ATOM 1067 O GLY A 102 14.259 -1.136 4.517 1.00 0.00 O ATOM 0 H GLY A 102 11.795 -0.939 4.919 1.00 0.00 H new ATOM 0 HA2 GLY A 102 12.949 -2.787 6.393 1.00 0.00 H new ATOM 0 HA3 GLY A 102 12.470 -3.798 5.044 1.00 0.00 H new ATOM 1071 N ARG A 103 14.637 -3.278 3.942 1.00 0.00 N ATOM 1072 CA ARG A 103 15.837 -2.974 3.171 1.00 0.00 C ATOM 1073 C ARG A 103 15.543 -3.008 1.674 1.00 0.00 C ATOM 1074 O ARG A 103 14.977 -3.975 1.163 1.00 0.00 O ATOM 1075 CB ARG A 103 16.950 -3.968 3.506 1.00 0.00 C ATOM 1076 CG ARG A 103 17.836 -3.524 4.658 1.00 0.00 C ATOM 1077 CD ARG A 103 19.138 -4.309 4.695 1.00 0.00 C ATOM 1078 NE ARG A 103 19.879 -4.083 5.933 1.00 0.00 N ATOM 1079 CZ ARG A 103 21.192 -4.249 6.044 1.00 0.00 C ATOM 1080 NH1 ARG A 103 21.906 -4.639 4.996 1.00 0.00 N ATOM 1081 NH2 ARG A 103 21.795 -4.024 7.204 1.00 0.00 N ATOM 0 H ARG A 103 14.388 -4.267 3.963 1.00 0.00 H new ATOM 0 HA ARG A 103 16.165 -1.969 3.437 1.00 0.00 H new ATOM 0 HB2 ARG A 103 16.503 -4.931 3.753 1.00 0.00 H new ATOM 0 HB3 ARG A 103 17.568 -4.120 2.621 1.00 0.00 H new ATOM 0 HG2 ARG A 103 18.054 -2.460 4.562 1.00 0.00 H new ATOM 0 HG3 ARG A 103 17.303 -3.656 5.600 1.00 0.00 H new ATOM 0 HD2 ARG A 103 18.923 -5.372 4.590 1.00 0.00 H new ATOM 0 HD3 ARG A 103 19.757 -4.024 3.845 1.00 0.00 H new ATOM 0 HE ARG A 103 19.360 -3.781 6.757 1.00 0.00 H new ATOM 0 HH11 ARG A 103 21.447 -4.812 4.102 1.00 0.00 H new ATOM 0 HH12 ARG A 103 22.914 -4.766 5.084 1.00 0.00 H new ATOM 0 HH21 ARG A 103 21.250 -3.723 8.012 1.00 0.00 H new ATOM 0 HH22 ARG A 103 22.803 -4.152 7.288 1.00 0.00 H new ATOM 1095 N VAL A 104 15.931 -1.946 0.975 1.00 0.00 N ATOM 1096 CA VAL A 104 15.710 -1.854 -0.463 1.00 0.00 C ATOM 1097 C VAL A 104 16.128 -3.141 -1.166 1.00 0.00 C ATOM 1098 O VAL A 104 17.173 -3.715 -0.864 1.00 0.00 O ATOM 1099 CB VAL A 104 16.486 -0.673 -1.076 1.00 0.00 C ATOM 1100 CG1 VAL A 104 16.292 -0.631 -2.584 1.00 0.00 C ATOM 1101 CG2 VAL A 104 16.050 0.638 -0.438 1.00 0.00 C ATOM 0 H VAL A 104 16.400 -1.137 1.382 1.00 0.00 H new ATOM 0 HA VAL A 104 14.642 -1.693 -0.609 1.00 0.00 H new ATOM 0 HB VAL A 104 17.548 -0.815 -0.874 1.00 0.00 H new ATOM 0 HG11 VAL A 104 16.848 0.210 -2.999 1.00 0.00 H new ATOM 0 HG12 VAL A 104 16.657 -1.559 -3.024 1.00 0.00 H new ATOM 0 HG13 VAL A 104 15.232 -0.513 -2.811 1.00 0.00 H new ATOM 0 HG21 VAL A 104 16.608 1.462 -0.882 1.00 0.00 H new ATOM 0 HG22 VAL A 104 14.984 0.788 -0.608 1.00 0.00 H new ATOM 0 HG23 VAL A 104 16.246 0.604 0.634 1.00 0.00 H new ATOM 1111 N GLY A 105 15.302 -3.590 -2.107 1.00 0.00 N ATOM 1112 CA GLY A 105 15.603 -4.806 -2.839 1.00 0.00 C ATOM 1113 C GLY A 105 14.910 -6.021 -2.256 1.00 0.00 C ATOM 1114 O GLY A 105 14.365 -6.844 -2.990 1.00 0.00 O ATOM 0 H GLY A 105 14.430 -3.133 -2.375 1.00 0.00 H new ATOM 0 HA2 GLY A 105 15.301 -4.684 -3.879 1.00 0.00 H new ATOM 0 HA3 GLY A 105 16.681 -4.970 -2.837 1.00 0.00 H new ATOM 1118 N GLU A 106 14.931 -6.133 -0.931 1.00 0.00 N ATOM 1119 CA GLU A 106 14.302 -7.259 -0.250 1.00 0.00 C ATOM 1120 C GLU A 106 12.888 -6.900 0.200 1.00 0.00 C ATOM 1121 O GLU A 106 12.492 -5.735 0.170 1.00 0.00 O ATOM 1122 CB GLU A 106 15.140 -7.688 0.956 1.00 0.00 C ATOM 1123 CG GLU A 106 15.055 -6.726 2.129 1.00 0.00 C ATOM 1124 CD GLU A 106 15.446 -7.373 3.443 1.00 0.00 C ATOM 1125 OE1 GLU A 106 16.631 -7.739 3.594 1.00 0.00 O ATOM 1126 OE2 GLU A 106 14.568 -7.514 4.320 1.00 0.00 O ATOM 0 H GLU A 106 15.376 -5.459 -0.309 1.00 0.00 H new ATOM 0 HA GLU A 106 14.242 -8.089 -0.954 1.00 0.00 H new ATOM 0 HB2 GLU A 106 14.813 -8.675 1.282 1.00 0.00 H new ATOM 0 HB3 GLU A 106 16.182 -7.782 0.649 1.00 0.00 H new ATOM 0 HG2 GLU A 106 15.705 -5.872 1.941 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.038 -6.342 2.206 1.00 0.00 H new ATOM 1133 N VAL A 107 12.132 -7.910 0.618 1.00 0.00 N ATOM 1134 CA VAL A 107 10.764 -7.703 1.076 1.00 0.00 C ATOM 1135 C VAL A 107 10.734 -6.904 2.374 1.00 0.00 C ATOM 1136 O VAL A 107 9.938 -5.978 2.527 1.00 0.00 O ATOM 1137 CB VAL A 107 10.036 -9.043 1.293 1.00 0.00 C ATOM 1138 CG1 VAL A 107 8.631 -8.807 1.828 1.00 0.00 C ATOM 1139 CG2 VAL A 107 9.995 -9.842 0.000 1.00 0.00 C ATOM 0 H VAL A 107 12.444 -8.880 0.649 1.00 0.00 H new ATOM 0 HA VAL A 107 10.250 -7.142 0.296 1.00 0.00 H new ATOM 0 HB VAL A 107 10.589 -9.621 2.033 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.132 -9.765 1.975 1.00 0.00 H new ATOM 0 HG12 VAL A 107 8.688 -8.278 2.779 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.065 -8.209 1.113 1.00 0.00 H new ATOM 0 HG21 VAL A 107 9.477 -10.786 0.172 1.00 0.00 H new ATOM 0 HG22 VAL A 107 9.466 -9.272 -0.764 1.00 0.00 H new ATOM 0 HG23 VAL A 107 11.012 -10.042 -0.336 1.00 0.00 H new ATOM 1149 N GLY A 108 11.606 -7.270 3.308 1.00 0.00 N ATOM 1150 CA GLY A 108 11.664 -6.577 4.582 1.00 0.00 C ATOM 1151 C GLY A 108 10.537 -6.981 5.513 1.00 0.00 C ATOM 1152 O GLY A 108 10.063 -8.115 5.466 1.00 0.00 O ATOM 0 H GLY A 108 12.274 -8.034 3.205 1.00 0.00 H new ATOM 0 HA2 GLY A 108 12.620 -6.785 5.062 1.00 0.00 H new ATOM 0 HA3 GLY A 108 11.621 -5.502 4.410 1.00 0.00 H new ATOM 1156 N GLN A 109 10.110 -6.050 6.361 1.00 0.00 N ATOM 1157 CA GLN A 109 9.034 -6.317 7.308 1.00 0.00 C ATOM 1158 C GLN A 109 7.672 -6.197 6.632 1.00 0.00 C ATOM 1159 O GLN A 109 7.569 -5.724 5.501 1.00 0.00 O ATOM 1160 CB GLN A 109 9.117 -5.351 8.491 1.00 0.00 C ATOM 1161 CG GLN A 109 10.133 -5.763 9.544 1.00 0.00 C ATOM 1162 CD GLN A 109 9.747 -5.308 10.937 1.00 0.00 C ATOM 1163 OE1 GLN A 109 8.568 -5.113 11.235 1.00 0.00 O ATOM 1164 NE2 GLN A 109 10.741 -5.135 11.800 1.00 0.00 N ATOM 0 H GLN A 109 10.492 -5.106 6.411 1.00 0.00 H new ATOM 0 HA GLN A 109 9.149 -7.338 7.673 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.372 -4.358 8.121 1.00 0.00 H new ATOM 0 HB3 GLN A 109 8.134 -5.275 8.957 1.00 0.00 H new ATOM 0 HG2 GLN A 109 10.239 -6.848 9.537 1.00 0.00 H new ATOM 0 HG3 GLN A 109 11.107 -5.346 9.287 1.00 0.00 H new ATOM 0 HE21 GLN A 109 11.704 -5.308 11.511 1.00 0.00 H new ATOM 0 HE22 GLN A 109 10.542 -4.829 12.752 1.00 0.00 H new ATOM 1173 N SER A 110 6.629 -6.630 7.334 1.00 0.00 N ATOM 1174 CA SER A 110 5.273 -6.575 6.800 1.00 0.00 C ATOM 1175 C SER A 110 4.272 -6.226 7.896 1.00 0.00 C ATOM 1176 O SER A 110 4.145 -6.943 8.889 1.00 0.00 O ATOM 1177 CB SER A 110 4.900 -7.913 6.159 1.00 0.00 C ATOM 1178 OG SER A 110 4.836 -8.943 7.130 1.00 0.00 O ATOM 0 H SER A 110 6.697 -7.022 8.273 1.00 0.00 H new ATOM 0 HA SER A 110 5.239 -5.795 6.040 1.00 0.00 H new ATOM 0 HB2 SER A 110 3.937 -7.823 5.656 1.00 0.00 H new ATOM 0 HB3 SER A 110 5.635 -8.172 5.397 1.00 0.00 H new ATOM 0 HG SER A 110 4.618 -8.556 8.004 1.00 0.00 H new ATOM 1184 N LYS A 111 3.560 -5.120 7.709 1.00 0.00 N ATOM 1185 CA LYS A 111 2.568 -4.674 8.679 1.00 0.00 C ATOM 1186 C LYS A 111 1.259 -4.306 7.989 1.00 0.00 C ATOM 1187 O LYS A 111 1.222 -3.411 7.143 1.00 0.00 O ATOM 1188 CB LYS A 111 3.097 -3.473 9.466 1.00 0.00 C ATOM 1189 CG LYS A 111 2.170 -3.018 10.579 1.00 0.00 C ATOM 1190 CD LYS A 111 2.154 -4.008 11.731 1.00 0.00 C ATOM 1191 CE LYS A 111 3.301 -3.757 12.698 1.00 0.00 C ATOM 1192 NZ LYS A 111 4.537 -4.481 12.293 1.00 0.00 N ATOM 0 H LYS A 111 3.652 -4.515 6.893 1.00 0.00 H new ATOM 0 HA LYS A 111 2.376 -5.496 9.368 1.00 0.00 H new ATOM 0 HB2 LYS A 111 4.066 -3.728 9.894 1.00 0.00 H new ATOM 0 HB3 LYS A 111 3.261 -2.643 8.779 1.00 0.00 H new ATOM 0 HG2 LYS A 111 2.488 -2.041 10.942 1.00 0.00 H new ATOM 0 HG3 LYS A 111 1.160 -2.899 10.187 1.00 0.00 H new ATOM 0 HD2 LYS A 111 1.205 -3.934 12.263 1.00 0.00 H new ATOM 0 HD3 LYS A 111 2.222 -5.023 11.340 1.00 0.00 H new ATOM 0 HE2 LYS A 111 3.506 -2.688 12.748 1.00 0.00 H new ATOM 0 HE3 LYS A 111 3.007 -4.072 13.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 4.885 -5.048 13.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 4.325 -5.107 11.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 5.266 -3.794 12.013 1.00 0.00 H new ATOM 1206 N ILE A 112 0.186 -4.999 8.355 1.00 0.00 N ATOM 1207 CA ILE A 112 -1.125 -4.742 7.773 1.00 0.00 C ATOM 1208 C ILE A 112 -2.136 -4.351 8.845 1.00 0.00 C ATOM 1209 O ILE A 112 -2.161 -4.931 9.930 1.00 0.00 O ATOM 1210 CB ILE A 112 -1.652 -5.972 7.010 1.00 0.00 C ATOM 1211 CG1 ILE A 112 -2.870 -5.591 6.165 1.00 0.00 C ATOM 1212 CG2 ILE A 112 -2.004 -7.088 7.982 1.00 0.00 C ATOM 1213 CD1 ILE A 112 -3.140 -6.552 5.028 1.00 0.00 C ATOM 0 H ILE A 112 0.199 -5.743 9.052 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.003 -3.915 7.074 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.868 -6.331 6.344 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.749 -5.546 6.808 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.721 -4.591 5.758 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -2.375 -7.950 7.427 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.116 -7.374 8.545 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -2.774 -6.741 8.671 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.017 -6.220 4.472 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.277 -6.580 4.362 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.321 -7.549 5.430 1.00 0.00 H new ATOM 1225 N ASN A 113 -2.970 -3.364 8.532 1.00 0.00 N ATOM 1226 CA ASN A 113 -3.985 -2.896 9.469 1.00 0.00 C ATOM 1227 C ASN A 113 -5.356 -2.840 8.802 1.00 0.00 C ATOM 1228 O ASN A 113 -5.481 -2.426 7.649 1.00 0.00 O ATOM 1229 CB ASN A 113 -3.611 -1.514 10.009 1.00 0.00 C ATOM 1230 CG ASN A 113 -2.724 -1.593 11.236 1.00 0.00 C ATOM 1231 OD1 ASN A 113 -3.207 -1.766 12.355 1.00 0.00 O ATOM 1232 ND2 ASN A 113 -1.418 -1.465 11.031 1.00 0.00 N ATOM 0 H ASN A 113 -2.963 -2.873 7.638 1.00 0.00 H new ATOM 0 HA ASN A 113 -4.033 -3.602 10.298 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -3.099 -0.949 9.230 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -4.520 -0.965 10.256 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -0.771 -1.509 11.819 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -1.062 -1.323 10.086 1.00 0.00 H new ATOM 1239 N HIS A 114 -6.382 -3.259 9.536 1.00 0.00 N ATOM 1240 CA HIS A 114 -7.745 -3.256 9.017 1.00 0.00 C ATOM 1241 C HIS A 114 -8.590 -2.194 9.714 1.00 0.00 C ATOM 1242 O HIS A 114 -8.742 -2.212 10.936 1.00 0.00 O ATOM 1243 CB HIS A 114 -8.385 -4.633 9.196 1.00 0.00 C ATOM 1244 CG HIS A 114 -7.535 -5.759 8.694 1.00 0.00 C ATOM 1245 ND1 HIS A 114 -7.466 -6.114 7.363 1.00 0.00 N ATOM 1246 CD2 HIS A 114 -6.713 -6.610 9.352 1.00 0.00 C ATOM 1247 CE1 HIS A 114 -6.640 -7.136 7.225 1.00 0.00 C ATOM 1248 NE2 HIS A 114 -6.169 -7.456 8.416 1.00 0.00 N ATOM 0 H HIS A 114 -6.295 -3.605 10.492 1.00 0.00 H new ATOM 0 HA HIS A 114 -7.702 -3.020 7.954 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -8.596 -4.792 10.254 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -9.342 -4.650 8.674 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -6.521 -6.622 10.415 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -6.392 -7.627 6.295 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -5.509 -8.209 8.610 1.00 0.00 H new ATOM 1256 N PHE A 115 -9.137 -1.271 8.930 1.00 0.00 N ATOM 1257 CA PHE A 115 -9.965 -0.200 9.473 1.00 0.00 C ATOM 1258 C PHE A 115 -11.402 -0.320 8.976 1.00 0.00 C ATOM 1259 O PHE A 115 -11.657 -0.327 7.771 1.00 0.00 O ATOM 1260 CB PHE A 115 -9.390 1.164 9.085 1.00 0.00 C ATOM 1261 CG PHE A 115 -8.046 1.443 9.694 1.00 0.00 C ATOM 1262 CD1 PHE A 115 -7.942 1.889 11.001 1.00 0.00 C ATOM 1263 CD2 PHE A 115 -6.886 1.261 8.958 1.00 0.00 C ATOM 1264 CE1 PHE A 115 -6.706 2.148 11.563 1.00 0.00 C ATOM 1265 CE2 PHE A 115 -5.648 1.517 9.515 1.00 0.00 C ATOM 1266 CZ PHE A 115 -5.557 1.960 10.820 1.00 0.00 C ATOM 0 H PHE A 115 -9.022 -1.243 7.917 1.00 0.00 H new ATOM 0 HA PHE A 115 -9.966 -0.290 10.559 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -9.307 1.219 8.000 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -10.088 1.944 9.391 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -8.837 2.036 11.588 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -6.951 0.915 7.937 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -6.639 2.497 12.583 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -4.752 1.371 8.930 1.00 0.00 H new ATOM 0 HZ PHE A 115 -4.590 2.159 11.258 1.00 0.00 H new ATOM 1276 N THR A 116 -12.340 -0.413 9.913 1.00 0.00 N ATOM 1277 CA THR A 116 -13.752 -0.534 9.573 1.00 0.00 C ATOM 1278 C THR A 116 -14.260 0.724 8.878 1.00 0.00 C ATOM 1279 O THR A 116 -15.035 0.648 7.924 1.00 0.00 O ATOM 1280 CB THR A 116 -14.612 -0.798 10.823 1.00 0.00 C ATOM 1281 OG1 THR A 116 -14.450 0.270 11.763 1.00 0.00 O ATOM 1282 CG2 THR A 116 -14.227 -2.118 11.476 1.00 0.00 C ATOM 0 H THR A 116 -12.147 -0.407 10.915 1.00 0.00 H new ATOM 0 HA THR A 116 -13.841 -1.383 8.895 1.00 0.00 H new ATOM 0 HB THR A 116 -15.656 -0.855 10.514 1.00 0.00 H new ATOM 0 HG1 THR A 116 -15.001 0.096 12.554 1.00 0.00 H new ATOM 0 HG21 THR A 116 -14.848 -2.283 12.357 1.00 0.00 H new ATOM 0 HG22 THR A 116 -14.379 -2.932 10.767 1.00 0.00 H new ATOM 0 HG23 THR A 116 -13.179 -2.085 11.772 1.00 0.00 H new ATOM 1290 N ARG A 117 -13.818 1.881 9.361 1.00 0.00 N ATOM 1291 CA ARG A 117 -14.228 3.156 8.786 1.00 0.00 C ATOM 1292 C ARG A 117 -13.291 3.569 7.654 1.00 0.00 C ATOM 1293 O ARG A 117 -12.123 3.178 7.627 1.00 0.00 O ATOM 1294 CB ARG A 117 -14.253 4.241 9.864 1.00 0.00 C ATOM 1295 CG ARG A 117 -15.596 4.376 10.562 1.00 0.00 C ATOM 1296 CD ARG A 117 -15.727 5.719 11.264 1.00 0.00 C ATOM 1297 NE ARG A 117 -15.127 5.701 12.595 1.00 0.00 N ATOM 1298 CZ ARG A 117 -14.729 6.794 13.236 1.00 0.00 C ATOM 1299 NH1 ARG A 117 -14.867 7.986 12.671 1.00 0.00 N ATOM 1300 NH2 ARG A 117 -14.192 6.697 14.446 1.00 0.00 N ATOM 0 H ARG A 117 -13.176 1.961 10.149 1.00 0.00 H new ATOM 0 HA ARG A 117 -15.231 3.036 8.378 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -13.487 4.020 10.608 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -13.991 5.197 9.411 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -16.399 4.266 9.833 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -15.712 3.572 11.288 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -15.249 6.491 10.661 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -16.781 5.985 11.345 1.00 0.00 H new ATOM 0 HE ARG A 117 -15.007 4.800 13.058 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -15.280 8.065 11.742 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -14.560 8.824 13.166 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -14.085 5.782 14.884 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -13.887 7.537 14.937 1.00 0.00 H new ATOM 1314 N LEU A 118 -13.810 4.360 6.722 1.00 0.00 N ATOM 1315 CA LEU A 118 -13.021 4.826 5.587 1.00 0.00 C ATOM 1316 C LEU A 118 -12.136 6.002 5.986 1.00 0.00 C ATOM 1317 O LEU A 118 -10.924 5.978 5.776 1.00 0.00 O ATOM 1318 CB LEU A 118 -13.940 5.231 4.434 1.00 0.00 C ATOM 1319 CG LEU A 118 -13.287 6.029 3.305 1.00 0.00 C ATOM 1320 CD1 LEU A 118 -12.108 5.265 2.723 1.00 0.00 C ATOM 1321 CD2 LEU A 118 -14.305 6.349 2.220 1.00 0.00 C ATOM 0 H LEU A 118 -14.774 4.692 6.730 1.00 0.00 H new ATOM 0 HA LEU A 118 -12.380 4.007 5.261 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -14.376 4.327 4.008 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -14.762 5.820 4.840 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.917 6.968 3.717 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -11.656 5.849 1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -11.368 5.088 3.504 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -12.453 4.310 2.327 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -13.823 6.917 1.425 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -14.705 5.421 1.812 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -15.117 6.938 2.646 1.00 0.00 H new ATOM 1333 N GLU A 119 -12.751 7.030 6.564 1.00 0.00 N ATOM 1334 CA GLU A 119 -12.018 8.215 6.993 1.00 0.00 C ATOM 1335 C GLU A 119 -10.861 7.836 7.913 1.00 0.00 C ATOM 1336 O GLU A 119 -9.726 8.267 7.710 1.00 0.00 O ATOM 1337 CB GLU A 119 -12.955 9.189 7.710 1.00 0.00 C ATOM 1338 CG GLU A 119 -14.142 9.625 6.866 1.00 0.00 C ATOM 1339 CD GLU A 119 -15.270 8.611 6.880 1.00 0.00 C ATOM 1340 OE1 GLU A 119 -15.596 8.101 7.972 1.00 0.00 O ATOM 1341 OE2 GLU A 119 -15.827 8.328 5.799 1.00 0.00 O ATOM 0 H GLU A 119 -13.754 7.065 6.746 1.00 0.00 H new ATOM 0 HA GLU A 119 -11.610 8.700 6.106 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -13.322 8.721 8.624 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -12.389 10.071 8.009 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.513 10.581 7.234 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -13.814 9.784 5.839 1.00 0.00 H new ATOM 1348 N ASP A 120 -11.158 7.027 8.924 1.00 0.00 N ATOM 1349 CA ASP A 120 -10.143 6.588 9.875 1.00 0.00 C ATOM 1350 C ASP A 120 -8.884 6.123 9.150 1.00 0.00 C ATOM 1351 O ASP A 120 -7.770 6.494 9.520 1.00 0.00 O ATOM 1352 CB ASP A 120 -10.689 5.460 10.751 1.00 0.00 C ATOM 1353 CG ASP A 120 -9.648 4.917 11.711 1.00 0.00 C ATOM 1354 OD1 ASP A 120 -8.493 4.717 11.282 1.00 0.00 O ATOM 1355 OD2 ASP A 120 -9.989 4.693 12.892 1.00 0.00 O ATOM 0 H ASP A 120 -12.093 6.662 9.106 1.00 0.00 H new ATOM 0 HA ASP A 120 -9.883 7.436 10.509 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -11.546 5.826 11.317 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -11.049 4.652 10.115 1.00 0.00 H new ATOM 1360 N ALA A 121 -9.069 5.307 8.117 1.00 0.00 N ATOM 1361 CA ALA A 121 -7.949 4.791 7.341 1.00 0.00 C ATOM 1362 C ALA A 121 -7.225 5.916 6.608 1.00 0.00 C ATOM 1363 O ALA A 121 -5.995 5.965 6.583 1.00 0.00 O ATOM 1364 CB ALA A 121 -8.431 3.740 6.352 1.00 0.00 C ATOM 0 H ALA A 121 -9.985 4.989 7.799 1.00 0.00 H new ATOM 0 HA ALA A 121 -7.244 4.328 8.031 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -7.583 3.364 5.779 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -8.897 2.917 6.894 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -9.158 4.185 5.673 1.00 0.00 H new ATOM 1370 N LYS A 122 -7.996 6.819 6.012 1.00 0.00 N ATOM 1371 CA LYS A 122 -7.429 7.945 5.278 1.00 0.00 C ATOM 1372 C LYS A 122 -6.522 8.779 6.178 1.00 0.00 C ATOM 1373 O LYS A 122 -5.426 9.173 5.778 1.00 0.00 O ATOM 1374 CB LYS A 122 -8.545 8.822 4.707 1.00 0.00 C ATOM 1375 CG LYS A 122 -9.450 8.095 3.728 1.00 0.00 C ATOM 1376 CD LYS A 122 -10.627 8.959 3.308 1.00 0.00 C ATOM 1377 CE LYS A 122 -11.087 8.627 1.897 1.00 0.00 C ATOM 1378 NZ LYS A 122 -12.254 9.455 1.485 1.00 0.00 N ATOM 0 H LYS A 122 -9.016 6.793 6.023 1.00 0.00 H new ATOM 0 HA LYS A 122 -6.832 7.548 4.457 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.148 9.208 5.529 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -8.100 9.682 4.207 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -8.877 7.807 2.847 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.817 7.176 4.184 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.453 8.814 4.005 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.345 10.011 3.362 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -10.264 8.786 1.200 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -11.353 7.571 1.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -12.537 9.199 0.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -13.048 9.284 2.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -11.993 10.461 1.514 1.00 0.00 H new ATOM 1392 N LYS A 123 -6.985 9.044 7.395 1.00 0.00 N ATOM 1393 CA LYS A 123 -6.215 9.828 8.353 1.00 0.00 C ATOM 1394 C LYS A 123 -4.831 9.223 8.565 1.00 0.00 C ATOM 1395 O LYS A 123 -3.836 9.942 8.656 1.00 0.00 O ATOM 1396 CB LYS A 123 -6.957 9.912 9.688 1.00 0.00 C ATOM 1397 CG LYS A 123 -8.326 10.562 9.584 1.00 0.00 C ATOM 1398 CD LYS A 123 -9.197 10.223 10.782 1.00 0.00 C ATOM 1399 CE LYS A 123 -8.829 11.064 11.995 1.00 0.00 C ATOM 1400 NZ LYS A 123 -9.116 10.353 13.271 1.00 0.00 N ATOM 0 H LYS A 123 -7.891 8.727 7.741 1.00 0.00 H new ATOM 0 HA LYS A 123 -6.094 10.833 7.948 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -7.071 8.907 10.094 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -6.350 10.475 10.397 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -8.212 11.643 9.511 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -8.818 10.231 8.670 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -10.245 10.386 10.529 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -9.089 9.166 11.024 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -7.770 11.319 11.952 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -9.384 12.001 11.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -8.851 10.959 14.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -10.131 10.131 13.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -8.567 9.471 13.308 1.00 0.00 H new ATOM 1414 N ASP A 124 -4.776 7.898 8.641 1.00 0.00 N ATOM 1415 CA ASP A 124 -3.513 7.196 8.840 1.00 0.00 C ATOM 1416 C ASP A 124 -2.648 7.268 7.586 1.00 0.00 C ATOM 1417 O ASP A 124 -1.426 7.394 7.669 1.00 0.00 O ATOM 1418 CB ASP A 124 -3.771 5.735 9.213 1.00 0.00 C ATOM 1419 CG ASP A 124 -2.488 4.944 9.375 1.00 0.00 C ATOM 1420 OD1 ASP A 124 -1.558 5.150 8.568 1.00 0.00 O ATOM 1421 OD2 ASP A 124 -2.414 4.117 10.309 1.00 0.00 O ATOM 0 H ASP A 124 -5.591 7.289 8.568 1.00 0.00 H new ATOM 0 HA ASP A 124 -2.979 7.683 9.656 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.339 5.695 10.143 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -4.387 5.270 8.443 1.00 0.00 H new ATOM 1426 N PHE A 125 -3.289 7.187 6.425 1.00 0.00 N ATOM 1427 CA PHE A 125 -2.578 7.241 5.153 1.00 0.00 C ATOM 1428 C PHE A 125 -1.979 8.626 4.923 1.00 0.00 C ATOM 1429 O PHE A 125 -0.838 8.754 4.481 1.00 0.00 O ATOM 1430 CB PHE A 125 -3.520 6.883 4.002 1.00 0.00 C ATOM 1431 CG PHE A 125 -2.847 6.867 2.659 1.00 0.00 C ATOM 1432 CD1 PHE A 125 -2.354 8.036 2.103 1.00 0.00 C ATOM 1433 CD2 PHE A 125 -2.708 5.683 1.954 1.00 0.00 C ATOM 1434 CE1 PHE A 125 -1.735 8.024 0.867 1.00 0.00 C ATOM 1435 CE2 PHE A 125 -2.089 5.664 0.718 1.00 0.00 C ATOM 1436 CZ PHE A 125 -1.601 6.836 0.175 1.00 0.00 C ATOM 0 H PHE A 125 -4.300 7.084 6.339 1.00 0.00 H new ATOM 0 HA PHE A 125 -1.766 6.514 5.188 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.957 5.903 4.192 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.341 7.599 3.979 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.454 8.967 2.641 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -3.088 4.764 2.375 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.357 8.942 0.443 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -1.987 4.734 0.178 1.00 0.00 H new ATOM 0 HZ PHE A 125 -1.115 6.824 -0.789 1.00 0.00 H new ATOM 1446 N GLU A 126 -2.759 9.659 5.227 1.00 0.00 N ATOM 1447 CA GLU A 126 -2.306 11.034 5.053 1.00 0.00 C ATOM 1448 C GLU A 126 -1.403 11.460 6.207 1.00 0.00 C ATOM 1449 O GLU A 126 -0.408 12.158 6.007 1.00 0.00 O ATOM 1450 CB GLU A 126 -3.504 11.980 4.952 1.00 0.00 C ATOM 1451 CG GLU A 126 -4.029 12.149 3.536 1.00 0.00 C ATOM 1452 CD GLU A 126 -4.667 13.506 3.309 1.00 0.00 C ATOM 1453 OE1 GLU A 126 -3.923 14.501 3.194 1.00 0.00 O ATOM 1454 OE2 GLU A 126 -5.913 13.571 3.246 1.00 0.00 O ATOM 0 H GLU A 126 -3.706 9.570 5.594 1.00 0.00 H new ATOM 0 HA GLU A 126 -1.732 11.086 4.128 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -4.307 11.604 5.586 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -3.219 12.956 5.344 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -3.210 12.014 2.830 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -4.761 11.368 3.328 1.00 0.00 H new ATOM 1461 N LYS A 127 -1.757 11.036 7.415 1.00 0.00 N ATOM 1462 CA LYS A 127 -0.980 11.371 8.602 1.00 0.00 C ATOM 1463 C LYS A 127 0.426 10.788 8.515 1.00 0.00 C ATOM 1464 O LYS A 127 1.417 11.514 8.598 1.00 0.00 O ATOM 1465 CB LYS A 127 -1.682 10.853 9.860 1.00 0.00 C ATOM 1466 CG LYS A 127 -0.921 11.139 11.143 1.00 0.00 C ATOM 1467 CD LYS A 127 0.032 10.008 11.490 1.00 0.00 C ATOM 1468 CE LYS A 127 -0.715 8.791 12.015 1.00 0.00 C ATOM 1469 NZ LYS A 127 0.215 7.695 12.403 1.00 0.00 N ATOM 0 H LYS A 127 -2.578 10.459 7.598 1.00 0.00 H new ATOM 0 HA LYS A 127 -0.901 12.457 8.659 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -2.672 11.305 9.926 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -1.829 9.777 9.767 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -0.361 12.068 11.035 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -1.627 11.285 11.961 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.606 9.730 10.606 1.00 0.00 H new ATOM 0 HD3 LYS A 127 0.746 10.349 12.240 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -1.317 9.078 12.877 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -1.403 8.430 11.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -0.207 6.777 12.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 1.116 7.809 11.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 0.386 7.732 13.428 1.00 0.00 H new ATOM 1483 N LYS A 128 0.507 9.472 8.346 1.00 0.00 N ATOM 1484 CA LYS A 128 1.792 8.791 8.245 1.00 0.00 C ATOM 1485 C LYS A 128 2.615 9.351 7.090 1.00 0.00 C ATOM 1486 O LYS A 128 3.809 9.615 7.236 1.00 0.00 O ATOM 1487 CB LYS A 128 1.581 7.287 8.052 1.00 0.00 C ATOM 1488 CG LYS A 128 2.875 6.496 7.977 1.00 0.00 C ATOM 1489 CD LYS A 128 3.537 6.379 9.340 1.00 0.00 C ATOM 1490 CE LYS A 128 2.698 5.546 10.297 1.00 0.00 C ATOM 1491 NZ LYS A 128 3.518 4.984 11.406 1.00 0.00 N ATOM 0 H LYS A 128 -0.303 8.856 8.276 1.00 0.00 H new ATOM 0 HA LYS A 128 2.338 8.960 9.173 1.00 0.00 H new ATOM 0 HB2 LYS A 128 0.978 6.905 8.876 1.00 0.00 H new ATOM 0 HB3 LYS A 128 1.011 7.123 7.137 1.00 0.00 H new ATOM 0 HG2 LYS A 128 2.671 5.500 7.584 1.00 0.00 H new ATOM 0 HG3 LYS A 128 3.559 6.980 7.280 1.00 0.00 H new ATOM 0 HD2 LYS A 128 4.522 5.926 9.230 1.00 0.00 H new ATOM 0 HD3 LYS A 128 3.689 7.374 9.759 1.00 0.00 H new ATOM 0 HE2 LYS A 128 1.900 6.162 10.711 1.00 0.00 H new ATOM 0 HE3 LYS A 128 2.221 4.733 9.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 2.911 4.423 12.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 4.264 4.376 11.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 3.952 5.760 11.944 1.00 0.00 H new ATOM 1505 N PHE A 129 1.970 9.533 5.942 1.00 0.00 N ATOM 1506 CA PHE A 129 2.644 10.063 4.762 1.00 0.00 C ATOM 1507 C PHE A 129 3.155 11.478 5.018 1.00 0.00 C ATOM 1508 O PHE A 129 4.349 11.749 4.896 1.00 0.00 O ATOM 1509 CB PHE A 129 1.694 10.060 3.563 1.00 0.00 C ATOM 1510 CG PHE A 129 2.144 10.951 2.440 1.00 0.00 C ATOM 1511 CD1 PHE A 129 1.885 12.312 2.471 1.00 0.00 C ATOM 1512 CD2 PHE A 129 2.825 10.426 1.353 1.00 0.00 C ATOM 1513 CE1 PHE A 129 2.298 13.134 1.439 1.00 0.00 C ATOM 1514 CE2 PHE A 129 3.241 11.244 0.319 1.00 0.00 C ATOM 1515 CZ PHE A 129 2.976 12.599 0.361 1.00 0.00 C ATOM 0 H PHE A 129 0.982 9.321 5.804 1.00 0.00 H new ATOM 0 HA PHE A 129 3.498 9.422 4.542 1.00 0.00 H new ATOM 0 HB2 PHE A 129 1.595 9.041 3.190 1.00 0.00 H new ATOM 0 HB3 PHE A 129 0.704 10.376 3.893 1.00 0.00 H new ATOM 0 HD1 PHE A 129 1.354 12.735 3.311 1.00 0.00 H new ATOM 0 HD2 PHE A 129 3.033 9.367 1.313 1.00 0.00 H new ATOM 0 HE1 PHE A 129 2.091 14.193 1.476 1.00 0.00 H new ATOM 0 HE2 PHE A 129 3.773 10.824 -0.522 1.00 0.00 H new ATOM 0 HZ PHE A 129 3.298 13.239 -0.447 1.00 0.00 H new ATOM 1525 N ARG A 130 2.241 12.376 5.372 1.00 0.00 N ATOM 1526 CA ARG A 130 2.598 13.763 5.643 1.00 0.00 C ATOM 1527 C ARG A 130 3.601 13.853 6.790 1.00 0.00 C ATOM 1528 O ARG A 130 4.413 14.775 6.845 1.00 0.00 O ATOM 1529 CB ARG A 130 1.348 14.577 5.980 1.00 0.00 C ATOM 1530 CG ARG A 130 1.647 15.890 6.685 1.00 0.00 C ATOM 1531 CD ARG A 130 0.460 16.838 6.625 1.00 0.00 C ATOM 1532 NE ARG A 130 -0.667 16.356 7.419 1.00 0.00 N ATOM 1533 CZ ARG A 130 -1.661 17.134 7.832 1.00 0.00 C ATOM 1534 NH1 ARG A 130 -1.668 18.424 7.527 1.00 0.00 N ATOM 1535 NH2 ARG A 130 -2.652 16.621 8.551 1.00 0.00 N ATOM 0 H ARG A 130 1.248 12.168 5.478 1.00 0.00 H new ATOM 0 HA ARG A 130 3.061 14.174 4.746 1.00 0.00 H new ATOM 0 HB2 ARG A 130 0.801 14.785 5.060 1.00 0.00 H new ATOM 0 HB3 ARG A 130 0.693 13.976 6.611 1.00 0.00 H new ATOM 0 HG2 ARG A 130 1.906 15.695 7.726 1.00 0.00 H new ATOM 0 HG3 ARG A 130 2.515 16.362 6.224 1.00 0.00 H new ATOM 0 HD2 ARG A 130 0.763 17.821 6.985 1.00 0.00 H new ATOM 0 HD3 ARG A 130 0.147 16.961 5.588 1.00 0.00 H new ATOM 0 HE ARG A 130 -0.692 15.368 7.670 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -0.909 18.821 6.974 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -2.433 19.019 7.845 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -2.650 15.629 8.787 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -3.415 17.219 8.868 1.00 0.00 H new ATOM 1549 N GLU A 131 3.536 12.888 7.702 1.00 0.00 N ATOM 1550 CA GLU A 131 4.438 12.859 8.848 1.00 0.00 C ATOM 1551 C GLU A 131 5.815 12.343 8.443 1.00 0.00 C ATOM 1552 O GLU A 131 6.830 12.727 9.025 1.00 0.00 O ATOM 1553 CB GLU A 131 3.858 11.982 9.959 1.00 0.00 C ATOM 1554 CG GLU A 131 2.840 12.697 10.832 1.00 0.00 C ATOM 1555 CD GLU A 131 3.481 13.429 11.995 1.00 0.00 C ATOM 1556 OE1 GLU A 131 4.199 12.777 12.782 1.00 0.00 O ATOM 1557 OE2 GLU A 131 3.266 14.653 12.118 1.00 0.00 O ATOM 0 H GLU A 131 2.869 12.117 7.670 1.00 0.00 H new ATOM 0 HA GLU A 131 4.546 13.878 9.219 1.00 0.00 H new ATOM 0 HB2 GLU A 131 3.388 11.106 9.511 1.00 0.00 H new ATOM 0 HB3 GLU A 131 4.672 11.621 10.587 1.00 0.00 H new ATOM 0 HG2 GLU A 131 2.281 13.408 10.224 1.00 0.00 H new ATOM 0 HG3 GLU A 131 2.122 11.972 11.215 1.00 0.00 H new ATOM 1564 N LYS A 132 5.843 11.469 7.443 1.00 0.00 N ATOM 1565 CA LYS A 132 7.095 10.899 6.959 1.00 0.00 C ATOM 1566 C LYS A 132 7.758 11.825 5.944 1.00 0.00 C ATOM 1567 O LYS A 132 8.974 11.789 5.756 1.00 0.00 O ATOM 1568 CB LYS A 132 6.844 9.528 6.326 1.00 0.00 C ATOM 1569 CG LYS A 132 6.459 8.456 7.331 1.00 0.00 C ATOM 1570 CD LYS A 132 7.676 7.914 8.061 1.00 0.00 C ATOM 1571 CE LYS A 132 7.281 6.905 9.129 1.00 0.00 C ATOM 1572 NZ LYS A 132 6.737 7.569 10.345 1.00 0.00 N ATOM 0 H LYS A 132 5.012 11.140 6.951 1.00 0.00 H new ATOM 0 HA LYS A 132 7.765 10.782 7.811 1.00 0.00 H new ATOM 0 HB2 LYS A 132 6.051 9.620 5.583 1.00 0.00 H new ATOM 0 HB3 LYS A 132 7.742 9.212 5.796 1.00 0.00 H new ATOM 0 HG2 LYS A 132 5.754 8.869 8.053 1.00 0.00 H new ATOM 0 HG3 LYS A 132 5.949 7.641 6.818 1.00 0.00 H new ATOM 0 HD2 LYS A 132 8.351 7.443 7.346 1.00 0.00 H new ATOM 0 HD3 LYS A 132 8.222 8.737 8.521 1.00 0.00 H new ATOM 0 HE2 LYS A 132 6.535 6.221 8.724 1.00 0.00 H new ATOM 0 HE3 LYS A 132 8.149 6.305 9.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 6.480 6.848 11.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 7.457 8.203 10.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 5.893 8.121 10.091 1.00 0.00 H new ATOM 1586 N THR A 133 6.950 12.657 5.293 1.00 0.00 N ATOM 1587 CA THR A 133 7.459 13.593 4.298 1.00 0.00 C ATOM 1588 C THR A 133 7.305 15.034 4.770 1.00 0.00 C ATOM 1589 O THR A 133 7.775 15.966 4.117 1.00 0.00 O ATOM 1590 CB THR A 133 6.735 13.427 2.948 1.00 0.00 C ATOM 1591 OG1 THR A 133 5.343 13.726 3.099 1.00 0.00 O ATOM 1592 CG2 THR A 133 6.899 12.011 2.417 1.00 0.00 C ATOM 0 H THR A 133 5.941 12.701 5.437 1.00 0.00 H new ATOM 0 HA THR A 133 8.517 13.368 4.165 1.00 0.00 H new ATOM 0 HB THR A 133 7.180 14.120 2.234 1.00 0.00 H new ATOM 0 HG1 THR A 133 4.934 13.078 3.709 1.00 0.00 H new ATOM 0 HG21 THR A 133 6.380 11.918 1.463 1.00 0.00 H new ATOM 0 HG22 THR A 133 7.958 11.796 2.276 1.00 0.00 H new ATOM 0 HG23 THR A 133 6.477 11.304 3.131 1.00 0.00 H new ATOM 1600 N LYS A 134 6.643 15.212 5.908 1.00 0.00 N ATOM 1601 CA LYS A 134 6.428 16.540 6.470 1.00 0.00 C ATOM 1602 C LYS A 134 5.764 17.461 5.451 1.00 0.00 C ATOM 1603 O LYS A 134 6.053 18.655 5.400 1.00 0.00 O ATOM 1604 CB LYS A 134 7.758 17.144 6.928 1.00 0.00 C ATOM 1605 CG LYS A 134 8.160 16.733 8.334 1.00 0.00 C ATOM 1606 CD LYS A 134 9.565 17.201 8.672 1.00 0.00 C ATOM 1607 CE LYS A 134 9.566 18.629 9.198 1.00 0.00 C ATOM 1608 NZ LYS A 134 10.723 18.887 10.098 1.00 0.00 N ATOM 0 H LYS A 134 6.246 14.452 6.460 1.00 0.00 H new ATOM 0 HA LYS A 134 5.766 16.440 7.330 1.00 0.00 H new ATOM 0 HB2 LYS A 134 8.542 16.844 6.233 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.689 18.231 6.882 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.454 17.151 9.052 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.105 15.648 8.427 1.00 0.00 H new ATOM 0 HD2 LYS A 134 10.001 16.537 9.418 1.00 0.00 H new ATOM 0 HD3 LYS A 134 10.194 17.139 7.784 1.00 0.00 H new ATOM 0 HE2 LYS A 134 9.596 19.325 8.360 1.00 0.00 H new ATOM 0 HE3 LYS A 134 8.637 18.818 9.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 10.688 19.870 10.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 10.681 18.240 10.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 11.610 18.731 9.577 1.00 0.00 H new ATOM 1622 N ASN A 135 4.872 16.896 4.643 1.00 0.00 N ATOM 1623 CA ASN A 135 4.166 17.667 3.626 1.00 0.00 C ATOM 1624 C ASN A 135 2.732 17.172 3.466 1.00 0.00 C ATOM 1625 O ASN A 135 2.363 16.126 3.999 1.00 0.00 O ATOM 1626 CB ASN A 135 4.901 17.578 2.287 1.00 0.00 C ATOM 1627 CG ASN A 135 6.001 18.614 2.161 1.00 0.00 C ATOM 1628 OD1 ASN A 135 5.883 19.572 1.397 1.00 0.00 O ATOM 1629 ND2 ASN A 135 7.080 18.427 2.913 1.00 0.00 N ATOM 0 H ASN A 135 4.621 15.908 4.673 1.00 0.00 H new ATOM 0 HA ASN A 135 4.138 18.708 3.949 1.00 0.00 H new ATOM 0 HB2 ASN A 135 5.330 16.582 2.176 1.00 0.00 H new ATOM 0 HB3 ASN A 135 4.187 17.710 1.474 1.00 0.00 H new ATOM 0 HD21 ASN A 135 7.853 19.092 2.871 1.00 0.00 H new ATOM 0 HD22 ASN A 135 7.136 17.619 3.533 1.00 0.00 H new ATOM 1636 N ASN A 136 1.929 17.931 2.728 1.00 0.00 N ATOM 1637 CA ASN A 136 0.535 17.569 2.497 1.00 0.00 C ATOM 1638 C ASN A 136 0.402 16.670 1.271 1.00 0.00 C ATOM 1639 O ASN A 136 1.147 16.812 0.301 1.00 0.00 O ATOM 1640 CB ASN A 136 -0.316 18.827 2.315 1.00 0.00 C ATOM 1641 CG ASN A 136 -0.450 19.625 3.598 1.00 0.00 C ATOM 1642 OD1 ASN A 136 -0.799 19.082 4.646 1.00 0.00 O ATOM 1643 ND2 ASN A 136 -0.173 20.921 3.520 1.00 0.00 N ATOM 0 H ASN A 136 2.219 18.800 2.280 1.00 0.00 H new ATOM 0 HA ASN A 136 0.179 17.020 3.369 1.00 0.00 H new ATOM 0 HB2 ASN A 136 0.130 19.456 1.544 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -1.307 18.544 1.961 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -0.246 21.509 4.350 1.00 0.00 H new ATOM 0 HD22 ASN A 136 0.113 21.329 2.630 1.00 0.00 H new ATOM 1650 N TRP A 137 -0.551 15.747 1.322 1.00 0.00 N ATOM 1651 CA TRP A 137 -0.782 14.825 0.216 1.00 0.00 C ATOM 1652 C TRP A 137 -1.424 15.543 -0.966 1.00 0.00 C ATOM 1653 O TRP A 137 -1.102 15.267 -2.121 1.00 0.00 O ATOM 1654 CB TRP A 137 -1.671 13.666 0.669 1.00 0.00 C ATOM 1655 CG TRP A 137 -2.077 12.756 -0.451 1.00 0.00 C ATOM 1656 CD1 TRP A 137 -3.327 12.619 -0.984 1.00 0.00 C ATOM 1657 CD2 TRP A 137 -1.229 11.856 -1.174 1.00 0.00 C ATOM 1658 NE1 TRP A 137 -3.307 11.688 -1.995 1.00 0.00 N ATOM 1659 CE2 TRP A 137 -2.032 11.206 -2.131 1.00 0.00 C ATOM 1660 CE3 TRP A 137 0.130 11.538 -1.107 1.00 0.00 C ATOM 1661 CZ2 TRP A 137 -1.519 10.256 -3.011 1.00 0.00 C ATOM 1662 CZ3 TRP A 137 0.637 10.595 -1.981 1.00 0.00 C ATOM 1663 CH2 TRP A 137 -0.185 9.964 -2.923 1.00 0.00 C ATOM 0 H TRP A 137 -1.176 15.617 2.117 1.00 0.00 H new ATOM 0 HA TRP A 137 0.183 14.430 -0.103 1.00 0.00 H new ATOM 0 HB2 TRP A 137 -1.142 13.086 1.425 1.00 0.00 H new ATOM 0 HB3 TRP A 137 -2.566 14.068 1.144 1.00 0.00 H new ATOM 0 HD1 TRP A 137 -4.202 13.162 -0.659 1.00 0.00 H new ATOM 0 HE1 TRP A 137 -4.111 11.402 -2.554 1.00 0.00 H new ATOM 0 HE3 TRP A 137 0.773 12.020 -0.385 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 -2.152 9.767 -3.737 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 1.686 10.340 -1.937 1.00 0.00 H new ATOM 0 HH2 TRP A 137 0.242 9.233 -3.593 1.00 0.00 H new ATOM 1674 N ALA A 138 -2.333 16.466 -0.669 1.00 0.00 N ATOM 1675 CA ALA A 138 -3.018 17.225 -1.708 1.00 0.00 C ATOM 1676 C ALA A 138 -2.049 18.138 -2.450 1.00 0.00 C ATOM 1677 O ALA A 138 -2.243 18.438 -3.628 1.00 0.00 O ATOM 1678 CB ALA A 138 -4.155 18.037 -1.106 1.00 0.00 C ATOM 0 H ALA A 138 -2.612 16.706 0.282 1.00 0.00 H new ATOM 0 HA ALA A 138 -3.432 16.518 -2.426 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -4.658 18.599 -1.893 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -4.868 17.366 -0.628 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -3.755 18.729 -0.365 1.00 0.00 H new ATOM 1684 N GLU A 139 -1.006 18.578 -1.753 1.00 0.00 N ATOM 1685 CA GLU A 139 -0.007 19.459 -2.347 1.00 0.00 C ATOM 1686 C GLU A 139 1.105 18.652 -3.010 1.00 0.00 C ATOM 1687 O GLU A 139 2.246 19.105 -3.100 1.00 0.00 O ATOM 1688 CB GLU A 139 0.585 20.386 -1.283 1.00 0.00 C ATOM 1689 CG GLU A 139 -0.427 21.345 -0.680 1.00 0.00 C ATOM 1690 CD GLU A 139 0.202 22.648 -0.226 1.00 0.00 C ATOM 1691 OE1 GLU A 139 1.405 22.641 0.109 1.00 0.00 O ATOM 1692 OE2 GLU A 139 -0.509 23.674 -0.206 1.00 0.00 O ATOM 0 H GLU A 139 -0.831 18.339 -0.777 1.00 0.00 H new ATOM 0 HA GLU A 139 -0.499 20.062 -3.110 1.00 0.00 H new ATOM 0 HB2 GLU A 139 1.019 19.781 -0.487 1.00 0.00 H new ATOM 0 HB3 GLU A 139 1.398 20.961 -1.726 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -1.203 21.557 -1.415 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -0.915 20.866 0.169 1.00 0.00 H new ATOM 1699 N ARG A 140 0.764 17.453 -3.472 1.00 0.00 N ATOM 1700 CA ARG A 140 1.733 16.582 -4.125 1.00 0.00 C ATOM 1701 C ARG A 140 2.381 17.284 -5.315 1.00 0.00 C ATOM 1702 O ARG A 140 3.496 16.949 -5.714 1.00 0.00 O ATOM 1703 CB ARG A 140 1.058 15.289 -4.588 1.00 0.00 C ATOM 1704 CG ARG A 140 0.143 15.476 -5.788 1.00 0.00 C ATOM 1705 CD ARG A 140 -1.005 14.478 -5.774 1.00 0.00 C ATOM 1706 NE ARG A 140 -2.075 14.863 -6.690 1.00 0.00 N ATOM 1707 CZ ARG A 140 -2.014 14.688 -8.005 1.00 0.00 C ATOM 1708 NH1 ARG A 140 -0.941 14.138 -8.556 1.00 0.00 N ATOM 1709 NH2 ARG A 140 -3.029 15.064 -8.773 1.00 0.00 N ATOM 0 H ARG A 140 -0.176 17.063 -3.406 1.00 0.00 H new ATOM 0 HA ARG A 140 2.511 16.339 -3.401 1.00 0.00 H new ATOM 0 HB2 ARG A 140 1.826 14.557 -4.838 1.00 0.00 H new ATOM 0 HB3 ARG A 140 0.480 14.875 -3.762 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -0.255 16.491 -5.789 1.00 0.00 H new ATOM 0 HG3 ARG A 140 0.717 15.359 -6.707 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -0.631 13.491 -6.047 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -1.404 14.399 -4.763 1.00 0.00 H new ATOM 0 HE ARG A 140 -2.915 15.289 -6.299 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -0.159 13.848 -7.970 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -0.898 14.005 -9.566 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -3.856 15.488 -8.353 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -2.982 14.929 -9.783 1.00 0.00 H new ATOM 1723 N ASP A 141 1.674 18.258 -5.877 1.00 0.00 N ATOM 1724 CA ASP A 141 2.180 19.008 -7.020 1.00 0.00 C ATOM 1725 C ASP A 141 3.504 19.685 -6.683 1.00 0.00 C ATOM 1726 O ASP A 141 4.471 19.594 -7.441 1.00 0.00 O ATOM 1727 CB ASP A 141 1.156 20.055 -7.464 1.00 0.00 C ATOM 1728 CG ASP A 141 -0.180 19.439 -7.829 1.00 0.00 C ATOM 1729 OD1 ASP A 141 -0.594 18.474 -7.152 1.00 0.00 O ATOM 1730 OD2 ASP A 141 -0.813 19.922 -8.790 1.00 0.00 O ATOM 0 H ASP A 141 0.749 18.547 -5.559 1.00 0.00 H new ATOM 0 HA ASP A 141 2.349 18.307 -7.837 1.00 0.00 H new ATOM 0 HB2 ASP A 141 1.012 20.780 -6.663 1.00 0.00 H new ATOM 0 HB3 ASP A 141 1.548 20.601 -8.322 1.00 0.00 H new ATOM 1735 N HIS A 142 3.542 20.366 -5.542 1.00 0.00 N ATOM 1736 CA HIS A 142 4.748 21.059 -5.104 1.00 0.00 C ATOM 1737 C HIS A 142 5.357 20.374 -3.885 1.00 0.00 C ATOM 1738 O HIS A 142 5.872 21.033 -2.982 1.00 0.00 O ATOM 1739 CB HIS A 142 4.432 22.520 -4.778 1.00 0.00 C ATOM 1740 CG HIS A 142 3.046 22.730 -4.252 1.00 0.00 C ATOM 1741 ND1 HIS A 142 1.995 23.140 -5.044 1.00 0.00 N ATOM 1742 CD2 HIS A 142 2.540 22.582 -3.005 1.00 0.00 C ATOM 1743 CE1 HIS A 142 0.903 23.238 -4.307 1.00 0.00 C ATOM 1744 NE2 HIS A 142 1.207 22.904 -3.066 1.00 0.00 N ATOM 0 H HIS A 142 2.751 20.453 -4.904 1.00 0.00 H new ATOM 0 HA HIS A 142 5.473 21.024 -5.917 1.00 0.00 H new ATOM 0 HB2 HIS A 142 5.150 22.883 -4.042 1.00 0.00 H new ATOM 0 HB3 HIS A 142 4.565 23.121 -5.677 1.00 0.00 H new ATOM 0 HD1 HIS A 142 2.052 23.337 -6.043 1.00 0.00 H new ATOM 0 HD2 HIS A 142 3.084 22.269 -2.126 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -0.072 23.540 -4.659 1.00 0.00 H new ATOM 1752 N PHE A 143 5.293 19.047 -3.865 1.00 0.00 N ATOM 1753 CA PHE A 143 5.836 18.272 -2.756 1.00 0.00 C ATOM 1754 C PHE A 143 7.254 18.725 -2.418 1.00 0.00 C ATOM 1755 O PHE A 143 8.127 18.768 -3.285 1.00 0.00 O ATOM 1756 CB PHE A 143 5.833 16.780 -3.098 1.00 0.00 C ATOM 1757 CG PHE A 143 6.620 15.942 -2.131 1.00 0.00 C ATOM 1758 CD1 PHE A 143 8.004 15.917 -2.182 1.00 0.00 C ATOM 1759 CD2 PHE A 143 5.974 15.178 -1.172 1.00 0.00 C ATOM 1760 CE1 PHE A 143 8.731 15.147 -1.293 1.00 0.00 C ATOM 1761 CE2 PHE A 143 6.696 14.407 -0.280 1.00 0.00 C ATOM 1762 CZ PHE A 143 8.076 14.390 -0.342 1.00 0.00 C ATOM 0 H PHE A 143 4.870 18.486 -4.604 1.00 0.00 H new ATOM 0 HA PHE A 143 5.203 18.439 -1.885 1.00 0.00 H new ATOM 0 HB2 PHE A 143 4.803 16.423 -3.122 1.00 0.00 H new ATOM 0 HB3 PHE A 143 6.241 16.644 -4.100 1.00 0.00 H new ATOM 0 HD1 PHE A 143 8.521 16.506 -2.925 1.00 0.00 H new ATOM 0 HD2 PHE A 143 4.895 15.185 -1.121 1.00 0.00 H new ATOM 0 HE1 PHE A 143 9.810 15.138 -1.342 1.00 0.00 H new ATOM 0 HE2 PHE A 143 6.181 13.818 0.465 1.00 0.00 H new ATOM 0 HZ PHE A 143 8.641 13.786 0.352 1.00 0.00 H new ATOM 1772 N VAL A 144 7.474 19.063 -1.152 1.00 0.00 N ATOM 1773 CA VAL A 144 8.785 19.513 -0.698 1.00 0.00 C ATOM 1774 C VAL A 144 9.575 18.367 -0.076 1.00 0.00 C ATOM 1775 O VAL A 144 9.022 17.542 0.652 1.00 0.00 O ATOM 1776 CB VAL A 144 8.662 20.654 0.329 1.00 0.00 C ATOM 1777 CG1 VAL A 144 10.029 21.021 0.886 1.00 0.00 C ATOM 1778 CG2 VAL A 144 7.990 21.866 -0.299 1.00 0.00 C ATOM 0 H VAL A 144 6.762 19.034 -0.422 1.00 0.00 H new ATOM 0 HA VAL A 144 9.315 19.880 -1.577 1.00 0.00 H new ATOM 0 HB VAL A 144 8.040 20.310 1.155 1.00 0.00 H new ATOM 0 HG11 VAL A 144 9.922 21.829 1.610 1.00 0.00 H new ATOM 0 HG12 VAL A 144 10.468 20.151 1.375 1.00 0.00 H new ATOM 0 HG13 VAL A 144 10.678 21.346 0.073 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.911 22.663 0.441 1.00 0.00 H new ATOM 0 HG22 VAL A 144 8.583 22.214 -1.145 1.00 0.00 H new ATOM 0 HG23 VAL A 144 6.993 21.591 -0.644 1.00 0.00 H new ATOM 1788 N SER A 145 10.871 18.322 -0.368 1.00 0.00 N ATOM 1789 CA SER A 145 11.737 17.275 0.160 1.00 0.00 C ATOM 1790 C SER A 145 12.747 17.851 1.147 1.00 0.00 C ATOM 1791 O SER A 145 13.183 18.995 1.011 1.00 0.00 O ATOM 1792 CB SER A 145 12.469 16.566 -0.981 1.00 0.00 C ATOM 1793 OG SER A 145 13.491 15.719 -0.483 1.00 0.00 O ATOM 0 H SER A 145 11.344 18.998 -0.967 1.00 0.00 H new ATOM 0 HA SER A 145 11.113 16.553 0.686 1.00 0.00 H new ATOM 0 HB2 SER A 145 11.759 15.980 -1.564 1.00 0.00 H new ATOM 0 HB3 SER A 145 12.901 17.306 -1.655 1.00 0.00 H new ATOM 0 HG SER A 145 14.044 15.401 -1.227 1.00 0.00 H new ATOM 1799 N HIS A 146 13.116 17.051 2.142 1.00 0.00 N ATOM 1800 CA HIS A 146 14.076 17.480 3.153 1.00 0.00 C ATOM 1801 C HIS A 146 15.222 16.480 3.275 1.00 0.00 C ATOM 1802 O HIS A 146 15.058 15.281 3.044 1.00 0.00 O ATOM 1803 CB HIS A 146 13.384 17.648 4.506 1.00 0.00 C ATOM 1804 CG HIS A 146 12.079 18.378 4.424 1.00 0.00 C ATOM 1805 ND1 HIS A 146 11.989 19.751 4.325 1.00 0.00 N ATOM 1806 CD2 HIS A 146 10.805 17.919 4.426 1.00 0.00 C ATOM 1807 CE1 HIS A 146 10.718 20.104 4.271 1.00 0.00 C ATOM 1808 NE2 HIS A 146 9.979 19.011 4.330 1.00 0.00 N ATOM 0 H HIS A 146 12.765 16.102 2.270 1.00 0.00 H new ATOM 0 HA HIS A 146 14.487 18.440 2.842 1.00 0.00 H new ATOM 0 HB2 HIS A 146 13.214 16.664 4.943 1.00 0.00 H new ATOM 0 HB3 HIS A 146 14.050 18.185 5.181 1.00 0.00 H new ATOM 0 HD1 HIS A 146 12.781 20.393 4.298 1.00 0.00 H new ATOM 0 HD2 HIS A 146 10.496 16.886 4.491 1.00 0.00 H new ATOM 0 HE1 HIS A 146 10.346 21.115 4.192 1.00 0.00 H new ATOM 1816 N PRO A 147 16.409 16.981 3.644 1.00 0.00 N ATOM 1817 CA PRO A 147 17.605 16.148 3.805 1.00 0.00 C ATOM 1818 C PRO A 147 17.509 15.222 5.013 1.00 0.00 C ATOM 1819 O PRO A 147 17.549 15.673 6.157 1.00 0.00 O ATOM 1820 CB PRO A 147 18.726 17.171 4.002 1.00 0.00 C ATOM 1821 CG PRO A 147 18.047 18.376 4.555 1.00 0.00 C ATOM 1822 CD PRO A 147 16.677 18.399 3.935 1.00 0.00 C ATOM 0 HA PRO A 147 17.759 15.486 2.952 1.00 0.00 H new ATOM 0 HB2 PRO A 147 19.487 16.797 4.686 1.00 0.00 H new ATOM 0 HB3 PRO A 147 19.227 17.396 3.060 1.00 0.00 H new ATOM 0 HG2 PRO A 147 17.983 18.324 5.642 1.00 0.00 H new ATOM 0 HG3 PRO A 147 18.601 19.283 4.312 1.00 0.00 H new ATOM 0 HD2 PRO A 147 15.935 18.816 4.616 1.00 0.00 H new ATOM 0 HD3 PRO A 147 16.656 19.006 3.030 1.00 0.00 H new ATOM 1830 N GLY A 148 17.382 13.925 4.751 1.00 0.00 N ATOM 1831 CA GLY A 148 17.283 12.957 5.827 1.00 0.00 C ATOM 1832 C GLY A 148 15.914 12.309 5.900 1.00 0.00 C ATOM 1833 O GLY A 148 15.796 11.122 6.204 1.00 0.00 O ATOM 0 H GLY A 148 17.346 13.527 3.812 1.00 0.00 H new ATOM 0 HA2 GLY A 148 18.040 12.185 5.688 1.00 0.00 H new ATOM 0 HA3 GLY A 148 17.500 13.449 6.775 1.00 0.00 H new ATOM 1837 N LYS A 149 14.876 13.091 5.622 1.00 0.00 N ATOM 1838 CA LYS A 149 13.508 12.587 5.658 1.00 0.00 C ATOM 1839 C LYS A 149 13.194 11.776 4.405 1.00 0.00 C ATOM 1840 O LYS A 149 14.069 11.541 3.571 1.00 0.00 O ATOM 1841 CB LYS A 149 12.519 13.748 5.788 1.00 0.00 C ATOM 1842 CG LYS A 149 12.652 14.517 7.091 1.00 0.00 C ATOM 1843 CD LYS A 149 12.119 13.717 8.268 1.00 0.00 C ATOM 1844 CE LYS A 149 10.598 13.694 8.283 1.00 0.00 C ATOM 1845 NZ LYS A 149 10.069 12.644 9.196 1.00 0.00 N ATOM 0 H LYS A 149 14.956 14.076 5.369 1.00 0.00 H new ATOM 0 HA LYS A 149 13.410 11.935 6.526 1.00 0.00 H new ATOM 0 HB2 LYS A 149 12.666 14.434 4.954 1.00 0.00 H new ATOM 0 HB3 LYS A 149 11.504 13.360 5.707 1.00 0.00 H new ATOM 0 HG2 LYS A 149 13.699 14.765 7.263 1.00 0.00 H new ATOM 0 HG3 LYS A 149 12.110 15.460 7.015 1.00 0.00 H new ATOM 0 HD2 LYS A 149 12.499 12.697 8.218 1.00 0.00 H new ATOM 0 HD3 LYS A 149 12.487 14.148 9.199 1.00 0.00 H new ATOM 0 HE2 LYS A 149 10.223 14.669 8.595 1.00 0.00 H new ATOM 0 HE3 LYS A 149 10.227 13.518 7.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 9.029 12.649 9.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 10.420 11.713 8.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 10.388 12.836 10.167 1.00 0.00 H new ATOM 1859 N TYR A 150 11.941 11.353 4.278 1.00 0.00 N ATOM 1860 CA TYR A 150 11.513 10.567 3.127 1.00 0.00 C ATOM 1861 C TYR A 150 11.348 11.451 1.895 1.00 0.00 C ATOM 1862 O TYR A 150 11.226 12.672 2.003 1.00 0.00 O ATOM 1863 CB TYR A 150 10.196 9.851 3.434 1.00 0.00 C ATOM 1864 CG TYR A 150 10.381 8.482 4.049 1.00 0.00 C ATOM 1865 CD1 TYR A 150 10.735 7.389 3.267 1.00 0.00 C ATOM 1866 CD2 TYR A 150 10.203 8.281 5.412 1.00 0.00 C ATOM 1867 CE1 TYR A 150 10.903 6.137 3.825 1.00 0.00 C ATOM 1868 CE2 TYR A 150 10.371 7.033 5.979 1.00 0.00 C ATOM 1869 CZ TYR A 150 10.721 5.963 5.181 1.00 0.00 C ATOM 1870 OH TYR A 150 10.889 4.718 5.741 1.00 0.00 O ATOM 0 H TYR A 150 11.204 11.541 4.958 1.00 0.00 H new ATOM 0 HA TYR A 150 12.283 9.825 2.919 1.00 0.00 H new ATOM 0 HB2 TYR A 150 9.606 10.468 4.112 1.00 0.00 H new ATOM 0 HB3 TYR A 150 9.623 9.752 2.512 1.00 0.00 H new ATOM 0 HD1 TYR A 150 10.881 7.521 2.205 1.00 0.00 H new ATOM 0 HD2 TYR A 150 9.928 9.116 6.040 1.00 0.00 H new ATOM 0 HE1 TYR A 150 11.176 5.298 3.202 1.00 0.00 H new ATOM 0 HE2 TYR A 150 10.229 6.895 7.041 1.00 0.00 H new ATOM 0 HH TYR A 150 10.724 4.768 6.706 1.00 0.00 H new ATOM 1880 N THR A 151 11.346 10.825 0.722 1.00 0.00 N ATOM 1881 CA THR A 151 11.197 11.553 -0.532 1.00 0.00 C ATOM 1882 C THR A 151 10.009 11.033 -1.332 1.00 0.00 C ATOM 1883 O THR A 151 9.569 9.898 -1.143 1.00 0.00 O ATOM 1884 CB THR A 151 12.468 11.450 -1.396 1.00 0.00 C ATOM 1885 OG1 THR A 151 12.938 10.097 -1.416 1.00 0.00 O ATOM 1886 CG2 THR A 151 13.561 12.363 -0.862 1.00 0.00 C ATOM 0 H THR A 151 11.446 9.816 0.614 1.00 0.00 H new ATOM 0 HA THR A 151 11.027 12.598 -0.272 1.00 0.00 H new ATOM 0 HB THR A 151 12.218 11.763 -2.410 1.00 0.00 H new ATOM 0 HG1 THR A 151 13.745 10.039 -1.969 1.00 0.00 H new ATOM 0 HG21 THR A 151 14.449 12.273 -1.488 1.00 0.00 H new ATOM 0 HG22 THR A 151 13.211 13.395 -0.875 1.00 0.00 H new ATOM 0 HG23 THR A 151 13.808 12.076 0.160 1.00 0.00 H new ATOM 1894 N LEU A 152 9.493 11.868 -2.228 1.00 0.00 N ATOM 1895 CA LEU A 152 8.355 11.491 -3.058 1.00 0.00 C ATOM 1896 C LEU A 152 8.817 11.011 -4.431 1.00 0.00 C ATOM 1897 O LEU A 152 9.266 11.806 -5.257 1.00 0.00 O ATOM 1898 CB LEU A 152 7.398 12.675 -3.215 1.00 0.00 C ATOM 1899 CG LEU A 152 5.913 12.328 -3.320 1.00 0.00 C ATOM 1900 CD1 LEU A 152 5.675 11.333 -4.446 1.00 0.00 C ATOM 1901 CD2 LEU A 152 5.400 11.773 -1.999 1.00 0.00 C ATOM 0 H LEU A 152 9.845 12.810 -2.398 1.00 0.00 H new ATOM 0 HA LEU A 152 7.832 10.672 -2.564 1.00 0.00 H new ATOM 0 HB2 LEU A 152 7.535 13.343 -2.364 1.00 0.00 H new ATOM 0 HB3 LEU A 152 7.684 13.232 -4.107 1.00 0.00 H new ATOM 0 HG LEU A 152 5.362 13.241 -3.547 1.00 0.00 H new ATOM 0 HD11 LEU A 152 4.612 11.098 -4.505 1.00 0.00 H new ATOM 0 HD12 LEU A 152 6.004 11.767 -5.390 1.00 0.00 H new ATOM 0 HD13 LEU A 152 6.238 10.420 -4.250 1.00 0.00 H new ATOM 0 HD21 LEU A 152 4.341 11.532 -2.092 1.00 0.00 H new ATOM 0 HD22 LEU A 152 5.956 10.872 -1.742 1.00 0.00 H new ATOM 0 HD23 LEU A 152 5.534 12.518 -1.215 1.00 0.00 H new ATOM 1913 N ILE A 153 8.702 9.709 -4.666 1.00 0.00 N ATOM 1914 CA ILE A 153 9.105 9.125 -5.939 1.00 0.00 C ATOM 1915 C ILE A 153 7.912 8.516 -6.667 1.00 0.00 C ATOM 1916 O ILE A 153 6.817 8.420 -6.113 1.00 0.00 O ATOM 1917 CB ILE A 153 10.182 8.041 -5.746 1.00 0.00 C ATOM 1918 CG1 ILE A 153 9.938 7.276 -4.443 1.00 0.00 C ATOM 1919 CG2 ILE A 153 11.569 8.666 -5.747 1.00 0.00 C ATOM 1920 CD1 ILE A 153 10.425 8.008 -3.212 1.00 0.00 C ATOM 0 H ILE A 153 8.333 9.038 -3.992 1.00 0.00 H new ATOM 0 HA ILE A 153 9.520 9.935 -6.540 1.00 0.00 H new ATOM 0 HB ILE A 153 10.121 7.337 -6.576 1.00 0.00 H new ATOM 0 HG12 ILE A 153 8.871 7.080 -4.341 1.00 0.00 H new ATOM 0 HG13 ILE A 153 10.436 6.308 -4.501 1.00 0.00 H new ATOM 0 HG21 ILE A 153 12.319 7.887 -5.610 1.00 0.00 H new ATOM 0 HG22 ILE A 153 11.740 9.171 -6.698 1.00 0.00 H new ATOM 0 HG23 ILE A 153 11.643 9.389 -4.934 1.00 0.00 H new ATOM 0 HD11 ILE A 153 10.219 7.407 -2.326 1.00 0.00 H new ATOM 0 HD12 ILE A 153 11.498 8.181 -3.292 1.00 0.00 H new ATOM 0 HD13 ILE A 153 9.909 8.965 -3.129 1.00 0.00 H new ATOM 1932 N GLU A 154 8.132 8.103 -7.912 1.00 0.00 N ATOM 1933 CA GLU A 154 7.074 7.502 -8.715 1.00 0.00 C ATOM 1934 C GLU A 154 7.441 6.077 -9.120 1.00 0.00 C ATOM 1935 O GLU A 154 6.827 5.496 -10.015 1.00 0.00 O ATOM 1936 CB GLU A 154 6.808 8.346 -9.963 1.00 0.00 C ATOM 1937 CG GLU A 154 8.051 8.607 -10.797 1.00 0.00 C ATOM 1938 CD GLU A 154 7.775 9.497 -11.994 1.00 0.00 C ATOM 1939 OE1 GLU A 154 7.648 10.724 -11.804 1.00 0.00 O ATOM 1940 OE2 GLU A 154 7.686 8.964 -13.120 1.00 0.00 O ATOM 0 H GLU A 154 9.033 8.174 -8.385 1.00 0.00 H new ATOM 0 HA GLU A 154 6.169 7.467 -8.109 1.00 0.00 H new ATOM 0 HB2 GLU A 154 6.065 7.842 -10.581 1.00 0.00 H new ATOM 0 HB3 GLU A 154 6.376 9.300 -9.661 1.00 0.00 H new ATOM 0 HG2 GLU A 154 8.813 9.072 -10.171 1.00 0.00 H new ATOM 0 HG3 GLU A 154 8.459 7.657 -11.142 1.00 0.00 H new ATOM 1947 N VAL A 155 8.448 5.520 -8.455 1.00 0.00 N ATOM 1948 CA VAL A 155 8.898 4.164 -8.744 1.00 0.00 C ATOM 1949 C VAL A 155 9.139 3.972 -10.237 1.00 0.00 C ATOM 1950 O VAL A 155 8.836 4.851 -11.042 1.00 0.00 O ATOM 1951 CB VAL A 155 7.874 3.119 -8.262 1.00 0.00 C ATOM 1952 CG1 VAL A 155 6.671 3.080 -9.191 1.00 0.00 C ATOM 1953 CG2 VAL A 155 8.523 1.746 -8.159 1.00 0.00 C ATOM 0 H VAL A 155 8.968 5.987 -7.712 1.00 0.00 H new ATOM 0 HA VAL A 155 9.835 4.019 -8.206 1.00 0.00 H new ATOM 0 HB VAL A 155 7.527 3.408 -7.270 1.00 0.00 H new ATOM 0 HG11 VAL A 155 5.959 2.336 -8.834 1.00 0.00 H new ATOM 0 HG12 VAL A 155 6.193 4.060 -9.209 1.00 0.00 H new ATOM 0 HG13 VAL A 155 6.997 2.817 -10.197 1.00 0.00 H new ATOM 0 HG21 VAL A 155 7.786 1.020 -7.817 1.00 0.00 H new ATOM 0 HG22 VAL A 155 8.900 1.447 -9.137 1.00 0.00 H new ATOM 0 HG23 VAL A 155 9.349 1.786 -7.449 1.00 0.00 H new ATOM 1963 N GLN A 156 9.687 2.815 -10.598 1.00 0.00 N ATOM 1964 CA GLN A 156 9.969 2.508 -11.995 1.00 0.00 C ATOM 1965 C GLN A 156 9.304 1.200 -12.410 1.00 0.00 C ATOM 1966 O GLN A 156 9.392 0.196 -11.703 1.00 0.00 O ATOM 1967 CB GLN A 156 11.479 2.421 -12.224 1.00 0.00 C ATOM 1968 CG GLN A 156 12.198 1.541 -11.215 1.00 0.00 C ATOM 1969 CD GLN A 156 13.650 1.301 -11.580 1.00 0.00 C ATOM 1970 OE1 GLN A 156 13.958 0.827 -12.674 1.00 0.00 O ATOM 1971 NE2 GLN A 156 14.553 1.629 -10.663 1.00 0.00 N ATOM 0 H GLN A 156 9.944 2.076 -9.943 1.00 0.00 H new ATOM 0 HA GLN A 156 9.561 3.312 -12.607 1.00 0.00 H new ATOM 0 HB2 GLN A 156 11.664 2.036 -13.227 1.00 0.00 H new ATOM 0 HB3 GLN A 156 11.902 3.425 -12.185 1.00 0.00 H new ATOM 0 HG2 GLN A 156 12.147 2.007 -10.231 1.00 0.00 H new ATOM 0 HG3 GLN A 156 11.683 0.583 -11.142 1.00 0.00 H new ATOM 0 HE21 GLN A 156 14.254 2.019 -9.769 1.00 0.00 H new ATOM 0 HE22 GLN A 156 15.546 1.491 -10.852 1.00 0.00 H new