USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1052 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 40 HIS : no HE2:sc= 1.53 K(o=1.8,f=-9!) USER MOD Set 1.2: A 179 HIS : no HE2:sc= 0.249 K(o=1.8,f=-6.4!) USER MOD Set 2.1: A 130 ASN :FLIP amide:sc= -0.175 F(o=-2.3!,f=-0.17) USER MOD Set 2.2: A 133 ASN : amide:sc= 0 X(o=-0.17,f=-0.17) USER MOD Set 3.1: A 88 ASN : amide:sc= 0.0426 X(o=0.11,f=0.28) USER MOD Set 3.2: A 142 TYR OH : rot 180:sc= 0.0682 USER MOD Set 4.1: A 85 ASN : amide:sc= 0.335 K(o=0.34,f=-1.8!) USER MOD Set 4.2: A 86 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 41 LYS NZ :NH3+ 178:sc= 2.39 (180deg=1.16) USER MOD Set 5.2: A 184 ASN : amide:sc= 0.665 K(o=3.1,f=-8.3!) USER MOD Set 6.1: A 36 SER OG : rot 7:sc= -0.0607 USER MOD Set 6.2: A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 112:sc= 1.25 USER MOD Single : A 33 THR OG1 : rot 147:sc= 0.878 USER MOD Single : A 34 THR OG1 : rot 171:sc= 1.24 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 176:sc= -0.211 (180deg=-0.306) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.754 K(o=0.75,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= -0.0377 K(o=-0.038,f=-2!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0.0876 USER MOD Single : A 64 ASN : amide:sc= 0.168 X(o=0.17,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= 0.193 K(o=0.19,f=-2.2!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -161:sc= 0.444 USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 94 ASN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.338 X(o=-0.34,f=-0.18) USER MOD Single : A 105 GLN :FLIP amide:sc= -0.0089 F(o=-0.71,f=-0.0089) USER MOD Single : A 106 THR OG1 : rot -160:sc= 0.248 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 170:sc= 0.645 USER MOD Single : A 113 MET CE :methyl -161:sc= -0.146 (180deg=-0.885) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.125 USER MOD Single : A 118 MET CE :methyl -134:sc= -0.496 (180deg=-3.2!) USER MOD Single : A 119 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00472) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.245 USER MOD Single : A 131 THR OG1 : rot 180:sc= 0.00438 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 TYR OH : rot -177:sc= 0.835 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 HIS : no HD1:sc= -0.0344 X(o=-0.034,f=-0.15) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ 176:sc= 1.08 (180deg=1.06) USER MOD Single : A 173 ASN : amide:sc= 0 K(o=0,f=-2.8!) USER MOD Single : A 181 TYR OH : rot 152:sc= 0.157 USER MOD Single : A 183 LYS NZ :NH3+ -171:sc= 0.845 (180deg=0.789) USER MOD Single : A 185 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 167 N THR A 32 0.303 -19.778 -1.475 1.00 1.61 N ATOM 168 CA THR A 32 1.060 -18.772 -2.231 1.00 1.37 C ATOM 169 C THR A 32 2.567 -19.036 -2.366 1.00 1.48 C ATOM 170 O THR A 32 3.117 -19.938 -1.731 1.00 1.72 O ATOM 171 CB THR A 32 0.852 -17.401 -1.585 1.00 1.22 C ATOM 172 OG1 THR A 32 1.291 -17.414 -0.240 1.00 1.59 O ATOM 173 CG2 THR A 32 -0.590 -16.920 -1.563 1.00 1.11 C ATOM 0 HA THR A 32 0.666 -18.819 -3.246 1.00 1.37 H new ATOM 0 HB THR A 32 1.431 -16.722 -2.211 1.00 1.22 H new ATOM 0 HG1 THR A 32 2.083 -16.844 -0.149 1.00 1.59 H new ATOM 0 HG21 THR A 32 -0.640 -15.941 -1.087 1.00 1.11 H new ATOM 0 HG22 THR A 32 -0.965 -16.846 -2.584 1.00 1.11 H new ATOM 0 HG23 THR A 32 -1.201 -17.627 -1.002 1.00 1.11 H new ATOM 181 N THR A 33 3.269 -18.229 -3.177 1.00 1.38 N ATOM 182 CA THR A 33 4.714 -18.425 -3.454 1.00 1.45 C ATOM 183 C THR A 33 5.650 -17.782 -2.423 1.00 1.43 C ATOM 184 O THR A 33 6.788 -18.228 -2.252 1.00 1.60 O ATOM 185 CB THR A 33 5.099 -17.921 -4.850 1.00 1.59 C ATOM 186 OG1 THR A 33 4.923 -16.529 -4.962 1.00 1.86 O ATOM 187 CG2 THR A 33 4.285 -18.593 -5.950 1.00 1.63 C ATOM 0 H THR A 33 2.862 -17.427 -3.659 1.00 1.38 H new ATOM 0 HA THR A 33 4.852 -19.504 -3.391 1.00 1.45 H new ATOM 0 HB THR A 33 6.151 -18.175 -4.976 1.00 1.59 H new ATOM 0 HG1 THR A 33 5.603 -16.161 -5.564 1.00 1.86 H new ATOM 0 HG21 THR A 33 4.593 -18.204 -6.920 1.00 1.63 H new ATOM 0 HG22 THR A 33 4.453 -19.670 -5.921 1.00 1.63 H new ATOM 0 HG23 THR A 33 3.226 -18.387 -5.796 1.00 1.63 H new ATOM 195 N THR A 34 5.153 -16.762 -1.723 1.00 1.31 N ATOM 196 CA THR A 34 5.756 -16.056 -0.579 1.00 1.23 C ATOM 197 C THR A 34 4.708 -15.917 0.536 1.00 0.95 C ATOM 198 O THR A 34 3.505 -15.986 0.256 1.00 0.93 O ATOM 199 CB THR A 34 6.308 -14.683 -1.013 1.00 1.39 C ATOM 200 OG1 THR A 34 6.846 -13.989 0.082 1.00 2.48 O ATOM 201 CG2 THR A 34 5.244 -13.766 -1.604 1.00 0.87 C ATOM 0 H THR A 34 4.241 -16.371 -1.957 1.00 1.31 H new ATOM 0 HA THR A 34 6.599 -16.632 -0.197 1.00 1.23 H new ATOM 0 HB THR A 34 7.061 -14.913 -1.767 1.00 1.39 H new ATOM 0 HG1 THR A 34 7.322 -13.194 -0.237 1.00 2.48 H new ATOM 0 HG21 THR A 34 5.699 -12.817 -1.889 1.00 0.87 H new ATOM 0 HG22 THR A 34 4.806 -14.237 -2.484 1.00 0.87 H new ATOM 0 HG23 THR A 34 4.465 -13.587 -0.863 1.00 0.87 H new ATOM 209 N THR A 35 5.141 -15.721 1.783 1.00 0.86 N ATOM 210 CA THR A 35 4.278 -15.551 2.974 1.00 0.66 C ATOM 211 C THR A 35 4.302 -14.130 3.552 1.00 0.63 C ATOM 212 O THR A 35 3.717 -13.890 4.610 1.00 0.61 O ATOM 213 CB THR A 35 4.595 -16.586 4.061 1.00 0.70 C ATOM 214 OG1 THR A 35 5.979 -16.703 4.278 1.00 0.93 O ATOM 215 CG2 THR A 35 4.016 -17.961 3.743 1.00 0.80 C ATOM 0 H THR A 35 6.135 -15.673 2.009 1.00 0.86 H new ATOM 0 HA THR A 35 3.262 -15.724 2.619 1.00 0.66 H new ATOM 0 HB THR A 35 4.120 -16.217 4.970 1.00 0.70 H new ATOM 0 HG1 THR A 35 6.145 -17.369 4.977 1.00 0.93 H new ATOM 0 HG21 THR A 35 4.269 -18.656 4.543 1.00 0.80 H new ATOM 0 HG22 THR A 35 2.932 -17.888 3.655 1.00 0.80 H new ATOM 0 HG23 THR A 35 4.433 -18.323 2.803 1.00 0.80 H new ATOM 223 N SER A 36 4.937 -13.184 2.853 1.00 0.68 N ATOM 224 CA SER A 36 4.863 -11.745 3.127 1.00 0.58 C ATOM 225 C SER A 36 4.723 -10.940 1.825 1.00 0.48 C ATOM 226 O SER A 36 4.979 -11.433 0.726 1.00 0.57 O ATOM 227 CB SER A 36 6.077 -11.249 3.927 1.00 0.69 C ATOM 228 OG SER A 36 6.115 -11.785 5.236 1.00 1.84 O ATOM 0 H SER A 36 5.535 -13.405 2.057 1.00 0.68 H new ATOM 0 HA SER A 36 3.973 -11.585 3.736 1.00 0.58 H new ATOM 0 HB2 SER A 36 6.992 -11.520 3.400 1.00 0.69 H new ATOM 0 HB3 SER A 36 6.052 -10.161 3.983 1.00 0.69 H new ATOM 0 HG SER A 36 5.408 -12.456 5.335 1.00 1.84 H new ATOM 234 N VAL A 37 4.309 -9.681 1.957 1.00 0.39 N ATOM 235 CA VAL A 37 4.232 -8.672 0.887 1.00 0.34 C ATOM 236 C VAL A 37 4.915 -7.384 1.351 1.00 0.32 C ATOM 237 O VAL A 37 4.764 -6.996 2.512 1.00 0.35 O ATOM 238 CB VAL A 37 2.776 -8.445 0.435 1.00 0.33 C ATOM 239 CG1 VAL A 37 1.896 -7.959 1.571 1.00 0.32 C ATOM 240 CG2 VAL A 37 2.648 -7.475 -0.745 1.00 0.34 C ATOM 0 H VAL A 37 4.001 -9.312 2.857 1.00 0.39 H new ATOM 0 HA VAL A 37 4.764 -9.035 0.008 1.00 0.34 H new ATOM 0 HB VAL A 37 2.434 -9.426 0.104 1.00 0.33 H new ATOM 0 HG11 VAL A 37 0.879 -7.813 1.207 1.00 0.32 H new ATOM 0 HG12 VAL A 37 1.892 -8.700 2.370 1.00 0.32 H new ATOM 0 HG13 VAL A 37 2.284 -7.015 1.953 1.00 0.32 H new ATOM 0 HG21 VAL A 37 1.597 -7.362 -1.011 1.00 0.34 H new ATOM 0 HG22 VAL A 37 3.058 -6.505 -0.465 1.00 0.34 H new ATOM 0 HG23 VAL A 37 3.198 -7.868 -1.600 1.00 0.34 H new ATOM 250 N THR A 38 5.654 -6.713 0.462 1.00 0.34 N ATOM 251 CA THR A 38 6.414 -5.495 0.798 1.00 0.34 C ATOM 252 C THR A 38 5.885 -4.276 0.031 1.00 0.33 C ATOM 253 O THR A 38 5.850 -4.266 -1.198 1.00 0.35 O ATOM 254 CB THR A 38 7.927 -5.688 0.590 1.00 0.45 C ATOM 255 OG1 THR A 38 8.389 -6.888 1.178 1.00 0.64 O ATOM 256 CG2 THR A 38 8.723 -4.588 1.293 1.00 0.48 C ATOM 0 H THR A 38 5.745 -6.996 -0.514 1.00 0.34 H new ATOM 0 HA THR A 38 6.263 -5.302 1.860 1.00 0.34 H new ATOM 0 HB THR A 38 8.072 -5.684 -0.490 1.00 0.45 H new ATOM 0 HG1 THR A 38 9.353 -6.978 1.024 1.00 0.64 H new ATOM 0 HG21 THR A 38 9.789 -4.749 1.130 1.00 0.48 H new ATOM 0 HG22 THR A 38 8.437 -3.617 0.889 1.00 0.48 H new ATOM 0 HG23 THR A 38 8.512 -4.613 2.362 1.00 0.48 H new ATOM 264 N VAL A 39 5.451 -3.237 0.746 1.00 0.39 N ATOM 265 CA VAL A 39 4.886 -1.997 0.178 1.00 0.42 C ATOM 266 C VAL A 39 5.929 -0.875 0.139 1.00 0.48 C ATOM 267 O VAL A 39 6.688 -0.684 1.092 1.00 0.57 O ATOM 268 CB VAL A 39 3.573 -1.602 0.887 1.00 0.47 C ATOM 269 CG1 VAL A 39 3.663 -1.579 2.407 1.00 0.58 C ATOM 270 CG2 VAL A 39 3.016 -0.251 0.428 1.00 0.49 C ATOM 0 H VAL A 39 5.481 -3.228 1.766 1.00 0.39 H new ATOM 0 HA VAL A 39 4.616 -2.185 -0.861 1.00 0.42 H new ATOM 0 HB VAL A 39 2.893 -2.400 0.589 1.00 0.47 H new ATOM 0 HG11 VAL A 39 2.698 -1.292 2.824 1.00 0.58 H new ATOM 0 HG12 VAL A 39 3.935 -2.570 2.770 1.00 0.58 H new ATOM 0 HG13 VAL A 39 4.420 -0.859 2.716 1.00 0.58 H new ATOM 0 HG21 VAL A 39 2.093 -0.036 0.967 1.00 0.49 H new ATOM 0 HG22 VAL A 39 3.746 0.532 0.632 1.00 0.49 H new ATOM 0 HG23 VAL A 39 2.812 -0.286 -0.642 1.00 0.49 H new ATOM 280 N HIS A 40 5.953 -0.140 -0.975 1.00 0.44 N ATOM 281 CA HIS A 40 6.943 0.908 -1.284 1.00 0.51 C ATOM 282 C HIS A 40 6.262 2.181 -1.836 1.00 0.77 C ATOM 283 O HIS A 40 5.712 2.154 -2.938 1.00 1.69 O ATOM 284 CB HIS A 40 7.940 0.357 -2.321 1.00 0.53 C ATOM 285 CG HIS A 40 8.519 -1.006 -2.024 1.00 0.46 C ATOM 286 ND1 HIS A 40 9.680 -1.270 -1.335 1.00 0.56 N ATOM 287 CD2 HIS A 40 8.026 -2.210 -2.457 1.00 0.45 C ATOM 288 CE1 HIS A 40 9.894 -2.593 -1.361 1.00 0.60 C ATOM 289 NE2 HIS A 40 8.921 -3.212 -2.050 1.00 0.52 N ATOM 0 H HIS A 40 5.262 -0.258 -1.716 1.00 0.44 H new ATOM 0 HA HIS A 40 7.463 1.182 -0.366 1.00 0.51 H new ATOM 0 HB2 HIS A 40 7.441 0.315 -3.289 1.00 0.53 H new ATOM 0 HB3 HIS A 40 8.762 1.066 -2.417 1.00 0.53 H new ATOM 0 HD1 HIS A 40 10.276 -0.577 -0.882 1.00 0.56 H new ATOM 0 HD2 HIS A 40 7.112 -2.361 -3.012 1.00 0.45 H new ATOM 0 HE1 HIS A 40 10.731 -3.091 -0.894 1.00 0.60 H new ATOM 297 N LYS A 41 6.271 3.308 -1.105 1.00 0.38 N ATOM 298 CA LYS A 41 5.478 4.502 -1.477 1.00 0.42 C ATOM 299 C LYS A 41 6.242 5.444 -2.411 1.00 0.46 C ATOM 300 O LYS A 41 7.350 5.891 -2.102 1.00 0.53 O ATOM 301 CB LYS A 41 4.911 5.207 -0.229 1.00 0.59 C ATOM 302 CG LYS A 41 3.706 6.121 -0.563 1.00 0.92 C ATOM 303 CD LYS A 41 4.096 7.572 -0.890 1.00 0.81 C ATOM 304 CE LYS A 41 3.096 8.258 -1.836 1.00 0.69 C ATOM 305 NZ LYS A 41 1.907 8.781 -1.128 1.00 1.02 N ATOM 0 H LYS A 41 6.818 3.422 -0.251 1.00 0.38 H new ATOM 0 HA LYS A 41 4.621 4.159 -2.057 1.00 0.42 H new ATOM 0 HB2 LYS A 41 4.604 4.457 0.500 1.00 0.59 H new ATOM 0 HB3 LYS A 41 5.696 5.802 0.237 1.00 0.59 H new ATOM 0 HG2 LYS A 41 3.167 5.700 -1.412 1.00 0.92 H new ATOM 0 HG3 LYS A 41 3.018 6.122 0.282 1.00 0.92 H new ATOM 0 HD2 LYS A 41 4.164 8.143 0.036 1.00 0.81 H new ATOM 0 HD3 LYS A 41 5.086 7.584 -1.345 1.00 0.81 H new ATOM 0 HE2 LYS A 41 3.595 9.077 -2.354 1.00 0.69 H new ATOM 0 HE3 LYS A 41 2.777 7.547 -2.598 1.00 0.69 H new ATOM 0 HZ1 LYS A 41 1.283 9.262 -1.806 1.00 1.02 H new ATOM 0 HZ2 LYS A 41 1.393 7.993 -0.683 1.00 1.02 H new ATOM 0 HZ3 LYS A 41 2.208 9.455 -0.396 1.00 1.02 H new ATOM 319 N LEU A 42 5.615 5.777 -3.541 1.00 0.47 N ATOM 320 CA LEU A 42 6.220 6.515 -4.653 1.00 0.46 C ATOM 321 C LEU A 42 5.557 7.881 -4.894 1.00 0.47 C ATOM 322 O LEU A 42 4.359 8.042 -4.665 1.00 0.53 O ATOM 323 CB LEU A 42 6.139 5.655 -5.931 1.00 0.46 C ATOM 324 CG LEU A 42 6.765 4.252 -5.877 1.00 0.51 C ATOM 325 CD1 LEU A 42 6.861 3.722 -7.305 1.00 0.57 C ATOM 326 CD2 LEU A 42 8.171 4.214 -5.299 1.00 0.52 C ATOM 0 H LEU A 42 4.640 5.533 -3.713 1.00 0.47 H new ATOM 0 HA LEU A 42 7.259 6.715 -4.391 1.00 0.46 H new ATOM 0 HB2 LEU A 42 5.088 5.545 -6.198 1.00 0.46 H new ATOM 0 HB3 LEU A 42 6.617 6.207 -6.740 1.00 0.46 H new ATOM 0 HG LEU A 42 6.125 3.656 -5.226 1.00 0.51 H new ATOM 0 HD11 LEU A 42 7.303 2.726 -7.294 1.00 0.57 H new ATOM 0 HD12 LEU A 42 5.864 3.672 -7.742 1.00 0.57 H new ATOM 0 HD13 LEU A 42 7.485 4.389 -7.900 1.00 0.57 H new ATOM 0 HD21 LEU A 42 8.536 3.187 -5.298 1.00 0.52 H new ATOM 0 HD22 LEU A 42 8.831 4.833 -5.906 1.00 0.52 H new ATOM 0 HD23 LEU A 42 8.155 4.594 -4.278 1.00 0.52 H new ATOM 338 N LEU A 43 6.333 8.839 -5.410 1.00 0.47 N ATOM 339 CA LEU A 43 5.894 10.141 -5.941 1.00 0.51 C ATOM 340 C LEU A 43 6.712 10.503 -7.203 1.00 0.44 C ATOM 341 O LEU A 43 7.599 9.760 -7.626 1.00 0.48 O ATOM 342 CB LEU A 43 5.990 11.255 -4.865 1.00 0.75 C ATOM 343 CG LEU A 43 4.910 11.264 -3.764 1.00 0.86 C ATOM 344 CD1 LEU A 43 4.984 12.584 -2.985 1.00 1.46 C ATOM 345 CD2 LEU A 43 3.475 11.191 -4.286 1.00 1.22 C ATOM 0 H LEU A 43 7.344 8.723 -5.474 1.00 0.47 H new ATOM 0 HA LEU A 43 4.844 10.061 -6.222 1.00 0.51 H new ATOM 0 HB2 LEU A 43 6.964 11.176 -4.382 1.00 0.75 H new ATOM 0 HB3 LEU A 43 5.963 12.219 -5.373 1.00 0.75 H new ATOM 0 HG LEU A 43 5.119 10.379 -3.163 1.00 0.86 H new ATOM 0 HD11 LEU A 43 4.221 12.591 -2.207 1.00 1.46 H new ATOM 0 HD12 LEU A 43 5.969 12.682 -2.528 1.00 1.46 H new ATOM 0 HD13 LEU A 43 4.815 13.418 -3.666 1.00 1.46 H new ATOM 0 HD21 LEU A 43 2.781 11.202 -3.446 1.00 1.22 H new ATOM 0 HD22 LEU A 43 3.278 12.048 -4.931 1.00 1.22 H new ATOM 0 HD23 LEU A 43 3.341 10.271 -4.855 1.00 1.22 H new ATOM 357 N ALA A 44 6.415 11.649 -7.815 1.00 0.49 N ATOM 358 CA ALA A 44 7.123 12.185 -8.980 1.00 0.53 C ATOM 359 C ALA A 44 7.875 13.500 -8.661 1.00 0.61 C ATOM 360 O ALA A 44 7.553 14.168 -7.675 1.00 0.73 O ATOM 361 CB ALA A 44 6.085 12.354 -10.087 1.00 0.66 C ATOM 0 H ALA A 44 5.651 12.250 -7.505 1.00 0.49 H new ATOM 0 HA ALA A 44 7.906 11.498 -9.300 1.00 0.53 H new ATOM 0 HB1 ALA A 44 6.567 12.753 -10.980 1.00 0.66 H new ATOM 0 HB2 ALA A 44 5.638 11.387 -10.317 1.00 0.66 H new ATOM 0 HB3 ALA A 44 5.308 13.043 -9.755 1.00 0.66 H new ATOM 367 N THR A 45 8.858 13.892 -9.485 1.00 0.67 N ATOM 368 CA THR A 45 9.672 15.114 -9.269 1.00 0.75 C ATOM 369 C THR A 45 9.099 16.390 -9.898 1.00 0.86 C ATOM 370 O THR A 45 9.422 17.479 -9.426 1.00 1.05 O ATOM 371 CB THR A 45 11.136 14.921 -9.694 1.00 0.77 C ATOM 372 OG1 THR A 45 11.232 14.459 -11.021 1.00 0.89 O ATOM 373 CG2 THR A 45 11.839 13.901 -8.799 1.00 0.77 C ATOM 0 H THR A 45 9.117 13.374 -10.325 1.00 0.67 H new ATOM 0 HA THR A 45 9.632 15.266 -8.190 1.00 0.75 H new ATOM 0 HB THR A 45 11.613 15.897 -9.604 1.00 0.77 H new ATOM 0 HG1 THR A 45 12.176 14.348 -11.261 1.00 0.89 H new ATOM 0 HG21 THR A 45 12.873 13.785 -9.123 1.00 0.77 H new ATOM 0 HG22 THR A 45 11.819 14.248 -7.766 1.00 0.77 H new ATOM 0 HG23 THR A 45 11.327 12.941 -8.869 1.00 0.77 H new ATOM 381 N ASP A 46 8.223 16.282 -10.902 1.00 0.82 N ATOM 382 CA ASP A 46 7.407 17.385 -11.444 1.00 0.90 C ATOM 383 C ASP A 46 5.913 16.989 -11.519 1.00 0.84 C ATOM 384 O ASP A 46 5.158 17.442 -12.379 1.00 1.10 O ATOM 385 CB ASP A 46 7.987 17.887 -12.781 1.00 1.07 C ATOM 386 CG ASP A 46 7.209 19.091 -13.318 1.00 1.33 C ATOM 387 OD1 ASP A 46 7.095 20.106 -12.587 1.00 1.81 O ATOM 388 OD2 ASP A 46 6.623 18.996 -14.426 1.00 2.45 O ATOM 0 H ASP A 46 8.053 15.397 -11.379 1.00 0.82 H new ATOM 0 HA ASP A 46 7.452 18.232 -10.759 1.00 0.90 H new ATOM 0 HB2 ASP A 46 9.033 18.161 -12.644 1.00 1.07 H new ATOM 0 HB3 ASP A 46 7.962 17.081 -13.514 1.00 1.07 H new ATOM 393 N GLY A 47 5.469 16.094 -10.631 1.00 0.83 N ATOM 394 CA GLY A 47 4.090 15.594 -10.621 1.00 0.90 C ATOM 395 C GLY A 47 3.761 14.587 -11.736 1.00 0.74 C ATOM 396 O GLY A 47 2.584 14.313 -11.952 1.00 0.89 O ATOM 0 H GLY A 47 6.056 15.695 -9.898 1.00 0.83 H new ATOM 0 HA2 GLY A 47 3.896 15.124 -9.657 1.00 0.90 H new ATOM 0 HA3 GLY A 47 3.410 16.442 -10.704 1.00 0.90 H new ATOM 400 N ASP A 48 4.776 14.018 -12.402 1.00 0.59 N ATOM 401 CA ASP A 48 4.749 13.074 -13.541 1.00 0.57 C ATOM 402 C ASP A 48 4.062 11.701 -13.305 1.00 0.55 C ATOM 403 O ASP A 48 4.431 10.692 -13.914 1.00 0.56 O ATOM 404 CB ASP A 48 6.201 12.839 -14.013 1.00 0.64 C ATOM 405 CG ASP A 48 7.024 14.123 -14.175 1.00 0.81 C ATOM 406 OD1 ASP A 48 7.668 14.517 -13.174 1.00 1.49 O ATOM 407 OD2 ASP A 48 7.051 14.695 -15.296 1.00 1.98 O ATOM 0 H ASP A 48 5.738 14.226 -12.132 1.00 0.59 H new ATOM 0 HA ASP A 48 4.122 13.558 -14.290 1.00 0.57 H new ATOM 0 HB2 ASP A 48 6.703 12.187 -13.298 1.00 0.64 H new ATOM 0 HB3 ASP A 48 6.181 12.311 -14.966 1.00 0.64 H new ATOM 412 N MET A 49 3.079 11.618 -12.409 1.00 0.57 N ATOM 413 CA MET A 49 2.454 10.363 -11.976 1.00 0.57 C ATOM 414 C MET A 49 1.638 9.668 -13.082 1.00 0.59 C ATOM 415 O MET A 49 1.376 8.471 -12.977 1.00 0.64 O ATOM 416 CB MET A 49 1.577 10.617 -10.735 1.00 0.56 C ATOM 417 CG MET A 49 2.311 11.216 -9.523 1.00 0.57 C ATOM 418 SD MET A 49 2.874 10.053 -8.237 1.00 0.54 S ATOM 419 CE MET A 49 3.782 8.812 -9.197 1.00 0.60 C ATOM 0 H MET A 49 2.684 12.440 -11.952 1.00 0.57 H new ATOM 0 HA MET A 49 3.264 9.678 -11.726 1.00 0.57 H new ATOM 0 HB2 MET A 49 0.765 11.288 -11.015 1.00 0.56 H new ATOM 0 HB3 MET A 49 1.121 9.674 -10.433 1.00 0.56 H new ATOM 0 HG2 MET A 49 3.180 11.762 -9.890 1.00 0.57 H new ATOM 0 HG3 MET A 49 1.651 11.946 -9.054 1.00 0.57 H new ATOM 0 HE1 MET A 49 4.234 8.088 -8.520 1.00 0.60 H new ATOM 0 HE2 MET A 49 3.095 8.299 -9.871 1.00 0.60 H new ATOM 0 HE3 MET A 49 4.563 9.302 -9.778 1.00 0.60 H new ATOM 429 N ASP A 50 1.246 10.372 -14.149 1.00 0.62 N ATOM 430 CA ASP A 50 0.475 9.802 -15.261 1.00 0.66 C ATOM 431 C ASP A 50 1.361 9.060 -16.279 1.00 0.66 C ATOM 432 O ASP A 50 1.048 7.917 -16.632 1.00 0.70 O ATOM 433 CB ASP A 50 -0.349 10.903 -15.934 1.00 0.73 C ATOM 434 CG ASP A 50 -1.380 11.533 -14.987 1.00 1.01 C ATOM 435 OD1 ASP A 50 -2.445 10.918 -14.736 1.00 2.23 O ATOM 436 OD2 ASP A 50 -1.140 12.664 -14.496 1.00 1.73 O ATOM 0 H ASP A 50 1.457 11.363 -14.267 1.00 0.62 H new ATOM 0 HA ASP A 50 -0.200 9.051 -14.849 1.00 0.66 H new ATOM 0 HB2 ASP A 50 0.322 11.679 -16.303 1.00 0.73 H new ATOM 0 HB3 ASP A 50 -0.864 10.488 -16.801 1.00 0.73 H new ATOM 441 N LYS A 51 2.508 9.628 -16.700 1.00 0.66 N ATOM 442 CA LYS A 51 3.473 8.898 -17.533 1.00 0.66 C ATOM 443 C LYS A 51 4.101 7.735 -16.761 1.00 0.66 C ATOM 444 O LYS A 51 4.096 6.622 -17.274 1.00 0.71 O ATOM 445 CB LYS A 51 4.477 9.857 -18.182 1.00 0.66 C ATOM 446 CG LYS A 51 5.336 10.629 -17.175 1.00 0.63 C ATOM 447 CD LYS A 51 6.184 11.705 -17.864 1.00 0.77 C ATOM 448 CE LYS A 51 7.299 11.039 -18.668 1.00 2.04 C ATOM 449 NZ LYS A 51 8.310 12.014 -19.143 1.00 2.48 N ATOM 0 H LYS A 51 2.784 10.584 -16.477 1.00 0.66 H new ATOM 0 HA LYS A 51 2.948 8.431 -18.366 1.00 0.66 H new ATOM 0 HB2 LYS A 51 5.131 9.290 -18.844 1.00 0.66 H new ATOM 0 HB3 LYS A 51 3.935 10.569 -18.804 1.00 0.66 H new ATOM 0 HG2 LYS A 51 4.692 11.095 -16.429 1.00 0.63 H new ATOM 0 HG3 LYS A 51 5.988 9.935 -16.645 1.00 0.63 H new ATOM 0 HD2 LYS A 51 5.559 12.310 -18.521 1.00 0.77 H new ATOM 0 HD3 LYS A 51 6.610 12.379 -17.120 1.00 0.77 H new ATOM 0 HE2 LYS A 51 7.787 10.284 -18.052 1.00 2.04 H new ATOM 0 HE3 LYS A 51 6.867 10.521 -19.524 1.00 2.04 H new ATOM 0 HZ1 LYS A 51 9.046 11.516 -19.683 1.00 2.48 H new ATOM 0 HZ2 LYS A 51 7.851 12.720 -19.753 1.00 2.48 H new ATOM 0 HZ3 LYS A 51 8.743 12.491 -18.326 1.00 2.48 H new ATOM 463 N ILE A 52 4.495 7.935 -15.494 1.00 0.63 N ATOM 464 CA ILE A 52 4.897 6.858 -14.575 1.00 0.62 C ATOM 465 C ILE A 52 3.848 5.734 -14.551 1.00 0.65 C ATOM 466 O ILE A 52 4.211 4.584 -14.758 1.00 0.67 O ATOM 467 CB ILE A 52 5.169 7.426 -13.161 1.00 0.61 C ATOM 468 CG1 ILE A 52 6.421 8.333 -13.205 1.00 0.59 C ATOM 469 CG2 ILE A 52 5.370 6.301 -12.122 1.00 0.62 C ATOM 470 CD1 ILE A 52 6.686 9.148 -11.941 1.00 0.61 C ATOM 0 H ILE A 52 4.544 8.863 -15.073 1.00 0.63 H new ATOM 0 HA ILE A 52 5.826 6.420 -14.938 1.00 0.62 H new ATOM 0 HB ILE A 52 4.299 8.006 -12.854 1.00 0.61 H new ATOM 0 HG12 ILE A 52 7.293 7.710 -13.404 1.00 0.59 H new ATOM 0 HG13 ILE A 52 6.321 9.020 -14.045 1.00 0.59 H new ATOM 0 HG21 ILE A 52 5.558 6.740 -11.142 1.00 0.62 H new ATOM 0 HG22 ILE A 52 4.473 5.683 -12.076 1.00 0.62 H new ATOM 0 HG23 ILE A 52 6.221 5.685 -12.413 1.00 0.62 H new ATOM 0 HD11 ILE A 52 7.585 9.748 -12.077 1.00 0.61 H new ATOM 0 HD12 ILE A 52 5.838 9.804 -11.747 1.00 0.61 H new ATOM 0 HD13 ILE A 52 6.824 8.474 -11.096 1.00 0.61 H new ATOM 482 N ALA A 53 2.554 6.029 -14.383 1.00 0.68 N ATOM 483 CA ALA A 53 1.515 4.992 -14.393 1.00 0.73 C ATOM 484 C ALA A 53 1.421 4.228 -15.732 1.00 0.79 C ATOM 485 O ALA A 53 1.143 3.025 -15.729 1.00 0.85 O ATOM 486 CB ALA A 53 0.184 5.632 -13.986 1.00 0.74 C ATOM 0 H ALA A 53 2.201 6.975 -14.239 1.00 0.68 H new ATOM 0 HA ALA A 53 1.786 4.224 -13.668 1.00 0.73 H new ATOM 0 HB1 ALA A 53 -0.600 4.874 -13.988 1.00 0.74 H new ATOM 0 HB2 ALA A 53 0.275 6.057 -12.986 1.00 0.74 H new ATOM 0 HB3 ALA A 53 -0.072 6.421 -14.693 1.00 0.74 H new ATOM 492 N ASN A 54 1.736 4.864 -16.866 1.00 0.79 N ATOM 493 CA ASN A 54 1.834 4.177 -18.158 1.00 0.84 C ATOM 494 C ASN A 54 3.113 3.324 -18.298 1.00 0.85 C ATOM 495 O ASN A 54 3.082 2.274 -18.943 1.00 0.93 O ATOM 496 CB ASN A 54 1.698 5.181 -19.306 1.00 0.86 C ATOM 497 CG ASN A 54 0.259 5.587 -19.562 1.00 0.91 C ATOM 498 OD1 ASN A 54 -0.370 5.126 -20.508 1.00 1.03 O ATOM 499 ND2 ASN A 54 -0.317 6.440 -18.752 1.00 0.89 N ATOM 0 H ASN A 54 1.929 5.864 -16.914 1.00 0.79 H new ATOM 0 HA ASN A 54 1.004 3.472 -18.208 1.00 0.84 H new ATOM 0 HB2 ASN A 54 2.287 6.070 -19.078 1.00 0.86 H new ATOM 0 HB3 ASN A 54 2.116 4.747 -20.214 1.00 0.86 H new ATOM 0 HD21 ASN A 54 -1.286 6.718 -18.909 1.00 0.89 H new ATOM 0 HD22 ASN A 54 0.203 6.826 -17.964 1.00 0.89 H new ATOM 506 N GLU A 55 4.221 3.716 -17.666 1.00 0.80 N ATOM 507 CA GLU A 55 5.421 2.871 -17.536 1.00 0.83 C ATOM 508 C GLU A 55 5.170 1.618 -16.674 1.00 0.90 C ATOM 509 O GLU A 55 5.944 0.662 -16.738 1.00 0.90 O ATOM 510 CB GLU A 55 6.604 3.658 -16.960 1.00 0.80 C ATOM 511 CG GLU A 55 7.050 4.853 -17.807 1.00 0.78 C ATOM 512 CD GLU A 55 7.326 4.492 -19.271 1.00 0.90 C ATOM 513 OE1 GLU A 55 8.333 3.790 -19.545 1.00 1.50 O ATOM 514 OE2 GLU A 55 6.550 4.924 -20.156 1.00 2.06 O ATOM 0 H GLU A 55 4.317 4.631 -17.226 1.00 0.80 H new ATOM 0 HA GLU A 55 5.666 2.544 -18.546 1.00 0.83 H new ATOM 0 HB2 GLU A 55 6.336 4.015 -15.966 1.00 0.80 H new ATOM 0 HB3 GLU A 55 7.449 2.980 -16.839 1.00 0.80 H new ATOM 0 HG2 GLU A 55 6.280 5.623 -17.769 1.00 0.78 H new ATOM 0 HG3 GLU A 55 7.952 5.282 -17.370 1.00 0.78 H new ATOM 521 N LEU A 56 4.103 1.605 -15.864 1.00 1.01 N ATOM 522 CA LEU A 56 3.706 0.455 -15.047 1.00 1.12 C ATOM 523 C LEU A 56 2.644 -0.445 -15.691 1.00 1.22 C ATOM 524 O LEU A 56 2.735 -1.663 -15.547 1.00 1.29 O ATOM 525 CB LEU A 56 3.273 0.931 -13.656 1.00 1.14 C ATOM 526 CG LEU A 56 4.329 1.746 -12.888 1.00 1.08 C ATOM 527 CD1 LEU A 56 3.819 1.947 -11.474 1.00 1.18 C ATOM 528 CD2 LEU A 56 5.714 1.113 -12.794 1.00 1.08 C ATOM 0 H LEU A 56 3.482 2.408 -15.758 1.00 1.01 H new ATOM 0 HA LEU A 56 4.587 -0.181 -14.960 1.00 1.12 H new ATOM 0 HB2 LEU A 56 2.373 1.537 -13.760 1.00 1.14 H new ATOM 0 HB3 LEU A 56 3.003 0.060 -13.058 1.00 1.14 H new ATOM 0 HG LEU A 56 4.459 2.670 -13.451 1.00 1.08 H new ATOM 0 HD11 LEU A 56 4.547 2.523 -10.903 1.00 1.18 H new ATOM 0 HD12 LEU A 56 2.872 2.486 -11.502 1.00 1.18 H new ATOM 0 HD13 LEU A 56 3.671 0.977 -10.999 1.00 1.18 H new ATOM 0 HD21 LEU A 56 6.378 1.771 -12.233 1.00 1.08 H new ATOM 0 HD22 LEU A 56 5.641 0.152 -12.285 1.00 1.08 H new ATOM 0 HD23 LEU A 56 6.114 0.963 -13.797 1.00 1.08 H new ATOM 540 N GLU A 57 1.666 0.099 -16.423 1.00 1.25 N ATOM 541 CA GLU A 57 0.590 -0.718 -17.027 1.00 1.37 C ATOM 542 C GLU A 57 1.090 -1.709 -18.104 1.00 1.34 C ATOM 543 O GLU A 57 0.427 -2.708 -18.387 1.00 1.43 O ATOM 544 CB GLU A 57 -0.573 0.162 -17.532 1.00 1.48 C ATOM 545 CG GLU A 57 -0.304 0.875 -18.866 1.00 1.43 C ATOM 546 CD GLU A 57 -1.505 1.698 -19.360 1.00 1.82 C ATOM 547 OE1 GLU A 57 -2.180 2.372 -18.550 1.00 2.30 O ATOM 548 OE2 GLU A 57 -1.774 1.693 -20.590 1.00 2.85 O ATOM 0 H GLU A 57 1.591 1.098 -16.615 1.00 1.25 H new ATOM 0 HA GLU A 57 0.203 -1.346 -16.224 1.00 1.37 H new ATOM 0 HB2 GLU A 57 -1.461 -0.460 -17.641 1.00 1.48 H new ATOM 0 HB3 GLU A 57 -0.800 0.912 -16.774 1.00 1.48 H new ATOM 0 HG2 GLU A 57 0.558 1.532 -18.753 1.00 1.43 H new ATOM 0 HG3 GLU A 57 -0.043 0.134 -19.622 1.00 1.43 H new ATOM 555 N THR A 58 2.281 -1.477 -18.670 1.00 1.23 N ATOM 556 CA THR A 58 2.979 -2.433 -19.556 1.00 1.21 C ATOM 557 C THR A 58 3.570 -3.668 -18.836 1.00 1.22 C ATOM 558 O THR A 58 3.849 -4.685 -19.481 1.00 1.27 O ATOM 559 CB THR A 58 4.049 -1.686 -20.374 1.00 1.22 C ATOM 560 OG1 THR A 58 4.598 -2.500 -21.384 1.00 1.37 O ATOM 561 CG2 THR A 58 5.207 -1.165 -19.533 1.00 1.10 C ATOM 0 H THR A 58 2.799 -0.610 -18.527 1.00 1.23 H new ATOM 0 HA THR A 58 2.224 -2.849 -20.223 1.00 1.21 H new ATOM 0 HB THR A 58 3.514 -0.839 -20.804 1.00 1.22 H new ATOM 0 HG1 THR A 58 5.272 -1.993 -21.883 1.00 1.37 H new ATOM 0 HG21 THR A 58 5.921 -0.650 -20.176 1.00 1.10 H new ATOM 0 HG22 THR A 58 4.828 -0.471 -18.783 1.00 1.10 H new ATOM 0 HG23 THR A 58 5.702 -2.000 -19.037 1.00 1.10 H new ATOM 569 N GLY A 59 3.772 -3.606 -17.511 1.00 1.27 N ATOM 570 CA GLY A 59 4.376 -4.662 -16.679 1.00 1.30 C ATOM 571 C GLY A 59 3.368 -5.566 -15.953 1.00 1.36 C ATOM 572 O GLY A 59 2.155 -5.362 -16.034 1.00 1.54 O ATOM 0 H GLY A 59 3.509 -2.785 -16.966 1.00 1.27 H new ATOM 0 HA2 GLY A 59 5.011 -5.284 -17.310 1.00 1.30 H new ATOM 0 HA3 GLY A 59 5.024 -4.195 -15.937 1.00 1.30 H new ATOM 576 N ASN A 60 3.870 -6.551 -15.197 1.00 1.29 N ATOM 577 CA ASN A 60 3.071 -7.442 -14.333 1.00 1.33 C ATOM 578 C ASN A 60 3.185 -7.030 -12.847 1.00 1.18 C ATOM 579 O ASN A 60 3.252 -7.874 -11.945 1.00 1.16 O ATOM 580 CB ASN A 60 3.434 -8.926 -14.573 1.00 1.52 C ATOM 581 CG ASN A 60 3.182 -9.449 -15.984 1.00 1.94 C ATOM 582 OD1 ASN A 60 3.314 -8.753 -16.984 1.00 1.68 O ATOM 583 ND2 ASN A 60 2.811 -10.700 -16.124 1.00 3.13 N ATOM 0 H ASN A 60 4.868 -6.759 -15.166 1.00 1.29 H new ATOM 0 HA ASN A 60 2.021 -7.331 -14.605 1.00 1.33 H new ATOM 0 HB2 ASN A 60 4.489 -9.066 -14.337 1.00 1.52 H new ATOM 0 HB3 ASN A 60 2.866 -9.538 -13.872 1.00 1.52 H new ATOM 0 HD21 ASN A 60 2.637 -11.079 -17.055 1.00 3.13 H new ATOM 0 HD22 ASN A 60 2.696 -11.293 -15.302 1.00 3.13 H new ATOM 590 N TYR A 61 3.262 -5.727 -12.557 1.00 1.09 N ATOM 591 CA TYR A 61 3.614 -5.215 -11.226 1.00 0.94 C ATOM 592 C TYR A 61 2.509 -5.344 -10.161 1.00 0.87 C ATOM 593 O TYR A 61 2.688 -4.915 -9.022 1.00 0.77 O ATOM 594 CB TYR A 61 4.178 -3.793 -11.326 1.00 0.92 C ATOM 595 CG TYR A 61 5.298 -3.590 -12.335 1.00 0.97 C ATOM 596 CD1 TYR A 61 6.400 -4.466 -12.385 1.00 1.86 C ATOM 597 CD2 TYR A 61 5.269 -2.466 -13.177 1.00 2.20 C ATOM 598 CE1 TYR A 61 7.479 -4.198 -13.251 1.00 1.90 C ATOM 599 CE2 TYR A 61 6.368 -2.164 -14.003 1.00 2.17 C ATOM 600 CZ TYR A 61 7.486 -3.023 -14.030 1.00 0.98 C ATOM 601 OH TYR A 61 8.596 -2.689 -14.740 1.00 0.98 O ATOM 0 H TYR A 61 3.081 -4.993 -13.242 1.00 1.09 H new ATOM 0 HA TYR A 61 4.398 -5.874 -10.854 1.00 0.94 H new ATOM 0 HB2 TYR A 61 3.361 -3.116 -11.578 1.00 0.92 H new ATOM 0 HB3 TYR A 61 4.544 -3.498 -10.342 1.00 0.92 H new ATOM 0 HD1 TYR A 61 6.418 -5.345 -11.758 1.00 1.86 H new ATOM 0 HD2 TYR A 61 4.397 -1.829 -13.191 1.00 2.20 H new ATOM 0 HE1 TYR A 61 8.302 -4.894 -13.318 1.00 1.90 H new ATOM 0 HE2 TYR A 61 6.355 -1.275 -14.616 1.00 2.17 H new ATOM 0 HH TYR A 61 8.435 -1.852 -15.223 1.00 0.98 H new ATOM 611 N ALA A 62 1.377 -5.969 -10.497 1.00 0.98 N ATOM 612 CA ALA A 62 0.360 -6.375 -9.527 1.00 1.01 C ATOM 613 C ALA A 62 0.847 -7.537 -8.624 1.00 0.98 C ATOM 614 O ALA A 62 0.292 -7.738 -7.540 1.00 1.02 O ATOM 615 CB ALA A 62 -0.915 -6.735 -10.300 1.00 1.26 C ATOM 0 H ALA A 62 1.140 -6.209 -11.460 1.00 0.98 H new ATOM 0 HA ALA A 62 0.152 -5.550 -8.845 1.00 1.01 H new ATOM 0 HB1 ALA A 62 -1.691 -7.042 -9.599 1.00 1.26 H new ATOM 0 HB2 ALA A 62 -1.257 -5.866 -10.862 1.00 1.26 H new ATOM 0 HB3 ALA A 62 -0.704 -7.553 -10.989 1.00 1.26 H new ATOM 621 N GLY A 63 1.877 -8.285 -9.053 1.00 0.96 N ATOM 622 CA GLY A 63 2.600 -9.275 -8.241 1.00 0.92 C ATOM 623 C GLY A 63 4.071 -8.898 -8.039 1.00 0.83 C ATOM 624 O GLY A 63 4.502 -8.635 -6.915 1.00 0.70 O ATOM 0 H GLY A 63 2.240 -8.214 -10.004 1.00 0.96 H new ATOM 0 HA2 GLY A 63 2.115 -9.369 -7.270 1.00 0.92 H new ATOM 0 HA3 GLY A 63 2.540 -10.251 -8.723 1.00 0.92 H new ATOM 628 N ASN A 64 4.845 -8.894 -9.131 1.00 0.99 N ATOM 629 CA ASN A 64 6.303 -8.700 -9.078 1.00 1.00 C ATOM 630 C ASN A 64 6.756 -7.238 -8.857 1.00 0.90 C ATOM 631 O ASN A 64 6.026 -6.305 -9.184 1.00 0.89 O ATOM 632 CB ASN A 64 7.007 -9.459 -10.214 1.00 1.21 C ATOM 633 CG ASN A 64 7.179 -8.663 -11.471 1.00 1.33 C ATOM 634 OD1 ASN A 64 8.241 -8.624 -12.068 1.00 1.72 O ATOM 635 ND2 ASN A 64 6.145 -8.035 -11.945 1.00 1.57 N ATOM 0 H ASN A 64 4.481 -9.025 -10.075 1.00 0.99 H new ATOM 0 HA ASN A 64 6.652 -9.166 -8.157 1.00 1.00 H new ATOM 0 HB2 ASN A 64 7.988 -9.783 -9.866 1.00 1.21 H new ATOM 0 HB3 ASN A 64 6.436 -10.359 -10.443 1.00 1.21 H new ATOM 0 HD21 ASN A 64 6.222 -7.510 -12.816 1.00 1.57 H new ATOM 0 HD22 ASN A 64 5.256 -8.067 -11.446 1.00 1.57 H new ATOM 642 N LYS A 65 7.964 -7.033 -8.306 1.00 0.88 N ATOM 643 CA LYS A 65 8.536 -5.687 -8.078 1.00 0.82 C ATOM 644 C LYS A 65 8.625 -4.861 -9.367 1.00 0.94 C ATOM 645 O LYS A 65 8.790 -5.422 -10.453 1.00 1.09 O ATOM 646 CB LYS A 65 9.909 -5.776 -7.380 1.00 0.87 C ATOM 647 CG LYS A 65 11.020 -6.330 -8.288 1.00 1.63 C ATOM 648 CD LYS A 65 12.347 -6.512 -7.548 1.00 1.80 C ATOM 649 CE LYS A 65 13.100 -5.200 -7.307 1.00 1.75 C ATOM 650 NZ LYS A 65 14.482 -5.466 -6.842 1.00 2.53 N ATOM 0 H LYS A 65 8.575 -7.793 -8.005 1.00 0.88 H new ATOM 0 HA LYS A 65 7.849 -5.163 -7.414 1.00 0.82 H new ATOM 0 HB2 LYS A 65 10.196 -4.784 -7.031 1.00 0.87 H new ATOM 0 HB3 LYS A 65 9.820 -6.411 -6.498 1.00 0.87 H new ATOM 0 HG2 LYS A 65 10.704 -7.288 -8.700 1.00 1.63 H new ATOM 0 HG3 LYS A 65 11.167 -5.654 -9.130 1.00 1.63 H new ATOM 0 HD2 LYS A 65 12.155 -6.993 -6.589 1.00 1.80 H new ATOM 0 HD3 LYS A 65 12.983 -7.186 -8.121 1.00 1.80 H new ATOM 0 HE2 LYS A 65 13.127 -4.616 -8.227 1.00 1.75 H new ATOM 0 HE3 LYS A 65 12.570 -4.602 -6.565 1.00 1.75 H new ATOM 0 HZ1 LYS A 65 14.975 -4.564 -6.685 1.00 2.53 H new ATOM 0 HZ2 LYS A 65 14.451 -6.004 -5.952 1.00 2.53 H new ATOM 0 HZ3 LYS A 65 14.991 -6.017 -7.562 1.00 2.53 H new ATOM 664 N VAL A 66 8.606 -3.529 -9.252 1.00 0.88 N ATOM 665 CA VAL A 66 8.862 -2.640 -10.399 1.00 0.89 C ATOM 666 C VAL A 66 10.298 -2.827 -10.890 1.00 0.95 C ATOM 667 O VAL A 66 11.229 -2.760 -10.089 1.00 1.02 O ATOM 668 CB VAL A 66 8.558 -1.164 -10.087 1.00 0.89 C ATOM 669 CG1 VAL A 66 9.061 -0.215 -11.183 1.00 0.88 C ATOM 670 CG2 VAL A 66 7.044 -0.965 -10.020 1.00 0.91 C ATOM 0 H VAL A 66 8.416 -3.039 -8.378 1.00 0.88 H new ATOM 0 HA VAL A 66 8.175 -2.922 -11.197 1.00 0.89 H new ATOM 0 HB VAL A 66 9.059 -0.937 -9.146 1.00 0.89 H new ATOM 0 HG11 VAL A 66 8.821 0.813 -10.913 1.00 0.88 H new ATOM 0 HG12 VAL A 66 10.141 -0.320 -11.287 1.00 0.88 H new ATOM 0 HG13 VAL A 66 8.579 -0.463 -12.129 1.00 0.88 H new ATOM 0 HG21 VAL A 66 6.824 0.079 -9.799 1.00 0.91 H new ATOM 0 HG22 VAL A 66 6.599 -1.235 -10.978 1.00 0.91 H new ATOM 0 HG23 VAL A 66 6.628 -1.597 -9.235 1.00 0.91 H new ATOM 680 N GLY A 67 10.487 -3.038 -12.197 1.00 0.99 N ATOM 681 CA GLY A 67 11.806 -3.301 -12.779 1.00 1.05 C ATOM 682 C GLY A 67 12.739 -2.092 -12.706 1.00 0.91 C ATOM 683 O GLY A 67 13.823 -2.171 -12.128 1.00 1.02 O ATOM 0 H GLY A 67 9.730 -3.031 -12.880 1.00 0.99 H new ATOM 0 HA2 GLY A 67 12.266 -4.141 -12.259 1.00 1.05 H new ATOM 0 HA3 GLY A 67 11.685 -3.598 -13.821 1.00 1.05 H new ATOM 687 N VAL A 68 12.299 -0.947 -13.239 1.00 0.86 N ATOM 688 CA VAL A 68 13.067 0.307 -13.244 1.00 0.86 C ATOM 689 C VAL A 68 12.133 1.487 -13.003 1.00 0.77 C ATOM 690 O VAL A 68 11.197 1.714 -13.771 1.00 0.82 O ATOM 691 CB VAL A 68 13.833 0.513 -14.573 1.00 1.14 C ATOM 692 CG1 VAL A 68 14.662 1.806 -14.546 1.00 1.65 C ATOM 693 CG2 VAL A 68 14.802 -0.636 -14.869 1.00 1.75 C ATOM 0 H VAL A 68 11.386 -0.862 -13.686 1.00 0.86 H new ATOM 0 HA VAL A 68 13.803 0.244 -12.442 1.00 0.86 H new ATOM 0 HB VAL A 68 13.066 0.560 -15.346 1.00 1.14 H new ATOM 0 HG11 VAL A 68 15.188 1.921 -15.494 1.00 1.65 H new ATOM 0 HG12 VAL A 68 14.001 2.659 -14.392 1.00 1.65 H new ATOM 0 HG13 VAL A 68 15.386 1.757 -13.733 1.00 1.65 H new ATOM 0 HG21 VAL A 68 15.315 -0.445 -15.811 1.00 1.75 H new ATOM 0 HG22 VAL A 68 15.535 -0.710 -14.065 1.00 1.75 H new ATOM 0 HG23 VAL A 68 14.246 -1.571 -14.941 1.00 1.75 H new ATOM 703 N LEU A 69 12.400 2.260 -11.951 1.00 0.79 N ATOM 704 CA LEU A 69 11.756 3.554 -11.734 1.00 0.70 C ATOM 705 C LEU A 69 12.418 4.616 -12.633 1.00 0.66 C ATOM 706 O LEU A 69 13.653 4.623 -12.743 1.00 0.84 O ATOM 707 CB LEU A 69 11.816 3.939 -10.245 1.00 0.85 C ATOM 708 CG LEU A 69 10.979 3.023 -9.338 1.00 0.97 C ATOM 709 CD1 LEU A 69 11.212 3.378 -7.869 1.00 1.19 C ATOM 710 CD2 LEU A 69 9.485 3.156 -9.630 1.00 0.92 C ATOM 0 H LEU A 69 13.070 2.006 -11.225 1.00 0.79 H new ATOM 0 HA LEU A 69 10.703 3.491 -12.007 1.00 0.70 H new ATOM 0 HB2 LEU A 69 12.854 3.914 -9.914 1.00 0.85 H new ATOM 0 HB3 LEU A 69 11.469 4.966 -10.130 1.00 0.85 H new ATOM 0 HG LEU A 69 11.293 1.999 -9.539 1.00 0.97 H new ATOM 0 HD11 LEU A 69 10.613 2.722 -7.237 1.00 1.19 H new ATOM 0 HD12 LEU A 69 12.267 3.251 -7.627 1.00 1.19 H new ATOM 0 HD13 LEU A 69 10.922 4.414 -7.695 1.00 1.19 H new ATOM 0 HD21 LEU A 69 8.925 2.494 -8.970 1.00 0.92 H new ATOM 0 HD22 LEU A 69 9.172 4.186 -9.461 1.00 0.92 H new ATOM 0 HD23 LEU A 69 9.291 2.883 -10.667 1.00 0.92 H new ATOM 722 N PRO A 70 11.633 5.503 -13.276 1.00 0.54 N ATOM 723 CA PRO A 70 12.157 6.486 -14.221 1.00 0.60 C ATOM 724 C PRO A 70 12.950 7.603 -13.534 1.00 0.60 C ATOM 725 O PRO A 70 12.816 7.818 -12.325 1.00 0.56 O ATOM 726 CB PRO A 70 10.914 7.043 -14.914 1.00 0.59 C ATOM 727 CG PRO A 70 9.805 6.935 -13.891 1.00 0.50 C ATOM 728 CD PRO A 70 10.183 5.645 -13.152 1.00 0.51 C ATOM 0 HA PRO A 70 12.864 6.032 -14.915 1.00 0.60 H new ATOM 0 HB2 PRO A 70 11.066 8.078 -15.222 1.00 0.59 H new ATOM 0 HB3 PRO A 70 10.677 6.474 -15.813 1.00 0.59 H new ATOM 0 HG2 PRO A 70 9.780 7.796 -13.223 1.00 0.50 H new ATOM 0 HG3 PRO A 70 8.823 6.865 -14.359 1.00 0.50 H new ATOM 0 HD2 PRO A 70 9.887 5.698 -12.104 1.00 0.51 H new ATOM 0 HD3 PRO A 70 9.671 4.786 -13.585 1.00 0.51 H new ATOM 736 N ALA A 71 13.698 8.385 -14.316 1.00 0.71 N ATOM 737 CA ALA A 71 14.389 9.582 -13.830 1.00 0.77 C ATOM 738 C ALA A 71 13.450 10.537 -13.063 1.00 0.73 C ATOM 739 O ALA A 71 13.804 11.021 -11.986 1.00 0.93 O ATOM 740 CB ALA A 71 15.029 10.286 -15.031 1.00 0.96 C ATOM 0 H ALA A 71 13.842 8.205 -15.310 1.00 0.71 H new ATOM 0 HA ALA A 71 15.154 9.280 -13.115 1.00 0.77 H new ATOM 0 HB1 ALA A 71 15.550 11.182 -14.693 1.00 0.96 H new ATOM 0 HB2 ALA A 71 15.739 9.613 -15.511 1.00 0.96 H new ATOM 0 HB3 ALA A 71 14.254 10.565 -15.745 1.00 0.96 H new ATOM 746 N ASN A 72 12.229 10.735 -13.575 1.00 0.63 N ATOM 747 CA ASN A 72 11.161 11.572 -13.011 1.00 0.62 C ATOM 748 C ASN A 72 10.406 10.970 -11.800 1.00 0.56 C ATOM 749 O ASN A 72 9.544 11.641 -11.232 1.00 0.60 O ATOM 750 CB ASN A 72 10.212 12.009 -14.150 1.00 0.66 C ATOM 751 CG ASN A 72 9.817 10.894 -15.105 1.00 0.74 C ATOM 752 OD1 ASN A 72 10.611 10.478 -15.933 1.00 1.44 O ATOM 753 ND2 ASN A 72 8.631 10.339 -15.019 1.00 1.17 N ATOM 0 H ASN A 72 11.942 10.289 -14.446 1.00 0.63 H new ATOM 0 HA ASN A 72 11.645 12.445 -12.573 1.00 0.62 H new ATOM 0 HB2 ASN A 72 9.308 12.431 -13.711 1.00 0.66 H new ATOM 0 HB3 ASN A 72 10.691 12.805 -14.720 1.00 0.66 H new ATOM 0 HD21 ASN A 72 8.382 9.569 -15.640 1.00 1.17 H new ATOM 0 HD22 ASN A 72 7.958 10.677 -14.331 1.00 1.17 H new ATOM 760 N ALA A 73 10.708 9.736 -11.381 1.00 0.52 N ATOM 761 CA ALA A 73 10.158 9.137 -10.156 1.00 0.50 C ATOM 762 C ALA A 73 11.057 9.343 -8.917 1.00 0.51 C ATOM 763 O ALA A 73 12.285 9.452 -9.025 1.00 0.56 O ATOM 764 CB ALA A 73 9.887 7.654 -10.418 1.00 0.48 C ATOM 0 H ALA A 73 11.345 9.119 -11.885 1.00 0.52 H new ATOM 0 HA ALA A 73 9.227 9.649 -9.914 1.00 0.50 H new ATOM 0 HB1 ALA A 73 9.478 7.194 -9.518 1.00 0.48 H new ATOM 0 HB2 ALA A 73 9.171 7.554 -11.234 1.00 0.48 H new ATOM 0 HB3 ALA A 73 10.818 7.156 -10.689 1.00 0.48 H new ATOM 770 N LYS A 74 10.442 9.338 -7.725 1.00 0.52 N ATOM 771 CA LYS A 74 11.107 9.337 -6.410 1.00 0.59 C ATOM 772 C LYS A 74 10.331 8.510 -5.380 1.00 0.56 C ATOM 773 O LYS A 74 9.169 8.159 -5.583 1.00 0.55 O ATOM 774 CB LYS A 74 11.348 10.783 -5.934 1.00 0.78 C ATOM 775 CG LYS A 74 10.130 11.440 -5.251 1.00 0.95 C ATOM 776 CD LYS A 74 10.250 12.972 -5.347 1.00 1.08 C ATOM 777 CE LYS A 74 9.217 13.770 -4.540 1.00 1.44 C ATOM 778 NZ LYS A 74 9.494 15.229 -4.627 1.00 2.22 N ATOM 0 H LYS A 74 9.425 9.334 -7.646 1.00 0.52 H new ATOM 0 HA LYS A 74 12.078 8.854 -6.518 1.00 0.59 H new ATOM 0 HB2 LYS A 74 12.187 10.788 -5.238 1.00 0.78 H new ATOM 0 HB3 LYS A 74 11.641 11.391 -6.790 1.00 0.78 H new ATOM 0 HG2 LYS A 74 9.209 11.106 -5.728 1.00 0.95 H new ATOM 0 HG3 LYS A 74 10.077 11.134 -4.206 1.00 0.95 H new ATOM 0 HD2 LYS A 74 11.247 13.262 -5.015 1.00 1.08 H new ATOM 0 HD3 LYS A 74 10.167 13.260 -6.395 1.00 1.08 H new ATOM 0 HE2 LYS A 74 8.215 13.562 -4.916 1.00 1.44 H new ATOM 0 HE3 LYS A 74 9.239 13.452 -3.498 1.00 1.44 H new ATOM 0 HZ1 LYS A 74 8.784 15.751 -4.074 1.00 2.22 H new ATOM 0 HZ2 LYS A 74 10.442 15.426 -4.247 1.00 2.22 H new ATOM 0 HZ3 LYS A 74 9.450 15.532 -5.621 1.00 2.22 H new ATOM 792 N GLU A 75 10.972 8.227 -4.256 1.00 0.65 N ATOM 793 CA GLU A 75 10.441 7.407 -3.161 1.00 0.70 C ATOM 794 C GLU A 75 10.428 8.215 -1.857 1.00 0.85 C ATOM 795 O GLU A 75 11.258 9.111 -1.688 1.00 1.11 O ATOM 796 CB GLU A 75 11.318 6.157 -2.996 1.00 0.79 C ATOM 797 CG GLU A 75 11.471 5.322 -4.279 1.00 0.72 C ATOM 798 CD GLU A 75 12.720 4.446 -4.163 1.00 0.94 C ATOM 799 OE1 GLU A 75 13.836 4.966 -4.406 1.00 1.72 O ATOM 800 OE2 GLU A 75 12.622 3.264 -3.756 1.00 2.10 O ATOM 0 H GLU A 75 11.913 8.572 -4.068 1.00 0.65 H new ATOM 0 HA GLU A 75 9.419 7.107 -3.394 1.00 0.70 H new ATOM 0 HB2 GLU A 75 12.307 6.463 -2.655 1.00 0.79 H new ATOM 0 HB3 GLU A 75 10.891 5.528 -2.215 1.00 0.79 H new ATOM 0 HG2 GLU A 75 10.589 4.700 -4.430 1.00 0.72 H new ATOM 0 HG3 GLU A 75 11.551 5.977 -5.146 1.00 0.72 H new ATOM 807 N ILE A 76 9.508 7.907 -0.936 1.00 0.76 N ATOM 808 CA ILE A 76 9.495 8.483 0.421 1.00 0.76 C ATOM 809 C ILE A 76 9.125 7.431 1.476 1.00 0.75 C ATOM 810 O ILE A 76 8.204 6.634 1.281 1.00 0.88 O ATOM 811 CB ILE A 76 8.585 9.733 0.533 1.00 0.76 C ATOM 812 CG1 ILE A 76 7.165 9.503 -0.036 1.00 0.79 C ATOM 813 CG2 ILE A 76 9.257 10.965 -0.105 1.00 0.78 C ATOM 814 CD1 ILE A 76 6.230 10.709 0.122 1.00 0.90 C ATOM 0 H ILE A 76 8.747 7.249 -1.108 1.00 0.76 H new ATOM 0 HA ILE A 76 10.513 8.818 0.621 1.00 0.76 H new ATOM 0 HB ILE A 76 8.454 9.927 1.598 1.00 0.76 H new ATOM 0 HG12 ILE A 76 7.244 9.253 -1.094 1.00 0.79 H new ATOM 0 HG13 ILE A 76 6.719 8.642 0.462 1.00 0.79 H new ATOM 0 HG21 ILE A 76 8.597 11.828 -0.013 1.00 0.78 H new ATOM 0 HG22 ILE A 76 10.198 11.171 0.405 1.00 0.78 H new ATOM 0 HG23 ILE A 76 9.452 10.768 -1.159 1.00 0.78 H new ATOM 0 HD11 ILE A 76 5.254 10.471 -0.301 1.00 0.90 H new ATOM 0 HD12 ILE A 76 6.119 10.947 1.180 1.00 0.90 H new ATOM 0 HD13 ILE A 76 6.652 11.567 -0.401 1.00 0.90 H new ATOM 826 N ALA A 77 9.833 7.443 2.607 1.00 0.65 N ATOM 827 CA ALA A 77 9.563 6.625 3.789 1.00 0.61 C ATOM 828 C ALA A 77 9.108 7.471 4.993 1.00 0.48 C ATOM 829 O ALA A 77 9.315 8.686 5.041 1.00 0.57 O ATOM 830 CB ALA A 77 10.780 5.746 4.104 1.00 0.74 C ATOM 0 H ALA A 77 10.644 8.049 2.728 1.00 0.65 H new ATOM 0 HA ALA A 77 8.723 5.966 3.569 1.00 0.61 H new ATOM 0 HB1 ALA A 77 10.572 5.139 4.985 1.00 0.74 H new ATOM 0 HB2 ALA A 77 10.987 5.094 3.255 1.00 0.74 H new ATOM 0 HB3 ALA A 77 11.646 6.379 4.295 1.00 0.74 H new ATOM 836 N GLY A 78 8.481 6.817 5.972 1.00 0.43 N ATOM 837 CA GLY A 78 7.800 7.447 7.105 1.00 0.42 C ATOM 838 C GLY A 78 6.373 7.909 6.779 1.00 0.45 C ATOM 839 O GLY A 78 5.869 8.871 7.359 1.00 0.66 O ATOM 0 H GLY A 78 8.431 5.799 5.999 1.00 0.43 H new ATOM 0 HA2 GLY A 78 7.765 6.742 7.936 1.00 0.42 H new ATOM 0 HA3 GLY A 78 8.384 8.305 7.439 1.00 0.42 H new ATOM 843 N VAL A 79 5.721 7.216 5.842 1.00 0.41 N ATOM 844 CA VAL A 79 4.292 7.325 5.504 1.00 0.41 C ATOM 845 C VAL A 79 3.562 6.077 5.999 1.00 0.36 C ATOM 846 O VAL A 79 4.125 4.987 5.945 1.00 0.38 O ATOM 847 CB VAL A 79 4.098 7.578 3.995 1.00 0.49 C ATOM 848 CG1 VAL A 79 4.950 6.695 3.079 1.00 0.70 C ATOM 849 CG2 VAL A 79 2.640 7.477 3.549 1.00 0.47 C ATOM 0 H VAL A 79 6.199 6.524 5.264 1.00 0.41 H new ATOM 0 HA VAL A 79 3.856 8.187 6.008 1.00 0.41 H new ATOM 0 HB VAL A 79 4.444 8.605 3.883 1.00 0.49 H new ATOM 0 HG11 VAL A 79 4.745 6.946 2.038 1.00 0.70 H new ATOM 0 HG12 VAL A 79 6.006 6.863 3.291 1.00 0.70 H new ATOM 0 HG13 VAL A 79 4.707 5.647 3.254 1.00 0.70 H new ATOM 0 HG21 VAL A 79 2.573 7.666 2.478 1.00 0.47 H new ATOM 0 HG22 VAL A 79 2.262 6.478 3.766 1.00 0.47 H new ATOM 0 HG23 VAL A 79 2.044 8.215 4.085 1.00 0.47 H new ATOM 859 N MET A 80 2.337 6.250 6.506 1.00 0.36 N ATOM 860 CA MET A 80 1.523 5.213 7.152 1.00 0.33 C ATOM 861 C MET A 80 0.384 4.720 6.251 1.00 0.31 C ATOM 862 O MET A 80 -0.317 5.513 5.624 1.00 0.34 O ATOM 863 CB MET A 80 0.980 5.781 8.477 1.00 0.37 C ATOM 864 CG MET A 80 0.028 4.843 9.232 1.00 0.40 C ATOM 865 SD MET A 80 0.713 3.212 9.623 1.00 0.51 S ATOM 866 CE MET A 80 0.408 3.091 11.403 1.00 0.41 C ATOM 0 H MET A 80 1.865 7.154 6.477 1.00 0.36 H new ATOM 0 HA MET A 80 2.148 4.341 7.346 1.00 0.33 H new ATOM 0 HB2 MET A 80 1.822 6.022 9.126 1.00 0.37 H new ATOM 0 HB3 MET A 80 0.459 6.716 8.270 1.00 0.37 H new ATOM 0 HG2 MET A 80 -0.273 5.326 10.161 1.00 0.40 H new ATOM 0 HG3 MET A 80 -0.874 4.708 8.636 1.00 0.40 H new ATOM 0 HE1 MET A 80 0.781 2.136 11.772 1.00 0.41 H new ATOM 0 HE2 MET A 80 0.922 3.904 11.916 1.00 0.41 H new ATOM 0 HE3 MET A 80 -0.663 3.161 11.594 1.00 0.41 H new ATOM 876 N PHE A 81 0.163 3.407 6.225 1.00 0.28 N ATOM 877 CA PHE A 81 -0.910 2.759 5.463 1.00 0.28 C ATOM 878 C PHE A 81 -1.499 1.557 6.217 1.00 0.27 C ATOM 879 O PHE A 81 -0.832 0.914 7.032 1.00 0.28 O ATOM 880 CB PHE A 81 -0.431 2.384 4.042 1.00 0.30 C ATOM 881 CG PHE A 81 1.052 2.098 3.972 1.00 0.31 C ATOM 882 CD1 PHE A 81 1.498 0.872 4.486 1.00 1.94 C ATOM 883 CD2 PHE A 81 1.986 3.095 3.598 1.00 2.02 C ATOM 884 CE1 PHE A 81 2.860 0.653 4.680 1.00 1.98 C ATOM 885 CE2 PHE A 81 3.357 2.842 3.764 1.00 2.02 C ATOM 886 CZ PHE A 81 3.791 1.631 4.322 1.00 0.61 C ATOM 0 H PHE A 81 0.738 2.745 6.746 1.00 0.28 H new ATOM 0 HA PHE A 81 -1.721 3.478 5.351 1.00 0.28 H new ATOM 0 HB2 PHE A 81 -0.981 1.507 3.699 1.00 0.30 H new ATOM 0 HB3 PHE A 81 -0.671 3.198 3.358 1.00 0.30 H new ATOM 0 HD1 PHE A 81 0.786 0.098 4.731 1.00 1.94 H new ATOM 0 HD2 PHE A 81 1.648 4.037 3.191 1.00 2.02 H new ATOM 0 HE1 PHE A 81 3.198 -0.278 5.110 1.00 1.98 H new ATOM 0 HE2 PHE A 81 4.081 3.584 3.460 1.00 2.02 H new ATOM 0 HZ PHE A 81 4.845 1.454 4.475 1.00 0.61 H new ATOM 896 N VAL A 82 -2.768 1.265 5.926 1.00 0.25 N ATOM 897 CA VAL A 82 -3.612 0.242 6.569 1.00 0.24 C ATOM 898 C VAL A 82 -4.135 -0.741 5.504 1.00 0.23 C ATOM 899 O VAL A 82 -4.443 -0.325 4.382 1.00 0.24 O ATOM 900 CB VAL A 82 -4.780 0.888 7.354 1.00 0.26 C ATOM 901 CG1 VAL A 82 -4.335 2.070 8.230 1.00 0.31 C ATOM 902 CG2 VAL A 82 -5.900 1.427 6.461 1.00 0.27 C ATOM 0 H VAL A 82 -3.269 1.764 5.191 1.00 0.25 H new ATOM 0 HA VAL A 82 -3.007 -0.308 7.290 1.00 0.24 H new ATOM 0 HB VAL A 82 -5.146 0.062 7.964 1.00 0.26 H new ATOM 0 HG11 VAL A 82 -5.198 2.480 8.754 1.00 0.31 H new ATOM 0 HG12 VAL A 82 -3.598 1.727 8.957 1.00 0.31 H new ATOM 0 HG13 VAL A 82 -3.892 2.843 7.601 1.00 0.31 H new ATOM 0 HG21 VAL A 82 -6.682 1.864 7.082 1.00 0.27 H new ATOM 0 HG22 VAL A 82 -5.498 2.189 5.793 1.00 0.27 H new ATOM 0 HG23 VAL A 82 -6.319 0.612 5.871 1.00 0.27 H new ATOM 912 N TRP A 83 -4.277 -2.027 5.831 1.00 0.23 N ATOM 913 CA TRP A 83 -4.965 -3.014 4.992 1.00 0.23 C ATOM 914 C TRP A 83 -6.485 -3.037 5.237 1.00 0.23 C ATOM 915 O TRP A 83 -6.988 -2.819 6.340 1.00 0.25 O ATOM 916 CB TRP A 83 -4.345 -4.406 5.175 1.00 0.26 C ATOM 917 CG TRP A 83 -3.137 -4.707 4.333 1.00 0.28 C ATOM 918 CD1 TRP A 83 -1.935 -4.086 4.394 1.00 0.37 C ATOM 919 CD2 TRP A 83 -2.987 -5.761 3.326 1.00 0.28 C ATOM 920 NE1 TRP A 83 -1.081 -4.637 3.455 1.00 0.38 N ATOM 921 CE2 TRP A 83 -1.678 -5.672 2.764 1.00 0.32 C ATOM 922 CE3 TRP A 83 -3.814 -6.808 2.856 1.00 0.26 C ATOM 923 CZ2 TRP A 83 -1.237 -6.540 1.750 1.00 0.33 C ATOM 924 CZ3 TRP A 83 -3.354 -7.729 1.895 1.00 0.29 C ATOM 925 CH2 TRP A 83 -2.078 -7.583 1.324 1.00 0.31 C ATOM 0 H TRP A 83 -3.912 -2.419 6.699 1.00 0.23 H new ATOM 0 HA TRP A 83 -4.826 -2.710 3.954 1.00 0.23 H new ATOM 0 HB2 TRP A 83 -4.071 -4.524 6.223 1.00 0.26 H new ATOM 0 HB3 TRP A 83 -5.109 -5.153 4.959 1.00 0.26 H new ATOM 0 HD1 TRP A 83 -1.682 -3.284 5.071 1.00 0.37 H new ATOM 0 HE1 TRP A 83 -0.126 -4.317 3.293 1.00 0.38 H new ATOM 0 HE3 TRP A 83 -4.818 -6.903 3.242 1.00 0.26 H new ATOM 0 HZ2 TRP A 83 -0.263 -6.407 1.303 1.00 0.33 H new ATOM 0 HZ3 TRP A 83 -3.985 -8.552 1.595 1.00 0.29 H new ATOM 0 HH2 TRP A 83 -1.745 -8.270 0.560 1.00 0.31 H new ATOM 936 N THR A 84 -7.222 -3.334 4.171 1.00 0.25 N ATOM 937 CA THR A 84 -8.686 -3.437 4.115 1.00 0.25 C ATOM 938 C THR A 84 -9.141 -4.579 3.196 1.00 0.27 C ATOM 939 O THR A 84 -8.344 -5.165 2.463 1.00 0.30 O ATOM 940 CB THR A 84 -9.325 -2.133 3.591 1.00 0.27 C ATOM 941 OG1 THR A 84 -8.738 -1.781 2.370 1.00 0.31 O ATOM 942 CG2 THR A 84 -9.202 -0.908 4.487 1.00 0.29 C ATOM 0 H THR A 84 -6.792 -3.522 3.265 1.00 0.25 H new ATOM 0 HA THR A 84 -9.011 -3.631 5.137 1.00 0.25 H new ATOM 0 HB THR A 84 -10.385 -2.378 3.527 1.00 0.27 H new ATOM 0 HG1 THR A 84 -8.908 -0.833 2.186 1.00 0.31 H new ATOM 0 HG21 THR A 84 -9.689 -0.058 4.010 1.00 0.29 H new ATOM 0 HG22 THR A 84 -9.680 -1.109 5.446 1.00 0.29 H new ATOM 0 HG23 THR A 84 -8.148 -0.679 4.648 1.00 0.29 H new ATOM 950 N ASN A 85 -10.439 -4.892 3.199 1.00 0.31 N ATOM 951 CA ASN A 85 -11.062 -5.819 2.254 1.00 0.37 C ATOM 952 C ASN A 85 -11.700 -5.134 1.031 1.00 0.45 C ATOM 953 O ASN A 85 -11.685 -3.910 0.909 1.00 0.52 O ATOM 954 CB ASN A 85 -12.048 -6.726 3.005 1.00 0.41 C ATOM 955 CG ASN A 85 -11.845 -8.131 2.492 1.00 0.77 C ATOM 956 OD1 ASN A 85 -12.460 -8.536 1.519 1.00 2.08 O ATOM 957 ND2 ASN A 85 -10.853 -8.817 3.006 1.00 0.65 N ATOM 0 H ASN A 85 -11.098 -4.500 3.872 1.00 0.31 H new ATOM 0 HA ASN A 85 -10.269 -6.432 1.825 1.00 0.37 H new ATOM 0 HB2 ASN A 85 -11.871 -6.680 4.079 1.00 0.41 H new ATOM 0 HB3 ASN A 85 -13.074 -6.400 2.837 1.00 0.41 H new ATOM 0 HD21 ASN A 85 -10.581 -9.709 2.592 1.00 0.65 H new ATOM 0 HD22 ASN A 85 -10.353 -8.459 3.820 1.00 0.65 H new ATOM 964 N THR A 86 -12.308 -5.918 0.135 1.00 0.55 N ATOM 965 CA THR A 86 -12.985 -5.412 -1.076 1.00 0.70 C ATOM 966 C THR A 86 -14.124 -4.434 -0.786 1.00 0.64 C ATOM 967 O THR A 86 -14.375 -3.535 -1.585 1.00 0.77 O ATOM 968 CB THR A 86 -13.555 -6.557 -1.924 1.00 0.94 C ATOM 969 OG1 THR A 86 -14.436 -7.327 -1.138 1.00 1.61 O ATOM 970 CG2 THR A 86 -12.458 -7.477 -2.439 1.00 1.21 C ATOM 0 H THR A 86 -12.348 -6.933 0.226 1.00 0.55 H new ATOM 0 HA THR A 86 -12.204 -4.879 -1.618 1.00 0.70 H new ATOM 0 HB THR A 86 -14.070 -6.111 -2.775 1.00 0.94 H new ATOM 0 HG1 THR A 86 -14.803 -8.058 -1.678 1.00 1.61 H new ATOM 0 HG21 THR A 86 -12.902 -8.275 -3.035 1.00 1.21 H new ATOM 0 HG22 THR A 86 -11.764 -6.906 -3.056 1.00 1.21 H new ATOM 0 HG23 THR A 86 -11.921 -7.910 -1.595 1.00 1.21 H new ATOM 978 N ASN A 87 -14.770 -4.554 0.379 1.00 0.55 N ATOM 979 CA ASN A 87 -15.792 -3.610 0.868 1.00 0.56 C ATOM 980 C ASN A 87 -15.190 -2.397 1.617 1.00 0.51 C ATOM 981 O ASN A 87 -15.898 -1.684 2.332 1.00 0.54 O ATOM 982 CB ASN A 87 -16.875 -4.382 1.657 1.00 0.68 C ATOM 983 CG ASN A 87 -17.861 -5.124 0.763 1.00 1.13 C ATOM 984 OD1 ASN A 87 -17.836 -5.041 -0.459 1.00 1.57 O ATOM 985 ND2 ASN A 87 -18.794 -5.840 1.338 1.00 1.76 N ATOM 0 H ASN A 87 -14.596 -5.324 1.025 1.00 0.55 H new ATOM 0 HA ASN A 87 -16.285 -3.150 0.012 1.00 0.56 H new ATOM 0 HB2 ASN A 87 -16.390 -5.097 2.322 1.00 0.68 H new ATOM 0 HB3 ASN A 87 -17.423 -3.682 2.287 1.00 0.68 H new ATOM 0 HD21 ASN A 87 -19.490 -6.322 0.769 1.00 1.76 H new ATOM 0 HD22 ASN A 87 -18.825 -5.916 2.355 1.00 1.76 H new ATOM 992 N ASN A 88 -13.883 -2.151 1.446 1.00 0.51 N ATOM 993 CA ASN A 88 -13.101 -1.063 2.047 1.00 0.54 C ATOM 994 C ASN A 88 -13.127 -1.086 3.589 1.00 0.51 C ATOM 995 O ASN A 88 -12.979 -0.053 4.239 1.00 0.59 O ATOM 996 CB ASN A 88 -13.479 0.303 1.435 1.00 0.60 C ATOM 997 CG ASN A 88 -14.050 0.234 0.032 1.00 0.62 C ATOM 998 OD1 ASN A 88 -15.258 0.244 -0.148 1.00 0.64 O ATOM 999 ND2 ASN A 88 -13.248 0.200 -0.996 1.00 0.65 N ATOM 0 H ASN A 88 -13.309 -2.744 0.847 1.00 0.51 H new ATOM 0 HA ASN A 88 -12.055 -1.233 1.791 1.00 0.54 H new ATOM 0 HB2 ASN A 88 -14.207 0.788 2.085 1.00 0.60 H new ATOM 0 HB3 ASN A 88 -12.592 0.937 1.421 1.00 0.60 H new ATOM 0 HD21 ASN A 88 -13.631 0.182 -1.941 1.00 0.65 H new ATOM 0 HD22 ASN A 88 -12.238 0.191 -0.855 1.00 0.65 H new ATOM 1006 N GLU A 89 -13.363 -2.264 4.171 1.00 0.43 N ATOM 1007 CA GLU A 89 -13.425 -2.485 5.616 1.00 0.40 C ATOM 1008 C GLU A 89 -12.049 -2.788 6.172 1.00 0.36 C ATOM 1009 O GLU A 89 -11.315 -3.584 5.588 1.00 0.37 O ATOM 1010 CB GLU A 89 -14.363 -3.649 5.952 1.00 0.42 C ATOM 1011 CG GLU A 89 -15.808 -3.121 5.923 1.00 0.67 C ATOM 1012 CD GLU A 89 -16.923 -4.169 6.005 1.00 1.16 C ATOM 1013 OE1 GLU A 89 -16.744 -5.352 5.622 1.00 1.83 O ATOM 1014 OE2 GLU A 89 -18.035 -3.769 6.426 1.00 2.23 O ATOM 0 H GLU A 89 -13.521 -3.116 3.633 1.00 0.43 H new ATOM 0 HA GLU A 89 -13.808 -1.571 6.070 1.00 0.40 H new ATOM 0 HB2 GLU A 89 -14.239 -4.458 5.232 1.00 0.42 H new ATOM 0 HB3 GLU A 89 -14.126 -4.057 6.935 1.00 0.42 H new ATOM 0 HG2 GLU A 89 -15.933 -2.425 6.752 1.00 0.67 H new ATOM 0 HG3 GLU A 89 -15.944 -2.550 5.004 1.00 0.67 H new ATOM 1021 N ILE A 90 -11.718 -2.194 7.314 1.00 0.37 N ATOM 1022 CA ILE A 90 -10.414 -2.369 7.946 1.00 0.34 C ATOM 1023 C ILE A 90 -10.323 -3.778 8.541 1.00 0.34 C ATOM 1024 O ILE A 90 -11.167 -4.169 9.350 1.00 0.38 O ATOM 1025 CB ILE A 90 -10.145 -1.279 9.000 1.00 0.37 C ATOM 1026 CG1 ILE A 90 -10.483 0.131 8.463 1.00 0.39 C ATOM 1027 CG2 ILE A 90 -8.670 -1.384 9.435 1.00 0.37 C ATOM 1028 CD1 ILE A 90 -10.163 1.246 9.454 1.00 0.43 C ATOM 0 H ILE A 90 -12.347 -1.577 7.828 1.00 0.37 H new ATOM 0 HA ILE A 90 -9.636 -2.261 7.191 1.00 0.34 H new ATOM 0 HB ILE A 90 -10.793 -1.435 9.862 1.00 0.37 H new ATOM 0 HG12 ILE A 90 -9.928 0.304 7.541 1.00 0.39 H new ATOM 0 HG13 ILE A 90 -11.543 0.172 8.210 1.00 0.39 H new ATOM 0 HG21 ILE A 90 -8.456 -0.620 10.183 1.00 0.37 H new ATOM 0 HG22 ILE A 90 -8.486 -2.370 9.861 1.00 0.37 H new ATOM 0 HG23 ILE A 90 -8.024 -1.236 8.570 1.00 0.37 H new ATOM 0 HD11 ILE A 90 -10.424 2.209 9.015 1.00 0.43 H new ATOM 0 HD12 ILE A 90 -10.738 1.096 10.368 1.00 0.43 H new ATOM 0 HD13 ILE A 90 -9.099 1.230 9.688 1.00 0.43 H new ATOM 1040 N ILE A 91 -9.301 -4.528 8.137 1.00 0.33 N ATOM 1041 CA ILE A 91 -8.970 -5.872 8.646 1.00 0.31 C ATOM 1042 C ILE A 91 -7.644 -5.966 9.438 1.00 0.28 C ATOM 1043 O ILE A 91 -6.714 -5.180 9.259 1.00 0.28 O ATOM 1044 CB ILE A 91 -9.068 -6.937 7.528 1.00 0.36 C ATOM 1045 CG1 ILE A 91 -7.997 -6.816 6.422 1.00 0.37 C ATOM 1046 CG2 ILE A 91 -10.441 -6.894 6.849 1.00 0.47 C ATOM 1047 CD1 ILE A 91 -7.529 -8.194 5.941 1.00 0.57 C ATOM 0 H ILE A 91 -8.650 -4.211 7.418 1.00 0.33 H new ATOM 0 HA ILE A 91 -9.734 -6.090 9.392 1.00 0.31 H new ATOM 0 HB ILE A 91 -8.903 -7.881 8.047 1.00 0.36 H new ATOM 0 HG12 ILE A 91 -8.403 -6.254 5.581 1.00 0.37 H new ATOM 0 HG13 ILE A 91 -7.144 -6.252 6.800 1.00 0.37 H new ATOM 0 HG21 ILE A 91 -10.484 -7.652 6.067 1.00 0.47 H new ATOM 0 HG22 ILE A 91 -11.218 -7.090 7.588 1.00 0.47 H new ATOM 0 HG23 ILE A 91 -10.598 -5.909 6.409 1.00 0.47 H new ATOM 0 HD11 ILE A 91 -6.776 -8.071 5.163 1.00 0.57 H new ATOM 0 HD12 ILE A 91 -7.100 -8.745 6.778 1.00 0.57 H new ATOM 0 HD13 ILE A 91 -8.378 -8.747 5.540 1.00 0.57 H new ATOM 1059 N ASP A 92 -7.586 -6.926 10.359 1.00 0.31 N ATOM 1060 CA ASP A 92 -6.393 -7.435 11.052 1.00 0.36 C ATOM 1061 C ASP A 92 -5.677 -8.449 10.137 1.00 0.37 C ATOM 1062 O ASP A 92 -6.289 -9.025 9.238 1.00 0.35 O ATOM 1063 CB ASP A 92 -6.854 -8.077 12.377 1.00 0.39 C ATOM 1064 CG ASP A 92 -5.798 -8.884 13.148 1.00 0.56 C ATOM 1065 OD1 ASP A 92 -4.610 -8.489 13.193 1.00 1.37 O ATOM 1066 OD2 ASP A 92 -6.155 -9.939 13.731 1.00 1.38 O ATOM 0 H ASP A 92 -8.431 -7.407 10.667 1.00 0.31 H new ATOM 0 HA ASP A 92 -5.685 -6.637 11.278 1.00 0.36 H new ATOM 0 HB2 ASP A 92 -7.223 -7.286 13.030 1.00 0.39 H new ATOM 0 HB3 ASP A 92 -7.697 -8.734 12.163 1.00 0.39 H new ATOM 1071 N GLU A 93 -4.398 -8.735 10.383 1.00 0.43 N ATOM 1072 CA GLU A 93 -3.576 -9.623 9.538 1.00 0.45 C ATOM 1073 C GLU A 93 -4.086 -11.076 9.472 1.00 0.48 C ATOM 1074 O GLU A 93 -3.719 -11.818 8.568 1.00 0.52 O ATOM 1075 CB GLU A 93 -2.101 -9.563 9.979 1.00 0.55 C ATOM 1076 CG GLU A 93 -1.889 -9.928 11.455 1.00 0.84 C ATOM 1077 CD GLU A 93 -0.416 -10.093 11.839 1.00 0.95 C ATOM 1078 OE1 GLU A 93 0.469 -9.345 11.353 1.00 1.95 O ATOM 1079 OE2 GLU A 93 -0.139 -10.943 12.721 1.00 1.93 O ATOM 0 H GLU A 93 -3.891 -8.355 11.183 1.00 0.43 H new ATOM 0 HA GLU A 93 -3.663 -9.246 8.519 1.00 0.45 H new ATOM 0 HB2 GLU A 93 -1.516 -10.241 9.357 1.00 0.55 H new ATOM 0 HB3 GLU A 93 -1.718 -8.558 9.803 1.00 0.55 H new ATOM 0 HG2 GLU A 93 -2.334 -9.154 12.080 1.00 0.84 H new ATOM 0 HG3 GLU A 93 -2.419 -10.856 11.671 1.00 0.84 H new ATOM 1086 N ASN A 94 -4.978 -11.480 10.381 1.00 0.59 N ATOM 1087 CA ASN A 94 -5.644 -12.785 10.388 1.00 0.69 C ATOM 1088 C ASN A 94 -6.965 -12.787 9.573 1.00 0.60 C ATOM 1089 O ASN A 94 -7.699 -13.781 9.580 1.00 0.72 O ATOM 1090 CB ASN A 94 -5.865 -13.201 11.854 1.00 0.84 C ATOM 1091 CG ASN A 94 -4.598 -13.186 12.695 1.00 1.89 C ATOM 1092 OD1 ASN A 94 -3.779 -14.093 12.661 1.00 3.63 O ATOM 1093 ND2 ASN A 94 -4.388 -12.143 13.464 1.00 1.61 N ATOM 0 H ASN A 94 -5.266 -10.887 11.159 1.00 0.59 H new ATOM 0 HA ASN A 94 -5.007 -13.516 9.890 1.00 0.69 H new ATOM 0 HB2 ASN A 94 -6.597 -12.531 12.305 1.00 0.84 H new ATOM 0 HB3 ASN A 94 -6.293 -14.203 11.877 1.00 0.84 H new ATOM 0 HD21 ASN A 94 -3.542 -12.090 14.032 1.00 1.61 H new ATOM 0 HD22 ASN A 94 -5.070 -11.385 13.493 1.00 1.61 H new ATOM 1100 N GLY A 95 -7.310 -11.669 8.915 1.00 0.49 N ATOM 1101 CA GLY A 95 -8.516 -11.473 8.095 1.00 0.50 C ATOM 1102 C GLY A 95 -9.776 -11.067 8.871 1.00 0.48 C ATOM 1103 O GLY A 95 -10.824 -10.845 8.263 1.00 0.62 O ATOM 0 H GLY A 95 -6.725 -10.834 8.942 1.00 0.49 H new ATOM 0 HA2 GLY A 95 -8.307 -10.708 7.347 1.00 0.50 H new ATOM 0 HA3 GLY A 95 -8.723 -12.397 7.556 1.00 0.50 H new ATOM 1107 N GLN A 96 -9.679 -10.926 10.196 1.00 0.42 N ATOM 1108 CA GLN A 96 -10.749 -10.438 11.062 1.00 0.44 C ATOM 1109 C GLN A 96 -11.016 -8.958 10.780 1.00 0.41 C ATOM 1110 O GLN A 96 -10.080 -8.174 10.663 1.00 0.35 O ATOM 1111 CB GLN A 96 -10.348 -10.669 12.529 1.00 0.48 C ATOM 1112 CG GLN A 96 -11.324 -10.004 13.507 1.00 0.57 C ATOM 1113 CD GLN A 96 -11.317 -10.668 14.876 1.00 1.29 C ATOM 1114 OE1 GLN A 96 -10.300 -10.805 15.548 1.00 2.26 O ATOM 1115 NE2 GLN A 96 -12.465 -11.098 15.332 1.00 1.82 N ATOM 0 H GLN A 96 -8.827 -11.156 10.708 1.00 0.42 H new ATOM 0 HA GLN A 96 -11.672 -10.982 10.863 1.00 0.44 H new ATOM 0 HB2 GLN A 96 -10.309 -11.740 12.729 1.00 0.48 H new ATOM 0 HB3 GLN A 96 -9.345 -10.277 12.696 1.00 0.48 H new ATOM 0 HG2 GLN A 96 -11.064 -8.951 13.616 1.00 0.57 H new ATOM 0 HG3 GLN A 96 -12.332 -10.042 13.093 1.00 0.57 H new ATOM 0 HE21 GLN A 96 -13.311 -10.984 14.773 1.00 1.82 H new ATOM 0 HE22 GLN A 96 -12.515 -11.547 16.246 1.00 1.82 H new ATOM 1124 N THR A 97 -12.282 -8.555 10.705 1.00 0.49 N ATOM 1125 CA THR A 97 -12.675 -7.188 10.354 1.00 0.51 C ATOM 1126 C THR A 97 -12.989 -6.363 11.605 1.00 0.52 C ATOM 1127 O THR A 97 -13.484 -6.883 12.609 1.00 0.59 O ATOM 1128 CB THR A 97 -13.783 -7.163 9.292 1.00 0.67 C ATOM 1129 OG1 THR A 97 -15.065 -7.295 9.856 1.00 0.84 O ATOM 1130 CG2 THR A 97 -13.643 -8.259 8.230 1.00 0.62 C ATOM 0 H THR A 97 -13.073 -9.172 10.887 1.00 0.49 H new ATOM 0 HA THR A 97 -11.823 -6.699 9.882 1.00 0.51 H new ATOM 0 HB THR A 97 -13.667 -6.188 8.819 1.00 0.67 H new ATOM 0 HG1 THR A 97 -15.739 -7.272 9.145 1.00 0.84 H new ATOM 0 HG21 THR A 97 -14.461 -8.178 7.514 1.00 0.62 H new ATOM 0 HG22 THR A 97 -12.692 -8.142 7.710 1.00 0.62 H new ATOM 0 HG23 THR A 97 -13.676 -9.237 8.710 1.00 0.62 H new ATOM 1138 N LEU A 98 -12.678 -5.067 11.573 1.00 0.51 N ATOM 1139 CA LEU A 98 -12.674 -4.184 12.749 1.00 0.56 C ATOM 1140 C LEU A 98 -13.983 -3.401 12.962 1.00 0.64 C ATOM 1141 O LEU A 98 -14.125 -2.738 13.992 1.00 0.74 O ATOM 1142 CB LEU A 98 -11.458 -3.238 12.635 1.00 0.57 C ATOM 1143 CG LEU A 98 -10.074 -3.816 12.996 1.00 0.57 C ATOM 1144 CD1 LEU A 98 -9.917 -3.991 14.496 1.00 0.70 C ATOM 1145 CD2 LEU A 98 -9.729 -5.172 12.380 1.00 0.41 C ATOM 0 H LEU A 98 -12.416 -4.587 10.712 1.00 0.51 H new ATOM 0 HA LEU A 98 -12.595 -4.812 13.636 1.00 0.56 H new ATOM 0 HB2 LEU A 98 -11.413 -2.870 11.610 1.00 0.57 H new ATOM 0 HB3 LEU A 98 -11.641 -2.376 13.276 1.00 0.57 H new ATOM 0 HG LEU A 98 -9.398 -3.070 12.578 1.00 0.57 H new ATOM 0 HD11 LEU A 98 -8.930 -4.400 14.713 1.00 0.70 H new ATOM 0 HD12 LEU A 98 -10.026 -3.025 14.988 1.00 0.70 H new ATOM 0 HD13 LEU A 98 -10.682 -4.674 14.865 1.00 0.70 H new ATOM 0 HD21 LEU A 98 -8.734 -5.476 12.704 1.00 0.41 H new ATOM 0 HD22 LEU A 98 -10.459 -5.915 12.703 1.00 0.41 H new ATOM 0 HD23 LEU A 98 -9.748 -5.093 11.293 1.00 0.41 H new ATOM 1157 N GLY A 99 -14.930 -3.453 12.017 1.00 0.65 N ATOM 1158 CA GLY A 99 -16.188 -2.702 12.099 1.00 0.72 C ATOM 1159 C GLY A 99 -16.052 -1.222 11.715 1.00 0.67 C ATOM 1160 O GLY A 99 -16.763 -0.378 12.264 1.00 0.69 O ATOM 0 H GLY A 99 -14.845 -4.018 11.172 1.00 0.65 H new ATOM 0 HA2 GLY A 99 -16.924 -3.171 11.446 1.00 0.72 H new ATOM 0 HA3 GLY A 99 -16.575 -2.770 13.116 1.00 0.72 H new ATOM 1164 N VAL A 100 -15.114 -0.894 10.815 1.00 0.65 N ATOM 1165 CA VAL A 100 -14.887 0.455 10.261 1.00 0.66 C ATOM 1166 C VAL A 100 -14.569 0.340 8.766 1.00 0.59 C ATOM 1167 O VAL A 100 -13.915 -0.616 8.348 1.00 0.51 O ATOM 1168 CB VAL A 100 -13.737 1.187 10.996 1.00 0.68 C ATOM 1169 CG1 VAL A 100 -13.544 2.622 10.482 1.00 1.24 C ATOM 1170 CG2 VAL A 100 -13.978 1.285 12.507 1.00 1.14 C ATOM 0 H VAL A 100 -14.466 -1.585 10.436 1.00 0.65 H new ATOM 0 HA VAL A 100 -15.794 1.043 10.404 1.00 0.66 H new ATOM 0 HB VAL A 100 -12.851 0.586 10.794 1.00 0.68 H new ATOM 0 HG11 VAL A 100 -12.727 3.097 11.026 1.00 1.24 H new ATOM 0 HG12 VAL A 100 -13.306 2.599 9.418 1.00 1.24 H new ATOM 0 HG13 VAL A 100 -14.461 3.190 10.636 1.00 1.24 H new ATOM 0 HG21 VAL A 100 -13.143 1.806 12.976 1.00 1.14 H new ATOM 0 HG22 VAL A 100 -14.900 1.835 12.693 1.00 1.14 H new ATOM 0 HG23 VAL A 100 -14.062 0.283 12.928 1.00 1.14 H new ATOM 1180 N ASN A 101 -15.012 1.312 7.970 1.00 0.67 N ATOM 1181 CA ASN A 101 -14.866 1.437 6.534 1.00 0.64 C ATOM 1182 C ASN A 101 -14.235 2.794 6.158 1.00 0.62 C ATOM 1183 O ASN A 101 -14.202 3.710 6.982 1.00 0.63 O ATOM 1184 CB ASN A 101 -16.305 1.286 6.010 1.00 0.76 C ATOM 1185 CG ASN A 101 -16.539 1.800 4.618 1.00 1.01 C ATOM 1186 OD1 ASN A 101 -16.967 2.925 4.396 1.00 1.49 O ATOM 1187 ND2 ASN A 101 -16.255 1.015 3.623 1.00 0.96 N ATOM 0 H ASN A 101 -15.529 2.101 8.357 1.00 0.67 H new ATOM 0 HA ASN A 101 -14.196 0.695 6.099 1.00 0.64 H new ATOM 0 HB2 ASN A 101 -16.576 0.231 6.040 1.00 0.76 H new ATOM 0 HB3 ASN A 101 -16.978 1.808 6.690 1.00 0.76 H new ATOM 0 HD21 ASN A 101 -16.389 1.337 2.665 1.00 0.96 H new ATOM 0 HD22 ASN A 101 -15.898 0.076 3.800 1.00 0.96 H new ATOM 1194 N ILE A 102 -13.721 2.911 4.930 1.00 0.59 N ATOM 1195 CA ILE A 102 -12.968 4.082 4.446 1.00 0.55 C ATOM 1196 C ILE A 102 -13.435 4.493 3.027 1.00 0.58 C ATOM 1197 O ILE A 102 -13.601 3.629 2.160 1.00 0.63 O ATOM 1198 CB ILE A 102 -11.440 3.789 4.533 1.00 0.47 C ATOM 1199 CG1 ILE A 102 -10.995 3.369 5.962 1.00 0.45 C ATOM 1200 CG2 ILE A 102 -10.654 5.039 4.115 1.00 0.47 C ATOM 1201 CD1 ILE A 102 -9.556 2.847 6.116 1.00 0.38 C ATOM 0 H ILE A 102 -13.817 2.180 4.225 1.00 0.59 H new ATOM 0 HA ILE A 102 -13.170 4.943 5.084 1.00 0.55 H new ATOM 0 HB ILE A 102 -11.233 2.956 3.861 1.00 0.47 H new ATOM 0 HG12 ILE A 102 -11.117 4.228 6.622 1.00 0.45 H new ATOM 0 HG13 ILE A 102 -11.676 2.596 6.316 1.00 0.45 H new ATOM 0 HG21 ILE A 102 -9.585 4.834 4.176 1.00 0.47 H new ATOM 0 HG22 ILE A 102 -10.914 5.307 3.091 1.00 0.47 H new ATOM 0 HG23 ILE A 102 -10.903 5.865 4.781 1.00 0.47 H new ATOM 0 HD11 ILE A 102 -9.372 2.589 7.159 1.00 0.38 H new ATOM 0 HD12 ILE A 102 -9.421 1.962 5.494 1.00 0.38 H new ATOM 0 HD13 ILE A 102 -8.853 3.620 5.804 1.00 0.38 H new ATOM 1213 N ASP A 103 -13.645 5.795 2.758 1.00 0.58 N ATOM 1214 CA ASP A 103 -13.950 6.311 1.408 1.00 0.60 C ATOM 1215 C ASP A 103 -12.721 6.224 0.488 1.00 0.56 C ATOM 1216 O ASP A 103 -11.631 6.532 0.968 1.00 0.51 O ATOM 1217 CB ASP A 103 -14.331 7.798 1.484 1.00 0.67 C ATOM 1218 CG ASP A 103 -15.337 8.191 0.410 1.00 0.89 C ATOM 1219 OD1 ASP A 103 -16.558 8.048 0.656 1.00 1.68 O ATOM 1220 OD2 ASP A 103 -14.905 8.627 -0.682 1.00 2.25 O ATOM 0 H ASP A 103 -13.608 6.522 3.472 1.00 0.58 H new ATOM 0 HA ASP A 103 -14.767 5.706 1.015 1.00 0.60 H new ATOM 0 HB2 ASP A 103 -14.749 8.014 2.467 1.00 0.67 H new ATOM 0 HB3 ASP A 103 -13.433 8.407 1.378 1.00 0.67 H new ATOM 1225 N PRO A 104 -12.822 5.930 -0.825 1.00 0.62 N ATOM 1226 CA PRO A 104 -11.643 5.945 -1.688 1.00 0.60 C ATOM 1227 C PRO A 104 -11.229 7.360 -2.110 1.00 0.63 C ATOM 1228 O PRO A 104 -10.073 7.573 -2.466 1.00 0.66 O ATOM 1229 CB PRO A 104 -12.013 5.048 -2.862 1.00 0.64 C ATOM 1230 CG PRO A 104 -13.510 5.293 -3.021 1.00 0.91 C ATOM 1231 CD PRO A 104 -14.011 5.605 -1.608 1.00 0.77 C ATOM 0 HA PRO A 104 -10.757 5.577 -1.171 1.00 0.60 H new ATOM 0 HB2 PRO A 104 -11.462 5.315 -3.764 1.00 0.64 H new ATOM 0 HB3 PRO A 104 -11.795 4.000 -2.654 1.00 0.64 H new ATOM 0 HG2 PRO A 104 -13.704 6.122 -3.701 1.00 0.91 H new ATOM 0 HG3 PRO A 104 -14.012 4.418 -3.434 1.00 0.91 H new ATOM 0 HD2 PRO A 104 -14.713 6.439 -1.618 1.00 0.77 H new ATOM 0 HD3 PRO A 104 -14.537 4.751 -1.183 1.00 0.77 H new ATOM 1239 N GLN A 105 -12.146 8.331 -2.041 1.00 0.66 N ATOM 1240 CA GLN A 105 -11.892 9.725 -2.401 1.00 0.71 C ATOM 1241 C GLN A 105 -11.377 10.547 -1.216 1.00 0.73 C ATOM 1242 O GLN A 105 -10.397 11.281 -1.342 1.00 0.81 O ATOM 1243 CB GLN A 105 -13.172 10.347 -2.986 1.00 0.80 C ATOM 1244 CG GLN A 105 -13.834 9.477 -4.052 1.00 0.82 C ATOM 1245 CD GLN A 105 -12.906 9.147 -5.214 1.00 0.80 C ATOM 1246 OE1 GLN A 105 -12.851 7.907 -5.629 1.00 1.32 O flip ATOM 1247 NE2 GLN A 105 -12.184 9.988 -5.736 1.00 0.90 N flip ATOM 0 H GLN A 105 -13.102 8.164 -1.727 1.00 0.66 H new ATOM 0 HA GLN A 105 -11.104 9.740 -3.154 1.00 0.71 H new ATOM 0 HB2 GLN A 105 -13.883 10.525 -2.179 1.00 0.80 H new ATOM 0 HB3 GLN A 105 -12.931 11.318 -3.418 1.00 0.80 H new ATOM 0 HG2 GLN A 105 -14.177 8.549 -3.594 1.00 0.82 H new ATOM 0 HG3 GLN A 105 -14.717 9.989 -4.434 1.00 0.82 H new ATOM 0 HE21 GLN A 105 -12.219 10.957 -5.420 1.00 0.90 H new ATOM 0 HE22 GLN A 105 -11.548 9.719 -6.487 1.00 0.90 H new ATOM 1256 N THR A 106 -12.043 10.409 -0.064 1.00 0.72 N ATOM 1257 CA THR A 106 -11.805 11.229 1.141 1.00 0.73 C ATOM 1258 C THR A 106 -10.803 10.604 2.106 1.00 0.65 C ATOM 1259 O THR A 106 -10.111 11.322 2.828 1.00 0.72 O ATOM 1260 CB THR A 106 -13.119 11.496 1.907 1.00 0.78 C ATOM 1261 OG1 THR A 106 -13.504 10.404 2.694 1.00 0.73 O ATOM 1262 CG2 THR A 106 -14.300 11.772 0.990 1.00 0.86 C ATOM 0 H THR A 106 -12.777 9.713 0.065 1.00 0.72 H new ATOM 0 HA THR A 106 -11.386 12.165 0.771 1.00 0.73 H new ATOM 0 HB THR A 106 -12.891 12.371 2.516 1.00 0.78 H new ATOM 0 HG1 THR A 106 -14.459 10.472 2.902 1.00 0.73 H new ATOM 0 HG21 THR A 106 -15.192 11.951 1.590 1.00 0.86 H new ATOM 0 HG22 THR A 106 -14.090 12.651 0.380 1.00 0.86 H new ATOM 0 HG23 THR A 106 -14.466 10.912 0.341 1.00 0.86 H new ATOM 1270 N PHE A 107 -10.710 9.268 2.118 1.00 0.54 N ATOM 1271 CA PHE A 107 -10.012 8.473 3.136 1.00 0.53 C ATOM 1272 C PHE A 107 -10.530 8.717 4.583 1.00 0.59 C ATOM 1273 O PHE A 107 -9.835 8.399 5.552 1.00 0.69 O ATOM 1274 CB PHE A 107 -8.482 8.596 3.011 1.00 0.65 C ATOM 1275 CG PHE A 107 -7.745 8.025 1.804 1.00 0.49 C ATOM 1276 CD1 PHE A 107 -8.337 7.269 0.764 1.00 1.89 C ATOM 1277 CD2 PHE A 107 -6.349 8.190 1.802 1.00 2.10 C ATOM 1278 CE1 PHE A 107 -7.524 6.607 -0.163 1.00 1.80 C ATOM 1279 CE2 PHE A 107 -5.547 7.581 0.825 1.00 2.19 C ATOM 1280 CZ PHE A 107 -6.130 6.758 -0.147 1.00 0.61 C ATOM 0 H PHE A 107 -11.134 8.690 1.392 1.00 0.54 H new ATOM 0 HA PHE A 107 -10.260 7.432 2.928 1.00 0.53 H new ATOM 0 HB2 PHE A 107 -8.242 9.658 3.059 1.00 0.65 H new ATOM 0 HB3 PHE A 107 -8.051 8.132 3.898 1.00 0.65 H new ATOM 0 HD1 PHE A 107 -9.412 7.203 0.686 1.00 1.89 H new ATOM 0 HD2 PHE A 107 -5.886 8.796 2.566 1.00 2.10 H new ATOM 0 HE1 PHE A 107 -7.979 5.968 -0.905 1.00 1.80 H new ATOM 0 HE2 PHE A 107 -4.480 7.747 0.822 1.00 2.19 H new ATOM 0 HZ PHE A 107 -5.515 6.247 -0.873 1.00 0.61 H new ATOM 1290 N LYS A 108 -11.741 9.271 4.776 1.00 0.62 N ATOM 1291 CA LYS A 108 -12.369 9.393 6.106 1.00 0.72 C ATOM 1292 C LYS A 108 -12.798 8.021 6.619 1.00 0.60 C ATOM 1293 O LYS A 108 -13.236 7.175 5.842 1.00 0.59 O ATOM 1294 CB LYS A 108 -13.518 10.430 6.113 1.00 1.02 C ATOM 1295 CG LYS A 108 -14.870 9.970 5.525 1.00 1.19 C ATOM 1296 CD LYS A 108 -15.824 9.321 6.543 1.00 1.81 C ATOM 1297 CE LYS A 108 -17.058 8.693 5.884 1.00 2.62 C ATOM 1298 NZ LYS A 108 -18.112 9.687 5.571 1.00 3.37 N ATOM 0 H LYS A 108 -12.311 9.646 4.018 1.00 0.62 H new ATOM 0 HA LYS A 108 -11.626 9.780 6.803 1.00 0.72 H new ATOM 0 HB2 LYS A 108 -13.685 10.747 7.143 1.00 1.02 H new ATOM 0 HB3 LYS A 108 -13.187 11.308 5.559 1.00 1.02 H new ATOM 0 HG2 LYS A 108 -15.368 10.830 5.077 1.00 1.19 H new ATOM 0 HG3 LYS A 108 -14.679 9.259 4.722 1.00 1.19 H new ATOM 0 HD2 LYS A 108 -15.286 8.555 7.101 1.00 1.81 H new ATOM 0 HD3 LYS A 108 -16.146 10.073 7.263 1.00 1.81 H new ATOM 0 HE2 LYS A 108 -16.757 8.189 4.966 1.00 2.62 H new ATOM 0 HE3 LYS A 108 -17.469 7.931 6.546 1.00 2.62 H new ATOM 0 HZ1 LYS A 108 -18.921 9.207 5.128 1.00 3.37 H new ATOM 0 HZ2 LYS A 108 -18.423 10.151 6.448 1.00 3.37 H new ATOM 0 HZ3 LYS A 108 -17.733 10.401 4.917 1.00 3.37 H new ATOM 1312 N LEU A 109 -12.727 7.830 7.934 1.00 0.64 N ATOM 1313 CA LEU A 109 -13.171 6.609 8.619 1.00 0.65 C ATOM 1314 C LEU A 109 -14.666 6.672 8.958 1.00 0.74 C ATOM 1315 O LEU A 109 -15.146 7.694 9.460 1.00 0.76 O ATOM 1316 CB LEU A 109 -12.351 6.429 9.905 1.00 0.67 C ATOM 1317 CG LEU A 109 -10.864 6.129 9.654 1.00 0.59 C ATOM 1318 CD1 LEU A 109 -9.999 6.583 10.823 1.00 0.65 C ATOM 1319 CD2 LEU A 109 -10.644 4.635 9.505 1.00 0.53 C ATOM 0 H LEU A 109 -12.352 8.533 8.571 1.00 0.64 H new ATOM 0 HA LEU A 109 -13.016 5.760 7.953 1.00 0.65 H new ATOM 0 HB2 LEU A 109 -12.433 7.334 10.507 1.00 0.67 H new ATOM 0 HB3 LEU A 109 -12.783 5.617 10.490 1.00 0.67 H new ATOM 0 HG LEU A 109 -10.587 6.665 8.746 1.00 0.59 H new ATOM 0 HD11 LEU A 109 -8.954 6.356 10.612 1.00 0.65 H new ATOM 0 HD12 LEU A 109 -10.115 7.657 10.966 1.00 0.65 H new ATOM 0 HD13 LEU A 109 -10.308 6.061 11.729 1.00 0.65 H new ATOM 0 HD21 LEU A 109 -9.587 4.439 9.328 1.00 0.53 H new ATOM 0 HD22 LEU A 109 -10.959 4.128 10.417 1.00 0.53 H new ATOM 0 HD23 LEU A 109 -11.228 4.263 8.663 1.00 0.53 H new ATOM 1331 N SER A 110 -15.387 5.565 8.777 1.00 0.82 N ATOM 1332 CA SER A 110 -16.816 5.431 9.127 1.00 0.99 C ATOM 1333 C SER A 110 -17.091 5.376 10.642 1.00 1.12 C ATOM 1334 O SER A 110 -18.244 5.262 11.066 1.00 1.37 O ATOM 1335 CB SER A 110 -17.446 4.221 8.427 1.00 1.09 C ATOM 1336 OG SER A 110 -17.080 3.012 9.065 1.00 1.41 O ATOM 0 H SER A 110 -14.993 4.714 8.375 1.00 0.82 H new ATOM 0 HA SER A 110 -17.287 6.345 8.766 1.00 0.99 H new ATOM 0 HB2 SER A 110 -18.531 4.322 8.428 1.00 1.09 H new ATOM 0 HB3 SER A 110 -17.129 4.195 7.384 1.00 1.09 H new ATOM 0 HG SER A 110 -17.617 2.276 8.704 1.00 1.41 H new ATOM 1342 N GLY A 111 -16.037 5.458 11.456 1.00 1.06 N ATOM 1343 CA GLY A 111 -16.036 5.387 12.916 1.00 1.17 C ATOM 1344 C GLY A 111 -14.655 5.720 13.494 1.00 1.12 C ATOM 1345 O GLY A 111 -13.854 6.402 12.850 1.00 1.06 O ATOM 0 H GLY A 111 -15.096 5.585 11.085 1.00 1.06 H new ATOM 0 HA2 GLY A 111 -16.776 6.081 13.316 1.00 1.17 H new ATOM 0 HA3 GLY A 111 -16.333 4.387 13.233 1.00 1.17 H new ATOM 1349 N ALA A 112 -14.368 5.249 14.706 1.00 1.20 N ATOM 1350 CA ALA A 112 -13.120 5.529 15.417 1.00 1.18 C ATOM 1351 C ALA A 112 -11.899 4.759 14.864 1.00 1.00 C ATOM 1352 O ALA A 112 -12.013 3.868 14.022 1.00 1.11 O ATOM 1353 CB ALA A 112 -13.365 5.249 16.909 1.00 1.40 C ATOM 0 H ALA A 112 -15.006 4.652 15.231 1.00 1.20 H new ATOM 0 HA ALA A 112 -12.853 6.575 15.265 1.00 1.18 H new ATOM 0 HB1 ALA A 112 -12.453 5.448 17.471 1.00 1.40 H new ATOM 0 HB2 ALA A 112 -14.164 5.894 17.274 1.00 1.40 H new ATOM 0 HB3 ALA A 112 -13.652 4.206 17.041 1.00 1.40 H new ATOM 1359 N MET A 113 -10.707 5.101 15.362 1.00 0.99 N ATOM 1360 CA MET A 113 -9.453 4.415 15.032 1.00 0.90 C ATOM 1361 C MET A 113 -9.488 2.971 15.589 1.00 0.85 C ATOM 1362 O MET A 113 -9.941 2.782 16.728 1.00 1.08 O ATOM 1363 CB MET A 113 -8.280 5.238 15.609 1.00 1.13 C ATOM 1364 CG MET A 113 -7.020 5.236 14.743 1.00 1.05 C ATOM 1365 SD MET A 113 -7.143 6.210 13.217 1.00 1.87 S ATOM 1366 CE MET A 113 -6.845 4.933 11.971 1.00 1.07 C ATOM 0 H MET A 113 -10.584 5.874 16.016 1.00 0.99 H new ATOM 0 HA MET A 113 -9.320 4.339 13.953 1.00 0.90 H new ATOM 0 HB2 MET A 113 -8.609 6.268 15.748 1.00 1.13 H new ATOM 0 HB3 MET A 113 -8.029 4.848 16.595 1.00 1.13 H new ATOM 0 HG2 MET A 113 -6.189 5.618 15.335 1.00 1.05 H new ATOM 0 HG3 MET A 113 -6.778 4.206 14.481 1.00 1.05 H new ATOM 0 HE1 MET A 113 -6.555 5.402 11.031 1.00 1.07 H new ATOM 0 HE2 MET A 113 -6.046 4.274 12.310 1.00 1.07 H new ATOM 0 HE3 MET A 113 -7.755 4.352 11.820 1.00 1.07 H new ATOM 1376 N PRO A 114 -9.049 1.942 14.841 1.00 0.65 N ATOM 1377 CA PRO A 114 -9.169 0.545 15.265 1.00 0.62 C ATOM 1378 C PRO A 114 -8.109 0.129 16.296 1.00 0.71 C ATOM 1379 O PRO A 114 -7.066 0.775 16.448 1.00 0.87 O ATOM 1380 CB PRO A 114 -9.023 -0.270 13.976 1.00 0.51 C ATOM 1381 CG PRO A 114 -8.055 0.581 13.168 1.00 0.53 C ATOM 1382 CD PRO A 114 -8.500 1.996 13.494 1.00 0.59 C ATOM 0 HA PRO A 114 -10.121 0.379 15.770 1.00 0.62 H new ATOM 0 HB2 PRO A 114 -8.627 -1.267 14.167 1.00 0.51 H new ATOM 0 HB3 PRO A 114 -9.977 -0.398 13.465 1.00 0.51 H new ATOM 0 HG2 PRO A 114 -7.020 0.405 13.461 1.00 0.53 H new ATOM 0 HG3 PRO A 114 -8.125 0.371 12.101 1.00 0.53 H new ATOM 0 HD2 PRO A 114 -7.662 2.691 13.442 1.00 0.59 H new ATOM 0 HD3 PRO A 114 -9.248 2.344 12.781 1.00 0.59 H new ATOM 1390 N ALA A 115 -8.351 -1.012 16.944 1.00 0.74 N ATOM 1391 CA ALA A 115 -7.388 -1.700 17.799 1.00 0.81 C ATOM 1392 C ALA A 115 -6.429 -2.601 16.995 1.00 0.81 C ATOM 1393 O ALA A 115 -5.295 -2.217 16.723 1.00 1.14 O ATOM 1394 CB ALA A 115 -8.150 -2.467 18.886 1.00 0.90 C ATOM 0 H ALA A 115 -9.248 -1.494 16.885 1.00 0.74 H new ATOM 0 HA ALA A 115 -6.745 -0.962 18.278 1.00 0.81 H new ATOM 0 HB1 ALA A 115 -7.440 -2.985 19.531 1.00 0.90 H new ATOM 0 HB2 ALA A 115 -8.737 -1.768 19.481 1.00 0.90 H new ATOM 0 HB3 ALA A 115 -8.815 -3.194 18.420 1.00 0.90 H new ATOM 1400 N THR A 116 -6.886 -3.781 16.559 1.00 0.75 N ATOM 1401 CA THR A 116 -6.032 -4.857 16.006 1.00 0.73 C ATOM 1402 C THR A 116 -5.653 -4.742 14.520 1.00 0.51 C ATOM 1403 O THR A 116 -5.041 -5.659 13.974 1.00 0.51 O ATOM 1404 CB THR A 116 -6.639 -6.244 16.302 1.00 0.94 C ATOM 1405 OG1 THR A 116 -7.878 -6.410 15.652 1.00 1.04 O ATOM 1406 CG2 THR A 116 -6.922 -6.444 17.789 1.00 1.24 C ATOM 0 H THR A 116 -7.876 -4.026 16.578 1.00 0.75 H new ATOM 0 HA THR A 116 -5.085 -4.729 16.531 1.00 0.73 H new ATOM 0 HB THR A 116 -5.899 -6.961 15.948 1.00 0.94 H new ATOM 0 HG1 THR A 116 -8.238 -7.298 15.856 1.00 1.04 H new ATOM 0 HG21 THR A 116 -7.348 -7.434 17.948 1.00 1.24 H new ATOM 0 HG22 THR A 116 -5.993 -6.354 18.352 1.00 1.24 H new ATOM 0 HG23 THR A 116 -7.627 -5.686 18.130 1.00 1.24 H new ATOM 1414 N ALA A 117 -6.009 -3.636 13.855 1.00 0.42 N ATOM 1415 CA ALA A 117 -5.870 -3.450 12.402 1.00 0.36 C ATOM 1416 C ALA A 117 -4.435 -3.608 11.853 1.00 0.35 C ATOM 1417 O ALA A 117 -3.470 -3.121 12.440 1.00 0.44 O ATOM 1418 CB ALA A 117 -6.412 -2.067 12.029 1.00 0.37 C ATOM 0 H ALA A 117 -6.412 -2.824 14.323 1.00 0.42 H new ATOM 0 HA ALA A 117 -6.443 -4.254 11.939 1.00 0.36 H new ATOM 0 HB1 ALA A 117 -6.315 -1.916 10.954 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -7.463 -2.000 12.311 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -5.845 -1.300 12.556 1.00 0.37 H new ATOM 1424 N MET A 118 -4.324 -4.193 10.658 1.00 0.29 N ATOM 1425 CA MET A 118 -3.088 -4.412 9.904 1.00 0.29 C ATOM 1426 C MET A 118 -2.578 -3.101 9.289 1.00 0.28 C ATOM 1427 O MET A 118 -3.097 -2.635 8.279 1.00 0.34 O ATOM 1428 CB MET A 118 -3.399 -5.474 8.835 1.00 0.30 C ATOM 1429 CG MET A 118 -2.256 -5.751 7.859 1.00 0.35 C ATOM 1430 SD MET A 118 -2.564 -7.187 6.789 1.00 1.80 S ATOM 1431 CE MET A 118 -0.959 -8.030 6.823 1.00 0.56 C ATOM 0 H MET A 118 -5.142 -4.547 10.162 1.00 0.29 H new ATOM 0 HA MET A 118 -2.287 -4.763 10.555 1.00 0.29 H new ATOM 0 HB2 MET A 118 -3.666 -6.405 9.334 1.00 0.30 H new ATOM 0 HB3 MET A 118 -4.273 -5.154 8.268 1.00 0.30 H new ATOM 0 HG2 MET A 118 -2.096 -4.870 7.237 1.00 0.35 H new ATOM 0 HG3 MET A 118 -1.337 -5.915 8.422 1.00 0.35 H new ATOM 0 HE1 MET A 118 -0.676 -8.314 5.810 1.00 0.56 H new ATOM 0 HE2 MET A 118 -0.205 -7.360 7.236 1.00 0.56 H new ATOM 0 HE3 MET A 118 -1.030 -8.923 7.444 1.00 0.56 H new ATOM 1441 N LYS A 119 -1.561 -2.489 9.893 1.00 0.31 N ATOM 1442 CA LYS A 119 -1.013 -1.169 9.504 1.00 0.32 C ATOM 1443 C LYS A 119 0.462 -1.011 9.895 1.00 0.37 C ATOM 1444 O LYS A 119 0.881 -1.557 10.916 1.00 0.48 O ATOM 1445 CB LYS A 119 -1.870 -0.074 10.156 1.00 0.35 C ATOM 1446 CG LYS A 119 -1.929 -0.145 11.692 1.00 0.41 C ATOM 1447 CD LYS A 119 -3.272 0.392 12.200 1.00 0.49 C ATOM 1448 CE LYS A 119 -3.502 0.061 13.681 1.00 0.62 C ATOM 1449 NZ LYS A 119 -2.452 0.588 14.588 1.00 0.93 N ATOM 0 H LYS A 119 -1.075 -2.900 10.690 1.00 0.31 H new ATOM 0 HA LYS A 119 -1.052 -1.082 8.418 1.00 0.32 H new ATOM 0 HB2 LYS A 119 -1.477 0.900 9.864 1.00 0.35 H new ATOM 0 HB3 LYS A 119 -2.884 -0.140 9.762 1.00 0.35 H new ATOM 0 HG2 LYS A 119 -1.794 -1.176 12.020 1.00 0.41 H new ATOM 0 HG3 LYS A 119 -1.112 0.435 12.121 1.00 0.41 H new ATOM 0 HD2 LYS A 119 -3.306 1.473 12.061 1.00 0.49 H new ATOM 0 HD3 LYS A 119 -4.080 -0.032 11.604 1.00 0.49 H new ATOM 0 HE2 LYS A 119 -4.467 0.464 13.987 1.00 0.62 H new ATOM 0 HE3 LYS A 119 -3.557 -1.021 13.796 1.00 0.62 H new ATOM 0 HZ1 LYS A 119 -2.694 0.354 15.572 1.00 0.93 H new ATOM 0 HZ2 LYS A 119 -1.536 0.159 14.345 1.00 0.93 H new ATOM 0 HZ3 LYS A 119 -2.389 1.621 14.483 1.00 0.93 H new ATOM 1463 N LYS A 120 1.254 -0.281 9.105 1.00 0.34 N ATOM 1464 CA LYS A 120 2.685 -0.005 9.366 1.00 0.37 C ATOM 1465 C LYS A 120 3.157 1.206 8.556 1.00 0.38 C ATOM 1466 O LYS A 120 2.560 1.523 7.531 1.00 0.47 O ATOM 1467 CB LYS A 120 3.534 -1.257 9.021 1.00 0.52 C ATOM 1468 CG LYS A 120 4.946 -1.234 9.633 1.00 0.57 C ATOM 1469 CD LYS A 120 5.822 -2.407 9.179 1.00 0.69 C ATOM 1470 CE LYS A 120 7.315 -2.091 9.361 1.00 1.16 C ATOM 1471 NZ LYS A 120 7.720 -2.020 10.783 1.00 1.93 N ATOM 0 H LYS A 120 0.918 0.149 8.243 1.00 0.34 H new ATOM 0 HA LYS A 120 2.812 0.226 10.424 1.00 0.37 H new ATOM 0 HB2 LYS A 120 3.011 -2.147 9.370 1.00 0.52 H new ATOM 0 HB3 LYS A 120 3.618 -1.341 7.938 1.00 0.52 H new ATOM 0 HG2 LYS A 120 5.436 -0.298 9.364 1.00 0.57 H new ATOM 0 HG3 LYS A 120 4.864 -1.250 10.720 1.00 0.57 H new ATOM 0 HD2 LYS A 120 5.564 -3.299 9.750 1.00 0.69 H new ATOM 0 HD3 LYS A 120 5.620 -2.630 8.131 1.00 0.69 H new ATOM 0 HE2 LYS A 120 7.907 -2.855 8.858 1.00 1.16 H new ATOM 0 HE3 LYS A 120 7.542 -1.142 8.876 1.00 1.16 H new ATOM 0 HZ1 LYS A 120 8.736 -1.804 10.844 1.00 1.93 H new ATOM 0 HZ2 LYS A 120 7.178 -1.273 11.261 1.00 1.93 H new ATOM 0 HZ3 LYS A 120 7.532 -2.933 11.244 1.00 1.93 H new ATOM 1485 N LEU A 121 4.232 1.855 8.998 1.00 0.41 N ATOM 1486 CA LEU A 121 4.947 2.878 8.229 1.00 0.40 C ATOM 1487 C LEU A 121 6.101 2.295 7.396 1.00 0.38 C ATOM 1488 O LEU A 121 6.807 1.399 7.871 1.00 0.41 O ATOM 1489 CB LEU A 121 5.465 3.992 9.153 1.00 0.42 C ATOM 1490 CG LEU A 121 4.330 4.802 9.803 1.00 0.47 C ATOM 1491 CD1 LEU A 121 4.084 4.433 11.264 1.00 0.63 C ATOM 1492 CD2 LEU A 121 4.621 6.301 9.722 1.00 0.59 C ATOM 0 H LEU A 121 4.640 1.683 9.917 1.00 0.41 H new ATOM 0 HA LEU A 121 4.227 3.301 7.528 1.00 0.40 H new ATOM 0 HB2 LEU A 121 6.084 3.551 9.934 1.00 0.42 H new ATOM 0 HB3 LEU A 121 6.104 4.665 8.581 1.00 0.42 H new ATOM 0 HG LEU A 121 3.431 4.553 9.239 1.00 0.47 H new ATOM 0 HD11 LEU A 121 3.271 5.041 11.661 1.00 0.63 H new ATOM 0 HD12 LEU A 121 3.815 3.379 11.333 1.00 0.63 H new ATOM 0 HD13 LEU A 121 4.990 4.615 11.843 1.00 0.63 H new ATOM 0 HD21 LEU A 121 3.806 6.856 10.187 1.00 0.59 H new ATOM 0 HD22 LEU A 121 5.553 6.519 10.244 1.00 0.59 H new ATOM 0 HD23 LEU A 121 4.712 6.598 8.677 1.00 0.59 H new ATOM 1504 N THR A 122 6.360 2.837 6.195 1.00 0.37 N ATOM 1505 CA THR A 122 7.587 2.503 5.437 1.00 0.38 C ATOM 1506 C THR A 122 8.812 3.002 6.206 1.00 0.42 C ATOM 1507 O THR A 122 8.836 4.140 6.674 1.00 0.48 O ATOM 1508 CB THR A 122 7.607 3.025 3.982 1.00 0.42 C ATOM 1509 OG1 THR A 122 7.018 4.301 3.890 1.00 0.51 O ATOM 1510 CG2 THR A 122 6.901 2.113 2.969 1.00 0.48 C ATOM 0 H THR A 122 5.745 3.503 5.727 1.00 0.37 H new ATOM 0 HA THR A 122 7.606 1.417 5.347 1.00 0.38 H new ATOM 0 HB THR A 122 8.666 3.056 3.725 1.00 0.42 H new ATOM 0 HG1 THR A 122 7.046 4.608 2.960 1.00 0.51 H new ATOM 0 HG21 THR A 122 6.964 2.556 1.975 1.00 0.48 H new ATOM 0 HG22 THR A 122 7.383 1.136 2.961 1.00 0.48 H new ATOM 0 HG23 THR A 122 5.854 1.999 3.250 1.00 0.48 H new ATOM 1518 N GLU A 123 9.826 2.155 6.380 1.00 0.43 N ATOM 1519 CA GLU A 123 11.002 2.477 7.223 1.00 0.52 C ATOM 1520 C GLU A 123 12.092 3.248 6.475 1.00 0.58 C ATOM 1521 O GLU A 123 12.474 4.352 6.868 1.00 0.68 O ATOM 1522 CB GLU A 123 11.565 1.241 7.944 1.00 0.61 C ATOM 1523 CG GLU A 123 11.423 -0.082 7.187 1.00 0.71 C ATOM 1524 CD GLU A 123 12.092 -1.250 7.924 1.00 1.19 C ATOM 1525 OE1 GLU A 123 12.063 -1.269 9.182 1.00 2.51 O ATOM 1526 OE2 GLU A 123 12.672 -2.135 7.254 1.00 1.56 O ATOM 0 H GLU A 123 9.866 1.231 5.949 1.00 0.43 H new ATOM 0 HA GLU A 123 10.629 3.153 7.992 1.00 0.52 H new ATOM 0 HB2 GLU A 123 12.622 1.411 8.149 1.00 0.61 H new ATOM 0 HB3 GLU A 123 11.065 1.144 8.908 1.00 0.61 H new ATOM 0 HG2 GLU A 123 10.366 -0.304 7.043 1.00 0.71 H new ATOM 0 HG3 GLU A 123 11.865 0.020 6.196 1.00 0.71 H new ATOM 1533 N ALA A 124 12.561 2.669 5.374 1.00 0.59 N ATOM 1534 CA ALA A 124 13.441 3.305 4.396 1.00 0.76 C ATOM 1535 C ALA A 124 13.370 2.557 3.056 1.00 0.76 C ATOM 1536 O ALA A 124 13.183 3.158 1.993 1.00 1.05 O ATOM 1537 CB ALA A 124 14.870 3.310 4.950 1.00 0.92 C ATOM 0 H ALA A 124 12.330 1.706 5.128 1.00 0.59 H new ATOM 0 HA ALA A 124 13.123 4.333 4.219 1.00 0.76 H new ATOM 0 HB1 ALA A 124 15.538 3.782 4.230 1.00 0.92 H new ATOM 0 HB2 ALA A 124 14.895 3.866 5.887 1.00 0.92 H new ATOM 0 HB3 ALA A 124 15.195 2.285 5.128 1.00 0.92 H new ATOM 1543 N GLU A 125 13.438 1.223 3.119 1.00 0.73 N ATOM 1544 CA GLU A 125 13.429 0.339 1.948 1.00 1.00 C ATOM 1545 C GLU A 125 12.014 -0.082 1.518 1.00 1.00 C ATOM 1546 O GLU A 125 11.810 -0.505 0.380 1.00 1.71 O ATOM 1547 CB GLU A 125 14.291 -0.896 2.259 1.00 1.27 C ATOM 1548 CG GLU A 125 15.684 -0.560 2.830 1.00 1.78 C ATOM 1549 CD GLU A 125 15.778 -0.781 4.345 1.00 3.65 C ATOM 1550 OE1 GLU A 125 14.862 -0.381 5.101 1.00 4.79 O ATOM 1551 OE2 GLU A 125 16.767 -1.400 4.810 1.00 4.74 O ATOM 0 H GLU A 125 13.502 0.717 4.003 1.00 0.73 H new ATOM 0 HA GLU A 125 13.842 0.894 1.106 1.00 1.00 H new ATOM 0 HB2 GLU A 125 13.760 -1.527 2.972 1.00 1.27 H new ATOM 0 HB3 GLU A 125 14.414 -1.479 1.347 1.00 1.27 H new ATOM 0 HG2 GLU A 125 16.433 -1.175 2.331 1.00 1.78 H new ATOM 0 HG3 GLU A 125 15.923 0.479 2.604 1.00 1.78 H new ATOM 1558 N GLY A 126 11.039 0.052 2.422 1.00 0.52 N ATOM 1559 CA GLY A 126 9.648 -0.378 2.283 1.00 0.44 C ATOM 1560 C GLY A 126 9.028 -0.666 3.659 1.00 0.43 C ATOM 1561 O GLY A 126 9.519 -0.167 4.670 1.00 0.59 O ATOM 0 H GLY A 126 11.213 0.491 3.326 1.00 0.52 H new ATOM 0 HA2 GLY A 126 9.072 0.395 1.774 1.00 0.44 H new ATOM 0 HA3 GLY A 126 9.599 -1.273 1.662 1.00 0.44 H new ATOM 1565 N ALA A 127 7.947 -1.444 3.693 1.00 0.36 N ATOM 1566 CA ALA A 127 7.333 -2.052 4.884 1.00 0.34 C ATOM 1567 C ALA A 127 6.808 -3.462 4.552 1.00 0.33 C ATOM 1568 O ALA A 127 6.103 -3.608 3.552 1.00 0.34 O ATOM 1569 CB ALA A 127 6.195 -1.158 5.399 1.00 0.34 C ATOM 0 H ALA A 127 7.442 -1.684 2.840 1.00 0.36 H new ATOM 0 HA ALA A 127 8.087 -2.143 5.666 1.00 0.34 H new ATOM 0 HB1 ALA A 127 5.745 -1.614 6.281 1.00 0.34 H new ATOM 0 HB2 ALA A 127 6.593 -0.177 5.660 1.00 0.34 H new ATOM 0 HB3 ALA A 127 5.439 -1.047 4.622 1.00 0.34 H new ATOM 1575 N LYS A 128 7.103 -4.481 5.375 1.00 0.35 N ATOM 1576 CA LYS A 128 6.578 -5.851 5.201 1.00 0.37 C ATOM 1577 C LYS A 128 5.294 -6.121 5.992 1.00 0.34 C ATOM 1578 O LYS A 128 5.116 -5.659 7.120 1.00 0.39 O ATOM 1579 CB LYS A 128 7.645 -6.945 5.413 1.00 0.55 C ATOM 1580 CG LYS A 128 8.051 -7.206 6.878 1.00 1.73 C ATOM 1581 CD LYS A 128 8.714 -8.580 7.083 1.00 1.27 C ATOM 1582 CE LYS A 128 7.700 -9.706 7.362 1.00 1.32 C ATOM 1583 NZ LYS A 128 8.395 -10.964 7.724 1.00 1.34 N ATOM 0 H LYS A 128 7.715 -4.380 6.185 1.00 0.35 H new ATOM 0 HA LYS A 128 6.294 -5.908 4.150 1.00 0.37 H new ATOM 0 HB2 LYS A 128 7.274 -7.877 4.986 1.00 0.55 H new ATOM 0 HB3 LYS A 128 8.538 -6.670 4.851 1.00 0.55 H new ATOM 0 HG2 LYS A 128 8.738 -6.425 7.203 1.00 1.73 H new ATOM 0 HG3 LYS A 128 7.167 -7.137 7.512 1.00 1.73 H new ATOM 0 HD2 LYS A 128 9.293 -8.833 6.195 1.00 1.27 H new ATOM 0 HD3 LYS A 128 9.416 -8.517 7.915 1.00 1.27 H new ATOM 0 HE2 LYS A 128 7.033 -9.408 8.171 1.00 1.32 H new ATOM 0 HE3 LYS A 128 7.079 -9.869 6.481 1.00 1.32 H new ATOM 0 HZ1 LYS A 128 7.692 -11.708 7.908 1.00 1.34 H new ATOM 0 HZ2 LYS A 128 9.013 -11.257 6.941 1.00 1.34 H new ATOM 0 HZ3 LYS A 128 8.968 -10.811 8.578 1.00 1.34 H new ATOM 1597 N PHE A 129 4.411 -6.903 5.382 1.00 0.34 N ATOM 1598 CA PHE A 129 3.115 -7.343 5.895 1.00 0.34 C ATOM 1599 C PHE A 129 3.059 -8.868 5.743 1.00 0.38 C ATOM 1600 O PHE A 129 3.249 -9.375 4.637 1.00 0.40 O ATOM 1601 CB PHE A 129 2.019 -6.613 5.099 1.00 0.30 C ATOM 1602 CG PHE A 129 1.882 -5.142 5.451 1.00 0.27 C ATOM 1603 CD1 PHE A 129 2.865 -4.223 5.044 1.00 1.89 C ATOM 1604 CD2 PHE A 129 0.792 -4.686 6.214 1.00 1.87 C ATOM 1605 CE1 PHE A 129 2.784 -2.888 5.450 1.00 1.96 C ATOM 1606 CE2 PHE A 129 0.692 -3.337 6.594 1.00 1.82 C ATOM 1607 CZ PHE A 129 1.696 -2.434 6.216 1.00 0.35 C ATOM 0 H PHE A 129 4.593 -7.274 4.449 1.00 0.34 H new ATOM 0 HA PHE A 129 2.965 -7.105 6.948 1.00 0.34 H new ATOM 0 HB2 PHE A 129 2.235 -6.704 4.034 1.00 0.30 H new ATOM 0 HB3 PHE A 129 1.064 -7.109 5.274 1.00 0.30 H new ATOM 0 HD1 PHE A 129 3.683 -4.548 4.418 1.00 1.89 H new ATOM 0 HD2 PHE A 129 0.022 -5.382 6.512 1.00 1.87 H new ATOM 0 HE1 PHE A 129 3.566 -2.197 5.172 1.00 1.96 H new ATOM 0 HE2 PHE A 129 -0.153 -2.997 7.174 1.00 1.82 H new ATOM 0 HZ PHE A 129 1.634 -1.397 6.511 1.00 0.35 H new ATOM 1617 N ASN A 130 2.861 -9.609 6.836 1.00 0.46 N ATOM 1618 CA ASN A 130 2.928 -11.073 6.818 1.00 0.53 C ATOM 1619 C ASN A 130 1.580 -11.650 6.351 1.00 0.58 C ATOM 1620 O ASN A 130 0.602 -11.655 7.097 1.00 0.87 O ATOM 1621 CB ASN A 130 3.328 -11.579 8.212 1.00 0.66 C ATOM 1622 CG ASN A 130 3.413 -13.095 8.260 1.00 0.90 C ATOM 1623 OD1 ASN A 130 2.377 -13.776 8.682 1.00 1.67 O flip ATOM 1624 ND2 ASN A 130 4.415 -13.697 7.901 1.00 1.05 N flip ATOM 0 H ASN A 130 2.651 -9.215 7.753 1.00 0.46 H new ATOM 0 HA ASN A 130 3.686 -11.411 6.111 1.00 0.53 H new ATOM 0 HB2 ASN A 130 4.291 -11.152 8.491 1.00 0.66 H new ATOM 0 HB3 ASN A 130 2.601 -11.232 8.947 1.00 0.66 H new ATOM 0 HD21 ASN A 130 5.229 -13.180 7.570 1.00 1.05 H new ATOM 0 HD22 ASN A 130 4.436 -14.716 7.933 1.00 1.05 H new ATOM 1631 N THR A 131 1.524 -12.158 5.122 1.00 0.50 N ATOM 1632 CA THR A 131 0.298 -12.688 4.505 1.00 0.53 C ATOM 1633 C THR A 131 0.002 -14.141 4.870 1.00 0.64 C ATOM 1634 O THR A 131 -1.080 -14.623 4.544 1.00 0.73 O ATOM 1635 CB THR A 131 0.324 -12.518 2.976 1.00 0.58 C ATOM 1636 OG1 THR A 131 1.535 -13.003 2.442 1.00 0.64 O ATOM 1637 CG2 THR A 131 0.210 -11.048 2.576 1.00 0.53 C ATOM 0 H THR A 131 2.340 -12.216 4.512 1.00 0.50 H new ATOM 0 HA THR A 131 -0.515 -12.093 4.920 1.00 0.53 H new ATOM 0 HB THR A 131 -0.525 -13.079 2.586 1.00 0.58 H new ATOM 0 HG1 THR A 131 1.533 -12.888 1.469 1.00 0.64 H new ATOM 0 HG21 THR A 131 0.232 -10.964 1.489 1.00 0.53 H new ATOM 0 HG22 THR A 131 -0.728 -10.640 2.953 1.00 0.53 H new ATOM 0 HG23 THR A 131 1.045 -10.490 3.000 1.00 0.53 H new ATOM 1645 N ALA A 132 0.892 -14.829 5.602 1.00 0.67 N ATOM 1646 CA ALA A 132 0.732 -16.235 6.008 1.00 0.76 C ATOM 1647 C ALA A 132 -0.575 -16.547 6.771 1.00 0.84 C ATOM 1648 O ALA A 132 -0.969 -17.711 6.872 1.00 1.07 O ATOM 1649 CB ALA A 132 1.921 -16.631 6.896 1.00 0.81 C ATOM 0 H ALA A 132 1.762 -14.415 5.936 1.00 0.67 H new ATOM 0 HA ALA A 132 0.689 -16.810 5.083 1.00 0.76 H new ATOM 0 HB1 ALA A 132 1.815 -17.671 7.204 1.00 0.81 H new ATOM 0 HB2 ALA A 132 2.849 -16.511 6.337 1.00 0.81 H new ATOM 0 HB3 ALA A 132 1.945 -15.992 7.779 1.00 0.81 H new ATOM 1655 N ASN A 133 -1.223 -15.527 7.350 1.00 0.76 N ATOM 1656 CA ASN A 133 -2.456 -15.647 8.127 1.00 0.83 C ATOM 1657 C ASN A 133 -3.734 -15.363 7.308 1.00 0.76 C ATOM 1658 O ASN A 133 -4.822 -15.727 7.763 1.00 0.86 O ATOM 1659 CB ASN A 133 -2.351 -14.730 9.357 1.00 0.95 C ATOM 1660 CG ASN A 133 -1.124 -14.991 10.199 1.00 1.02 C ATOM 1661 OD1 ASN A 133 -0.139 -14.267 10.137 1.00 1.86 O ATOM 1662 ND2 ASN A 133 -1.117 -16.032 10.990 1.00 1.77 N ATOM 0 H ASN A 133 -0.889 -14.565 7.286 1.00 0.76 H new ATOM 0 HA ASN A 133 -2.557 -16.685 8.442 1.00 0.83 H new ATOM 0 HB2 ASN A 133 -2.341 -13.691 9.026 1.00 0.95 H new ATOM 0 HB3 ASN A 133 -3.240 -14.860 9.974 1.00 0.95 H new ATOM 0 HD21 ASN A 133 -0.292 -16.239 11.553 1.00 1.77 H new ATOM 0 HD22 ASN A 133 -1.936 -16.637 11.044 1.00 1.77 H new ATOM 1669 N LEU A 134 -3.643 -14.756 6.116 1.00 0.65 N ATOM 1670 CA LEU A 134 -4.796 -14.531 5.248 1.00 0.66 C ATOM 1671 C LEU A 134 -5.197 -15.774 4.426 1.00 0.80 C ATOM 1672 O LEU A 134 -4.340 -16.580 4.057 1.00 0.94 O ATOM 1673 CB LEU A 134 -4.508 -13.388 4.251 1.00 0.60 C ATOM 1674 CG LEU A 134 -4.587 -11.935 4.742 1.00 0.52 C ATOM 1675 CD1 LEU A 134 -5.675 -11.695 5.785 1.00 0.52 C ATOM 1676 CD2 LEU A 134 -3.253 -11.410 5.248 1.00 0.44 C ATOM 0 H LEU A 134 -2.765 -14.409 5.731 1.00 0.65 H new ATOM 0 HA LEU A 134 -5.618 -14.280 5.918 1.00 0.66 H new ATOM 0 HB2 LEU A 134 -3.507 -13.546 3.850 1.00 0.60 H new ATOM 0 HB3 LEU A 134 -5.205 -13.493 3.420 1.00 0.60 H new ATOM 0 HG LEU A 134 -4.863 -11.369 3.853 1.00 0.52 H new ATOM 0 HD11 LEU A 134 -5.669 -10.646 6.083 1.00 0.52 H new ATOM 0 HD12 LEU A 134 -6.647 -11.946 5.361 1.00 0.52 H new ATOM 0 HD13 LEU A 134 -5.487 -12.321 6.657 1.00 0.52 H new ATOM 0 HD21 LEU A 134 -3.371 -10.379 5.582 1.00 0.44 H new ATOM 0 HD22 LEU A 134 -2.913 -12.024 6.082 1.00 0.44 H new ATOM 0 HD23 LEU A 134 -2.518 -11.450 4.444 1.00 0.44 H new ATOM 1688 N PRO A 135 -6.491 -15.898 4.074 1.00 0.82 N ATOM 1689 CA PRO A 135 -6.967 -16.843 3.073 1.00 0.95 C ATOM 1690 C PRO A 135 -6.847 -16.260 1.657 1.00 0.93 C ATOM 1691 O PRO A 135 -6.638 -15.059 1.456 1.00 0.84 O ATOM 1692 CB PRO A 135 -8.431 -17.086 3.419 1.00 1.02 C ATOM 1693 CG PRO A 135 -8.880 -15.740 3.995 1.00 0.93 C ATOM 1694 CD PRO A 135 -7.619 -15.192 4.671 1.00 0.79 C ATOM 0 HA PRO A 135 -6.380 -17.761 3.081 1.00 0.95 H new ATOM 0 HB2 PRO A 135 -9.013 -17.362 2.539 1.00 1.02 H new ATOM 0 HB3 PRO A 135 -8.546 -17.893 4.143 1.00 1.02 H new ATOM 0 HG2 PRO A 135 -9.238 -15.070 3.213 1.00 0.93 H new ATOM 0 HG3 PRO A 135 -9.695 -15.862 4.708 1.00 0.93 H new ATOM 0 HD2 PRO A 135 -7.531 -14.117 4.515 1.00 0.79 H new ATOM 0 HD3 PRO A 135 -7.653 -15.356 5.748 1.00 0.79 H new ATOM 1702 N ALA A 136 -7.066 -17.107 0.652 1.00 1.00 N ATOM 1703 CA ALA A 136 -7.063 -16.738 -0.753 1.00 0.94 C ATOM 1704 C ALA A 136 -8.313 -15.904 -1.064 1.00 0.97 C ATOM 1705 O ALA A 136 -9.413 -16.442 -1.250 1.00 1.19 O ATOM 1706 CB ALA A 136 -6.983 -18.032 -1.569 1.00 1.03 C ATOM 0 H ALA A 136 -7.256 -18.098 0.803 1.00 1.00 H new ATOM 0 HA ALA A 136 -6.207 -16.116 -1.013 1.00 0.94 H new ATOM 0 HB1 ALA A 136 -6.979 -17.792 -2.632 1.00 1.03 H new ATOM 0 HB2 ALA A 136 -6.068 -18.567 -1.314 1.00 1.03 H new ATOM 0 HB3 ALA A 136 -7.845 -18.659 -1.342 1.00 1.03 H new ATOM 1712 N ALA A 137 -8.143 -14.582 -1.081 1.00 0.84 N ATOM 1713 CA ALA A 137 -9.180 -13.620 -1.416 1.00 0.84 C ATOM 1714 C ALA A 137 -8.585 -12.310 -1.990 1.00 0.74 C ATOM 1715 O ALA A 137 -7.360 -12.166 -2.068 1.00 0.69 O ATOM 1716 CB ALA A 137 -10.026 -13.367 -0.159 1.00 0.85 C ATOM 0 H ALA A 137 -7.251 -14.143 -0.854 1.00 0.84 H new ATOM 0 HA ALA A 137 -9.815 -14.025 -2.204 1.00 0.84 H new ATOM 0 HB1 ALA A 137 -10.812 -12.647 -0.388 1.00 0.85 H new ATOM 0 HB2 ALA A 137 -10.477 -14.303 0.171 1.00 0.85 H new ATOM 0 HB3 ALA A 137 -9.391 -12.971 0.633 1.00 0.85 H new ATOM 1722 N LYS A 138 -9.439 -11.355 -2.388 1.00 0.74 N ATOM 1723 CA LYS A 138 -9.046 -9.978 -2.729 1.00 0.67 C ATOM 1724 C LYS A 138 -9.093 -9.032 -1.519 1.00 0.62 C ATOM 1725 O LYS A 138 -9.898 -9.202 -0.600 1.00 0.71 O ATOM 1726 CB LYS A 138 -9.927 -9.467 -3.875 1.00 0.73 C ATOM 1727 CG LYS A 138 -9.451 -10.007 -5.231 1.00 0.72 C ATOM 1728 CD LYS A 138 -10.397 -9.568 -6.351 1.00 0.84 C ATOM 1729 CE LYS A 138 -11.702 -10.370 -6.374 1.00 2.39 C ATOM 1730 NZ LYS A 138 -12.599 -9.898 -7.456 1.00 2.61 N ATOM 0 H LYS A 138 -10.441 -11.521 -2.484 1.00 0.74 H new ATOM 0 HA LYS A 138 -8.005 -9.994 -3.053 1.00 0.67 H new ATOM 0 HB2 LYS A 138 -10.960 -9.769 -3.704 1.00 0.73 H new ATOM 0 HB3 LYS A 138 -9.911 -8.377 -3.890 1.00 0.73 H new ATOM 0 HG2 LYS A 138 -8.443 -9.647 -5.438 1.00 0.72 H new ATOM 0 HG3 LYS A 138 -9.400 -11.095 -5.197 1.00 0.72 H new ATOM 0 HD2 LYS A 138 -10.628 -8.510 -6.231 1.00 0.84 H new ATOM 0 HD3 LYS A 138 -9.892 -9.677 -7.311 1.00 0.84 H new ATOM 0 HE2 LYS A 138 -11.480 -11.428 -6.517 1.00 2.39 H new ATOM 0 HE3 LYS A 138 -12.207 -10.277 -5.412 1.00 2.39 H new ATOM 0 HZ1 LYS A 138 -13.475 -10.458 -7.449 1.00 2.61 H new ATOM 0 HZ2 LYS A 138 -12.828 -8.895 -7.304 1.00 2.61 H new ATOM 0 HZ3 LYS A 138 -12.124 -10.010 -8.374 1.00 2.61 H new ATOM 1744 N TYR A 139 -8.242 -8.010 -1.562 1.00 0.51 N ATOM 1745 CA TYR A 139 -7.990 -7.025 -0.496 1.00 0.44 C ATOM 1746 C TYR A 139 -7.708 -5.631 -1.091 1.00 0.42 C ATOM 1747 O TYR A 139 -7.609 -5.479 -2.314 1.00 0.47 O ATOM 1748 CB TYR A 139 -6.798 -7.501 0.360 1.00 0.40 C ATOM 1749 CG TYR A 139 -6.948 -8.883 0.967 1.00 0.43 C ATOM 1750 CD1 TYR A 139 -7.607 -9.041 2.201 1.00 0.51 C ATOM 1751 CD2 TYR A 139 -6.446 -10.014 0.288 1.00 0.50 C ATOM 1752 CE1 TYR A 139 -7.793 -10.331 2.736 1.00 0.56 C ATOM 1753 CE2 TYR A 139 -6.630 -11.302 0.828 1.00 0.58 C ATOM 1754 CZ TYR A 139 -7.319 -11.459 2.045 1.00 0.58 C ATOM 1755 OH TYR A 139 -7.551 -12.690 2.560 1.00 0.66 O ATOM 0 H TYR A 139 -7.672 -7.830 -2.389 1.00 0.51 H new ATOM 0 HA TYR A 139 -8.877 -6.942 0.132 1.00 0.44 H new ATOM 0 HB2 TYR A 139 -5.900 -7.489 -0.258 1.00 0.40 H new ATOM 0 HB3 TYR A 139 -6.640 -6.783 1.165 1.00 0.40 H new ATOM 0 HD1 TYR A 139 -7.969 -8.176 2.736 1.00 0.51 H new ATOM 0 HD2 TYR A 139 -5.920 -9.892 -0.647 1.00 0.50 H new ATOM 0 HE1 TYR A 139 -8.302 -10.453 3.681 1.00 0.56 H new ATOM 0 HE2 TYR A 139 -6.243 -12.167 0.309 1.00 0.58 H new ATOM 0 HH TYR A 139 -7.123 -13.367 1.995 1.00 0.66 H new ATOM 1765 N LYS A 140 -7.574 -4.608 -0.235 1.00 0.39 N ATOM 1766 CA LYS A 140 -7.137 -3.244 -0.610 1.00 0.39 C ATOM 1767 C LYS A 140 -6.236 -2.584 0.449 1.00 0.36 C ATOM 1768 O LYS A 140 -6.283 -2.969 1.615 1.00 0.44 O ATOM 1769 CB LYS A 140 -8.347 -2.330 -0.906 1.00 0.40 C ATOM 1770 CG LYS A 140 -9.271 -2.832 -2.013 1.00 0.62 C ATOM 1771 CD LYS A 140 -10.239 -1.738 -2.464 1.00 0.50 C ATOM 1772 CE LYS A 140 -11.248 -2.430 -3.382 1.00 0.66 C ATOM 1773 NZ LYS A 140 -12.079 -1.480 -4.153 1.00 1.58 N ATOM 0 H LYS A 140 -7.770 -4.702 0.762 1.00 0.39 H new ATOM 0 HA LYS A 140 -6.542 -3.364 -1.515 1.00 0.39 H new ATOM 0 HB2 LYS A 140 -8.929 -2.213 0.008 1.00 0.40 H new ATOM 0 HB3 LYS A 140 -7.979 -1.341 -1.179 1.00 0.40 H new ATOM 0 HG2 LYS A 140 -8.676 -3.168 -2.862 1.00 0.62 H new ATOM 0 HG3 LYS A 140 -9.834 -3.695 -1.657 1.00 0.62 H new ATOM 0 HD2 LYS A 140 -10.737 -1.280 -1.610 1.00 0.50 H new ATOM 0 HD3 LYS A 140 -9.712 -0.942 -2.991 1.00 0.50 H new ATOM 0 HE2 LYS A 140 -10.713 -3.080 -4.074 1.00 0.66 H new ATOM 0 HE3 LYS A 140 -11.898 -3.068 -2.782 1.00 0.66 H new ATOM 0 HZ1 LYS A 140 -12.742 -2.008 -4.755 1.00 1.58 H new ATOM 0 HZ2 LYS A 140 -12.614 -0.875 -3.497 1.00 1.58 H new ATOM 0 HZ3 LYS A 140 -11.466 -0.888 -4.749 1.00 1.58 H new ATOM 1787 N ILE A 141 -5.471 -1.553 0.083 1.00 0.33 N ATOM 1788 CA ILE A 141 -4.655 -0.723 0.999 1.00 0.34 C ATOM 1789 C ILE A 141 -5.062 0.758 0.908 1.00 0.32 C ATOM 1790 O ILE A 141 -5.416 1.246 -0.167 1.00 0.41 O ATOM 1791 CB ILE A 141 -3.135 -0.926 0.758 1.00 0.36 C ATOM 1792 CG1 ILE A 141 -2.686 -2.381 1.027 1.00 0.42 C ATOM 1793 CG2 ILE A 141 -2.244 -0.005 1.612 1.00 0.32 C ATOM 1794 CD1 ILE A 141 -2.584 -3.181 -0.269 1.00 0.43 C ATOM 0 H ILE A 141 -5.394 -1.256 -0.890 1.00 0.33 H new ATOM 0 HA ILE A 141 -4.855 -1.055 2.018 1.00 0.34 H new ATOM 0 HB ILE A 141 -3.004 -0.673 -0.294 1.00 0.36 H new ATOM 0 HG12 ILE A 141 -1.720 -2.378 1.531 1.00 0.42 H new ATOM 0 HG13 ILE A 141 -3.395 -2.864 1.700 1.00 0.42 H new ATOM 0 HG21 ILE A 141 -1.196 -0.204 1.389 1.00 0.32 H new ATOM 0 HG22 ILE A 141 -2.472 1.036 1.383 1.00 0.32 H new ATOM 0 HG23 ILE A 141 -2.433 -0.194 2.669 1.00 0.32 H new ATOM 0 HD11 ILE A 141 -2.266 -4.199 -0.044 1.00 0.43 H new ATOM 0 HD12 ILE A 141 -3.557 -3.205 -0.760 1.00 0.43 H new ATOM 0 HD13 ILE A 141 -1.856 -2.711 -0.930 1.00 0.43 H new ATOM 1806 N TYR A 142 -4.988 1.465 2.041 1.00 0.27 N ATOM 1807 CA TYR A 142 -5.308 2.891 2.198 1.00 0.29 C ATOM 1808 C TYR A 142 -4.186 3.628 2.958 1.00 0.30 C ATOM 1809 O TYR A 142 -3.639 3.083 3.914 1.00 0.33 O ATOM 1810 CB TYR A 142 -6.653 3.018 2.930 1.00 0.31 C ATOM 1811 CG TYR A 142 -7.871 2.729 2.071 1.00 0.31 C ATOM 1812 CD1 TYR A 142 -8.213 1.412 1.698 1.00 1.81 C ATOM 1813 CD2 TYR A 142 -8.676 3.799 1.644 1.00 1.73 C ATOM 1814 CE1 TYR A 142 -9.319 1.171 0.865 1.00 1.87 C ATOM 1815 CE2 TYR A 142 -9.797 3.561 0.831 1.00 1.69 C ATOM 1816 CZ TYR A 142 -10.101 2.250 0.414 1.00 0.40 C ATOM 1817 OH TYR A 142 -11.137 2.033 -0.432 1.00 0.52 O ATOM 0 H TYR A 142 -4.689 1.038 2.918 1.00 0.27 H new ATOM 0 HA TYR A 142 -5.387 3.358 1.216 1.00 0.29 H new ATOM 0 HB2 TYR A 142 -6.655 2.336 3.780 1.00 0.31 H new ATOM 0 HB3 TYR A 142 -6.739 4.028 3.331 1.00 0.31 H new ATOM 0 HD1 TYR A 142 -7.620 0.583 2.055 1.00 1.81 H new ATOM 0 HD2 TYR A 142 -8.432 4.808 1.942 1.00 1.73 H new ATOM 0 HE1 TYR A 142 -9.568 0.162 0.572 1.00 1.87 H new ATOM 0 HE2 TYR A 142 -10.426 4.384 0.525 1.00 1.69 H new ATOM 0 HH TYR A 142 -11.571 2.886 -0.643 1.00 0.52 H new ATOM 1827 N GLU A 143 -3.838 4.859 2.563 1.00 0.36 N ATOM 1828 CA GLU A 143 -2.763 5.663 3.184 1.00 0.39 C ATOM 1829 C GLU A 143 -3.338 6.663 4.201 1.00 0.44 C ATOM 1830 O GLU A 143 -3.972 7.646 3.811 1.00 0.63 O ATOM 1831 CB GLU A 143 -1.935 6.361 2.087 1.00 0.48 C ATOM 1832 CG GLU A 143 -0.757 7.177 2.646 1.00 0.66 C ATOM 1833 CD GLU A 143 -0.011 7.943 1.547 1.00 0.81 C ATOM 1834 OE1 GLU A 143 0.433 7.311 0.564 1.00 1.60 O ATOM 1835 OE2 GLU A 143 0.180 9.182 1.675 1.00 2.11 O ATOM 0 H GLU A 143 -4.300 5.338 1.790 1.00 0.36 H new ATOM 0 HA GLU A 143 -2.097 5.002 3.739 1.00 0.39 H new ATOM 0 HB2 GLU A 143 -1.553 5.610 1.396 1.00 0.48 H new ATOM 0 HB3 GLU A 143 -2.586 7.021 1.513 1.00 0.48 H new ATOM 0 HG2 GLU A 143 -1.126 7.882 3.391 1.00 0.66 H new ATOM 0 HG3 GLU A 143 -0.063 6.508 3.156 1.00 0.66 H new ATOM 1842 N ILE A 144 -3.116 6.425 5.498 1.00 0.51 N ATOM 1843 CA ILE A 144 -3.716 7.200 6.595 1.00 0.53 C ATOM 1844 C ILE A 144 -2.615 7.899 7.401 1.00 0.66 C ATOM 1845 O ILE A 144 -1.863 7.239 8.116 1.00 0.77 O ATOM 1846 CB ILE A 144 -4.567 6.284 7.512 1.00 0.56 C ATOM 1847 CG1 ILE A 144 -5.538 5.334 6.772 1.00 0.54 C ATOM 1848 CG2 ILE A 144 -5.326 7.141 8.541 1.00 0.65 C ATOM 1849 CD1 ILE A 144 -6.617 6.003 5.918 1.00 0.54 C ATOM 0 H ILE A 144 -2.504 5.676 5.823 1.00 0.51 H new ATOM 0 HA ILE A 144 -4.376 7.957 6.170 1.00 0.53 H new ATOM 0 HB ILE A 144 -3.858 5.623 8.010 1.00 0.56 H new ATOM 0 HG12 ILE A 144 -4.952 4.677 6.130 1.00 0.54 H new ATOM 0 HG13 ILE A 144 -6.029 4.702 7.512 1.00 0.54 H new ATOM 0 HG21 ILE A 144 -5.923 6.494 9.184 1.00 0.65 H new ATOM 0 HG22 ILE A 144 -4.612 7.697 9.149 1.00 0.65 H new ATOM 0 HG23 ILE A 144 -5.981 7.839 8.020 1.00 0.65 H new ATOM 0 HD11 ILE A 144 -7.236 5.238 5.449 1.00 0.54 H new ATOM 0 HD12 ILE A 144 -7.240 6.637 6.549 1.00 0.54 H new ATOM 0 HD13 ILE A 144 -6.145 6.611 5.146 1.00 0.54 H new ATOM 1861 N HIS A 145 -2.549 9.231 7.379 1.00 0.86 N ATOM 1862 CA HIS A 145 -1.461 9.990 8.026 1.00 1.07 C ATOM 1863 C HIS A 145 -1.759 10.398 9.480 1.00 1.15 C ATOM 1864 O HIS A 145 -0.879 10.912 10.171 1.00 1.51 O ATOM 1865 CB HIS A 145 -1.068 11.193 7.157 1.00 1.30 C ATOM 1866 CG HIS A 145 -2.169 12.197 6.934 1.00 2.40 C ATOM 1867 ND1 HIS A 145 -2.660 13.110 7.842 1.00 3.80 N ATOM 1868 CD2 HIS A 145 -2.843 12.394 5.760 1.00 3.47 C ATOM 1869 CE1 HIS A 145 -3.612 13.831 7.226 1.00 5.28 C ATOM 1870 NE2 HIS A 145 -3.752 13.441 5.945 1.00 5.21 N ATOM 0 H HIS A 145 -3.242 9.819 6.916 1.00 0.86 H new ATOM 0 HA HIS A 145 -0.609 9.315 8.102 1.00 1.07 H new ATOM 0 HB2 HIS A 145 -0.223 11.699 7.623 1.00 1.30 H new ATOM 0 HB3 HIS A 145 -0.727 10.828 6.188 1.00 1.30 H new ATOM 0 HD2 HIS A 145 -2.698 11.836 4.846 1.00 3.47 H new ATOM 0 HE1 HIS A 145 -4.187 14.616 7.695 1.00 5.28 H new ATOM 0 HE2 HIS A 145 -4.391 13.830 5.251 1.00 5.21 H new ATOM 1878 N SER A 146 -2.977 10.146 9.971 1.00 1.03 N ATOM 1879 CA SER A 146 -3.461 10.561 11.299 1.00 1.18 C ATOM 1880 C SER A 146 -2.868 9.777 12.487 1.00 1.56 C ATOM 1881 O SER A 146 -3.217 10.043 13.643 1.00 2.19 O ATOM 1882 CB SER A 146 -4.993 10.510 11.303 1.00 1.24 C ATOM 1883 OG SER A 146 -5.447 9.177 11.205 1.00 1.99 O ATOM 0 H SER A 146 -3.679 9.631 9.440 1.00 1.03 H new ATOM 0 HA SER A 146 -3.107 11.580 11.458 1.00 1.18 H new ATOM 0 HB2 SER A 146 -5.375 10.963 12.218 1.00 1.24 H new ATOM 0 HB3 SER A 146 -5.384 11.095 10.470 1.00 1.24 H new ATOM 0 HG SER A 146 -6.427 9.164 11.211 1.00 1.99 H new ATOM 2086 N LYS A 162 -2.624 13.948 -3.193 1.00 1.35 N ATOM 2087 CA LYS A 162 -3.624 13.021 -2.648 1.00 1.37 C ATOM 2088 C LYS A 162 -3.318 11.595 -3.125 1.00 1.09 C ATOM 2089 O LYS A 162 -3.321 11.338 -4.334 1.00 1.23 O ATOM 2090 CB LYS A 162 -5.013 13.531 -3.099 1.00 1.77 C ATOM 2091 CG LYS A 162 -6.172 13.330 -2.113 1.00 1.61 C ATOM 2092 CD LYS A 162 -6.650 11.882 -1.945 1.00 1.81 C ATOM 2093 CE LYS A 162 -7.321 11.270 -3.182 1.00 1.50 C ATOM 2094 NZ LYS A 162 -8.628 11.895 -3.501 1.00 1.72 N ATOM 0 HA LYS A 162 -3.604 12.986 -1.559 1.00 1.37 H new ATOM 0 HB2 LYS A 162 -4.931 14.596 -3.316 1.00 1.77 H new ATOM 0 HB3 LYS A 162 -5.271 13.034 -4.034 1.00 1.77 H new ATOM 0 HG2 LYS A 162 -5.867 13.709 -1.138 1.00 1.61 H new ATOM 0 HG3 LYS A 162 -7.015 13.937 -2.441 1.00 1.61 H new ATOM 0 HD2 LYS A 162 -5.796 11.263 -1.671 1.00 1.81 H new ATOM 0 HD3 LYS A 162 -7.353 11.842 -1.113 1.00 1.81 H new ATOM 0 HE2 LYS A 162 -6.656 11.375 -4.039 1.00 1.50 H new ATOM 0 HE3 LYS A 162 -7.465 10.202 -3.019 1.00 1.50 H new ATOM 0 HZ1 LYS A 162 -9.001 11.489 -4.383 1.00 1.72 H new ATOM 0 HZ2 LYS A 162 -9.297 11.715 -2.726 1.00 1.72 H new ATOM 0 HZ3 LYS A 162 -8.503 12.921 -3.619 1.00 1.72 H new ATOM 2108 N ALA A 163 -3.053 10.678 -2.195 1.00 0.88 N ATOM 2109 CA ALA A 163 -2.915 9.249 -2.490 1.00 0.69 C ATOM 2110 C ALA A 163 -4.277 8.634 -2.837 1.00 0.60 C ATOM 2111 O ALA A 163 -5.309 9.037 -2.311 1.00 0.72 O ATOM 2112 CB ALA A 163 -2.240 8.516 -1.321 1.00 0.88 C ATOM 0 H ALA A 163 -2.927 10.906 -1.209 1.00 0.88 H new ATOM 0 HA ALA A 163 -2.272 9.134 -3.363 1.00 0.69 H new ATOM 0 HB1 ALA A 163 -2.147 7.457 -1.561 1.00 0.88 H new ATOM 0 HB2 ALA A 163 -1.249 8.938 -1.151 1.00 0.88 H new ATOM 0 HB3 ALA A 163 -2.844 8.633 -0.421 1.00 0.88 H new ATOM 2118 N VAL A 164 -4.283 7.633 -3.712 1.00 0.52 N ATOM 2119 CA VAL A 164 -5.489 6.870 -4.075 1.00 0.47 C ATOM 2120 C VAL A 164 -5.291 5.393 -3.725 1.00 0.43 C ATOM 2121 O VAL A 164 -4.158 4.903 -3.770 1.00 0.46 O ATOM 2122 CB VAL A 164 -5.935 7.112 -5.530 1.00 0.49 C ATOM 2123 CG1 VAL A 164 -6.830 8.354 -5.616 1.00 0.60 C ATOM 2124 CG2 VAL A 164 -4.759 7.314 -6.486 1.00 0.54 C ATOM 0 H VAL A 164 -3.444 7.319 -4.199 1.00 0.52 H new ATOM 0 HA VAL A 164 -6.325 7.238 -3.480 1.00 0.47 H new ATOM 0 HB VAL A 164 -6.477 6.215 -5.830 1.00 0.49 H new ATOM 0 HG11 VAL A 164 -7.136 8.511 -6.650 1.00 0.60 H new ATOM 0 HG12 VAL A 164 -7.713 8.210 -4.994 1.00 0.60 H new ATOM 0 HG13 VAL A 164 -6.278 9.226 -5.265 1.00 0.60 H new ATOM 0 HG21 VAL A 164 -5.135 7.480 -7.496 1.00 0.54 H new ATOM 0 HG22 VAL A 164 -4.177 8.179 -6.169 1.00 0.54 H new ATOM 0 HG23 VAL A 164 -4.126 6.427 -6.476 1.00 0.54 H new ATOM 2134 N PRO A 165 -6.358 4.683 -3.318 1.00 0.40 N ATOM 2135 CA PRO A 165 -6.244 3.364 -2.708 1.00 0.40 C ATOM 2136 C PRO A 165 -5.900 2.269 -3.722 1.00 0.41 C ATOM 2137 O PRO A 165 -6.200 2.375 -4.914 1.00 0.49 O ATOM 2138 CB PRO A 165 -7.576 3.144 -1.991 1.00 0.44 C ATOM 2139 CG PRO A 165 -8.570 3.920 -2.853 1.00 0.46 C ATOM 2140 CD PRO A 165 -7.754 5.087 -3.415 1.00 0.44 C ATOM 0 HA PRO A 165 -5.412 3.311 -2.006 1.00 0.40 H new ATOM 0 HB2 PRO A 165 -7.833 2.086 -1.934 1.00 0.44 H new ATOM 0 HB3 PRO A 165 -7.550 3.521 -0.969 1.00 0.44 H new ATOM 0 HG2 PRO A 165 -8.975 3.298 -3.651 1.00 0.46 H new ATOM 0 HG3 PRO A 165 -9.416 4.274 -2.264 1.00 0.46 H new ATOM 0 HD2 PRO A 165 -8.030 5.294 -4.449 1.00 0.44 H new ATOM 0 HD3 PRO A 165 -7.937 6.000 -2.848 1.00 0.44 H new ATOM 2148 N ILE A 166 -5.246 1.215 -3.242 1.00 0.41 N ATOM 2149 CA ILE A 166 -4.669 0.137 -4.059 1.00 0.41 C ATOM 2150 C ILE A 166 -5.516 -1.124 -3.899 1.00 0.39 C ATOM 2151 O ILE A 166 -5.791 -1.512 -2.768 1.00 0.46 O ATOM 2152 CB ILE A 166 -3.196 -0.157 -3.666 1.00 0.47 C ATOM 2153 CG1 ILE A 166 -2.327 1.101 -3.405 1.00 0.57 C ATOM 2154 CG2 ILE A 166 -2.548 -1.013 -4.762 1.00 0.52 C ATOM 2155 CD1 ILE A 166 -2.418 1.574 -1.946 1.00 1.28 C ATOM 0 H ILE A 166 -5.095 1.078 -2.243 1.00 0.41 H new ATOM 0 HA ILE A 166 -4.671 0.458 -5.101 1.00 0.41 H new ATOM 0 HB ILE A 166 -3.236 -0.685 -2.713 1.00 0.47 H new ATOM 0 HG12 ILE A 166 -1.288 0.881 -3.650 1.00 0.57 H new ATOM 0 HG13 ILE A 166 -2.647 1.906 -4.067 1.00 0.57 H new ATOM 0 HG21 ILE A 166 -1.513 -1.224 -4.494 1.00 0.52 H new ATOM 0 HG22 ILE A 166 -3.095 -1.950 -4.863 1.00 0.52 H new ATOM 0 HG23 ILE A 166 -2.575 -0.473 -5.709 1.00 0.52 H new ATOM 0 HD11 ILE A 166 -1.793 2.457 -1.810 1.00 1.28 H new ATOM 0 HD12 ILE A 166 -3.452 1.821 -1.707 1.00 1.28 H new ATOM 0 HD13 ILE A 166 -2.073 0.780 -1.284 1.00 1.28 H new ATOM 2167 N GLU A 167 -5.886 -1.794 -4.991 1.00 0.42 N ATOM 2168 CA GLU A 167 -6.509 -3.127 -4.954 1.00 0.44 C ATOM 2169 C GLU A 167 -5.469 -4.238 -5.204 1.00 0.45 C ATOM 2170 O GLU A 167 -4.556 -4.064 -6.017 1.00 0.55 O ATOM 2171 CB GLU A 167 -7.761 -3.176 -5.851 1.00 0.57 C ATOM 2172 CG GLU A 167 -7.593 -2.799 -7.331 1.00 1.61 C ATOM 2173 CD GLU A 167 -6.724 -3.782 -8.121 1.00 2.83 C ATOM 2174 OE1 GLU A 167 -6.861 -5.018 -7.960 1.00 3.71 O ATOM 2175 OE2 GLU A 167 -5.882 -3.346 -8.941 1.00 4.21 O ATOM 0 H GLU A 167 -5.763 -1.428 -5.935 1.00 0.42 H new ATOM 0 HA GLU A 167 -6.881 -3.327 -3.949 1.00 0.44 H new ATOM 0 HB2 GLU A 167 -8.167 -4.187 -5.806 1.00 0.57 H new ATOM 0 HB3 GLU A 167 -8.510 -2.512 -5.419 1.00 0.57 H new ATOM 0 HG2 GLU A 167 -8.577 -2.742 -7.796 1.00 1.61 H new ATOM 0 HG3 GLU A 167 -7.152 -1.804 -7.396 1.00 1.61 H new ATOM 2182 N ILE A 168 -5.566 -5.359 -4.477 1.00 0.41 N ATOM 2183 CA ILE A 168 -4.559 -6.429 -4.470 1.00 0.40 C ATOM 2184 C ILE A 168 -5.185 -7.824 -4.264 1.00 0.44 C ATOM 2185 O ILE A 168 -6.200 -7.987 -3.584 1.00 0.47 O ATOM 2186 CB ILE A 168 -3.471 -6.095 -3.414 1.00 0.37 C ATOM 2187 CG1 ILE A 168 -2.219 -6.970 -3.611 1.00 0.40 C ATOM 2188 CG2 ILE A 168 -4.002 -6.211 -1.970 1.00 0.34 C ATOM 2189 CD1 ILE A 168 -1.003 -6.529 -2.784 1.00 0.38 C ATOM 0 H ILE A 168 -6.360 -5.551 -3.867 1.00 0.41 H new ATOM 0 HA ILE A 168 -4.086 -6.476 -5.451 1.00 0.40 H new ATOM 0 HB ILE A 168 -3.190 -5.053 -3.569 1.00 0.37 H new ATOM 0 HG12 ILE A 168 -2.465 -8.000 -3.352 1.00 0.40 H new ATOM 0 HG13 ILE A 168 -1.948 -6.963 -4.667 1.00 0.40 H new ATOM 0 HG21 ILE A 168 -3.204 -5.968 -1.268 1.00 0.34 H new ATOM 0 HG22 ILE A 168 -4.832 -5.518 -1.831 1.00 0.34 H new ATOM 0 HG23 ILE A 168 -4.346 -7.229 -1.790 1.00 0.34 H new ATOM 0 HD11 ILE A 168 -0.166 -7.198 -2.982 1.00 0.38 H new ATOM 0 HD12 ILE A 168 -0.726 -5.511 -3.058 1.00 0.38 H new ATOM 0 HD13 ILE A 168 -1.252 -6.564 -1.723 1.00 0.38 H new ATOM 2201 N GLU A 169 -4.540 -8.847 -4.817 1.00 0.50 N ATOM 2202 CA GLU A 169 -4.813 -10.274 -4.594 1.00 0.57 C ATOM 2203 C GLU A 169 -3.503 -10.982 -4.189 1.00 0.62 C ATOM 2204 O GLU A 169 -2.408 -10.471 -4.439 1.00 0.66 O ATOM 2205 CB GLU A 169 -5.443 -10.854 -5.871 1.00 0.62 C ATOM 2206 CG GLU A 169 -6.067 -12.252 -5.730 1.00 0.91 C ATOM 2207 CD GLU A 169 -6.542 -12.807 -7.084 1.00 1.11 C ATOM 2208 OE1 GLU A 169 -6.727 -12.028 -8.050 1.00 1.86 O ATOM 2209 OE2 GLU A 169 -6.742 -14.037 -7.227 1.00 2.06 O ATOM 0 H GLU A 169 -3.770 -8.701 -5.469 1.00 0.50 H new ATOM 0 HA GLU A 169 -5.521 -10.427 -3.779 1.00 0.57 H new ATOM 0 HB2 GLU A 169 -6.213 -10.166 -6.219 1.00 0.62 H new ATOM 0 HB3 GLU A 169 -4.678 -10.894 -6.646 1.00 0.62 H new ATOM 0 HG2 GLU A 169 -5.336 -12.934 -5.294 1.00 0.91 H new ATOM 0 HG3 GLU A 169 -6.910 -12.206 -5.041 1.00 0.91 H new ATOM 2216 N LEU A 170 -3.589 -12.139 -3.528 1.00 0.72 N ATOM 2217 CA LEU A 170 -2.423 -12.836 -2.965 1.00 0.78 C ATOM 2218 C LEU A 170 -1.507 -13.495 -4.033 1.00 0.80 C ATOM 2219 O LEU A 170 -1.947 -13.723 -5.167 1.00 0.87 O ATOM 2220 CB LEU A 170 -2.910 -13.822 -1.885 1.00 0.86 C ATOM 2221 CG LEU A 170 -3.619 -13.172 -0.680 1.00 0.80 C ATOM 2222 CD1 LEU A 170 -3.785 -14.217 0.418 1.00 0.76 C ATOM 2223 CD2 LEU A 170 -2.876 -11.985 -0.058 1.00 1.13 C ATOM 0 H LEU A 170 -4.472 -12.623 -3.366 1.00 0.72 H new ATOM 0 HA LEU A 170 -1.771 -12.096 -2.501 1.00 0.78 H new ATOM 0 HB2 LEU A 170 -3.592 -14.535 -2.347 1.00 0.86 H new ATOM 0 HB3 LEU A 170 -2.054 -14.390 -1.521 1.00 0.86 H new ATOM 0 HG LEU A 170 -4.565 -12.796 -1.070 1.00 0.80 H new ATOM 0 HD11 LEU A 170 -4.286 -13.767 1.275 1.00 0.76 H new ATOM 0 HD12 LEU A 170 -4.383 -15.047 0.043 1.00 0.76 H new ATOM 0 HD13 LEU A 170 -2.805 -14.584 0.722 1.00 0.76 H new ATOM 0 HD21 LEU A 170 -3.452 -11.595 0.781 1.00 1.13 H new ATOM 0 HD22 LEU A 170 -1.898 -12.312 0.294 1.00 1.13 H new ATOM 0 HD23 LEU A 170 -2.750 -11.202 -0.806 1.00 1.13 H new ATOM 2235 N PRO A 171 -0.229 -13.796 -3.707 1.00 0.79 N ATOM 2236 CA PRO A 171 0.779 -14.207 -4.690 1.00 0.82 C ATOM 2237 C PRO A 171 0.661 -15.679 -5.100 1.00 0.89 C ATOM 2238 O PRO A 171 1.402 -16.552 -4.650 1.00 1.22 O ATOM 2239 CB PRO A 171 2.139 -13.826 -4.094 1.00 0.83 C ATOM 2240 CG PRO A 171 1.891 -13.844 -2.589 1.00 0.90 C ATOM 2241 CD PRO A 171 0.430 -13.460 -2.452 1.00 0.83 C ATOM 0 HA PRO A 171 0.632 -13.690 -5.638 1.00 0.82 H new ATOM 0 HB2 PRO A 171 2.915 -14.536 -4.381 1.00 0.83 H new ATOM 0 HB3 PRO A 171 2.464 -12.843 -4.435 1.00 0.83 H new ATOM 0 HG2 PRO A 171 2.086 -14.829 -2.164 1.00 0.90 H new ATOM 0 HG3 PRO A 171 2.539 -13.139 -2.069 1.00 0.90 H new ATOM 0 HD2 PRO A 171 -0.031 -13.995 -1.621 1.00 0.83 H new ATOM 0 HD3 PRO A 171 0.331 -12.395 -2.240 1.00 0.83 H new ATOM 2249 N LEU A 172 -0.277 -15.930 -6.008 1.00 0.76 N ATOM 2250 CA LEU A 172 -0.476 -17.178 -6.750 1.00 0.78 C ATOM 2251 C LEU A 172 -0.027 -16.968 -8.215 1.00 0.79 C ATOM 2252 O LEU A 172 -0.727 -17.300 -9.177 1.00 1.15 O ATOM 2253 CB LEU A 172 -1.942 -17.607 -6.555 1.00 0.95 C ATOM 2254 CG LEU A 172 -2.246 -18.232 -5.181 1.00 2.42 C ATOM 2255 CD1 LEU A 172 -3.758 -18.351 -4.991 1.00 3.28 C ATOM 2256 CD2 LEU A 172 -1.633 -19.625 -5.024 1.00 3.05 C ATOM 0 H LEU A 172 -0.966 -15.223 -6.265 1.00 0.76 H new ATOM 0 HA LEU A 172 0.136 -18.003 -6.384 1.00 0.78 H new ATOM 0 HB2 LEU A 172 -2.584 -16.737 -6.695 1.00 0.95 H new ATOM 0 HB3 LEU A 172 -2.204 -18.324 -7.333 1.00 0.95 H new ATOM 0 HG LEU A 172 -1.805 -17.575 -4.431 1.00 2.42 H new ATOM 0 HD11 LEU A 172 -3.969 -18.794 -4.017 1.00 3.28 H new ATOM 0 HD12 LEU A 172 -4.211 -17.361 -5.045 1.00 3.28 H new ATOM 0 HD13 LEU A 172 -4.175 -18.983 -5.775 1.00 3.28 H new ATOM 0 HD21 LEU A 172 -1.877 -20.021 -4.038 1.00 3.05 H new ATOM 0 HD22 LEU A 172 -2.035 -20.288 -5.791 1.00 3.05 H new ATOM 0 HD23 LEU A 172 -0.550 -19.560 -5.131 1.00 3.05 H new ATOM 2268 N ASN A 173 1.156 -16.363 -8.354 1.00 0.77 N ATOM 2269 CA ASN A 173 1.790 -15.882 -9.587 1.00 0.86 C ATOM 2270 C ASN A 173 3.182 -16.539 -9.747 1.00 0.97 C ATOM 2271 O ASN A 173 3.659 -17.208 -8.833 1.00 1.77 O ATOM 2272 CB ASN A 173 1.932 -14.344 -9.510 1.00 0.97 C ATOM 2273 CG ASN A 173 0.654 -13.515 -9.452 1.00 1.58 C ATOM 2274 OD1 ASN A 173 -0.399 -13.905 -8.959 1.00 3.18 O ATOM 2275 ND2 ASN A 173 0.743 -12.286 -9.894 1.00 1.33 N ATOM 0 H ASN A 173 1.744 -16.182 -7.541 1.00 0.77 H new ATOM 0 HA ASN A 173 1.177 -16.147 -10.449 1.00 0.86 H new ATOM 0 HB2 ASN A 173 2.526 -14.106 -8.628 1.00 0.97 H new ATOM 0 HB3 ASN A 173 2.505 -14.017 -10.378 1.00 0.97 H new ATOM 0 HD21 ASN A 173 -0.060 -11.661 -9.827 1.00 1.33 H new ATOM 0 HD22 ASN A 173 1.615 -11.954 -10.305 1.00 1.33 H new ATOM 2282 N ASP A 174 3.896 -16.312 -10.852 1.00 1.06 N ATOM 2283 CA ASP A 174 5.245 -16.870 -11.107 1.00 1.24 C ATOM 2284 C ASP A 174 6.392 -16.193 -10.301 1.00 1.13 C ATOM 2285 O ASP A 174 7.581 -16.383 -10.586 1.00 1.32 O ATOM 2286 CB ASP A 174 5.487 -16.818 -12.626 1.00 1.54 C ATOM 2287 CG ASP A 174 6.676 -17.656 -13.101 1.00 2.23 C ATOM 2288 OD1 ASP A 174 6.786 -18.847 -12.720 1.00 2.67 O ATOM 2289 OD2 ASP A 174 7.453 -17.164 -13.953 1.00 3.55 O ATOM 0 H ASP A 174 3.555 -15.726 -11.614 1.00 1.06 H new ATOM 0 HA ASP A 174 5.265 -17.898 -10.746 1.00 1.24 H new ATOM 0 HB2 ASP A 174 4.588 -17.161 -13.138 1.00 1.54 H new ATOM 0 HB3 ASP A 174 5.646 -15.781 -12.922 1.00 1.54 H new ATOM 2294 N VAL A 175 6.041 -15.385 -9.293 1.00 0.97 N ATOM 2295 CA VAL A 175 6.938 -14.473 -8.558 1.00 0.91 C ATOM 2296 C VAL A 175 7.606 -15.117 -7.342 1.00 0.96 C ATOM 2297 O VAL A 175 7.063 -16.052 -6.743 1.00 1.05 O ATOM 2298 CB VAL A 175 6.274 -13.118 -8.229 1.00 0.82 C ATOM 2299 CG1 VAL A 175 5.445 -12.606 -9.410 1.00 1.01 C ATOM 2300 CG2 VAL A 175 5.370 -13.138 -6.998 1.00 0.63 C ATOM 0 H VAL A 175 5.082 -15.344 -8.949 1.00 0.97 H new ATOM 0 HA VAL A 175 7.752 -14.254 -9.249 1.00 0.91 H new ATOM 0 HB VAL A 175 7.113 -12.455 -8.016 1.00 0.82 H new ATOM 0 HG11 VAL A 175 4.990 -11.651 -9.148 1.00 1.01 H new ATOM 0 HG12 VAL A 175 6.091 -12.475 -10.278 1.00 1.01 H new ATOM 0 HG13 VAL A 175 4.663 -13.328 -9.646 1.00 1.01 H new ATOM 0 HG21 VAL A 175 4.946 -12.146 -6.842 1.00 0.63 H new ATOM 0 HG22 VAL A 175 4.565 -13.857 -7.150 1.00 0.63 H new ATOM 0 HG23 VAL A 175 5.953 -13.426 -6.123 1.00 0.63 H new ATOM 2310 N VAL A 176 8.787 -14.614 -6.972 1.00 1.00 N ATOM 2311 CA VAL A 176 9.562 -15.065 -5.797 1.00 1.09 C ATOM 2312 C VAL A 176 9.202 -14.273 -4.534 1.00 0.92 C ATOM 2313 O VAL A 176 9.249 -14.796 -3.418 1.00 1.03 O ATOM 2314 CB VAL A 176 11.069 -14.965 -6.098 1.00 1.31 C ATOM 2315 CG1 VAL A 176 11.906 -15.380 -4.887 1.00 1.62 C ATOM 2316 CG2 VAL A 176 11.451 -15.862 -7.284 1.00 1.68 C ATOM 0 H VAL A 176 9.247 -13.864 -7.488 1.00 1.00 H new ATOM 0 HA VAL A 176 9.304 -16.106 -5.601 1.00 1.09 H new ATOM 0 HB VAL A 176 11.276 -13.923 -6.341 1.00 1.31 H new ATOM 0 HG11 VAL A 176 12.965 -15.298 -5.132 1.00 1.62 H new ATOM 0 HG12 VAL A 176 11.677 -14.727 -4.045 1.00 1.62 H new ATOM 0 HG13 VAL A 176 11.674 -16.411 -4.620 1.00 1.62 H new ATOM 0 HG21 VAL A 176 12.520 -15.774 -7.477 1.00 1.68 H new ATOM 0 HG22 VAL A 176 11.209 -16.898 -7.049 1.00 1.68 H new ATOM 0 HG23 VAL A 176 10.896 -15.551 -8.169 1.00 1.68 H new ATOM 2326 N ASP A 177 8.808 -13.011 -4.699 1.00 0.76 N ATOM 2327 CA ASP A 177 8.228 -12.197 -3.633 1.00 0.68 C ATOM 2328 C ASP A 177 7.203 -11.195 -4.190 1.00 0.56 C ATOM 2329 O ASP A 177 7.255 -10.843 -5.373 1.00 0.68 O ATOM 2330 CB ASP A 177 9.327 -11.500 -2.815 1.00 0.79 C ATOM 2331 CG ASP A 177 9.263 -11.920 -1.349 1.00 1.65 C ATOM 2332 OD1 ASP A 177 8.193 -11.743 -0.722 1.00 2.98 O ATOM 2333 OD2 ASP A 177 10.269 -12.457 -0.827 1.00 2.38 O ATOM 0 H ASP A 177 8.884 -12.519 -5.589 1.00 0.76 H new ATOM 0 HA ASP A 177 7.689 -12.860 -2.956 1.00 0.68 H new ATOM 0 HB2 ASP A 177 10.305 -11.749 -3.226 1.00 0.79 H new ATOM 0 HB3 ASP A 177 9.214 -10.419 -2.893 1.00 0.79 H new ATOM 2338 N ALA A 178 6.270 -10.751 -3.344 1.00 0.41 N ATOM 2339 CA ALA A 178 5.169 -9.860 -3.715 1.00 0.37 C ATOM 2340 C ALA A 178 5.427 -8.419 -3.270 1.00 0.35 C ATOM 2341 O ALA A 178 5.916 -8.208 -2.154 1.00 0.36 O ATOM 2342 CB ALA A 178 3.880 -10.372 -3.075 1.00 0.38 C ATOM 0 H ALA A 178 6.260 -11.008 -2.357 1.00 0.41 H new ATOM 0 HA ALA A 178 5.082 -9.858 -4.802 1.00 0.37 H new ATOM 0 HB1 ALA A 178 3.054 -9.715 -3.345 1.00 0.38 H new ATOM 0 HB2 ALA A 178 3.673 -11.381 -3.431 1.00 0.38 H new ATOM 0 HB3 ALA A 178 3.993 -10.386 -1.991 1.00 0.38 H new ATOM 2348 N HIS A 179 5.046 -7.436 -4.094 1.00 0.36 N ATOM 2349 CA HIS A 179 5.258 -6.020 -3.773 1.00 0.35 C ATOM 2350 C HIS A 179 4.057 -5.109 -4.082 1.00 0.35 C ATOM 2351 O HIS A 179 3.106 -5.514 -4.751 1.00 0.45 O ATOM 2352 CB HIS A 179 6.539 -5.500 -4.451 1.00 0.41 C ATOM 2353 CG HIS A 179 7.778 -6.294 -4.118 1.00 0.47 C ATOM 2354 ND1 HIS A 179 8.735 -5.926 -3.203 1.00 0.52 N ATOM 2355 CD2 HIS A 179 8.142 -7.519 -4.613 1.00 0.52 C ATOM 2356 CE1 HIS A 179 9.657 -6.897 -3.144 1.00 0.59 C ATOM 2357 NE2 HIS A 179 9.339 -7.893 -3.990 1.00 0.59 N ATOM 0 H HIS A 179 4.588 -7.596 -4.991 1.00 0.36 H new ATOM 0 HA HIS A 179 5.375 -5.976 -2.690 1.00 0.35 H new ATOM 0 HB2 HIS A 179 6.395 -5.508 -5.531 1.00 0.41 H new ATOM 0 HB3 HIS A 179 6.696 -4.462 -4.159 1.00 0.41 H new ATOM 0 HD1 HIS A 179 8.742 -5.062 -2.661 1.00 0.52 H new ATOM 0 HD2 HIS A 179 7.602 -8.093 -5.351 1.00 0.52 H new ATOM 0 HE1 HIS A 179 10.530 -6.882 -2.508 1.00 0.59 H new ATOM 2365 N VAL A 180 4.108 -3.868 -3.581 1.00 0.30 N ATOM 2366 CA VAL A 180 3.069 -2.835 -3.758 1.00 0.34 C ATOM 2367 C VAL A 180 3.674 -1.460 -4.036 1.00 0.36 C ATOM 2368 O VAL A 180 4.644 -1.076 -3.382 1.00 0.34 O ATOM 2369 CB VAL A 180 2.173 -2.664 -2.513 1.00 0.38 C ATOM 2370 CG1 VAL A 180 0.752 -2.309 -2.923 1.00 0.54 C ATOM 2371 CG2 VAL A 180 2.141 -3.832 -1.536 1.00 0.41 C ATOM 0 H VAL A 180 4.897 -3.541 -3.023 1.00 0.30 H new ATOM 0 HA VAL A 180 2.479 -3.188 -4.604 1.00 0.34 H new ATOM 0 HB VAL A 180 2.646 -1.850 -1.964 1.00 0.38 H new ATOM 0 HG11 VAL A 180 0.135 -2.192 -2.032 1.00 0.54 H new ATOM 0 HG12 VAL A 180 0.758 -1.375 -3.485 1.00 0.54 H new ATOM 0 HG13 VAL A 180 0.343 -3.105 -3.546 1.00 0.54 H new ATOM 0 HG21 VAL A 180 1.478 -3.593 -0.704 1.00 0.41 H new ATOM 0 HG22 VAL A 180 1.776 -4.723 -2.046 1.00 0.41 H new ATOM 0 HG23 VAL A 180 3.146 -4.017 -1.157 1.00 0.41 H new ATOM 2381 N TYR A 181 3.024 -0.684 -4.906 1.00 0.49 N ATOM 2382 CA TYR A 181 3.417 0.673 -5.294 1.00 0.57 C ATOM 2383 C TYR A 181 2.241 1.644 -5.208 1.00 0.70 C ATOM 2384 O TYR A 181 1.574 1.876 -6.213 1.00 0.95 O ATOM 2385 CB TYR A 181 4.119 0.609 -6.652 1.00 0.69 C ATOM 2386 CG TYR A 181 5.387 -0.234 -6.604 1.00 0.73 C ATOM 2387 CD1 TYR A 181 6.575 0.322 -6.087 1.00 1.75 C ATOM 2388 CD2 TYR A 181 5.362 -1.592 -6.986 1.00 2.28 C ATOM 2389 CE1 TYR A 181 7.746 -0.461 -5.996 1.00 1.73 C ATOM 2390 CE2 TYR A 181 6.512 -2.391 -6.843 1.00 2.40 C ATOM 2391 CZ TYR A 181 7.712 -1.819 -6.374 1.00 0.99 C ATOM 2392 OH TYR A 181 8.833 -2.583 -6.336 1.00 1.20 O ATOM 0 H TYR A 181 2.176 -0.996 -5.378 1.00 0.49 H new ATOM 0 HA TYR A 181 4.138 1.087 -4.589 1.00 0.57 H new ATOM 0 HB2 TYR A 181 3.436 0.194 -7.393 1.00 0.69 H new ATOM 0 HB3 TYR A 181 4.368 1.619 -6.979 1.00 0.69 H new ATOM 0 HD1 TYR A 181 6.589 1.351 -5.759 1.00 1.75 H new ATOM 0 HD2 TYR A 181 4.457 -2.020 -7.390 1.00 2.28 H new ATOM 0 HE1 TYR A 181 8.665 -0.021 -5.638 1.00 1.73 H new ATOM 0 HE2 TYR A 181 6.475 -3.441 -7.092 1.00 2.40 H new ATOM 0 HH TYR A 181 8.586 -3.520 -6.188 1.00 1.20 H new ATOM 2402 N PRO A 182 1.952 2.201 -4.016 1.00 0.60 N ATOM 2403 CA PRO A 182 1.038 3.323 -3.860 1.00 0.66 C ATOM 2404 C PRO A 182 1.687 4.608 -4.377 1.00 0.67 C ATOM 2405 O PRO A 182 2.835 4.927 -4.053 1.00 0.82 O ATOM 2406 CB PRO A 182 0.718 3.435 -2.370 1.00 0.69 C ATOM 2407 CG PRO A 182 1.834 2.662 -1.667 1.00 0.64 C ATOM 2408 CD PRO A 182 2.363 1.689 -2.723 1.00 0.56 C ATOM 0 HA PRO A 182 0.125 3.169 -4.434 1.00 0.66 H new ATOM 0 HB2 PRO A 182 0.696 4.476 -2.048 1.00 0.69 H new ATOM 0 HB3 PRO A 182 -0.260 3.010 -2.143 1.00 0.69 H new ATOM 0 HG2 PRO A 182 2.620 3.332 -1.318 1.00 0.64 H new ATOM 0 HG3 PRO A 182 1.457 2.130 -0.793 1.00 0.64 H new ATOM 0 HD2 PRO A 182 3.449 1.612 -2.666 1.00 0.56 H new ATOM 0 HD3 PRO A 182 1.963 0.688 -2.560 1.00 0.56 H new ATOM 2416 N LYS A 183 0.919 5.350 -5.171 1.00 0.59 N ATOM 2417 CA LYS A 183 1.246 6.671 -5.724 1.00 0.73 C ATOM 2418 C LYS A 183 0.048 7.631 -5.603 1.00 0.58 C ATOM 2419 O LYS A 183 -1.082 7.210 -5.331 1.00 0.98 O ATOM 2420 CB LYS A 183 1.808 6.621 -7.158 1.00 1.18 C ATOM 2421 CG LYS A 183 1.589 5.332 -7.945 1.00 0.76 C ATOM 2422 CD LYS A 183 2.727 4.331 -7.847 1.00 2.13 C ATOM 2423 CE LYS A 183 2.472 3.207 -8.854 1.00 2.29 C ATOM 2424 NZ LYS A 183 1.098 2.629 -8.843 1.00 2.11 N ATOM 0 H LYS A 183 -0.004 5.030 -5.466 1.00 0.59 H new ATOM 0 HA LYS A 183 2.060 7.066 -5.115 1.00 0.73 H new ATOM 0 HB2 LYS A 183 1.367 7.442 -7.723 1.00 1.18 H new ATOM 0 HB3 LYS A 183 2.881 6.809 -7.108 1.00 1.18 H new ATOM 0 HG2 LYS A 183 0.673 4.857 -7.592 1.00 0.76 H new ATOM 0 HG3 LYS A 183 1.433 5.584 -8.994 1.00 0.76 H new ATOM 0 HD2 LYS A 183 3.679 4.818 -8.056 1.00 2.13 H new ATOM 0 HD3 LYS A 183 2.791 3.927 -6.837 1.00 2.13 H new ATOM 0 HE2 LYS A 183 2.679 3.587 -9.855 1.00 2.29 H new ATOM 0 HE3 LYS A 183 3.185 2.405 -8.664 1.00 2.29 H new ATOM 0 HZ1 LYS A 183 1.073 1.782 -9.447 1.00 2.11 H new ATOM 0 HZ2 LYS A 183 0.839 2.368 -7.870 1.00 2.11 H new ATOM 0 HZ3 LYS A 183 0.423 3.332 -9.205 1.00 2.11 H new ATOM 2438 N ASN A 184 0.296 8.917 -5.828 0.49 0.55 N ATOM 2439 CA ASN A 184 -0.718 9.976 -5.842 0.49 0.49 C ATOM 2440 C ASN A 184 -1.193 10.264 -7.284 0.49 0.59 C ATOM 2441 O ASN A 184 -0.738 9.615 -8.227 0.49 0.82 O ATOM 2442 CB ASN A 184 -0.154 11.202 -5.089 0.49 0.75 C ATOM 2443 CG ASN A 184 0.095 10.960 -3.607 0.49 1.87 C ATOM 2444 OD1 ASN A 184 0.200 9.848 -3.113 0.49 2.91 O ATOM 2445 ND2 ASN A 184 0.245 12.009 -2.846 0.49 2.36 N ATOM 0 H ASN A 184 1.237 9.266 -6.012 0.49 0.55 H new ATOM 0 HA ASN A 184 -1.621 9.666 -5.316 0.49 0.49 H new ATOM 0 HB2 ASN A 184 0.782 11.505 -5.559 0.49 0.75 H new ATOM 0 HB3 ASN A 184 -0.850 12.034 -5.199 0.49 0.75 H new ATOM 0 HD21 ASN A 184 0.447 11.894 -1.853 0.49 2.36 H new ATOM 0 HD22 ASN A 184 0.160 12.944 -3.244 0.49 2.36 H new ATOM 2452 N THR A 185 -2.143 11.190 -7.467 0.49 0.78 N ATOM 2453 CA THR A 185 -2.605 11.601 -8.821 0.49 1.20 C ATOM 2454 C THR A 185 -3.145 13.033 -8.926 0.49 1.52 C ATOM 2455 O THR A 185 -3.106 13.644 -9.997 0.49 2.87 O ATOM 2456 CB THR A 185 -3.668 10.618 -9.337 0.49 1.54 C ATOM 2457 OG1 THR A 185 -3.960 10.898 -10.686 0.49 2.07 O ATOM 2458 CG2 THR A 185 -4.984 10.632 -8.556 0.49 1.61 C ATOM 0 H THR A 185 -2.613 11.675 -6.702 0.49 0.78 H new ATOM 0 HA THR A 185 -1.708 11.579 -9.440 0.49 1.20 H new ATOM 0 HB THR A 185 -3.229 9.629 -9.206 0.49 1.54 H new ATOM 0 HG1 THR A 185 -4.637 10.268 -11.012 0.49 2.07 H new ATOM 0 HG21 THR A 185 -5.673 9.908 -8.991 0.49 1.61 H new ATOM 0 HG22 THR A 185 -4.792 10.371 -7.515 0.49 1.61 H new ATOM 0 HG23 THR A 185 -5.425 11.627 -8.605 0.49 1.61 H new