USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=37 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 130 ASN : amide:sc= -1.21! K(o=0.71!,f=-0.37) USER MOD Set 1.2: A 133 ASN : amide:sc= 1.91 K(o=0.71,f=-0.37) USER MOD Set 2.1: A 88 ASN :FLIP amide:sc= 0.263 F(o=0.011,f=0.57) USER MOD Set 2.2: A 142 TYR OH : rot 49:sc= 0.302 USER MOD Set 3.1: A 86 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 87 ASN : amide:sc= 0 X(o=0,f=0.15) USER MOD Set 4.1: A 41 LYS NZ :NH3+ -164:sc= 2.4 (180deg=0.537) USER MOD Set 4.2: A 184 ASN : amide:sc= 1.05 K(o=3.5,f=-10!) USER MOD Set 5.1: A 40 HIS : no HE2:sc= 1.44 K(o=1.9,f=-10!) USER MOD Set 5.2: A 179 HIS : no HE2:sc= 0.486 K(o=1.9,f=-8.3!) USER MOD Single : A 32 THR OG1 : rot -23:sc= 0.352 USER MOD Single : A 33 THR OG1 : rot -165:sc= 0.64 USER MOD Single : A 34 THR OG1 : rot 131:sc= 1.01 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : 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= -0.0217 USER MOD Single : A 49 MET CE :methyl 168:sc= -0.479 (180deg=-0.741) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.856 K(o=0.86,f=0) USER MOD Single : A 58 THR OG1 : rot -36:sc= 0.0063 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 TYR OH : rot 180:sc= 0.0121 USER MOD Single : A 64 ASN : amide:sc= 0.346 X(o=0.35,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.0472 K(o=-0.047,f=-1.1) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl -148:sc= -0.0243 (180deg=-1.51!) USER MOD Single : A 84 THR OG1 : rot -31:sc= 0.594 USER MOD Single : A 85 ASN :FLIP amide:sc= 0 F(o=-0.96,f=0) USER MOD Single : A 94 ASN : amide:sc= 0.832 K(o=0.83,f=-1.8) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.227 X(o=-0.23,f=-0.11) USER MOD Single : A 105 GLN : amide:sc= -0.0606 X(o=-0.061,f=-0.46) USER MOD Single : A 106 THR OG1 : rot -150:sc= -0.186 USER MOD Single : A 108 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0051) USER MOD Single : A 110 SER OG : rot 160:sc= 0.637 USER MOD Single : A 113 MET CE :methyl -114:sc= -0.164 (180deg=-0.543) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.0445 USER MOD Single : A 118 MET CE :methyl 154:sc= -0.872 (180deg=-1.71) USER MOD Single : A 119 LYS NZ :NH3+ -160:sc= 0.925 (180deg=0.64) USER MOD Single : A 120 LYS NZ :NH3+ 169:sc= 1.25 (180deg=1.06) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.185 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 170:sc= 1.19 (180deg=1.11) USER MOD Single : A 139 TYR OH : rot 4:sc= 0.692 USER MOD Single : A 140 LYS NZ :NH3+ 154:sc= 0.806 (180deg=0.399) USER MOD Single : A 145 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ -162:sc= 0.179 (180deg=0.00928) USER MOD Single : A 173 ASN : amide:sc= -0.109 K(o=-0.11,f=-1.5!) USER MOD Single : A 181 TYR OH : rot 130:sc= 0.0344 USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 167 N THR A 32 -0.972 -20.787 -3.697 1.00 2.23 N ATOM 168 CA THR A 32 -0.319 -19.607 -3.101 1.00 1.29 C ATOM 169 C THR A 32 1.184 -19.850 -2.906 1.00 0.94 C ATOM 170 O THR A 32 1.592 -20.976 -2.609 1.00 1.10 O ATOM 171 CB THR A 32 -0.989 -19.210 -1.771 1.00 1.95 C ATOM 172 OG1 THR A 32 -1.370 -20.346 -1.012 1.00 3.05 O ATOM 173 CG2 THR A 32 -2.235 -18.368 -2.011 1.00 1.95 C ATOM 0 HA THR A 32 -0.439 -18.776 -3.796 1.00 1.29 H new ATOM 0 HB THR A 32 -0.247 -18.634 -1.218 1.00 1.95 H new ATOM 0 HG1 THR A 32 -1.476 -21.117 -1.608 1.00 3.05 H new ATOM 0 HG21 THR A 32 -2.685 -18.104 -1.054 1.00 1.95 H new ATOM 0 HG22 THR A 32 -1.962 -17.459 -2.547 1.00 1.95 H new ATOM 0 HG23 THR A 32 -2.951 -18.938 -2.604 1.00 1.95 H new ATOM 181 N THR A 33 2.023 -18.817 -3.081 1.00 0.79 N ATOM 182 CA THR A 33 3.491 -18.992 -3.195 1.00 0.89 C ATOM 183 C THR A 33 4.384 -18.187 -2.241 1.00 0.86 C ATOM 184 O THR A 33 5.581 -18.479 -2.187 1.00 1.04 O ATOM 185 CB THR A 33 3.955 -18.760 -4.649 1.00 1.04 C ATOM 186 OG1 THR A 33 3.859 -17.402 -5.007 1.00 1.31 O ATOM 187 CG2 THR A 33 3.125 -19.552 -5.656 1.00 1.32 C ATOM 0 H THR A 33 1.715 -17.847 -3.148 1.00 0.79 H new ATOM 0 HA THR A 33 3.631 -20.025 -2.878 1.00 0.89 H new ATOM 0 HB THR A 33 4.992 -19.096 -4.681 1.00 1.04 H new ATOM 0 HG1 THR A 33 3.934 -17.314 -5.980 1.00 1.31 H new ATOM 0 HG21 THR A 33 3.490 -19.355 -6.664 1.00 1.32 H new ATOM 0 HG22 THR A 33 3.211 -20.617 -5.441 1.00 1.32 H new ATOM 0 HG23 THR A 33 2.080 -19.250 -5.584 1.00 1.32 H new ATOM 195 N THR A 34 3.882 -17.215 -1.467 1.00 0.84 N ATOM 196 CA THR A 34 4.712 -16.475 -0.481 1.00 0.82 C ATOM 197 C THR A 34 3.960 -16.030 0.783 1.00 0.75 C ATOM 198 O THR A 34 2.735 -15.898 0.782 1.00 0.86 O ATOM 199 CB THR A 34 5.467 -15.311 -1.147 1.00 0.96 C ATOM 200 OG1 THR A 34 6.482 -14.861 -0.286 1.00 1.99 O ATOM 201 CG2 THR A 34 4.605 -14.108 -1.517 1.00 1.08 C ATOM 0 H THR A 34 2.907 -16.916 -1.498 1.00 0.84 H new ATOM 0 HA THR A 34 5.446 -17.196 -0.121 1.00 0.82 H new ATOM 0 HB THR A 34 5.854 -15.721 -2.080 1.00 0.96 H new ATOM 0 HG1 THR A 34 7.326 -14.798 -0.780 1.00 1.99 H new ATOM 0 HG21 THR A 34 5.228 -13.342 -1.979 1.00 1.08 H new ATOM 0 HG22 THR A 34 3.830 -14.418 -2.218 1.00 1.08 H new ATOM 0 HG23 THR A 34 4.140 -13.703 -0.618 1.00 1.08 H new ATOM 209 N THR A 35 4.703 -15.815 1.874 1.00 0.70 N ATOM 210 CA THR A 35 4.185 -15.531 3.231 1.00 0.75 C ATOM 211 C THR A 35 4.219 -14.052 3.644 1.00 0.65 C ATOM 212 O THR A 35 3.684 -13.701 4.701 1.00 0.69 O ATOM 213 CB THR A 35 4.934 -16.362 4.284 1.00 0.93 C ATOM 214 OG1 THR A 35 6.322 -16.103 4.245 1.00 1.08 O ATOM 215 CG2 THR A 35 4.714 -17.865 4.124 1.00 1.15 C ATOM 0 H THR A 35 5.722 -15.833 1.842 1.00 0.70 H new ATOM 0 HA THR A 35 3.133 -15.813 3.185 1.00 0.75 H new ATOM 0 HB THR A 35 4.521 -16.057 5.245 1.00 0.93 H new ATOM 0 HG1 THR A 35 6.775 -16.643 4.926 1.00 1.08 H new ATOM 0 HG21 THR A 35 5.268 -18.398 4.896 1.00 1.15 H new ATOM 0 HG22 THR A 35 3.652 -18.089 4.220 1.00 1.15 H new ATOM 0 HG23 THR A 35 5.065 -18.182 3.142 1.00 1.15 H new ATOM 223 N SER A 36 4.815 -13.181 2.826 1.00 0.59 N ATOM 224 CA SER A 36 4.922 -11.738 3.041 1.00 0.55 C ATOM 225 C SER A 36 4.905 -10.914 1.742 1.00 0.51 C ATOM 226 O SER A 36 5.258 -11.384 0.657 1.00 0.63 O ATOM 227 CB SER A 36 6.178 -11.421 3.867 1.00 0.63 C ATOM 228 OG SER A 36 7.371 -11.845 3.229 1.00 1.89 O ATOM 0 H SER A 36 5.256 -13.478 1.956 1.00 0.59 H new ATOM 0 HA SER A 36 4.030 -11.441 3.593 1.00 0.55 H new ATOM 0 HB2 SER A 36 6.229 -10.347 4.047 1.00 0.63 H new ATOM 0 HB3 SER A 36 6.100 -11.904 4.841 1.00 0.63 H new ATOM 0 HG SER A 36 8.141 -11.620 3.792 1.00 1.89 H new ATOM 234 N VAL A 37 4.517 -9.646 1.885 1.00 0.43 N ATOM 235 CA VAL A 37 4.463 -8.593 0.853 1.00 0.39 C ATOM 236 C VAL A 37 5.132 -7.324 1.395 1.00 0.37 C ATOM 237 O VAL A 37 4.935 -6.996 2.563 1.00 0.36 O ATOM 238 CB VAL A 37 3.010 -8.337 0.397 1.00 0.36 C ATOM 239 CG1 VAL A 37 2.105 -7.913 1.540 1.00 0.34 C ATOM 240 CG2 VAL A 37 2.899 -7.303 -0.731 1.00 0.37 C ATOM 0 H VAL A 37 4.208 -9.295 2.791 1.00 0.43 H new ATOM 0 HA VAL A 37 5.010 -8.919 -0.032 1.00 0.39 H new ATOM 0 HB VAL A 37 2.676 -9.301 0.014 1.00 0.36 H new ATOM 0 HG11 VAL A 37 1.096 -7.746 1.163 1.00 0.34 H new ATOM 0 HG12 VAL A 37 2.084 -8.696 2.298 1.00 0.34 H new ATOM 0 HG13 VAL A 37 2.484 -6.991 1.981 1.00 0.34 H new ATOM 0 HG21 VAL A 37 1.852 -7.172 -1.002 1.00 0.37 H new ATOM 0 HG22 VAL A 37 3.309 -6.351 -0.393 1.00 0.37 H new ATOM 0 HG23 VAL A 37 3.458 -7.651 -1.600 1.00 0.37 H new ATOM 250 N THR A 38 5.900 -6.590 0.583 1.00 0.43 N ATOM 251 CA THR A 38 6.520 -5.314 1.001 1.00 0.44 C ATOM 252 C THR A 38 5.944 -4.132 0.220 1.00 0.40 C ATOM 253 O THR A 38 5.902 -4.141 -1.007 1.00 0.39 O ATOM 254 CB THR A 38 8.055 -5.353 0.929 1.00 0.64 C ATOM 255 OG1 THR A 38 8.545 -6.453 1.661 1.00 0.93 O ATOM 256 CG2 THR A 38 8.733 -4.145 1.571 1.00 0.65 C ATOM 0 H THR A 38 6.113 -6.856 -0.379 1.00 0.43 H new ATOM 0 HA THR A 38 6.267 -5.170 2.051 1.00 0.44 H new ATOM 0 HB THR A 38 8.278 -5.392 -0.137 1.00 0.64 H new ATOM 0 HG1 THR A 38 9.523 -6.471 1.608 1.00 0.93 H new ATOM 0 HG21 THR A 38 9.815 -4.244 1.481 1.00 0.65 H new ATOM 0 HG22 THR A 38 8.409 -3.235 1.066 1.00 0.65 H new ATOM 0 HG23 THR A 38 8.460 -4.092 2.625 1.00 0.65 H new ATOM 264 N VAL A 39 5.480 -3.100 0.924 1.00 0.46 N ATOM 265 CA VAL A 39 4.961 -1.856 0.327 1.00 0.50 C ATOM 266 C VAL A 39 6.048 -0.780 0.289 1.00 0.53 C ATOM 267 O VAL A 39 6.785 -0.594 1.261 1.00 0.60 O ATOM 268 CB VAL A 39 3.654 -1.405 1.010 1.00 0.59 C ATOM 269 CG1 VAL A 39 3.747 -1.287 2.524 1.00 0.78 C ATOM 270 CG2 VAL A 39 3.135 -0.065 0.489 1.00 0.61 C ATOM 0 H VAL A 39 5.451 -3.099 1.944 1.00 0.46 H new ATOM 0 HA VAL A 39 4.690 -2.048 -0.711 1.00 0.50 H new ATOM 0 HB VAL A 39 2.963 -2.208 0.753 1.00 0.59 H new ATOM 0 HG11 VAL A 39 2.785 -0.965 2.924 1.00 0.78 H new ATOM 0 HG12 VAL A 39 4.011 -2.256 2.949 1.00 0.78 H new ATOM 0 HG13 VAL A 39 4.512 -0.556 2.786 1.00 0.78 H new ATOM 0 HG21 VAL A 39 2.214 0.196 1.010 1.00 0.61 H new ATOM 0 HG22 VAL A 39 3.883 0.708 0.666 1.00 0.61 H new ATOM 0 HG23 VAL A 39 2.938 -0.142 -0.580 1.00 0.61 H new ATOM 280 N HIS A 40 6.129 -0.080 -0.844 1.00 0.50 N ATOM 281 CA HIS A 40 7.143 0.938 -1.156 1.00 0.56 C ATOM 282 C HIS A 40 6.480 2.212 -1.694 1.00 0.78 C ATOM 283 O HIS A 40 5.982 2.232 -2.820 1.00 1.72 O ATOM 284 CB HIS A 40 8.113 0.380 -2.209 1.00 0.60 C ATOM 285 CG HIS A 40 8.706 -0.947 -1.842 1.00 0.52 C ATOM 286 ND1 HIS A 40 9.839 -1.149 -1.093 1.00 0.62 N ATOM 287 CD2 HIS A 40 8.189 -2.178 -2.153 1.00 0.47 C ATOM 288 CE1 HIS A 40 10.007 -2.468 -0.954 1.00 0.69 C ATOM 289 NE2 HIS A 40 9.018 -3.137 -1.567 1.00 0.60 N ATOM 0 H HIS A 40 5.462 -0.210 -1.605 1.00 0.50 H new ATOM 0 HA HIS A 40 7.686 1.187 -0.244 1.00 0.56 H new ATOM 0 HB2 HIS A 40 7.587 0.282 -3.159 1.00 0.60 H new ATOM 0 HB3 HIS A 40 8.919 1.097 -2.364 1.00 0.60 H new ATOM 0 HD1 HIS A 40 10.444 -0.422 -0.711 1.00 0.62 H new ATOM 0 HD2 HIS A 40 7.304 -2.370 -2.742 1.00 0.47 H new ATOM 0 HE1 HIS A 40 10.825 -2.931 -0.422 1.00 0.69 H new ATOM 297 N LYS A 41 6.437 3.289 -0.906 1.00 0.42 N ATOM 298 CA LYS A 41 5.643 4.472 -1.253 1.00 0.45 C ATOM 299 C LYS A 41 6.394 5.384 -2.224 1.00 0.47 C ATOM 300 O LYS A 41 7.420 5.978 -1.881 1.00 0.60 O ATOM 301 CB LYS A 41 5.134 5.162 0.023 1.00 0.57 C ATOM 302 CG LYS A 41 3.931 6.075 -0.276 1.00 0.87 C ATOM 303 CD LYS A 41 4.329 7.512 -0.626 1.00 0.92 C ATOM 304 CE LYS A 41 3.355 8.112 -1.642 1.00 0.70 C ATOM 305 NZ LYS A 41 2.032 8.378 -1.045 1.00 0.98 N ATOM 0 H LYS A 41 6.942 3.367 -0.023 1.00 0.42 H new ATOM 0 HA LYS A 41 4.751 4.169 -1.802 1.00 0.45 H new ATOM 0 HB2 LYS A 41 4.848 4.409 0.757 1.00 0.57 H new ATOM 0 HB3 LYS A 41 5.938 5.750 0.466 1.00 0.57 H new ATOM 0 HG2 LYS A 41 3.361 5.652 -1.103 1.00 0.87 H new ATOM 0 HG3 LYS A 41 3.271 6.090 0.592 1.00 0.87 H new ATOM 0 HD2 LYS A 41 4.341 8.122 0.278 1.00 0.92 H new ATOM 0 HD3 LYS A 41 5.340 7.526 -1.033 1.00 0.92 H new ATOM 0 HE2 LYS A 41 3.768 9.040 -2.037 1.00 0.70 H new ATOM 0 HE3 LYS A 41 3.243 7.429 -2.484 1.00 0.70 H new ATOM 0 HZ1 LYS A 41 1.333 8.522 -1.801 1.00 0.98 H new ATOM 0 HZ2 LYS A 41 1.746 7.568 -0.459 1.00 0.98 H new ATOM 0 HZ3 LYS A 41 2.083 9.232 -0.454 1.00 0.98 H new ATOM 319 N LEU A 42 5.854 5.502 -3.438 1.00 0.45 N ATOM 320 CA LEU A 42 6.453 6.248 -4.542 1.00 0.46 C ATOM 321 C LEU A 42 5.839 7.643 -4.706 1.00 0.46 C ATOM 322 O LEU A 42 4.687 7.888 -4.351 1.00 0.47 O ATOM 323 CB LEU A 42 6.356 5.429 -5.846 1.00 0.48 C ATOM 324 CG LEU A 42 7.090 4.079 -5.865 1.00 0.48 C ATOM 325 CD1 LEU A 42 7.220 3.604 -7.312 1.00 0.53 C ATOM 326 CD2 LEU A 42 8.501 4.140 -5.293 1.00 0.46 C ATOM 0 H LEU A 42 4.964 5.069 -3.685 1.00 0.45 H new ATOM 0 HA LEU A 42 7.505 6.406 -4.305 1.00 0.46 H new ATOM 0 HB2 LEU A 42 5.302 5.247 -6.057 1.00 0.48 H new ATOM 0 HB3 LEU A 42 6.744 6.039 -6.662 1.00 0.48 H new ATOM 0 HG LEU A 42 6.499 3.405 -5.245 1.00 0.48 H new ATOM 0 HD11 LEU A 42 7.740 2.646 -7.335 1.00 0.53 H new ATOM 0 HD12 LEU A 42 6.228 3.489 -7.748 1.00 0.53 H new ATOM 0 HD13 LEU A 42 7.785 4.338 -7.886 1.00 0.53 H new ATOM 0 HD21 LEU A 42 8.956 3.150 -5.340 1.00 0.46 H new ATOM 0 HD22 LEU A 42 9.099 4.842 -5.874 1.00 0.46 H new ATOM 0 HD23 LEU A 42 8.459 4.471 -4.255 1.00 0.46 H new ATOM 338 N LEU A 43 6.625 8.550 -5.281 1.00 0.48 N ATOM 339 CA LEU A 43 6.221 9.874 -5.748 1.00 0.50 C ATOM 340 C LEU A 43 6.928 10.209 -7.069 1.00 0.54 C ATOM 341 O LEU A 43 7.866 9.532 -7.497 1.00 0.57 O ATOM 342 CB LEU A 43 6.539 10.946 -4.682 1.00 0.57 C ATOM 343 CG LEU A 43 5.580 11.029 -3.483 1.00 0.81 C ATOM 344 CD1 LEU A 43 5.927 12.287 -2.692 1.00 1.73 C ATOM 345 CD2 LEU A 43 4.112 11.174 -3.870 1.00 0.79 C ATOM 0 H LEU A 43 7.616 8.371 -5.443 1.00 0.48 H new ATOM 0 HA LEU A 43 5.144 9.867 -5.918 1.00 0.50 H new ATOM 0 HB2 LEU A 43 7.544 10.762 -4.302 1.00 0.57 H new ATOM 0 HB3 LEU A 43 6.557 11.919 -5.172 1.00 0.57 H new ATOM 0 HG LEU A 43 5.700 10.098 -2.929 1.00 0.81 H new ATOM 0 HD11 LEU A 43 5.261 12.372 -1.833 1.00 1.73 H new ATOM 0 HD12 LEU A 43 6.959 12.226 -2.346 1.00 1.73 H new ATOM 0 HD13 LEU A 43 5.809 13.162 -3.331 1.00 1.73 H new ATOM 0 HD21 LEU A 43 3.501 11.226 -2.969 1.00 0.79 H new ATOM 0 HD22 LEU A 43 3.978 12.086 -4.452 1.00 0.79 H new ATOM 0 HD23 LEU A 43 3.806 10.314 -4.466 1.00 0.79 H new ATOM 357 N ALA A 44 6.482 11.288 -7.704 1.00 0.59 N ATOM 358 CA ALA A 44 7.156 11.897 -8.841 1.00 0.64 C ATOM 359 C ALA A 44 7.922 13.160 -8.416 1.00 0.67 C ATOM 360 O ALA A 44 7.495 13.864 -7.496 1.00 0.69 O ATOM 361 CB ALA A 44 6.112 12.210 -9.901 1.00 0.69 C ATOM 0 H ALA A 44 5.625 11.772 -7.436 1.00 0.59 H new ATOM 0 HA ALA A 44 7.894 11.207 -9.250 1.00 0.64 H new ATOM 0 HB1 ALA A 44 6.596 12.668 -10.764 1.00 0.69 H new ATOM 0 HB2 ALA A 44 5.618 11.288 -10.209 1.00 0.69 H new ATOM 0 HB3 ALA A 44 5.373 12.899 -9.492 1.00 0.69 H new ATOM 367 N THR A 45 9.017 13.486 -9.102 1.00 0.89 N ATOM 368 CA THR A 45 9.837 14.670 -8.789 1.00 0.98 C ATOM 369 C THR A 45 9.214 15.985 -9.271 1.00 1.01 C ATOM 370 O THR A 45 9.517 17.033 -8.707 1.00 1.13 O ATOM 371 CB THR A 45 11.275 14.525 -9.315 1.00 1.03 C ATOM 372 OG1 THR A 45 11.301 14.323 -10.710 1.00 1.02 O ATOM 373 CG2 THR A 45 11.986 13.330 -8.675 1.00 1.07 C ATOM 0 H THR A 45 9.366 12.941 -9.891 1.00 0.89 H new ATOM 0 HA THR A 45 9.872 14.720 -7.701 1.00 0.98 H new ATOM 0 HB THR A 45 11.782 15.455 -9.058 1.00 1.03 H new ATOM 0 HG1 THR A 45 12.230 14.237 -11.011 1.00 1.02 H new ATOM 0 HG21 THR A 45 13.000 13.256 -9.069 1.00 1.07 H new ATOM 0 HG22 THR A 45 12.025 13.466 -7.594 1.00 1.07 H new ATOM 0 HG23 THR A 45 11.440 12.415 -8.906 1.00 1.07 H new ATOM 381 N ASP A 46 8.310 15.941 -10.257 1.00 0.98 N ATOM 382 CA ASP A 46 7.542 17.082 -10.781 1.00 1.04 C ATOM 383 C ASP A 46 6.061 16.711 -11.029 1.00 1.07 C ATOM 384 O ASP A 46 5.458 17.135 -12.012 1.00 1.25 O ATOM 385 CB ASP A 46 8.241 17.611 -12.046 1.00 1.11 C ATOM 386 CG ASP A 46 7.640 18.908 -12.585 1.00 1.27 C ATOM 387 OD1 ASP A 46 7.715 19.936 -11.871 1.00 2.13 O ATOM 388 OD2 ASP A 46 7.148 18.908 -13.740 1.00 2.03 O ATOM 0 H ASP A 46 8.082 15.069 -10.735 1.00 0.98 H new ATOM 0 HA ASP A 46 7.520 17.879 -10.038 1.00 1.04 H new ATOM 0 HB2 ASP A 46 9.296 17.774 -11.826 1.00 1.11 H new ATOM 0 HB3 ASP A 46 8.192 16.848 -12.823 1.00 1.11 H new ATOM 393 N GLY A 47 5.463 15.846 -10.203 1.00 1.07 N ATOM 394 CA GLY A 47 4.058 15.425 -10.373 1.00 1.07 C ATOM 395 C GLY A 47 3.789 14.491 -11.566 1.00 0.85 C ATOM 396 O GLY A 47 2.639 14.294 -11.950 1.00 0.91 O ATOM 0 H GLY A 47 5.929 15.418 -9.403 1.00 1.07 H new ATOM 0 HA2 GLY A 47 3.734 14.924 -9.461 1.00 1.07 H new ATOM 0 HA3 GLY A 47 3.440 16.316 -10.484 1.00 1.07 H new ATOM 400 N ASP A 48 4.835 13.888 -12.136 1.00 0.67 N ATOM 401 CA ASP A 48 4.856 12.938 -13.267 1.00 0.59 C ATOM 402 C ASP A 48 4.164 11.575 -12.999 1.00 0.55 C ATOM 403 O ASP A 48 4.530 10.554 -13.583 1.00 0.57 O ATOM 404 CB ASP A 48 6.323 12.699 -13.690 1.00 0.57 C ATOM 405 CG ASP A 48 7.196 13.963 -13.693 1.00 0.76 C ATOM 406 OD1 ASP A 48 7.710 14.312 -12.604 1.00 1.82 O ATOM 407 OD2 ASP A 48 7.419 14.578 -14.763 1.00 1.62 O ATOM 0 H ASP A 48 5.779 14.064 -11.791 1.00 0.67 H new ATOM 0 HA ASP A 48 4.272 13.404 -14.061 1.00 0.59 H new ATOM 0 HB2 ASP A 48 6.768 11.966 -13.017 1.00 0.57 H new ATOM 0 HB3 ASP A 48 6.334 12.262 -14.689 1.00 0.57 H new ATOM 412 N MET A 49 3.191 11.513 -12.086 1.00 0.54 N ATOM 413 CA MET A 49 2.576 10.259 -11.641 1.00 0.53 C ATOM 414 C MET A 49 1.791 9.538 -12.749 1.00 0.55 C ATOM 415 O MET A 49 1.692 8.314 -12.705 1.00 0.56 O ATOM 416 CB MET A 49 1.674 10.511 -10.419 1.00 0.55 C ATOM 417 CG MET A 49 2.403 11.044 -9.173 1.00 0.54 C ATOM 418 SD MET A 49 2.939 9.815 -7.937 1.00 0.53 S ATOM 419 CE MET A 49 4.046 8.749 -8.897 1.00 0.51 C ATOM 0 H MET A 49 2.804 12.340 -11.630 1.00 0.54 H new ATOM 0 HA MET A 49 3.394 9.594 -11.362 1.00 0.53 H new ATOM 0 HB2 MET A 49 0.898 11.223 -10.700 1.00 0.55 H new ATOM 0 HB3 MET A 49 1.173 9.579 -10.158 1.00 0.55 H new ATOM 0 HG2 MET A 49 3.282 11.596 -9.505 1.00 0.54 H new ATOM 0 HG3 MET A 49 1.747 11.759 -8.677 1.00 0.54 H new ATOM 0 HE1 MET A 49 4.600 8.097 -8.221 1.00 0.51 H new ATOM 0 HE2 MET A 49 3.459 8.142 -9.587 1.00 0.51 H new ATOM 0 HE3 MET A 49 4.746 9.365 -9.461 1.00 0.51 H new ATOM 429 N ASP A 50 1.279 10.249 -13.761 1.00 0.58 N ATOM 430 CA ASP A 50 0.497 9.654 -14.854 1.00 0.64 C ATOM 431 C ASP A 50 1.364 8.862 -15.844 1.00 0.62 C ATOM 432 O ASP A 50 1.037 7.719 -16.181 1.00 0.67 O ATOM 433 CB ASP A 50 -0.278 10.745 -15.603 1.00 0.72 C ATOM 434 CG ASP A 50 -1.362 11.400 -14.749 1.00 1.04 C ATOM 435 OD1 ASP A 50 -2.470 10.827 -14.616 1.00 1.98 O ATOM 436 OD2 ASP A 50 -1.143 12.523 -14.235 1.00 1.95 O ATOM 0 H ASP A 50 1.396 11.259 -13.846 1.00 0.58 H new ATOM 0 HA ASP A 50 -0.197 8.949 -14.397 1.00 0.64 H new ATOM 0 HB2 ASP A 50 0.420 11.510 -15.944 1.00 0.72 H new ATOM 0 HB3 ASP A 50 -0.736 10.312 -16.492 1.00 0.72 H new ATOM 441 N LYS A 51 2.503 9.419 -16.287 1.00 0.58 N ATOM 442 CA LYS A 51 3.449 8.666 -17.121 1.00 0.59 C ATOM 443 C LYS A 51 4.070 7.512 -16.342 1.00 0.59 C ATOM 444 O LYS A 51 4.060 6.397 -16.851 1.00 0.67 O ATOM 445 CB LYS A 51 4.454 9.591 -17.804 1.00 0.62 C ATOM 446 CG LYS A 51 5.349 10.362 -16.830 1.00 0.64 C ATOM 447 CD LYS A 51 6.010 11.557 -17.509 1.00 0.74 C ATOM 448 CE LYS A 51 6.845 11.189 -18.733 1.00 1.84 C ATOM 449 NZ LYS A 51 7.378 12.413 -19.367 1.00 2.08 N ATOM 0 H LYS A 51 2.787 10.377 -16.084 1.00 0.58 H new ATOM 0 HA LYS A 51 2.903 8.198 -17.940 1.00 0.59 H new ATOM 0 HB2 LYS A 51 5.083 9.000 -18.470 1.00 0.62 H new ATOM 0 HB3 LYS A 51 3.913 10.304 -18.426 1.00 0.62 H new ATOM 0 HG2 LYS A 51 4.756 10.705 -15.982 1.00 0.64 H new ATOM 0 HG3 LYS A 51 6.116 9.697 -16.434 1.00 0.64 H new ATOM 0 HD2 LYS A 51 5.238 12.266 -17.808 1.00 0.74 H new ATOM 0 HD3 LYS A 51 6.647 12.066 -16.786 1.00 0.74 H new ATOM 0 HE2 LYS A 51 7.666 10.534 -18.440 1.00 1.84 H new ATOM 0 HE3 LYS A 51 6.235 10.636 -19.447 1.00 1.84 H new ATOM 0 HZ1 LYS A 51 7.945 12.154 -20.199 1.00 2.08 H new ATOM 0 HZ2 LYS A 51 6.589 13.023 -19.662 1.00 2.08 H new ATOM 0 HZ3 LYS A 51 7.975 12.924 -18.687 1.00 2.08 H new ATOM 463 N ILE A 52 4.475 7.723 -15.083 1.00 0.54 N ATOM 464 CA ILE A 52 4.864 6.644 -14.165 1.00 0.54 C ATOM 465 C ILE A 52 3.784 5.548 -14.124 1.00 0.57 C ATOM 466 O ILE A 52 4.108 4.395 -14.373 1.00 0.61 O ATOM 467 CB ILE A 52 5.197 7.220 -12.767 1.00 0.51 C ATOM 468 CG1 ILE A 52 6.457 8.115 -12.871 1.00 0.53 C ATOM 469 CG2 ILE A 52 5.419 6.094 -11.736 1.00 0.53 C ATOM 470 CD1 ILE A 52 6.826 8.881 -11.604 1.00 0.53 C ATOM 0 H ILE A 52 4.542 8.653 -14.670 1.00 0.54 H new ATOM 0 HA ILE A 52 5.772 6.167 -14.533 1.00 0.54 H new ATOM 0 HB ILE A 52 4.352 7.817 -12.423 1.00 0.51 H new ATOM 0 HG12 ILE A 52 7.303 7.489 -13.156 1.00 0.53 H new ATOM 0 HG13 ILE A 52 6.306 8.833 -13.677 1.00 0.53 H new ATOM 0 HG21 ILE A 52 5.651 6.531 -10.765 1.00 0.53 H new ATOM 0 HG22 ILE A 52 4.515 5.490 -11.656 1.00 0.53 H new ATOM 0 HG23 ILE A 52 6.248 5.464 -12.058 1.00 0.53 H new ATOM 0 HD11 ILE A 52 7.722 9.475 -11.786 1.00 0.53 H new ATOM 0 HD12 ILE A 52 6.004 9.540 -11.325 1.00 0.53 H new ATOM 0 HD13 ILE A 52 7.017 8.176 -10.795 1.00 0.53 H new ATOM 482 N ALA A 53 2.499 5.860 -13.927 1.00 0.59 N ATOM 483 CA ALA A 53 1.441 4.840 -13.908 1.00 0.66 C ATOM 484 C ALA A 53 1.339 4.027 -15.220 1.00 0.71 C ATOM 485 O ALA A 53 1.072 2.824 -15.170 1.00 0.76 O ATOM 486 CB ALA A 53 0.110 5.519 -13.556 1.00 0.70 C ATOM 0 H ALA A 53 2.164 6.812 -13.778 1.00 0.59 H new ATOM 0 HA ALA A 53 1.698 4.104 -13.146 1.00 0.66 H new ATOM 0 HB1 ALA A 53 -0.685 4.774 -13.538 1.00 0.70 H new ATOM 0 HB2 ALA A 53 0.189 5.989 -12.576 1.00 0.70 H new ATOM 0 HB3 ALA A 53 -0.120 6.278 -14.304 1.00 0.70 H new ATOM 492 N ASN A 54 1.634 4.635 -16.377 1.00 0.72 N ATOM 493 CA ASN A 54 1.729 3.932 -17.665 1.00 0.79 C ATOM 494 C ASN A 54 3.020 3.087 -17.790 1.00 0.79 C ATOM 495 O ASN A 54 3.008 2.028 -18.420 1.00 0.86 O ATOM 496 CB ASN A 54 1.629 4.940 -18.822 1.00 0.78 C ATOM 497 CG ASN A 54 0.223 5.444 -19.093 1.00 0.82 C ATOM 498 OD1 ASN A 54 -0.382 5.139 -20.112 1.00 0.95 O ATOM 499 ND2 ASN A 54 -0.310 6.295 -18.250 1.00 0.79 N ATOM 0 H ASN A 54 1.815 5.636 -16.447 1.00 0.72 H new ATOM 0 HA ASN A 54 0.893 3.234 -17.716 1.00 0.79 H new ATOM 0 HB2 ASN A 54 2.272 5.792 -18.602 1.00 0.78 H new ATOM 0 HB3 ASN A 54 2.016 4.474 -19.728 1.00 0.78 H new ATOM 0 HD21 ASN A 54 -1.226 6.700 -18.445 1.00 0.79 H new ATOM 0 HD22 ASN A 54 0.191 6.552 -17.399 1.00 0.79 H new ATOM 506 N GLU A 55 4.131 3.525 -17.192 1.00 0.73 N ATOM 507 CA GLU A 55 5.380 2.753 -17.078 1.00 0.74 C ATOM 508 C GLU A 55 5.268 1.576 -16.088 1.00 0.72 C ATOM 509 O GLU A 55 6.020 0.607 -16.204 1.00 0.80 O ATOM 510 CB GLU A 55 6.540 3.661 -16.661 1.00 0.71 C ATOM 511 CG GLU A 55 6.911 4.732 -17.702 1.00 0.82 C ATOM 512 CD GLU A 55 7.366 4.223 -19.079 1.00 0.87 C ATOM 513 OE1 GLU A 55 7.788 3.050 -19.211 1.00 1.95 O ATOM 514 OE2 GLU A 55 7.390 5.034 -20.042 1.00 1.71 O ATOM 0 H GLU A 55 4.193 4.448 -16.762 1.00 0.73 H new ATOM 0 HA GLU A 55 5.572 2.335 -18.066 1.00 0.74 H new ATOM 0 HB2 GLU A 55 6.281 4.155 -15.725 1.00 0.71 H new ATOM 0 HB3 GLU A 55 7.416 3.044 -16.464 1.00 0.71 H new ATOM 0 HG2 GLU A 55 6.047 5.381 -17.847 1.00 0.82 H new ATOM 0 HG3 GLU A 55 7.707 5.350 -17.287 1.00 0.82 H new ATOM 521 N LEU A 56 4.340 1.633 -15.124 1.00 0.68 N ATOM 522 CA LEU A 56 4.099 0.562 -14.152 1.00 0.70 C ATOM 523 C LEU A 56 3.019 -0.440 -14.581 1.00 0.82 C ATOM 524 O LEU A 56 3.152 -1.633 -14.305 1.00 0.93 O ATOM 525 CB LEU A 56 3.772 1.157 -12.775 1.00 0.65 C ATOM 526 CG LEU A 56 4.856 2.064 -12.160 1.00 0.57 C ATOM 527 CD1 LEU A 56 4.486 2.338 -10.716 1.00 0.62 C ATOM 528 CD2 LEU A 56 6.271 1.503 -12.185 1.00 0.58 C ATOM 0 H LEU A 56 3.727 2.438 -14.997 1.00 0.68 H new ATOM 0 HA LEU A 56 5.025 -0.010 -14.096 1.00 0.70 H new ATOM 0 HB2 LEU A 56 2.849 1.731 -12.858 1.00 0.65 H new ATOM 0 HB3 LEU A 56 3.576 0.337 -12.084 1.00 0.65 H new ATOM 0 HG LEU A 56 4.877 2.960 -12.780 1.00 0.57 H new ATOM 0 HD11 LEU A 56 5.242 2.979 -10.262 1.00 0.62 H new ATOM 0 HD12 LEU A 56 3.517 2.836 -10.677 1.00 0.62 H new ATOM 0 HD13 LEU A 56 4.433 1.397 -10.169 1.00 0.62 H new ATOM 0 HD21 LEU A 56 6.954 2.219 -11.729 1.00 0.58 H new ATOM 0 HD22 LEU A 56 6.301 0.567 -11.628 1.00 0.58 H new ATOM 0 HD23 LEU A 56 6.572 1.321 -13.217 1.00 0.58 H new ATOM 540 N GLU A 57 1.960 0.003 -15.266 1.00 0.86 N ATOM 541 CA GLU A 57 0.886 -0.904 -15.713 1.00 0.98 C ATOM 542 C GLU A 57 1.347 -1.891 -16.802 1.00 1.06 C ATOM 543 O GLU A 57 0.821 -3.000 -16.904 1.00 1.19 O ATOM 544 CB GLU A 57 -0.359 -0.115 -16.161 1.00 1.02 C ATOM 545 CG GLU A 57 -0.248 0.478 -17.569 1.00 1.05 C ATOM 546 CD GLU A 57 -1.551 1.160 -17.971 1.00 1.50 C ATOM 547 OE1 GLU A 57 -1.854 2.260 -17.457 1.00 2.48 O ATOM 548 OE2 GLU A 57 -2.289 0.583 -18.812 1.00 2.22 O ATOM 0 H GLU A 57 1.819 0.980 -15.525 1.00 0.86 H new ATOM 0 HA GLU A 57 0.613 -1.509 -14.848 1.00 0.98 H new ATOM 0 HB2 GLU A 57 -1.227 -0.773 -16.123 1.00 1.02 H new ATOM 0 HB3 GLU A 57 -0.540 0.692 -15.451 1.00 1.02 H new ATOM 0 HG2 GLU A 57 0.570 1.197 -17.602 1.00 1.05 H new ATOM 0 HG3 GLU A 57 -0.009 -0.310 -18.283 1.00 1.05 H new ATOM 555 N THR A 58 2.347 -1.495 -17.599 1.00 1.01 N ATOM 556 CA THR A 58 2.968 -2.310 -18.662 1.00 1.05 C ATOM 557 C THR A 58 3.883 -3.418 -18.113 1.00 0.96 C ATOM 558 O THR A 58 4.275 -4.322 -18.853 1.00 0.98 O ATOM 559 CB THR A 58 3.720 -1.371 -19.622 1.00 1.11 C ATOM 560 OG1 THR A 58 3.987 -1.969 -20.873 1.00 1.26 O ATOM 561 CG2 THR A 58 5.045 -0.889 -19.031 1.00 1.03 C ATOM 0 H THR A 58 2.764 -0.567 -17.523 1.00 1.01 H new ATOM 0 HA THR A 58 2.180 -2.835 -19.201 1.00 1.05 H new ATOM 0 HB THR A 58 3.051 -0.523 -19.769 1.00 1.11 H new ATOM 0 HG1 THR A 58 4.181 -2.921 -20.746 1.00 1.26 H new ATOM 0 HG21 THR A 58 5.542 -0.229 -19.742 1.00 1.03 H new ATOM 0 HG22 THR A 58 4.854 -0.347 -18.105 1.00 1.03 H new ATOM 0 HG23 THR A 58 5.685 -1.747 -18.824 1.00 1.03 H new ATOM 569 N GLY A 59 4.218 -3.368 -16.817 1.00 0.94 N ATOM 570 CA GLY A 59 4.906 -4.429 -16.080 1.00 0.94 C ATOM 571 C GLY A 59 3.933 -5.375 -15.368 1.00 0.93 C ATOM 572 O GLY A 59 2.716 -5.161 -15.346 1.00 0.97 O ATOM 0 H GLY A 59 4.009 -2.557 -16.235 1.00 0.94 H new ATOM 0 HA2 GLY A 59 5.526 -5.002 -16.769 1.00 0.94 H new ATOM 0 HA3 GLY A 59 5.576 -3.981 -15.345 1.00 0.94 H new ATOM 576 N ASN A 60 4.468 -6.420 -14.741 1.00 0.96 N ATOM 577 CA ASN A 60 3.746 -7.320 -13.834 1.00 1.00 C ATOM 578 C ASN A 60 3.881 -6.873 -12.363 1.00 0.87 C ATOM 579 O ASN A 60 3.969 -7.700 -11.451 1.00 0.93 O ATOM 580 CB ASN A 60 4.177 -8.776 -14.081 1.00 1.15 C ATOM 581 CG ASN A 60 3.847 -9.248 -15.479 1.00 1.53 C ATOM 582 OD1 ASN A 60 2.689 -9.461 -15.813 1.00 2.35 O ATOM 583 ND2 ASN A 60 4.828 -9.391 -16.335 1.00 1.65 N ATOM 0 H ASN A 60 5.449 -6.675 -14.852 1.00 0.96 H new ATOM 0 HA ASN A 60 2.679 -7.266 -14.051 1.00 1.00 H new ATOM 0 HB2 ASN A 60 5.250 -8.867 -13.914 1.00 1.15 H new ATOM 0 HB3 ASN A 60 3.685 -9.425 -13.356 1.00 1.15 H new ATOM 0 HD21 ASN A 60 4.631 -9.683 -17.292 1.00 1.65 H new ATOM 0 HD22 ASN A 60 5.789 -9.210 -16.044 1.00 1.65 H new ATOM 590 N TYR A 61 3.937 -5.562 -12.098 1.00 0.77 N ATOM 591 CA TYR A 61 4.170 -5.042 -10.742 1.00 0.71 C ATOM 592 C TYR A 61 2.943 -5.131 -9.811 1.00 0.74 C ATOM 593 O TYR A 61 2.866 -4.436 -8.799 1.00 0.86 O ATOM 594 CB TYR A 61 4.824 -3.655 -10.749 1.00 0.65 C ATOM 595 CG TYR A 61 5.930 -3.404 -11.763 1.00 0.63 C ATOM 596 CD1 TYR A 61 6.976 -4.327 -11.967 1.00 1.80 C ATOM 597 CD2 TYR A 61 5.943 -2.182 -12.454 1.00 1.82 C ATOM 598 CE1 TYR A 61 8.018 -4.035 -12.873 1.00 1.81 C ATOM 599 CE2 TYR A 61 7.012 -1.855 -13.307 1.00 1.85 C ATOM 600 CZ TYR A 61 8.048 -2.785 -13.529 1.00 0.71 C ATOM 601 OH TYR A 61 9.091 -2.430 -14.324 1.00 0.81 O ATOM 0 H TYR A 61 3.824 -4.838 -12.807 1.00 0.77 H new ATOM 0 HA TYR A 61 4.897 -5.722 -10.297 1.00 0.71 H new ATOM 0 HB2 TYR A 61 4.041 -2.915 -10.915 1.00 0.65 H new ATOM 0 HB3 TYR A 61 5.231 -3.470 -9.755 1.00 0.65 H new ATOM 0 HD1 TYR A 61 6.980 -5.262 -11.427 1.00 1.80 H new ATOM 0 HD2 TYR A 61 5.125 -1.487 -12.329 1.00 1.82 H new ATOM 0 HE1 TYR A 61 8.790 -4.766 -13.064 1.00 1.81 H new ATOM 0 HE2 TYR A 61 7.039 -0.891 -13.792 1.00 1.85 H new ATOM 0 HH TYR A 61 8.933 -1.535 -14.690 1.00 0.81 H new ATOM 611 N ALA A 62 1.960 -5.963 -10.165 1.00 0.81 N ATOM 612 CA ALA A 62 0.883 -6.388 -9.276 1.00 0.88 C ATOM 613 C ALA A 62 1.395 -7.473 -8.302 1.00 0.87 C ATOM 614 O ALA A 62 0.833 -7.647 -7.218 1.00 0.96 O ATOM 615 CB ALA A 62 -0.264 -6.925 -10.135 1.00 1.01 C ATOM 0 H ALA A 62 1.892 -6.367 -11.099 1.00 0.81 H new ATOM 0 HA ALA A 62 0.530 -5.547 -8.680 1.00 0.88 H new ATOM 0 HB1 ALA A 62 -1.081 -7.249 -9.490 1.00 1.01 H new ATOM 0 HB2 ALA A 62 -0.618 -6.139 -10.802 1.00 1.01 H new ATOM 0 HB3 ALA A 62 0.089 -7.770 -10.726 1.00 1.01 H new ATOM 621 N GLY A 63 2.464 -8.184 -8.695 1.00 0.80 N ATOM 622 CA GLY A 63 3.206 -9.140 -7.874 1.00 0.78 C ATOM 623 C GLY A 63 4.671 -8.739 -7.678 1.00 0.61 C ATOM 624 O GLY A 63 5.105 -8.566 -6.541 1.00 0.60 O ATOM 0 H GLY A 63 2.848 -8.101 -9.636 1.00 0.80 H new ATOM 0 HA2 GLY A 63 2.724 -9.227 -6.900 1.00 0.78 H new ATOM 0 HA3 GLY A 63 3.162 -10.124 -8.341 1.00 0.78 H new ATOM 628 N ASN A 64 5.438 -8.601 -8.769 1.00 0.71 N ATOM 629 CA ASN A 64 6.902 -8.435 -8.698 1.00 0.65 C ATOM 630 C ASN A 64 7.395 -6.987 -8.487 1.00 0.55 C ATOM 631 O ASN A 64 6.701 -6.031 -8.829 1.00 0.60 O ATOM 632 CB ASN A 64 7.616 -9.215 -9.814 1.00 0.83 C ATOM 633 CG ASN A 64 7.865 -8.388 -11.034 1.00 1.03 C ATOM 634 OD1 ASN A 64 8.987 -8.169 -11.467 1.00 1.44 O ATOM 635 ND2 ASN A 64 6.820 -7.930 -11.650 1.00 1.33 N ATOM 0 H ASN A 64 5.068 -8.601 -9.719 1.00 0.71 H new ATOM 0 HA ASN A 64 7.209 -8.902 -7.762 1.00 0.65 H new ATOM 0 HB2 ASN A 64 8.567 -9.592 -9.436 1.00 0.83 H new ATOM 0 HB3 ASN A 64 7.015 -10.083 -10.086 1.00 0.83 H new ATOM 0 HD21 ASN A 64 6.930 -7.382 -12.503 1.00 1.33 H new ATOM 0 HD22 ASN A 64 5.888 -8.118 -11.281 1.00 1.33 H new ATOM 642 N LYS A 65 8.606 -6.819 -7.938 1.00 0.50 N ATOM 643 CA LYS A 65 9.214 -5.498 -7.690 1.00 0.47 C ATOM 644 C LYS A 65 9.403 -4.664 -8.964 1.00 0.48 C ATOM 645 O LYS A 65 9.690 -5.220 -10.028 1.00 0.54 O ATOM 646 CB LYS A 65 10.528 -5.633 -6.901 1.00 0.52 C ATOM 647 CG LYS A 65 11.705 -6.207 -7.705 1.00 1.20 C ATOM 648 CD LYS A 65 12.939 -6.404 -6.820 1.00 1.56 C ATOM 649 CE LYS A 65 13.509 -5.083 -6.299 1.00 1.43 C ATOM 650 NZ LYS A 65 14.666 -5.316 -5.407 1.00 2.51 N ATOM 0 H LYS A 65 9.197 -7.599 -7.651 1.00 0.50 H new ATOM 0 HA LYS A 65 8.502 -4.944 -7.078 1.00 0.47 H new ATOM 0 HB2 LYS A 65 10.810 -4.651 -6.521 1.00 0.52 H new ATOM 0 HB3 LYS A 65 10.352 -6.271 -6.035 1.00 0.52 H new ATOM 0 HG2 LYS A 65 11.416 -7.160 -8.147 1.00 1.20 H new ATOM 0 HG3 LYS A 65 11.948 -5.535 -8.528 1.00 1.20 H new ATOM 0 HD2 LYS A 65 12.677 -7.040 -5.975 1.00 1.56 H new ATOM 0 HD3 LYS A 65 13.708 -6.928 -7.387 1.00 1.56 H new ATOM 0 HE2 LYS A 65 13.814 -4.459 -7.139 1.00 1.43 H new ATOM 0 HE3 LYS A 65 12.735 -4.537 -5.760 1.00 1.43 H new ATOM 0 HZ1 LYS A 65 15.033 -4.404 -5.068 1.00 2.51 H new ATOM 0 HZ2 LYS A 65 14.367 -5.892 -4.594 1.00 2.51 H new ATOM 0 HZ3 LYS A 65 15.413 -5.816 -5.930 1.00 2.51 H new ATOM 664 N VAL A 66 9.331 -3.333 -8.860 1.00 0.47 N ATOM 665 CA VAL A 66 9.579 -2.444 -10.013 1.00 0.47 C ATOM 666 C VAL A 66 11.018 -2.610 -10.505 1.00 0.56 C ATOM 667 O VAL A 66 11.966 -2.457 -9.735 1.00 0.68 O ATOM 668 CB VAL A 66 9.269 -0.959 -9.745 1.00 0.46 C ATOM 669 CG1 VAL A 66 9.625 -0.095 -10.963 1.00 0.52 C ATOM 670 CG2 VAL A 66 7.775 -0.767 -9.499 1.00 0.44 C ATOM 0 H VAL A 66 9.104 -2.843 -7.995 1.00 0.47 H new ATOM 0 HA VAL A 66 8.879 -2.755 -10.789 1.00 0.47 H new ATOM 0 HB VAL A 66 9.857 -0.662 -8.876 1.00 0.46 H new ATOM 0 HG11 VAL A 66 9.397 0.949 -10.748 1.00 0.52 H new ATOM 0 HG12 VAL A 66 10.688 -0.196 -11.183 1.00 0.52 H new ATOM 0 HG13 VAL A 66 9.044 -0.423 -11.825 1.00 0.52 H new ATOM 0 HG21 VAL A 66 7.570 0.287 -9.311 1.00 0.44 H new ATOM 0 HG22 VAL A 66 7.217 -1.095 -10.376 1.00 0.44 H new ATOM 0 HG23 VAL A 66 7.470 -1.356 -8.634 1.00 0.44 H new ATOM 680 N GLY A 67 11.187 -2.929 -11.790 1.00 0.62 N ATOM 681 CA GLY A 67 12.491 -3.300 -12.343 1.00 0.73 C ATOM 682 C GLY A 67 13.457 -2.126 -12.501 1.00 0.67 C ATOM 683 O GLY A 67 14.617 -2.228 -12.089 1.00 0.80 O ATOM 0 H GLY A 67 10.429 -2.938 -12.473 1.00 0.62 H new ATOM 0 HA2 GLY A 67 12.948 -4.049 -11.696 1.00 0.73 H new ATOM 0 HA3 GLY A 67 12.342 -3.768 -13.316 1.00 0.73 H new ATOM 687 N VAL A 68 12.977 -1.015 -13.071 1.00 0.67 N ATOM 688 CA VAL A 68 13.717 0.245 -13.253 1.00 0.80 C ATOM 689 C VAL A 68 12.738 1.410 -13.104 1.00 0.70 C ATOM 690 O VAL A 68 11.817 1.556 -13.911 1.00 0.83 O ATOM 691 CB VAL A 68 14.405 0.323 -14.637 1.00 1.15 C ATOM 692 CG1 VAL A 68 15.186 1.635 -14.806 1.00 1.71 C ATOM 693 CG2 VAL A 68 15.392 -0.826 -14.875 1.00 1.84 C ATOM 0 H VAL A 68 12.025 -0.964 -13.433 1.00 0.67 H new ATOM 0 HA VAL A 68 14.501 0.294 -12.497 1.00 0.80 H new ATOM 0 HB VAL A 68 13.592 0.261 -15.360 1.00 1.15 H new ATOM 0 HG11 VAL A 68 15.656 1.655 -15.789 1.00 1.71 H new ATOM 0 HG12 VAL A 68 14.503 2.479 -14.713 1.00 1.71 H new ATOM 0 HG13 VAL A 68 15.954 1.703 -14.036 1.00 1.71 H new ATOM 0 HG21 VAL A 68 15.844 -0.719 -15.861 1.00 1.84 H new ATOM 0 HG22 VAL A 68 16.172 -0.799 -14.114 1.00 1.84 H new ATOM 0 HG23 VAL A 68 14.863 -1.777 -14.819 1.00 1.84 H new ATOM 703 N LEU A 69 12.930 2.250 -12.090 1.00 0.62 N ATOM 704 CA LEU A 69 12.198 3.506 -11.920 1.00 0.55 C ATOM 705 C LEU A 69 12.689 4.576 -12.913 1.00 0.59 C ATOM 706 O LEU A 69 13.887 4.620 -13.213 1.00 0.70 O ATOM 707 CB LEU A 69 12.359 4.001 -10.470 1.00 0.58 C ATOM 708 CG LEU A 69 11.668 3.114 -9.424 1.00 0.59 C ATOM 709 CD1 LEU A 69 12.065 3.556 -8.017 1.00 0.74 C ATOM 710 CD2 LEU A 69 10.148 3.193 -9.526 1.00 0.53 C ATOM 0 H LEU A 69 13.610 2.076 -11.350 1.00 0.62 H new ATOM 0 HA LEU A 69 11.143 3.326 -12.126 1.00 0.55 H new ATOM 0 HB2 LEU A 69 13.421 4.062 -10.234 1.00 0.58 H new ATOM 0 HB3 LEU A 69 11.958 5.012 -10.396 1.00 0.58 H new ATOM 0 HG LEU A 69 11.987 2.090 -9.617 1.00 0.59 H new ATOM 0 HD11 LEU A 69 11.570 2.921 -7.283 1.00 0.74 H new ATOM 0 HD12 LEU A 69 13.145 3.471 -7.900 1.00 0.74 H new ATOM 0 HD13 LEU A 69 11.764 4.592 -7.862 1.00 0.74 H new ATOM 0 HD21 LEU A 69 9.699 2.551 -8.768 1.00 0.53 H new ATOM 0 HD22 LEU A 69 9.826 4.222 -9.367 1.00 0.53 H new ATOM 0 HD23 LEU A 69 9.832 2.863 -10.516 1.00 0.53 H new ATOM 722 N PRO A 70 11.807 5.472 -13.396 1.00 0.53 N ATOM 723 CA PRO A 70 12.225 6.573 -14.255 1.00 0.56 C ATOM 724 C PRO A 70 13.045 7.619 -13.491 1.00 0.59 C ATOM 725 O PRO A 70 12.956 7.730 -12.264 1.00 0.59 O ATOM 726 CB PRO A 70 10.925 7.157 -14.808 1.00 0.52 C ATOM 727 CG PRO A 70 9.872 6.849 -13.763 1.00 0.47 C ATOM 728 CD PRO A 70 10.370 5.537 -13.138 1.00 0.49 C ATOM 0 HA PRO A 70 12.886 6.234 -15.052 1.00 0.56 H new ATOM 0 HB2 PRO A 70 11.015 8.231 -14.972 1.00 0.52 H new ATOM 0 HB3 PRO A 70 10.669 6.709 -15.768 1.00 0.52 H new ATOM 0 HG2 PRO A 70 9.796 7.645 -13.022 1.00 0.47 H new ATOM 0 HG3 PRO A 70 8.884 6.733 -14.209 1.00 0.47 H new ATOM 0 HD2 PRO A 70 10.167 5.516 -12.067 1.00 0.49 H new ATOM 0 HD3 PRO A 70 9.858 4.680 -13.576 1.00 0.49 H new ATOM 736 N ALA A 71 13.782 8.458 -14.222 1.00 0.66 N ATOM 737 CA ALA A 71 14.522 9.587 -13.647 1.00 0.71 C ATOM 738 C ALA A 71 13.607 10.539 -12.846 1.00 0.71 C ATOM 739 O ALA A 71 13.999 11.080 -11.811 1.00 0.91 O ATOM 740 CB ALA A 71 15.220 10.321 -14.797 1.00 0.82 C ATOM 0 H ALA A 71 13.884 8.374 -15.233 1.00 0.66 H new ATOM 0 HA ALA A 71 15.256 9.214 -12.933 1.00 0.71 H new ATOM 0 HB1 ALA A 71 15.780 11.168 -14.401 1.00 0.82 H new ATOM 0 HB2 ALA A 71 15.903 9.639 -15.303 1.00 0.82 H new ATOM 0 HB3 ALA A 71 14.474 10.679 -15.506 1.00 0.82 H new ATOM 746 N ASN A 72 12.356 10.686 -13.296 1.00 0.59 N ATOM 747 CA ASN A 72 11.295 11.480 -12.671 1.00 0.61 C ATOM 748 C ASN A 72 10.517 10.779 -11.533 1.00 0.60 C ATOM 749 O ASN A 72 9.601 11.385 -10.980 1.00 0.68 O ATOM 750 CB ASN A 72 10.382 12.048 -13.776 1.00 0.59 C ATOM 751 CG ASN A 72 9.961 11.025 -14.810 1.00 0.63 C ATOM 752 OD1 ASN A 72 10.696 10.767 -15.751 1.00 1.41 O ATOM 753 ND2 ASN A 72 8.827 10.384 -14.664 1.00 1.13 N ATOM 0 H ASN A 72 12.041 10.229 -14.152 1.00 0.59 H new ATOM 0 HA ASN A 72 11.780 12.299 -12.139 1.00 0.61 H new ATOM 0 HB2 ASN A 72 9.490 12.472 -13.315 1.00 0.59 H new ATOM 0 HB3 ASN A 72 10.900 12.865 -14.278 1.00 0.59 H new ATOM 0 HD21 ASN A 72 8.556 9.667 -15.337 1.00 1.13 H new ATOM 0 HD22 ASN A 72 8.216 10.602 -13.877 1.00 1.13 H new ATOM 760 N ALA A 73 10.852 9.540 -11.160 1.00 0.58 N ATOM 761 CA ALA A 73 10.328 8.875 -9.956 1.00 0.59 C ATOM 762 C ALA A 73 11.274 9.005 -8.746 1.00 0.64 C ATOM 763 O ALA A 73 12.494 9.083 -8.915 1.00 0.73 O ATOM 764 CB ALA A 73 10.074 7.400 -10.278 1.00 0.57 C ATOM 0 H ALA A 73 11.503 8.961 -11.690 1.00 0.58 H new ATOM 0 HA ALA A 73 9.398 9.369 -9.675 1.00 0.59 H new ATOM 0 HB1 ALA A 73 9.685 6.896 -9.393 1.00 0.57 H new ATOM 0 HB2 ALA A 73 9.348 7.324 -11.087 1.00 0.57 H new ATOM 0 HB3 ALA A 73 11.008 6.928 -10.583 1.00 0.57 H new ATOM 770 N LYS A 74 10.714 8.977 -7.528 1.00 0.61 N ATOM 771 CA LYS A 74 11.440 8.863 -6.249 1.00 0.73 C ATOM 772 C LYS A 74 10.608 8.123 -5.196 1.00 0.57 C ATOM 773 O LYS A 74 9.409 7.920 -5.379 1.00 0.49 O ATOM 774 CB LYS A 74 11.893 10.251 -5.757 1.00 0.99 C ATOM 775 CG LYS A 74 10.870 10.982 -4.867 1.00 0.84 C ATOM 776 CD LYS A 74 11.362 12.407 -4.609 1.00 1.26 C ATOM 777 CE LYS A 74 10.566 13.123 -3.518 1.00 1.55 C ATOM 778 NZ LYS A 74 11.223 14.415 -3.215 1.00 2.14 N ATOM 0 H LYS A 74 9.704 9.035 -7.399 1.00 0.61 H new ATOM 0 HA LYS A 74 12.335 8.265 -6.417 1.00 0.73 H new ATOM 0 HB2 LYS A 74 12.824 10.139 -5.201 1.00 0.99 H new ATOM 0 HB3 LYS A 74 12.113 10.875 -6.623 1.00 0.99 H new ATOM 0 HG2 LYS A 74 9.895 11.003 -5.354 1.00 0.84 H new ATOM 0 HG3 LYS A 74 10.744 10.451 -3.924 1.00 0.84 H new ATOM 0 HD2 LYS A 74 12.414 12.377 -4.324 1.00 1.26 H new ATOM 0 HD3 LYS A 74 11.299 12.981 -5.534 1.00 1.26 H new ATOM 0 HE2 LYS A 74 9.540 13.290 -3.847 1.00 1.55 H new ATOM 0 HE3 LYS A 74 10.516 12.506 -2.621 1.00 1.55 H new ATOM 0 HZ1 LYS A 74 10.689 14.911 -2.473 1.00 2.14 H new ATOM 0 HZ2 LYS A 74 12.194 14.242 -2.885 1.00 2.14 H new ATOM 0 HZ3 LYS A 74 11.248 15.001 -4.074 1.00 2.14 H new ATOM 792 N GLU A 75 11.230 7.730 -4.088 1.00 0.63 N ATOM 793 CA GLU A 75 10.592 6.930 -3.030 1.00 0.62 C ATOM 794 C GLU A 75 10.789 7.590 -1.652 1.00 0.62 C ATOM 795 O GLU A 75 11.865 8.133 -1.389 1.00 0.77 O ATOM 796 CB GLU A 75 11.109 5.474 -3.059 1.00 0.94 C ATOM 797 CG GLU A 75 11.595 4.956 -4.435 1.00 0.66 C ATOM 798 CD GLU A 75 13.123 4.997 -4.520 1.00 1.07 C ATOM 799 OE1 GLU A 75 13.708 6.066 -4.815 1.00 2.61 O ATOM 800 OE2 GLU A 75 13.769 3.954 -4.259 1.00 1.38 O ATOM 0 H GLU A 75 12.204 7.958 -3.891 1.00 0.63 H new ATOM 0 HA GLU A 75 9.519 6.894 -3.218 1.00 0.62 H new ATOM 0 HB2 GLU A 75 11.931 5.387 -2.349 1.00 0.94 H new ATOM 0 HB3 GLU A 75 10.312 4.819 -2.707 1.00 0.94 H new ATOM 0 HG2 GLU A 75 11.245 3.935 -4.589 1.00 0.66 H new ATOM 0 HG3 GLU A 75 11.165 5.564 -5.231 1.00 0.66 H new ATOM 807 N ILE A 76 9.787 7.558 -0.767 1.00 0.55 N ATOM 808 CA ILE A 76 9.819 8.220 0.558 1.00 0.54 C ATOM 809 C ILE A 76 9.483 7.250 1.697 1.00 0.54 C ATOM 810 O ILE A 76 8.586 6.419 1.556 1.00 0.63 O ATOM 811 CB ILE A 76 8.886 9.458 0.622 1.00 0.54 C ATOM 812 CG1 ILE A 76 7.476 9.177 0.050 1.00 0.54 C ATOM 813 CG2 ILE A 76 9.523 10.687 -0.050 1.00 0.60 C ATOM 814 CD1 ILE A 76 6.499 10.343 0.233 1.00 0.67 C ATOM 0 H ILE A 76 8.912 7.065 -0.947 1.00 0.55 H new ATOM 0 HA ILE A 76 10.845 8.563 0.692 1.00 0.54 H new ATOM 0 HB ILE A 76 8.756 9.684 1.680 1.00 0.54 H new ATOM 0 HG12 ILE A 76 7.562 8.949 -1.012 1.00 0.54 H new ATOM 0 HG13 ILE A 76 7.066 8.291 0.534 1.00 0.54 H new ATOM 0 HG21 ILE A 76 8.839 11.533 0.016 1.00 0.60 H new ATOM 0 HG22 ILE A 76 10.456 10.935 0.455 1.00 0.60 H new ATOM 0 HG23 ILE A 76 9.726 10.465 -1.098 1.00 0.60 H new ATOM 0 HD11 ILE A 76 5.531 10.076 -0.191 1.00 0.67 H new ATOM 0 HD12 ILE A 76 6.383 10.557 1.295 1.00 0.67 H new ATOM 0 HD13 ILE A 76 6.887 11.226 -0.275 1.00 0.67 H new ATOM 826 N ALA A 77 10.166 7.376 2.840 1.00 0.53 N ATOM 827 CA ALA A 77 9.895 6.612 4.063 1.00 0.51 C ATOM 828 C ALA A 77 9.276 7.487 5.176 1.00 0.49 C ATOM 829 O ALA A 77 9.335 8.716 5.114 1.00 0.58 O ATOM 830 CB ALA A 77 11.182 5.900 4.496 1.00 0.56 C ATOM 0 H ALA A 77 10.943 8.029 2.943 1.00 0.53 H new ATOM 0 HA ALA A 77 9.138 5.856 3.857 1.00 0.51 H new ATOM 0 HB1 ALA A 77 10.993 5.328 5.405 1.00 0.56 H new ATOM 0 HB2 ALA A 77 11.509 5.226 3.704 1.00 0.56 H new ATOM 0 HB3 ALA A 77 11.960 6.639 4.687 1.00 0.56 H new ATOM 836 N GLY A 78 8.687 6.861 6.200 1.00 0.49 N ATOM 837 CA GLY A 78 8.035 7.525 7.341 1.00 0.52 C ATOM 838 C GLY A 78 6.538 7.819 7.162 1.00 0.55 C ATOM 839 O GLY A 78 5.965 8.604 7.922 1.00 0.64 O ATOM 0 H GLY A 78 8.648 5.844 6.262 1.00 0.49 H new ATOM 0 HA2 GLY A 78 8.162 6.900 8.225 1.00 0.52 H new ATOM 0 HA3 GLY A 78 8.552 8.464 7.537 1.00 0.52 H new ATOM 843 N VAL A 79 5.901 7.209 6.161 1.00 0.54 N ATOM 844 CA VAL A 79 4.452 7.261 5.881 1.00 0.55 C ATOM 845 C VAL A 79 3.757 6.017 6.447 1.00 0.51 C ATOM 846 O VAL A 79 4.344 4.937 6.443 1.00 0.51 O ATOM 847 CB VAL A 79 4.199 7.451 4.369 1.00 0.59 C ATOM 848 CG1 VAL A 79 5.024 6.518 3.479 1.00 0.73 C ATOM 849 CG2 VAL A 79 2.720 7.363 3.990 1.00 0.58 C ATOM 0 H VAL A 79 6.402 6.633 5.484 1.00 0.54 H new ATOM 0 HA VAL A 79 4.017 8.125 6.383 1.00 0.55 H new ATOM 0 HB VAL A 79 4.539 8.468 4.176 1.00 0.59 H new ATOM 0 HG11 VAL A 79 4.790 6.713 2.432 1.00 0.73 H new ATOM 0 HG12 VAL A 79 6.086 6.694 3.652 1.00 0.73 H new ATOM 0 HG13 VAL A 79 4.785 5.482 3.718 1.00 0.73 H new ATOM 0 HG21 VAL A 79 2.611 7.505 2.915 1.00 0.58 H new ATOM 0 HG22 VAL A 79 2.331 6.384 4.268 1.00 0.58 H new ATOM 0 HG23 VAL A 79 2.163 8.138 4.517 1.00 0.58 H new ATOM 859 N MET A 80 2.524 6.179 6.942 1.00 0.52 N ATOM 860 CA MET A 80 1.683 5.119 7.513 1.00 0.49 C ATOM 861 C MET A 80 0.561 4.701 6.555 1.00 0.46 C ATOM 862 O MET A 80 -0.086 5.541 5.927 1.00 0.51 O ATOM 863 CB MET A 80 1.118 5.602 8.866 1.00 0.55 C ATOM 864 CG MET A 80 0.032 4.698 9.465 1.00 0.49 C ATOM 865 SD MET A 80 0.510 2.981 9.746 1.00 0.52 S ATOM 866 CE MET A 80 0.648 2.946 11.547 1.00 0.53 C ATOM 0 H MET A 80 2.066 7.090 6.956 1.00 0.52 H new ATOM 0 HA MET A 80 2.295 4.231 7.673 1.00 0.49 H new ATOM 0 HB2 MET A 80 1.938 5.683 9.579 1.00 0.55 H new ATOM 0 HB3 MET A 80 0.708 6.604 8.737 1.00 0.55 H new ATOM 0 HG2 MET A 80 -0.289 5.127 10.415 1.00 0.49 H new ATOM 0 HG3 MET A 80 -0.833 4.711 8.801 1.00 0.49 H new ATOM 0 HE1 MET A 80 1.423 2.237 11.839 1.00 0.53 H new ATOM 0 HE2 MET A 80 0.909 3.940 11.911 1.00 0.53 H new ATOM 0 HE3 MET A 80 -0.305 2.640 11.979 1.00 0.53 H new ATOM 876 N PHE A 81 0.285 3.401 6.495 1.00 0.42 N ATOM 877 CA PHE A 81 -0.816 2.799 5.738 1.00 0.40 C ATOM 878 C PHE A 81 -1.419 1.596 6.476 1.00 0.37 C ATOM 879 O PHE A 81 -0.778 0.943 7.304 1.00 0.38 O ATOM 880 CB PHE A 81 -0.369 2.414 4.308 1.00 0.41 C ATOM 881 CG PHE A 81 1.103 2.097 4.229 1.00 0.43 C ATOM 882 CD1 PHE A 81 1.538 0.919 4.854 1.00 1.63 C ATOM 883 CD2 PHE A 81 2.039 3.053 3.774 1.00 1.56 C ATOM 884 CE1 PHE A 81 2.896 0.726 5.105 1.00 1.72 C ATOM 885 CE2 PHE A 81 3.407 2.811 3.972 1.00 1.61 C ATOM 886 CZ PHE A 81 3.831 1.667 4.665 1.00 0.84 C ATOM 0 H PHE A 81 0.844 2.707 6.992 1.00 0.42 H new ATOM 0 HA PHE A 81 -1.599 3.552 5.650 1.00 0.40 H new ATOM 0 HB2 PHE A 81 -0.942 1.550 3.972 1.00 0.41 H new ATOM 0 HB3 PHE A 81 -0.598 3.233 3.626 1.00 0.41 H new ATOM 0 HD1 PHE A 81 0.822 0.163 5.140 1.00 1.63 H new ATOM 0 HD2 PHE A 81 1.707 3.955 3.282 1.00 1.56 H new ATOM 0 HE1 PHE A 81 3.226 -0.152 5.640 1.00 1.72 H new ATOM 0 HE2 PHE A 81 4.137 3.509 3.589 1.00 1.61 H new ATOM 0 HZ PHE A 81 4.882 1.513 4.859 1.00 0.84 H new ATOM 896 N VAL A 82 -2.670 1.294 6.135 1.00 0.33 N ATOM 897 CA VAL A 82 -3.509 0.249 6.729 1.00 0.31 C ATOM 898 C VAL A 82 -4.041 -0.678 5.627 1.00 0.29 C ATOM 899 O VAL A 82 -4.354 -0.223 4.523 1.00 0.30 O ATOM 900 CB VAL A 82 -4.652 0.860 7.573 1.00 0.33 C ATOM 901 CG1 VAL A 82 -4.158 1.955 8.534 1.00 0.40 C ATOM 902 CG2 VAL A 82 -5.766 1.495 6.730 1.00 0.35 C ATOM 0 H VAL A 82 -3.156 1.800 5.394 1.00 0.33 H new ATOM 0 HA VAL A 82 -2.903 -0.347 7.411 1.00 0.31 H new ATOM 0 HB VAL A 82 -5.043 0.005 8.124 1.00 0.33 H new ATOM 0 HG11 VAL A 82 -5.001 2.349 9.101 1.00 0.40 H new ATOM 0 HG12 VAL A 82 -3.424 1.533 9.221 1.00 0.40 H new ATOM 0 HG13 VAL A 82 -3.698 2.761 7.962 1.00 0.40 H new ATOM 0 HG21 VAL A 82 -6.533 1.903 7.388 1.00 0.35 H new ATOM 0 HG22 VAL A 82 -5.349 2.296 6.119 1.00 0.35 H new ATOM 0 HG23 VAL A 82 -6.209 0.738 6.083 1.00 0.35 H new ATOM 912 N TRP A 83 -4.168 -1.970 5.920 1.00 0.29 N ATOM 913 CA TRP A 83 -4.850 -2.945 5.069 1.00 0.30 C ATOM 914 C TRP A 83 -6.359 -2.970 5.345 1.00 0.31 C ATOM 915 O TRP A 83 -6.838 -2.791 6.467 1.00 0.33 O ATOM 916 CB TRP A 83 -4.239 -4.345 5.228 1.00 0.30 C ATOM 917 CG TRP A 83 -3.029 -4.662 4.397 1.00 0.35 C ATOM 918 CD1 TRP A 83 -1.818 -4.057 4.450 1.00 0.43 C ATOM 919 CD2 TRP A 83 -2.891 -5.726 3.402 1.00 0.34 C ATOM 920 NE1 TRP A 83 -0.976 -4.626 3.507 1.00 0.44 N ATOM 921 CE2 TRP A 83 -1.582 -5.670 2.836 1.00 0.39 C ATOM 922 CE3 TRP A 83 -3.745 -6.753 2.943 1.00 0.33 C ATOM 923 CZ2 TRP A 83 -1.153 -6.569 1.840 1.00 0.40 C ATOM 924 CZ3 TRP A 83 -3.320 -7.674 1.968 1.00 0.33 C ATOM 925 CH2 TRP A 83 -2.032 -7.585 1.413 1.00 0.37 C ATOM 0 H TRP A 83 -3.791 -2.379 6.775 1.00 0.29 H new ATOM 0 HA TRP A 83 -4.707 -2.632 4.035 1.00 0.30 H new ATOM 0 HB2 TRP A 83 -3.974 -4.481 6.277 1.00 0.30 H new ATOM 0 HB3 TRP A 83 -5.011 -5.079 4.996 1.00 0.30 H new ATOM 0 HD1 TRP A 83 -1.550 -3.256 5.123 1.00 0.43 H new ATOM 0 HE1 TRP A 83 -0.022 -4.311 3.330 1.00 0.44 H new ATOM 0 HE3 TRP A 83 -4.743 -6.833 3.348 1.00 0.33 H new ATOM 0 HZ2 TRP A 83 -0.166 -6.481 1.410 1.00 0.40 H new ATOM 0 HZ3 TRP A 83 -3.990 -8.457 1.643 1.00 0.33 H new ATOM 0 HH2 TRP A 83 -1.716 -8.293 0.661 1.00 0.37 H new ATOM 936 N THR A 84 -7.113 -3.233 4.287 1.00 0.32 N ATOM 937 CA THR A 84 -8.578 -3.293 4.259 1.00 0.33 C ATOM 938 C THR A 84 -9.076 -4.417 3.346 1.00 0.33 C ATOM 939 O THR A 84 -8.293 -5.029 2.622 1.00 0.37 O ATOM 940 CB THR A 84 -9.188 -1.961 3.775 1.00 0.36 C ATOM 941 OG1 THR A 84 -8.676 -1.633 2.517 1.00 0.34 O ATOM 942 CG2 THR A 84 -8.934 -0.746 4.658 1.00 0.42 C ATOM 0 H THR A 84 -6.702 -3.421 3.373 1.00 0.32 H new ATOM 0 HA THR A 84 -8.898 -3.489 5.282 1.00 0.33 H new ATOM 0 HB THR A 84 -10.260 -2.156 3.783 1.00 0.36 H new ATOM 0 HG1 THR A 84 -7.763 -1.981 2.434 1.00 0.34 H new ATOM 0 HG21 THR A 84 -9.410 0.130 4.217 1.00 0.42 H new ATOM 0 HG22 THR A 84 -9.349 -0.924 5.650 1.00 0.42 H new ATOM 0 HG23 THR A 84 -7.861 -0.573 4.739 1.00 0.42 H new ATOM 950 N ASN A 85 -10.376 -4.710 3.370 1.00 0.35 N ATOM 951 CA ASN A 85 -11.054 -5.573 2.393 1.00 0.37 C ATOM 952 C ASN A 85 -11.632 -4.780 1.214 1.00 0.42 C ATOM 953 O ASN A 85 -11.682 -3.550 1.247 1.00 0.46 O ATOM 954 CB ASN A 85 -12.079 -6.477 3.111 1.00 0.41 C ATOM 955 CG ASN A 85 -11.596 -7.913 3.150 1.00 0.59 C ATOM 956 OD1 ASN A 85 -10.436 -8.149 3.713 1.00 1.50 O flip ATOM 957 ND2 ASN A 85 -12.228 -8.827 2.645 1.00 1.11 N flip ATOM 0 H ASN A 85 -11.006 -4.347 4.086 1.00 0.35 H new ATOM 0 HA ASN A 85 -10.318 -6.232 1.934 1.00 0.37 H new ATOM 0 HB2 ASN A 85 -12.241 -6.115 4.126 1.00 0.41 H new ATOM 0 HB3 ASN A 85 -13.039 -6.425 2.597 1.00 0.41 H new ATOM 0 HD21 ASN A 85 -13.131 -8.642 2.207 1.00 1.11 H new ATOM 0 HD22 ASN A 85 -11.854 -9.776 2.661 1.00 1.11 H new ATOM 964 N THR A 86 -12.099 -5.503 0.189 1.00 0.51 N ATOM 965 CA THR A 86 -12.840 -4.992 -0.983 1.00 0.55 C ATOM 966 C THR A 86 -13.743 -3.796 -0.685 1.00 0.69 C ATOM 967 O THR A 86 -13.681 -2.795 -1.395 1.00 0.91 O ATOM 968 CB THR A 86 -13.765 -6.086 -1.552 1.00 0.95 C ATOM 969 OG1 THR A 86 -14.320 -6.868 -0.512 1.00 1.79 O ATOM 970 CG2 THR A 86 -13.019 -7.047 -2.460 1.00 1.09 C ATOM 0 H THR A 86 -11.966 -6.513 0.147 1.00 0.51 H new ATOM 0 HA THR A 86 -12.062 -4.684 -1.681 1.00 0.55 H new ATOM 0 HB THR A 86 -14.538 -5.560 -2.112 1.00 0.95 H new ATOM 0 HG1 THR A 86 -14.905 -7.555 -0.895 1.00 1.79 H new ATOM 0 HG21 THR A 86 -13.710 -7.801 -2.838 1.00 1.09 H new ATOM 0 HG22 THR A 86 -12.589 -6.497 -3.297 1.00 1.09 H new ATOM 0 HG23 THR A 86 -12.222 -7.534 -1.898 1.00 1.09 H new ATOM 978 N ASN A 87 -14.519 -3.867 0.401 1.00 0.72 N ATOM 979 CA ASN A 87 -15.535 -2.868 0.768 1.00 0.87 C ATOM 980 C ASN A 87 -14.981 -1.752 1.683 1.00 0.77 C ATOM 981 O ASN A 87 -15.691 -1.195 2.526 1.00 0.76 O ATOM 982 CB ASN A 87 -16.780 -3.583 1.316 1.00 1.08 C ATOM 983 CG ASN A 87 -17.242 -4.698 0.396 1.00 1.38 C ATOM 984 OD1 ASN A 87 -17.676 -4.489 -0.732 1.00 1.79 O ATOM 985 ND2 ASN A 87 -17.086 -5.925 0.821 1.00 1.99 N ATOM 0 H ASN A 87 -14.459 -4.638 1.067 1.00 0.72 H new ATOM 0 HA ASN A 87 -15.841 -2.327 -0.128 1.00 0.87 H new ATOM 0 HB2 ASN A 87 -16.559 -3.993 2.301 1.00 1.08 H new ATOM 0 HB3 ASN A 87 -17.586 -2.861 1.445 1.00 1.08 H new ATOM 0 HD21 ASN A 87 -17.325 -6.709 0.214 1.00 1.99 H new ATOM 0 HD22 ASN A 87 -16.725 -6.098 1.759 1.00 1.99 H new ATOM 992 N ASN A 88 -13.684 -1.460 1.532 1.00 0.73 N ATOM 993 CA ASN A 88 -12.898 -0.448 2.250 1.00 0.70 C ATOM 994 C ASN A 88 -12.933 -0.619 3.786 1.00 0.66 C ATOM 995 O ASN A 88 -12.782 0.348 4.531 1.00 0.71 O ATOM 996 CB ASN A 88 -13.243 0.981 1.766 1.00 0.80 C ATOM 997 CG ASN A 88 -13.945 1.068 0.422 1.00 0.81 C ATOM 998 OD1 ASN A 88 -13.270 0.841 -0.678 1.00 1.15 O flip ATOM 999 ND2 ASN A 88 -15.140 1.323 0.359 1.00 0.53 N flip ATOM 0 H ASN A 88 -13.112 -1.963 0.853 1.00 0.73 H new ATOM 0 HA ASN A 88 -11.852 -0.614 1.993 1.00 0.70 H new ATOM 0 HB2 ASN A 88 -13.874 1.457 2.517 1.00 0.80 H new ATOM 0 HB3 ASN A 88 -12.321 1.559 1.712 1.00 0.80 H new ATOM 0 HD21 ASN A 88 -15.669 1.500 1.213 1.00 0.53 H new ATOM 0 HD22 ASN A 88 -15.607 1.358 -0.547 1.00 0.53 H new ATOM 1006 N GLU A 89 -13.180 -1.839 4.269 1.00 0.58 N ATOM 1007 CA GLU A 89 -13.276 -2.176 5.696 1.00 0.50 C ATOM 1008 C GLU A 89 -11.910 -2.492 6.288 1.00 0.39 C ATOM 1009 O GLU A 89 -11.172 -3.272 5.696 1.00 0.33 O ATOM 1010 CB GLU A 89 -14.159 -3.411 5.909 1.00 0.54 C ATOM 1011 CG GLU A 89 -15.635 -3.031 6.069 1.00 0.65 C ATOM 1012 CD GLU A 89 -16.470 -4.238 6.502 1.00 0.87 C ATOM 1013 OE1 GLU A 89 -16.717 -5.151 5.675 1.00 1.78 O ATOM 1014 OE2 GLU A 89 -16.881 -4.283 7.689 1.00 1.70 O ATOM 0 H GLU A 89 -13.323 -2.646 3.662 1.00 0.58 H new ATOM 0 HA GLU A 89 -13.706 -1.304 6.189 1.00 0.50 H new ATOM 0 HB2 GLU A 89 -14.047 -4.089 5.063 1.00 0.54 H new ATOM 0 HB3 GLU A 89 -13.824 -3.950 6.795 1.00 0.54 H new ATOM 0 HG2 GLU A 89 -15.731 -2.235 6.807 1.00 0.65 H new ATOM 0 HG3 GLU A 89 -16.017 -2.640 5.126 1.00 0.65 H new ATOM 1021 N ILE A 90 -11.601 -1.979 7.479 1.00 0.38 N ATOM 1022 CA ILE A 90 -10.313 -2.232 8.136 1.00 0.34 C ATOM 1023 C ILE A 90 -10.272 -3.662 8.692 1.00 0.31 C ATOM 1024 O ILE A 90 -11.145 -4.063 9.467 1.00 0.34 O ATOM 1025 CB ILE A 90 -9.996 -1.195 9.232 1.00 0.37 C ATOM 1026 CG1 ILE A 90 -10.276 0.236 8.730 1.00 0.42 C ATOM 1027 CG2 ILE A 90 -8.521 -1.374 9.649 1.00 0.40 C ATOM 1028 CD1 ILE A 90 -9.870 1.326 9.719 1.00 0.48 C ATOM 0 H ILE A 90 -12.230 -1.380 8.015 1.00 0.38 H new ATOM 0 HA ILE A 90 -9.534 -2.127 7.381 1.00 0.34 H new ATOM 0 HB ILE A 90 -10.639 -1.353 10.098 1.00 0.37 H new ATOM 0 HG12 ILE A 90 -9.743 0.393 7.792 1.00 0.42 H new ATOM 0 HG13 ILE A 90 -11.340 0.333 8.513 1.00 0.42 H new ATOM 0 HG21 ILE A 90 -8.272 -0.650 10.425 1.00 0.40 H new ATOM 0 HG22 ILE A 90 -8.371 -2.383 10.033 1.00 0.40 H new ATOM 0 HG23 ILE A 90 -7.877 -1.215 8.784 1.00 0.40 H new ATOM 0 HD11 ILE A 90 -10.098 2.304 9.296 1.00 0.48 H new ATOM 0 HD12 ILE A 90 -10.422 1.196 10.650 1.00 0.48 H new ATOM 0 HD13 ILE A 90 -8.801 1.257 9.918 1.00 0.48 H new ATOM 1040 N ILE A 91 -9.240 -4.413 8.304 1.00 0.27 N ATOM 1041 CA ILE A 91 -9.004 -5.812 8.709 1.00 0.27 C ATOM 1042 C ILE A 91 -7.668 -6.042 9.449 1.00 0.26 C ATOM 1043 O ILE A 91 -6.699 -5.301 9.291 1.00 0.27 O ATOM 1044 CB ILE A 91 -9.242 -6.775 7.515 1.00 0.30 C ATOM 1045 CG1 ILE A 91 -8.204 -6.687 6.368 1.00 0.29 C ATOM 1046 CG2 ILE A 91 -10.630 -6.523 6.904 1.00 0.38 C ATOM 1047 CD1 ILE A 91 -7.031 -7.660 6.501 1.00 1.06 C ATOM 0 H ILE A 91 -8.517 -4.058 7.678 1.00 0.27 H new ATOM 0 HA ILE A 91 -9.747 -6.053 9.469 1.00 0.27 H new ATOM 0 HB ILE A 91 -9.148 -7.770 7.951 1.00 0.30 H new ATOM 0 HG12 ILE A 91 -8.710 -6.875 5.421 1.00 0.29 H new ATOM 0 HG13 ILE A 91 -7.814 -5.670 6.325 1.00 0.29 H new ATOM 0 HG21 ILE A 91 -10.788 -7.203 6.067 1.00 0.38 H new ATOM 0 HG22 ILE A 91 -11.397 -6.693 7.660 1.00 0.38 H new ATOM 0 HG23 ILE A 91 -10.691 -5.493 6.551 1.00 0.38 H new ATOM 0 HD11 ILE A 91 -6.354 -7.531 5.657 1.00 1.06 H new ATOM 0 HD12 ILE A 91 -6.496 -7.460 7.429 1.00 1.06 H new ATOM 0 HD13 ILE A 91 -7.406 -8.683 6.512 1.00 1.06 H new ATOM 1059 N ASP A 92 -7.639 -7.060 10.309 1.00 0.28 N ATOM 1060 CA ASP A 92 -6.440 -7.629 10.963 1.00 0.32 C ATOM 1061 C ASP A 92 -5.736 -8.664 10.052 1.00 0.32 C ATOM 1062 O ASP A 92 -6.349 -9.199 9.134 1.00 0.32 O ATOM 1063 CB ASP A 92 -6.894 -8.230 12.304 1.00 0.37 C ATOM 1064 CG ASP A 92 -5.813 -8.841 13.197 1.00 0.56 C ATOM 1065 OD1 ASP A 92 -4.609 -8.535 13.043 1.00 1.37 O ATOM 1066 OD2 ASP A 92 -6.187 -9.609 14.113 1.00 1.40 O ATOM 0 H ASP A 92 -8.493 -7.542 10.589 1.00 0.28 H new ATOM 0 HA ASP A 92 -5.694 -6.855 11.145 1.00 0.32 H new ATOM 0 HB2 ASP A 92 -7.399 -7.448 12.871 1.00 0.37 H new ATOM 0 HB3 ASP A 92 -7.635 -9.001 12.095 1.00 0.37 H new ATOM 1071 N GLU A 93 -4.470 -9.010 10.312 1.00 0.37 N ATOM 1072 CA GLU A 93 -3.593 -9.818 9.424 1.00 0.39 C ATOM 1073 C GLU A 93 -3.951 -11.318 9.302 1.00 0.45 C ATOM 1074 O GLU A 93 -3.206 -12.113 8.729 1.00 0.71 O ATOM 1075 CB GLU A 93 -2.099 -9.553 9.715 1.00 0.56 C ATOM 1076 CG GLU A 93 -1.596 -10.073 11.068 1.00 0.78 C ATOM 1077 CD GLU A 93 -0.112 -9.753 11.330 1.00 1.19 C ATOM 1078 OE1 GLU A 93 0.413 -8.717 10.852 1.00 2.40 O ATOM 1079 OE2 GLU A 93 0.548 -10.490 12.103 1.00 1.67 O ATOM 0 H GLU A 93 -4.001 -8.731 11.174 1.00 0.37 H new ATOM 0 HA GLU A 93 -3.801 -9.455 8.417 1.00 0.39 H new ATOM 0 HB2 GLU A 93 -1.504 -10.010 8.924 1.00 0.56 H new ATOM 0 HB3 GLU A 93 -1.921 -8.479 9.667 1.00 0.56 H new ATOM 0 HG2 GLU A 93 -2.200 -9.638 11.864 1.00 0.78 H new ATOM 0 HG3 GLU A 93 -1.741 -11.152 11.111 1.00 0.78 H new ATOM 1086 N ASN A 94 -5.122 -11.693 9.821 1.00 0.51 N ATOM 1087 CA ASN A 94 -5.812 -12.976 9.656 1.00 0.57 C ATOM 1088 C ASN A 94 -7.160 -12.851 8.901 1.00 0.56 C ATOM 1089 O ASN A 94 -7.822 -13.859 8.643 1.00 0.72 O ATOM 1090 CB ASN A 94 -5.956 -13.651 11.023 1.00 0.64 C ATOM 1091 CG ASN A 94 -6.641 -12.722 11.987 1.00 1.41 C ATOM 1092 OD1 ASN A 94 -7.828 -12.446 11.881 1.00 2.72 O ATOM 1093 ND2 ASN A 94 -5.873 -12.102 12.839 1.00 1.21 N ATOM 0 H ASN A 94 -5.655 -11.058 10.415 1.00 0.51 H new ATOM 0 HA ASN A 94 -5.202 -13.613 9.015 1.00 0.57 H new ATOM 0 HB2 ASN A 94 -6.530 -14.573 10.924 1.00 0.64 H new ATOM 0 HB3 ASN A 94 -4.974 -13.927 11.407 1.00 0.64 H new ATOM 0 HD21 ASN A 94 -6.259 -11.370 13.435 1.00 1.21 H new ATOM 0 HD22 ASN A 94 -4.886 -12.349 12.910 1.00 1.21 H new ATOM 1100 N GLY A 95 -7.570 -11.630 8.542 1.00 0.45 N ATOM 1101 CA GLY A 95 -8.796 -11.295 7.813 1.00 0.47 C ATOM 1102 C GLY A 95 -10.040 -11.054 8.677 1.00 0.50 C ATOM 1103 O GLY A 95 -11.134 -10.954 8.121 1.00 0.58 O ATOM 0 H GLY A 95 -7.021 -10.800 8.766 1.00 0.45 H new ATOM 0 HA2 GLY A 95 -8.610 -10.400 7.219 1.00 0.47 H new ATOM 0 HA3 GLY A 95 -9.013 -12.103 7.114 1.00 0.47 H new ATOM 1107 N GLN A 96 -9.894 -10.946 10.004 1.00 0.48 N ATOM 1108 CA GLN A 96 -10.954 -10.463 10.895 1.00 0.53 C ATOM 1109 C GLN A 96 -11.181 -8.972 10.629 1.00 0.48 C ATOM 1110 O GLN A 96 -10.229 -8.228 10.400 1.00 0.46 O ATOM 1111 CB GLN A 96 -10.570 -10.694 12.369 1.00 0.57 C ATOM 1112 CG GLN A 96 -11.568 -10.039 13.342 1.00 0.66 C ATOM 1113 CD GLN A 96 -11.304 -10.348 14.805 1.00 1.25 C ATOM 1114 OE1 GLN A 96 -10.215 -10.739 15.211 1.00 2.20 O ATOM 1115 NE2 GLN A 96 -12.283 -10.159 15.654 1.00 1.56 N ATOM 0 H GLN A 96 -9.032 -11.193 10.491 1.00 0.48 H new ATOM 0 HA GLN A 96 -11.873 -11.015 10.699 1.00 0.53 H new ATOM 0 HB2 GLN A 96 -10.523 -11.765 12.566 1.00 0.57 H new ATOM 0 HB3 GLN A 96 -9.573 -10.292 12.550 1.00 0.57 H new ATOM 0 HG2 GLN A 96 -11.541 -8.959 13.200 1.00 0.66 H new ATOM 0 HG3 GLN A 96 -12.575 -10.369 13.088 1.00 0.66 H new ATOM 0 HE21 GLN A 96 -13.191 -9.834 15.321 1.00 1.56 H new ATOM 0 HE22 GLN A 96 -12.138 -10.337 16.648 1.00 1.56 H new ATOM 1124 N THR A 97 -12.426 -8.515 10.716 1.00 0.48 N ATOM 1125 CA THR A 97 -12.806 -7.123 10.462 1.00 0.44 C ATOM 1126 C THR A 97 -13.015 -6.338 11.759 1.00 0.44 C ATOM 1127 O THR A 97 -13.458 -6.894 12.766 1.00 0.52 O ATOM 1128 CB THR A 97 -14.041 -7.058 9.562 1.00 0.50 C ATOM 1129 OG1 THR A 97 -15.189 -7.529 10.236 1.00 0.63 O ATOM 1130 CG2 THR A 97 -13.909 -7.888 8.282 1.00 0.54 C ATOM 0 H THR A 97 -13.216 -9.109 10.969 1.00 0.48 H new ATOM 0 HA THR A 97 -11.978 -6.645 9.939 1.00 0.44 H new ATOM 0 HB THR A 97 -14.134 -6.004 9.298 1.00 0.50 H new ATOM 0 HG1 THR A 97 -15.964 -7.475 9.639 1.00 0.63 H new ATOM 0 HG21 THR A 97 -14.821 -7.795 7.692 1.00 0.54 H new ATOM 0 HG22 THR A 97 -13.062 -7.526 7.699 1.00 0.54 H new ATOM 0 HG23 THR A 97 -13.750 -8.935 8.542 1.00 0.54 H new ATOM 1138 N LEU A 98 -12.687 -5.042 11.762 1.00 0.41 N ATOM 1139 CA LEU A 98 -12.668 -4.214 12.981 1.00 0.44 C ATOM 1140 C LEU A 98 -13.951 -3.386 13.203 1.00 0.52 C ATOM 1141 O LEU A 98 -14.117 -2.812 14.277 1.00 0.65 O ATOM 1142 CB LEU A 98 -11.402 -3.327 12.982 1.00 0.41 C ATOM 1143 CG LEU A 98 -10.063 -3.990 13.371 1.00 0.41 C ATOM 1144 CD1 LEU A 98 -10.029 -4.501 14.810 1.00 0.49 C ATOM 1145 CD2 LEU A 98 -9.626 -5.145 12.470 1.00 0.36 C ATOM 0 H LEU A 98 -12.426 -4.532 10.918 1.00 0.41 H new ATOM 0 HA LEU A 98 -12.636 -4.897 13.830 1.00 0.44 H new ATOM 0 HB2 LEU A 98 -11.289 -2.902 11.984 1.00 0.41 H new ATOM 0 HB3 LEU A 98 -11.575 -2.495 13.665 1.00 0.41 H new ATOM 0 HG LEU A 98 -9.364 -3.164 13.245 1.00 0.41 H new ATOM 0 HD11 LEU A 98 -9.058 -4.954 15.012 1.00 0.49 H new ATOM 0 HD12 LEU A 98 -10.191 -3.669 15.495 1.00 0.49 H new ATOM 0 HD13 LEU A 98 -10.813 -5.245 14.951 1.00 0.49 H new ATOM 0 HD21 LEU A 98 -8.676 -5.544 12.825 1.00 0.36 H new ATOM 0 HD22 LEU A 98 -10.381 -5.931 12.494 1.00 0.36 H new ATOM 0 HD23 LEU A 98 -9.509 -4.785 11.448 1.00 0.36 H new ATOM 1157 N GLY A 99 -14.868 -3.309 12.231 1.00 0.53 N ATOM 1158 CA GLY A 99 -16.091 -2.495 12.327 1.00 0.59 C ATOM 1159 C GLY A 99 -15.892 -1.023 11.932 1.00 0.58 C ATOM 1160 O GLY A 99 -16.610 -0.137 12.406 1.00 0.66 O ATOM 0 H GLY A 99 -14.784 -3.813 11.348 1.00 0.53 H new ATOM 0 HA2 GLY A 99 -16.858 -2.932 11.687 1.00 0.59 H new ATOM 0 HA3 GLY A 99 -16.466 -2.539 13.350 1.00 0.59 H new ATOM 1164 N VAL A 100 -14.887 -0.751 11.093 1.00 0.52 N ATOM 1165 CA VAL A 100 -14.529 0.582 10.575 1.00 0.53 C ATOM 1166 C VAL A 100 -14.295 0.495 9.062 1.00 0.52 C ATOM 1167 O VAL A 100 -13.883 -0.551 8.550 1.00 0.44 O ATOM 1168 CB VAL A 100 -13.295 1.163 11.307 1.00 0.54 C ATOM 1169 CG1 VAL A 100 -12.982 2.608 10.883 1.00 1.05 C ATOM 1170 CG2 VAL A 100 -13.473 1.186 12.832 1.00 1.05 C ATOM 0 H VAL A 100 -14.271 -1.483 10.738 1.00 0.52 H new ATOM 0 HA VAL A 100 -15.356 1.267 10.765 1.00 0.53 H new ATOM 0 HB VAL A 100 -12.479 0.497 11.026 1.00 0.54 H new ATOM 0 HG11 VAL A 100 -12.108 2.966 11.427 1.00 1.05 H new ATOM 0 HG12 VAL A 100 -12.780 2.637 9.812 1.00 1.05 H new ATOM 0 HG13 VAL A 100 -13.836 3.247 11.109 1.00 1.05 H new ATOM 0 HG21 VAL A 100 -12.579 1.603 13.296 1.00 1.05 H new ATOM 0 HG22 VAL A 100 -14.335 1.801 13.088 1.00 1.05 H new ATOM 0 HG23 VAL A 100 -13.631 0.171 13.195 1.00 1.05 H new ATOM 1180 N ASN A 101 -14.561 1.589 8.352 1.00 0.62 N ATOM 1181 CA ASN A 101 -14.519 1.779 6.921 1.00 0.63 C ATOM 1182 C ASN A 101 -13.824 3.111 6.568 1.00 0.64 C ATOM 1183 O ASN A 101 -13.691 3.991 7.420 1.00 0.71 O ATOM 1184 CB ASN A 101 -16.000 1.748 6.512 1.00 0.70 C ATOM 1185 CG ASN A 101 -16.288 2.297 5.147 1.00 1.00 C ATOM 1186 OD1 ASN A 101 -16.835 3.380 4.985 1.00 1.47 O ATOM 1187 ND2 ASN A 101 -15.922 1.595 4.118 1.00 0.96 N ATOM 0 H ASN A 101 -14.840 2.449 8.824 1.00 0.62 H new ATOM 0 HA ASN A 101 -13.941 1.021 6.392 1.00 0.63 H new ATOM 0 HB2 ASN A 101 -16.353 0.718 6.555 1.00 0.70 H new ATOM 0 HB3 ASN A 101 -16.576 2.313 7.244 1.00 0.70 H new ATOM 0 HD21 ASN A 101 -16.090 1.946 3.175 1.00 0.96 H new ATOM 0 HD22 ASN A 101 -15.466 0.692 4.252 1.00 0.96 H new ATOM 1194 N ILE A 102 -13.359 3.249 5.323 1.00 0.64 N ATOM 1195 CA ILE A 102 -12.553 4.389 4.848 1.00 0.67 C ATOM 1196 C ILE A 102 -13.023 4.834 3.447 1.00 0.75 C ATOM 1197 O ILE A 102 -13.295 3.994 2.588 1.00 0.74 O ATOM 1198 CB ILE A 102 -11.038 4.037 4.890 1.00 0.61 C ATOM 1199 CG1 ILE A 102 -10.587 3.527 6.287 1.00 0.53 C ATOM 1200 CG2 ILE A 102 -10.214 5.281 4.519 1.00 0.69 C ATOM 1201 CD1 ILE A 102 -9.160 2.965 6.379 1.00 0.51 C ATOM 0 H ILE A 102 -13.534 2.556 4.595 1.00 0.64 H new ATOM 0 HA ILE A 102 -12.699 5.238 5.515 1.00 0.67 H new ATOM 0 HB ILE A 102 -10.870 3.233 4.173 1.00 0.61 H new ATOM 0 HG12 ILE A 102 -10.677 4.349 6.997 1.00 0.53 H new ATOM 0 HG13 ILE A 102 -11.282 2.751 6.608 1.00 0.53 H new ATOM 0 HG21 ILE A 102 -9.152 5.036 4.548 1.00 0.69 H new ATOM 0 HG22 ILE A 102 -10.483 5.610 3.515 1.00 0.69 H new ATOM 0 HG23 ILE A 102 -10.421 6.080 5.230 1.00 0.69 H new ATOM 0 HD11 ILE A 102 -8.961 2.642 7.401 1.00 0.51 H new ATOM 0 HD12 ILE A 102 -9.059 2.115 5.704 1.00 0.51 H new ATOM 0 HD13 ILE A 102 -8.445 3.739 6.098 1.00 0.51 H new ATOM 1213 N ASP A 103 -13.138 6.143 3.184 1.00 0.82 N ATOM 1214 CA ASP A 103 -13.511 6.680 1.861 1.00 0.87 C ATOM 1215 C ASP A 103 -12.369 6.484 0.841 1.00 0.73 C ATOM 1216 O ASP A 103 -11.227 6.733 1.229 1.00 0.71 O ATOM 1217 CB ASP A 103 -13.748 8.189 2.007 1.00 1.10 C ATOM 1218 CG ASP A 103 -14.757 8.740 1.015 1.00 1.35 C ATOM 1219 OD1 ASP A 103 -14.414 8.823 -0.182 1.00 2.15 O ATOM 1220 OD2 ASP A 103 -15.867 9.144 1.442 1.00 2.01 O ATOM 0 H ASP A 103 -12.975 6.866 3.885 1.00 0.82 H new ATOM 0 HA ASP A 103 -14.401 6.157 1.510 1.00 0.87 H new ATOM 0 HB2 ASP A 103 -14.093 8.399 3.019 1.00 1.10 H new ATOM 0 HB3 ASP A 103 -12.800 8.712 1.879 1.00 1.10 H new ATOM 1225 N PRO A 104 -12.586 6.141 -0.448 1.00 0.72 N ATOM 1226 CA PRO A 104 -11.474 6.092 -1.400 1.00 0.67 C ATOM 1227 C PRO A 104 -10.962 7.491 -1.782 1.00 0.76 C ATOM 1228 O PRO A 104 -9.779 7.658 -2.083 1.00 0.83 O ATOM 1229 CB PRO A 104 -12.001 5.282 -2.584 1.00 0.69 C ATOM 1230 CG PRO A 104 -13.511 5.507 -2.572 1.00 0.92 C ATOM 1231 CD PRO A 104 -13.852 5.841 -1.117 1.00 0.83 C ATOM 0 HA PRO A 104 -10.590 5.619 -0.972 1.00 0.67 H new ATOM 0 HB2 PRO A 104 -11.559 5.619 -3.522 1.00 0.69 H new ATOM 0 HB3 PRO A 104 -11.758 4.225 -2.479 1.00 0.69 H new ATOM 0 HG2 PRO A 104 -13.794 6.320 -3.240 1.00 0.92 H new ATOM 0 HG3 PRO A 104 -14.045 4.618 -2.908 1.00 0.92 H new ATOM 0 HD2 PRO A 104 -14.529 6.693 -1.064 1.00 0.83 H new ATOM 0 HD3 PRO A 104 -14.356 5.003 -0.635 1.00 0.83 H new ATOM 1239 N GLN A 105 -11.835 8.498 -1.715 1.00 0.83 N ATOM 1240 CA GLN A 105 -11.574 9.879 -2.112 1.00 0.91 C ATOM 1241 C GLN A 105 -10.989 10.720 -0.979 1.00 1.00 C ATOM 1242 O GLN A 105 -10.007 11.426 -1.181 1.00 1.06 O ATOM 1243 CB GLN A 105 -12.887 10.492 -2.629 1.00 1.01 C ATOM 1244 CG GLN A 105 -13.538 9.622 -3.701 1.00 1.01 C ATOM 1245 CD GLN A 105 -12.578 9.333 -4.853 1.00 1.00 C ATOM 1246 OE1 GLN A 105 -11.749 10.154 -5.241 1.00 1.71 O ATOM 1247 NE2 GLN A 105 -12.591 8.133 -5.381 1.00 0.80 N ATOM 0 H GLN A 105 -12.784 8.365 -1.367 1.00 0.83 H new ATOM 0 HA GLN A 105 -10.820 9.875 -2.899 1.00 0.91 H new ATOM 0 HB2 GLN A 105 -13.579 10.622 -1.797 1.00 1.01 H new ATOM 0 HB3 GLN A 105 -12.689 11.483 -3.037 1.00 1.01 H new ATOM 0 HG2 GLN A 105 -13.867 8.682 -3.257 1.00 1.01 H new ATOM 0 HG3 GLN A 105 -14.427 10.122 -4.085 1.00 1.01 H new ATOM 0 HE21 GLN A 105 -13.275 7.445 -5.066 1.00 0.80 H new ATOM 0 HE22 GLN A 105 -11.917 7.888 -6.107 1.00 0.80 H new ATOM 1256 N THR A 106 -11.579 10.622 0.212 1.00 1.05 N ATOM 1257 CA THR A 106 -11.168 11.429 1.381 1.00 1.19 C ATOM 1258 C THR A 106 -10.076 10.769 2.218 1.00 1.14 C ATOM 1259 O THR A 106 -9.350 11.460 2.936 1.00 1.25 O ATOM 1260 CB THR A 106 -12.359 11.771 2.297 1.00 1.33 C ATOM 1261 OG1 THR A 106 -12.710 10.708 3.137 1.00 1.24 O ATOM 1262 CG2 THR A 106 -13.619 12.104 1.524 1.00 1.39 C ATOM 0 H THR A 106 -12.353 9.986 0.403 1.00 1.05 H new ATOM 0 HA THR A 106 -10.762 12.346 0.954 1.00 1.19 H new ATOM 0 HB THR A 106 -12.009 12.632 2.867 1.00 1.33 H new ATOM 0 HG1 THR A 106 -13.670 10.747 3.330 1.00 1.24 H new ATOM 0 HG21 THR A 106 -14.423 12.336 2.222 1.00 1.39 H new ATOM 0 HG22 THR A 106 -13.435 12.966 0.882 1.00 1.39 H new ATOM 0 HG23 THR A 106 -13.906 11.250 0.911 1.00 1.39 H new ATOM 1270 N PHE A 107 -9.980 9.434 2.153 1.00 0.98 N ATOM 1271 CA PHE A 107 -9.160 8.600 3.046 1.00 0.93 C ATOM 1272 C PHE A 107 -9.494 8.794 4.551 1.00 0.98 C ATOM 1273 O PHE A 107 -8.671 8.492 5.419 1.00 1.01 O ATOM 1274 CB PHE A 107 -7.660 8.719 2.674 1.00 0.97 C ATOM 1275 CG PHE A 107 -7.102 7.817 1.574 1.00 0.83 C ATOM 1276 CD1 PHE A 107 -7.902 7.064 0.687 1.00 1.45 C ATOM 1277 CD2 PHE A 107 -5.704 7.684 1.481 1.00 1.91 C ATOM 1278 CE1 PHE A 107 -7.317 6.148 -0.192 1.00 1.53 C ATOM 1279 CE2 PHE A 107 -5.121 6.768 0.591 1.00 1.80 C ATOM 1280 CZ PHE A 107 -5.927 5.980 -0.237 1.00 0.74 C ATOM 0 H PHE A 107 -10.486 8.887 1.457 1.00 0.98 H new ATOM 0 HA PHE A 107 -9.426 7.556 2.881 1.00 0.93 H new ATOM 0 HB2 PHE A 107 -7.473 9.752 2.380 1.00 0.97 H new ATOM 0 HB3 PHE A 107 -7.080 8.535 3.578 1.00 0.97 H new ATOM 0 HD1 PHE A 107 -8.974 7.197 0.688 1.00 1.45 H new ATOM 0 HD2 PHE A 107 -5.069 8.296 2.104 1.00 1.91 H new ATOM 0 HE1 PHE A 107 -7.946 5.561 -0.846 1.00 1.53 H new ATOM 0 HE2 PHE A 107 -4.046 6.671 0.546 1.00 1.80 H new ATOM 0 HZ PHE A 107 -5.484 5.253 -0.901 1.00 0.74 H new ATOM 1290 N LYS A 108 -10.707 9.272 4.881 1.00 1.00 N ATOM 1291 CA LYS A 108 -11.183 9.492 6.262 1.00 1.04 C ATOM 1292 C LYS A 108 -11.970 8.291 6.811 1.00 0.90 C ATOM 1293 O LYS A 108 -12.652 7.585 6.058 1.00 0.83 O ATOM 1294 CB LYS A 108 -11.929 10.845 6.359 1.00 1.24 C ATOM 1295 CG LYS A 108 -13.456 10.789 6.143 1.00 1.28 C ATOM 1296 CD LYS A 108 -14.231 10.735 7.471 1.00 1.50 C ATOM 1297 CE LYS A 108 -15.582 10.016 7.387 1.00 1.53 C ATOM 1298 NZ LYS A 108 -16.474 10.595 6.360 1.00 2.60 N ATOM 0 H LYS A 108 -11.402 9.523 4.178 1.00 1.00 H new ATOM 0 HA LYS A 108 -10.320 9.564 6.924 1.00 1.04 H new ATOM 0 HB2 LYS A 108 -11.736 11.275 7.342 1.00 1.24 H new ATOM 0 HB3 LYS A 108 -11.502 11.527 5.624 1.00 1.24 H new ATOM 0 HG2 LYS A 108 -13.773 11.664 5.575 1.00 1.28 H new ATOM 0 HG3 LYS A 108 -13.704 9.913 5.544 1.00 1.28 H new ATOM 0 HD2 LYS A 108 -13.614 10.236 8.218 1.00 1.50 H new ATOM 0 HD3 LYS A 108 -14.396 11.753 7.823 1.00 1.50 H new ATOM 0 HE2 LYS A 108 -15.415 8.962 7.165 1.00 1.53 H new ATOM 0 HE3 LYS A 108 -16.075 10.063 8.358 1.00 1.53 H new ATOM 0 HZ1 LYS A 108 -17.385 10.094 6.369 1.00 2.60 H new ATOM 0 HZ2 LYS A 108 -16.631 11.602 6.565 1.00 2.60 H new ATOM 0 HZ3 LYS A 108 -16.034 10.497 5.423 1.00 2.60 H new ATOM 1312 N LEU A 109 -11.888 8.079 8.123 1.00 0.92 N ATOM 1313 CA LEU A 109 -12.452 6.933 8.852 1.00 0.83 C ATOM 1314 C LEU A 109 -13.945 7.093 9.181 1.00 0.88 C ATOM 1315 O LEU A 109 -14.396 8.172 9.567 1.00 0.96 O ATOM 1316 CB LEU A 109 -11.653 6.751 10.159 1.00 0.78 C ATOM 1317 CG LEU A 109 -10.206 6.277 9.929 1.00 0.74 C ATOM 1318 CD1 LEU A 109 -9.274 6.683 11.066 1.00 0.75 C ATOM 1319 CD2 LEU A 109 -10.162 4.758 9.857 1.00 0.65 C ATOM 0 H LEU A 109 -11.404 8.730 8.741 1.00 0.92 H new ATOM 0 HA LEU A 109 -12.372 6.059 8.206 1.00 0.83 H new ATOM 0 HB2 LEU A 109 -11.636 7.697 10.701 1.00 0.78 H new ATOM 0 HB3 LEU A 109 -12.168 6.029 10.793 1.00 0.78 H new ATOM 0 HG LEU A 109 -9.877 6.742 9.000 1.00 0.74 H new ATOM 0 HD11 LEU A 109 -8.266 6.325 10.856 1.00 0.75 H new ATOM 0 HD12 LEU A 109 -9.262 7.769 11.156 1.00 0.75 H new ATOM 0 HD13 LEU A 109 -9.627 6.245 12.000 1.00 0.75 H new ATOM 0 HD21 LEU A 109 -9.135 4.431 9.694 1.00 0.65 H new ATOM 0 HD22 LEU A 109 -10.532 4.339 10.792 1.00 0.65 H new ATOM 0 HD23 LEU A 109 -10.787 4.415 9.033 1.00 0.65 H new ATOM 1331 N SER A 110 -14.699 5.993 9.161 1.00 0.86 N ATOM 1332 CA SER A 110 -16.094 5.922 9.637 1.00 0.92 C ATOM 1333 C SER A 110 -16.241 5.886 11.171 1.00 0.94 C ATOM 1334 O SER A 110 -17.346 5.663 11.671 1.00 1.08 O ATOM 1335 CB SER A 110 -16.786 4.697 9.027 1.00 0.94 C ATOM 1336 OG SER A 110 -16.255 3.517 9.599 1.00 1.38 O ATOM 0 H SER A 110 -14.354 5.101 8.806 1.00 0.86 H new ATOM 0 HA SER A 110 -16.570 6.846 9.309 1.00 0.92 H new ATOM 0 HB2 SER A 110 -17.860 4.748 9.205 1.00 0.94 H new ATOM 0 HB3 SER A 110 -16.642 4.686 7.947 1.00 0.94 H new ATOM 0 HG SER A 110 -16.885 2.778 9.468 1.00 1.38 H new ATOM 1342 N GLY A 111 -15.145 6.034 11.922 1.00 0.88 N ATOM 1343 CA GLY A 111 -15.101 5.843 13.372 1.00 0.85 C ATOM 1344 C GLY A 111 -13.700 6.009 13.972 1.00 0.80 C ATOM 1345 O GLY A 111 -12.837 6.670 13.384 1.00 0.88 O ATOM 0 H GLY A 111 -14.242 6.297 11.527 1.00 0.88 H new ATOM 0 HA2 GLY A 111 -15.776 6.557 13.844 1.00 0.85 H new ATOM 0 HA3 GLY A 111 -15.473 4.847 13.610 1.00 0.85 H new ATOM 1349 N ALA A 112 -13.478 5.422 15.150 1.00 0.82 N ATOM 1350 CA ALA A 112 -12.246 5.573 15.929 1.00 0.84 C ATOM 1351 C ALA A 112 -11.132 4.581 15.539 1.00 0.82 C ATOM 1352 O ALA A 112 -11.401 3.441 15.142 1.00 0.89 O ATOM 1353 CB ALA A 112 -12.593 5.467 17.419 1.00 0.94 C ATOM 0 H ALA A 112 -14.164 4.815 15.599 1.00 0.82 H new ATOM 0 HA ALA A 112 -11.831 6.555 15.704 1.00 0.84 H new ATOM 0 HB1 ALA A 112 -11.686 5.577 18.013 1.00 0.94 H new ATOM 0 HB2 ALA A 112 -13.299 6.254 17.685 1.00 0.94 H new ATOM 0 HB3 ALA A 112 -13.042 4.494 17.620 1.00 0.94 H new ATOM 1359 N MET A 113 -9.874 5.011 15.706 1.00 0.80 N ATOM 1360 CA MET A 113 -8.659 4.258 15.390 1.00 0.82 C ATOM 1361 C MET A 113 -8.655 2.846 16.018 1.00 0.81 C ATOM 1362 O MET A 113 -8.851 2.708 17.235 1.00 0.97 O ATOM 1363 CB MET A 113 -7.431 5.072 15.858 1.00 0.97 C ATOM 1364 CG MET A 113 -6.291 4.983 14.847 1.00 1.19 C ATOM 1365 SD MET A 113 -6.672 5.828 13.292 1.00 1.46 S ATOM 1366 CE MET A 113 -5.910 4.692 12.120 1.00 1.16 C ATOM 0 H MET A 113 -9.669 5.937 16.083 1.00 0.80 H new ATOM 0 HA MET A 113 -8.621 4.110 14.311 1.00 0.82 H new ATOM 0 HB2 MET A 113 -7.715 6.115 15.999 1.00 0.97 H new ATOM 0 HB3 MET A 113 -7.092 4.701 16.825 1.00 0.97 H new ATOM 0 HG2 MET A 113 -5.391 5.417 15.281 1.00 1.19 H new ATOM 0 HG3 MET A 113 -6.073 3.935 14.643 1.00 1.19 H new ATOM 0 HE1 MET A 113 -5.071 5.185 11.629 1.00 1.16 H new ATOM 0 HE2 MET A 113 -5.553 3.809 12.649 1.00 1.16 H new ATOM 0 HE3 MET A 113 -6.645 4.394 11.372 1.00 1.16 H new ATOM 1376 N PRO A 114 -8.449 1.785 15.214 1.00 0.66 N ATOM 1377 CA PRO A 114 -8.619 0.409 15.662 1.00 0.60 C ATOM 1378 C PRO A 114 -7.478 -0.083 16.551 1.00 0.66 C ATOM 1379 O PRO A 114 -6.361 0.434 16.510 1.00 0.79 O ATOM 1380 CB PRO A 114 -8.705 -0.425 14.384 1.00 0.49 C ATOM 1381 CG PRO A 114 -7.760 0.343 13.467 1.00 0.56 C ATOM 1382 CD PRO A 114 -8.085 1.786 13.805 1.00 0.64 C ATOM 0 HA PRO A 114 -9.511 0.324 16.283 1.00 0.60 H new ATOM 0 HB2 PRO A 114 -8.381 -1.454 14.541 1.00 0.49 H new ATOM 0 HB3 PRO A 114 -9.719 -0.468 13.988 1.00 0.49 H new ATOM 0 HG2 PRO A 114 -6.716 0.104 13.667 1.00 0.56 H new ATOM 0 HG3 PRO A 114 -7.943 0.120 12.416 1.00 0.56 H new ATOM 0 HD2 PRO A 114 -7.228 2.434 13.622 1.00 0.64 H new ATOM 0 HD3 PRO A 114 -8.903 2.158 13.189 1.00 0.64 H new ATOM 1390 N ALA A 115 -7.757 -1.156 17.286 1.00 0.66 N ATOM 1391 CA ALA A 115 -6.778 -1.882 18.078 1.00 0.74 C ATOM 1392 C ALA A 115 -5.833 -2.720 17.189 1.00 0.67 C ATOM 1393 O ALA A 115 -4.793 -2.258 16.716 1.00 1.07 O ATOM 1394 CB ALA A 115 -7.568 -2.716 19.101 1.00 0.84 C ATOM 0 H ALA A 115 -8.695 -1.552 17.346 1.00 0.66 H new ATOM 0 HA ALA A 115 -6.110 -1.202 18.607 1.00 0.74 H new ATOM 0 HB1 ALA A 115 -6.874 -3.282 19.723 1.00 0.84 H new ATOM 0 HB2 ALA A 115 -8.161 -2.053 19.731 1.00 0.84 H new ATOM 0 HB3 ALA A 115 -8.229 -3.405 18.576 1.00 0.84 H new ATOM 1400 N THR A 116 -6.243 -3.951 16.889 1.00 0.64 N ATOM 1401 CA THR A 116 -5.420 -5.011 16.286 1.00 0.59 C ATOM 1402 C THR A 116 -5.179 -4.900 14.774 1.00 0.54 C ATOM 1403 O THR A 116 -4.488 -5.755 14.223 1.00 0.64 O ATOM 1404 CB THR A 116 -6.048 -6.378 16.614 1.00 0.60 C ATOM 1405 OG1 THR A 116 -7.348 -6.427 16.083 1.00 0.65 O ATOM 1406 CG2 THR A 116 -6.182 -6.620 18.118 1.00 0.79 C ATOM 0 H THR A 116 -7.200 -4.256 17.066 1.00 0.64 H new ATOM 0 HA THR A 116 -4.430 -4.895 16.728 1.00 0.59 H new ATOM 0 HB THR A 116 -5.390 -7.134 16.187 1.00 0.60 H new ATOM 0 HG1 THR A 116 -7.752 -7.296 16.287 1.00 0.65 H new ATOM 0 HG21 THR A 116 -6.631 -7.598 18.291 1.00 0.79 H new ATOM 0 HG22 THR A 116 -5.196 -6.586 18.581 1.00 0.79 H new ATOM 0 HG23 THR A 116 -6.815 -5.848 18.556 1.00 0.79 H new ATOM 1414 N ALA A 117 -5.729 -3.888 14.090 1.00 0.49 N ATOM 1415 CA ALA A 117 -5.725 -3.757 12.624 1.00 0.44 C ATOM 1416 C ALA A 117 -4.332 -3.874 11.966 1.00 0.38 C ATOM 1417 O ALA A 117 -3.308 -3.523 12.562 1.00 0.44 O ATOM 1418 CB ALA A 117 -6.370 -2.417 12.249 1.00 0.45 C ATOM 0 H ALA A 117 -6.204 -3.114 14.554 1.00 0.49 H new ATOM 0 HA ALA A 117 -6.295 -4.601 12.236 1.00 0.44 H new ATOM 0 HB1 ALA A 117 -6.374 -2.306 11.165 1.00 0.45 H new ATOM 0 HB2 ALA A 117 -7.394 -2.390 12.620 1.00 0.45 H new ATOM 0 HB3 ALA A 117 -5.801 -1.602 12.695 1.00 0.45 H new ATOM 1424 N MET A 118 -4.304 -4.320 10.707 1.00 0.30 N ATOM 1425 CA MET A 118 -3.087 -4.525 9.914 1.00 0.28 C ATOM 1426 C MET A 118 -2.549 -3.200 9.361 1.00 0.29 C ATOM 1427 O MET A 118 -2.986 -2.723 8.321 1.00 0.32 O ATOM 1428 CB MET A 118 -3.407 -5.557 8.824 1.00 0.28 C ATOM 1429 CG MET A 118 -2.257 -5.877 7.862 1.00 0.31 C ATOM 1430 SD MET A 118 -2.557 -7.442 6.992 1.00 1.74 S ATOM 1431 CE MET A 118 -0.918 -7.871 6.356 1.00 0.74 C ATOM 0 H MET A 118 -5.154 -4.556 10.195 1.00 0.30 H new ATOM 0 HA MET A 118 -2.281 -4.914 10.536 1.00 0.28 H new ATOM 0 HB2 MET A 118 -3.723 -6.482 9.305 1.00 0.28 H new ATOM 0 HB3 MET A 118 -4.254 -5.195 8.242 1.00 0.28 H new ATOM 0 HG2 MET A 118 -2.147 -5.069 7.138 1.00 0.31 H new ATOM 0 HG3 MET A 118 -1.320 -5.938 8.416 1.00 0.31 H new ATOM 0 HE1 MET A 118 -0.849 -8.951 6.227 1.00 0.74 H new ATOM 0 HE2 MET A 118 -0.761 -7.380 5.396 1.00 0.74 H new ATOM 0 HE3 MET A 118 -0.156 -7.540 7.062 1.00 0.74 H new ATOM 1441 N LYS A 119 -1.599 -2.588 10.069 1.00 0.34 N ATOM 1442 CA LYS A 119 -0.984 -1.286 9.741 1.00 0.37 C ATOM 1443 C LYS A 119 0.510 -1.273 10.073 1.00 0.41 C ATOM 1444 O LYS A 119 0.951 -2.086 10.895 1.00 0.67 O ATOM 1445 CB LYS A 119 -1.752 -0.177 10.477 1.00 0.46 C ATOM 1446 CG LYS A 119 -1.785 -0.306 12.013 1.00 0.53 C ATOM 1447 CD LYS A 119 -3.236 -0.280 12.519 1.00 0.88 C ATOM 1448 CE LYS A 119 -3.425 -0.456 14.037 1.00 0.96 C ATOM 1449 NZ LYS A 119 -2.628 -1.571 14.607 1.00 2.39 N ATOM 0 H LYS A 119 -1.217 -2.996 10.922 1.00 0.34 H new ATOM 0 HA LYS A 119 -1.054 -1.109 8.668 1.00 0.37 H new ATOM 0 HB2 LYS A 119 -1.306 0.784 10.219 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -2.778 -0.162 10.108 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -1.303 -1.235 12.317 1.00 0.53 H new ATOM 0 HG3 LYS A 119 -1.220 0.509 12.466 1.00 0.53 H new ATOM 0 HD2 LYS A 119 -3.686 0.668 12.225 1.00 0.88 H new ATOM 0 HD3 LYS A 119 -3.791 -1.068 12.010 1.00 0.88 H new ATOM 0 HE2 LYS A 119 -3.149 0.471 14.539 1.00 0.96 H new ATOM 0 HE3 LYS A 119 -4.480 -0.630 14.246 1.00 0.96 H new ATOM 0 HZ1 LYS A 119 -3.035 -1.857 15.521 1.00 2.39 H new ATOM 0 HZ2 LYS A 119 -2.644 -2.379 13.953 1.00 2.39 H new ATOM 0 HZ3 LYS A 119 -1.646 -1.259 14.748 1.00 2.39 H new ATOM 1463 N LYS A 120 1.274 -0.411 9.392 1.00 0.37 N ATOM 1464 CA LYS A 120 2.734 -0.235 9.553 1.00 0.36 C ATOM 1465 C LYS A 120 3.229 1.009 8.812 1.00 0.39 C ATOM 1466 O LYS A 120 2.545 1.507 7.921 1.00 0.58 O ATOM 1467 CB LYS A 120 3.449 -1.484 9.000 1.00 0.46 C ATOM 1468 CG LYS A 120 4.855 -1.749 9.557 1.00 0.55 C ATOM 1469 CD LYS A 120 5.204 -3.199 9.213 1.00 0.99 C ATOM 1470 CE LYS A 120 6.650 -3.591 9.515 1.00 1.24 C ATOM 1471 NZ LYS A 120 6.782 -5.066 9.488 1.00 2.87 N ATOM 0 H LYS A 120 0.883 0.211 8.684 1.00 0.37 H new ATOM 0 HA LYS A 120 2.956 -0.106 10.612 1.00 0.36 H new ATOM 0 HB2 LYS A 120 2.827 -2.356 9.204 1.00 0.46 H new ATOM 0 HB3 LYS A 120 3.520 -1.389 7.916 1.00 0.46 H new ATOM 0 HG2 LYS A 120 5.580 -1.063 9.118 1.00 0.55 H new ATOM 0 HG3 LYS A 120 4.879 -1.591 10.635 1.00 0.55 H new ATOM 0 HD2 LYS A 120 4.538 -3.861 9.767 1.00 0.99 H new ATOM 0 HD3 LYS A 120 5.010 -3.365 8.153 1.00 0.99 H new ATOM 0 HE2 LYS A 120 7.320 -3.143 8.781 1.00 1.24 H new ATOM 0 HE3 LYS A 120 6.945 -3.207 10.492 1.00 1.24 H new ATOM 0 HZ1 LYS A 120 7.789 -5.325 9.507 1.00 2.87 H new ATOM 0 HZ2 LYS A 120 6.304 -5.473 10.317 1.00 2.87 H new ATOM 0 HZ3 LYS A 120 6.346 -5.438 8.620 1.00 2.87 H new ATOM 1485 N LEU A 121 4.439 1.454 9.138 1.00 0.42 N ATOM 1486 CA LEU A 121 5.146 2.533 8.430 1.00 0.44 C ATOM 1487 C LEU A 121 6.313 2.037 7.562 1.00 0.43 C ATOM 1488 O LEU A 121 6.954 1.046 7.920 1.00 0.43 O ATOM 1489 CB LEU A 121 5.621 3.598 9.429 1.00 0.50 C ATOM 1490 CG LEU A 121 4.449 4.331 10.096 1.00 0.50 C ATOM 1491 CD1 LEU A 121 4.040 3.738 11.440 1.00 0.52 C ATOM 1492 CD2 LEU A 121 4.786 5.805 10.305 1.00 0.59 C ATOM 0 H LEU A 121 4.973 1.070 9.918 1.00 0.42 H new ATOM 0 HA LEU A 121 4.429 2.975 7.739 1.00 0.44 H new ATOM 0 HB2 LEU A 121 6.236 3.126 10.196 1.00 0.50 H new ATOM 0 HB3 LEU A 121 6.253 4.321 8.914 1.00 0.50 H new ATOM 0 HG LEU A 121 3.609 4.215 9.411 1.00 0.50 H new ATOM 0 HD11 LEU A 121 3.207 4.308 11.851 1.00 0.52 H new ATOM 0 HD12 LEU A 121 3.737 2.700 11.303 1.00 0.52 H new ATOM 0 HD13 LEU A 121 4.884 3.782 12.129 1.00 0.52 H new ATOM 0 HD21 LEU A 121 3.943 6.307 10.779 1.00 0.59 H new ATOM 0 HD22 LEU A 121 5.665 5.890 10.944 1.00 0.59 H new ATOM 0 HD23 LEU A 121 4.991 6.271 9.341 1.00 0.59 H new ATOM 1504 N THR A 122 6.637 2.727 6.457 1.00 0.44 N ATOM 1505 CA THR A 122 7.866 2.435 5.683 1.00 0.44 C ATOM 1506 C THR A 122 9.095 3.016 6.376 1.00 0.43 C ATOM 1507 O THR A 122 9.078 4.154 6.836 1.00 0.43 O ATOM 1508 CB THR A 122 7.826 2.877 4.207 1.00 0.47 C ATOM 1509 OG1 THR A 122 7.369 4.198 4.054 1.00 0.48 O ATOM 1510 CG2 THR A 122 6.949 1.992 3.317 1.00 0.61 C ATOM 0 H THR A 122 6.073 3.487 6.077 1.00 0.44 H new ATOM 0 HA THR A 122 7.929 1.347 5.659 1.00 0.44 H new ATOM 0 HB THR A 122 8.865 2.788 3.888 1.00 0.47 H new ATOM 0 HG1 THR A 122 7.363 4.434 3.103 1.00 0.48 H new ATOM 0 HG21 THR A 122 6.973 2.368 2.294 1.00 0.61 H new ATOM 0 HG22 THR A 122 7.326 0.969 3.337 1.00 0.61 H new ATOM 0 HG23 THR A 122 5.923 2.008 3.686 1.00 0.61 H new ATOM 1518 N GLU A 123 10.173 2.234 6.459 1.00 0.49 N ATOM 1519 CA GLU A 123 11.345 2.572 7.302 1.00 0.57 C ATOM 1520 C GLU A 123 12.503 3.267 6.570 1.00 0.60 C ATOM 1521 O GLU A 123 12.889 4.380 6.941 1.00 0.67 O ATOM 1522 CB GLU A 123 11.836 1.346 8.088 1.00 0.69 C ATOM 1523 CG GLU A 123 11.637 0.014 7.369 1.00 0.78 C ATOM 1524 CD GLU A 123 12.332 -1.130 8.100 1.00 1.22 C ATOM 1525 OE1 GLU A 123 12.037 -1.356 9.297 1.00 2.57 O ATOM 1526 OE2 GLU A 123 13.170 -1.826 7.480 1.00 1.45 O ATOM 0 H GLU A 123 10.268 1.354 5.953 1.00 0.49 H new ATOM 0 HA GLU A 123 10.975 3.322 8.001 1.00 0.57 H new ATOM 0 HB2 GLU A 123 12.896 1.471 8.308 1.00 0.69 H new ATOM 0 HB3 GLU A 123 11.314 1.310 9.044 1.00 0.69 H new ATOM 0 HG2 GLU A 123 10.571 -0.200 7.288 1.00 0.78 H new ATOM 0 HG3 GLU A 123 12.026 0.087 6.353 1.00 0.78 H new ATOM 1533 N ALA A 124 13.057 2.620 5.542 1.00 0.66 N ATOM 1534 CA ALA A 124 14.086 3.174 4.650 1.00 0.76 C ATOM 1535 C ALA A 124 14.059 2.520 3.256 1.00 0.85 C ATOM 1536 O ALA A 124 14.264 3.192 2.240 1.00 1.11 O ATOM 1537 CB ALA A 124 15.462 2.994 5.304 1.00 0.86 C ATOM 0 H ALA A 124 12.795 1.665 5.297 1.00 0.66 H new ATOM 0 HA ALA A 124 13.879 4.234 4.503 1.00 0.76 H new ATOM 0 HB1 ALA A 124 16.232 3.402 4.649 1.00 0.86 H new ATOM 0 HB2 ALA A 124 15.482 3.519 6.259 1.00 0.86 H new ATOM 0 HB3 ALA A 124 15.651 1.933 5.469 1.00 0.86 H new ATOM 1543 N GLU A 125 13.751 1.220 3.193 1.00 0.81 N ATOM 1544 CA GLU A 125 13.520 0.486 1.944 1.00 1.02 C ATOM 1545 C GLU A 125 12.022 0.296 1.654 1.00 1.06 C ATOM 1546 O GLU A 125 11.584 0.439 0.510 1.00 1.93 O ATOM 1547 CB GLU A 125 14.220 -0.876 2.046 1.00 1.20 C ATOM 1548 CG GLU A 125 15.752 -0.815 2.198 1.00 1.55 C ATOM 1549 CD GLU A 125 16.471 -0.249 0.968 1.00 2.62 C ATOM 1550 OE1 GLU A 125 16.171 -0.681 -0.171 1.00 3.68 O ATOM 1551 OE2 GLU A 125 17.402 0.577 1.133 1.00 3.71 O ATOM 0 H GLU A 125 13.653 0.637 4.025 1.00 0.81 H new ATOM 0 HA GLU A 125 13.929 1.065 1.116 1.00 1.02 H new ATOM 0 HB2 GLU A 125 13.807 -1.416 2.898 1.00 1.20 H new ATOM 0 HB3 GLU A 125 13.982 -1.457 1.155 1.00 1.20 H new ATOM 0 HG2 GLU A 125 15.998 -0.203 3.066 1.00 1.55 H new ATOM 0 HG3 GLU A 125 16.129 -1.818 2.399 1.00 1.55 H new ATOM 1558 N GLY A 126 11.220 0.033 2.688 1.00 0.69 N ATOM 1559 CA GLY A 126 9.797 -0.295 2.570 1.00 0.59 C ATOM 1560 C GLY A 126 9.174 -0.694 3.915 1.00 0.54 C ATOM 1561 O GLY A 126 9.724 -0.371 4.966 1.00 0.67 O ATOM 0 H GLY A 126 11.549 0.042 3.653 1.00 0.69 H new ATOM 0 HA2 GLY A 126 9.262 0.564 2.165 1.00 0.59 H new ATOM 0 HA3 GLY A 126 9.673 -1.112 1.859 1.00 0.59 H new ATOM 1565 N ALA A 127 8.028 -1.377 3.887 1.00 0.44 N ATOM 1566 CA ALA A 127 7.370 -2.028 5.034 1.00 0.38 C ATOM 1567 C ALA A 127 6.881 -3.447 4.696 1.00 0.36 C ATOM 1568 O ALA A 127 6.073 -3.599 3.779 1.00 0.37 O ATOM 1569 CB ALA A 127 6.185 -1.167 5.488 1.00 0.34 C ATOM 0 H ALA A 127 7.502 -1.500 3.022 1.00 0.44 H new ATOM 0 HA ALA A 127 8.104 -2.120 5.834 1.00 0.38 H new ATOM 0 HB1 ALA A 127 5.693 -1.643 6.337 1.00 0.34 H new ATOM 0 HB2 ALA A 127 6.544 -0.181 5.783 1.00 0.34 H new ATOM 0 HB3 ALA A 127 5.474 -1.064 4.668 1.00 0.34 H new ATOM 1575 N LYS A 128 7.308 -4.474 5.449 1.00 0.37 N ATOM 1576 CA LYS A 128 6.830 -5.865 5.299 1.00 0.35 C ATOM 1577 C LYS A 128 5.489 -6.101 6.013 1.00 0.33 C ATOM 1578 O LYS A 128 5.348 -5.774 7.190 1.00 0.41 O ATOM 1579 CB LYS A 128 7.892 -6.853 5.816 1.00 0.42 C ATOM 1580 CG LYS A 128 7.591 -8.321 5.434 1.00 0.89 C ATOM 1581 CD LYS A 128 8.113 -9.332 6.466 1.00 0.85 C ATOM 1582 CE LYS A 128 7.216 -9.348 7.714 1.00 1.82 C ATOM 1583 NZ LYS A 128 7.842 -10.066 8.848 1.00 2.46 N ATOM 0 H LYS A 128 8.002 -4.364 6.188 1.00 0.37 H new ATOM 0 HA LYS A 128 6.664 -6.037 4.236 1.00 0.35 H new ATOM 0 HB2 LYS A 128 8.866 -6.572 5.416 1.00 0.42 H new ATOM 0 HB3 LYS A 128 7.957 -6.772 6.901 1.00 0.42 H new ATOM 0 HG2 LYS A 128 6.514 -8.448 5.323 1.00 0.89 H new ATOM 0 HG3 LYS A 128 8.039 -8.537 4.464 1.00 0.89 H new ATOM 0 HD2 LYS A 128 8.146 -10.327 6.023 1.00 0.85 H new ATOM 0 HD3 LYS A 128 9.134 -9.076 6.749 1.00 0.85 H new ATOM 0 HE2 LYS A 128 6.995 -8.323 8.013 1.00 1.82 H new ATOM 0 HE3 LYS A 128 6.265 -9.820 7.469 1.00 1.82 H new ATOM 0 HZ1 LYS A 128 7.200 -10.050 9.666 1.00 2.46 H new ATOM 0 HZ2 LYS A 128 8.029 -11.052 8.574 1.00 2.46 H new ATOM 0 HZ3 LYS A 128 8.737 -9.601 9.102 1.00 2.46 H new ATOM 1597 N PHE A 129 4.561 -6.752 5.322 1.00 0.34 N ATOM 1598 CA PHE A 129 3.246 -7.224 5.763 1.00 0.33 C ATOM 1599 C PHE A 129 3.164 -8.743 5.590 1.00 0.34 C ATOM 1600 O PHE A 129 3.672 -9.291 4.613 1.00 0.48 O ATOM 1601 CB PHE A 129 2.188 -6.497 4.937 1.00 0.32 C ATOM 1602 CG PHE A 129 1.961 -5.079 5.405 1.00 0.29 C ATOM 1603 CD1 PHE A 129 2.847 -4.072 4.998 1.00 1.92 C ATOM 1604 CD2 PHE A 129 0.913 -4.768 6.292 1.00 1.84 C ATOM 1605 CE1 PHE A 129 2.673 -2.765 5.464 1.00 1.90 C ATOM 1606 CE2 PHE A 129 0.726 -3.451 6.741 1.00 1.87 C ATOM 1607 CZ PHE A 129 1.604 -2.443 6.320 1.00 0.32 C ATOM 0 H PHE A 129 4.723 -6.987 4.343 1.00 0.34 H new ATOM 0 HA PHE A 129 3.079 -7.010 6.819 1.00 0.33 H new ATOM 0 HB2 PHE A 129 2.493 -6.486 3.891 1.00 0.32 H new ATOM 0 HB3 PHE A 129 1.249 -7.048 4.990 1.00 0.32 H new ATOM 0 HD1 PHE A 129 3.661 -4.305 4.327 1.00 1.92 H new ATOM 0 HD2 PHE A 129 0.248 -5.549 6.630 1.00 1.84 H new ATOM 0 HE1 PHE A 129 3.367 -1.994 5.163 1.00 1.90 H new ATOM 0 HE2 PHE A 129 -0.091 -3.216 7.408 1.00 1.87 H new ATOM 0 HZ PHE A 129 1.461 -1.425 6.651 1.00 0.32 H new ATOM 1617 N ASN A 130 2.534 -9.432 6.537 1.00 0.58 N ATOM 1618 CA ASN A 130 2.469 -10.894 6.590 1.00 0.57 C ATOM 1619 C ASN A 130 1.187 -11.425 5.921 1.00 0.50 C ATOM 1620 O ASN A 130 0.091 -11.255 6.448 1.00 0.73 O ATOM 1621 CB ASN A 130 2.540 -11.263 8.086 1.00 0.89 C ATOM 1622 CG ASN A 130 2.309 -12.730 8.397 1.00 1.17 C ATOM 1623 OD1 ASN A 130 1.728 -13.083 9.413 1.00 2.91 O ATOM 1624 ND2 ASN A 130 2.769 -13.640 7.574 1.00 1.36 N ATOM 0 H ASN A 130 2.042 -8.981 7.308 1.00 0.58 H new ATOM 0 HA ASN A 130 3.289 -11.352 6.038 1.00 0.57 H new ATOM 0 HB2 ASN A 130 3.519 -10.976 8.469 1.00 0.89 H new ATOM 0 HB3 ASN A 130 1.800 -10.672 8.626 1.00 0.89 H new ATOM 0 HD21 ASN A 130 2.640 -14.630 7.785 1.00 1.36 H new ATOM 0 HD22 ASN A 130 3.256 -13.359 6.723 1.00 1.36 H new ATOM 1631 N THR A 131 1.321 -12.125 4.792 1.00 0.42 N ATOM 1632 CA THR A 131 0.204 -12.756 4.065 1.00 0.50 C ATOM 1633 C THR A 131 -0.030 -14.220 4.426 1.00 0.51 C ATOM 1634 O THR A 131 -0.946 -14.830 3.880 1.00 0.73 O ATOM 1635 CB THR A 131 0.349 -12.611 2.541 1.00 0.63 C ATOM 1636 OG1 THR A 131 1.628 -13.033 2.118 1.00 0.64 O ATOM 1637 CG2 THR A 131 0.158 -11.154 2.132 1.00 0.69 C ATOM 0 H THR A 131 2.225 -12.275 4.344 1.00 0.42 H new ATOM 0 HA THR A 131 -0.677 -12.205 4.395 1.00 0.50 H new ATOM 0 HB THR A 131 -0.412 -13.234 2.072 1.00 0.63 H new ATOM 0 HG1 THR A 131 1.700 -12.934 1.146 1.00 0.64 H new ATOM 0 HG21 THR A 131 0.263 -11.063 1.051 1.00 0.69 H new ATOM 0 HG22 THR A 131 -0.836 -10.820 2.430 1.00 0.69 H new ATOM 0 HG23 THR A 131 0.910 -10.537 2.623 1.00 0.69 H new ATOM 1645 N ALA A 132 0.740 -14.800 5.354 1.00 0.48 N ATOM 1646 CA ALA A 132 0.626 -16.219 5.698 1.00 0.54 C ATOM 1647 C ALA A 132 -0.764 -16.627 6.225 1.00 0.53 C ATOM 1648 O ALA A 132 -1.122 -17.794 6.123 1.00 0.72 O ATOM 1649 CB ALA A 132 1.712 -16.594 6.713 1.00 0.61 C ATOM 0 H ALA A 132 1.455 -14.301 5.884 1.00 0.48 H new ATOM 0 HA ALA A 132 0.765 -16.774 4.770 1.00 0.54 H new ATOM 0 HB1 ALA A 132 1.624 -17.650 6.966 1.00 0.61 H new ATOM 0 HB2 ALA A 132 2.695 -16.405 6.281 1.00 0.61 H new ATOM 0 HB3 ALA A 132 1.591 -15.993 7.614 1.00 0.61 H new ATOM 1655 N ASN A 133 -1.549 -15.688 6.767 1.00 0.56 N ATOM 1656 CA ASN A 133 -2.797 -15.982 7.482 1.00 0.73 C ATOM 1657 C ASN A 133 -4.071 -15.482 6.778 1.00 0.66 C ATOM 1658 O ASN A 133 -5.170 -15.757 7.264 1.00 0.74 O ATOM 1659 CB ASN A 133 -2.722 -15.479 8.938 1.00 0.99 C ATOM 1660 CG ASN A 133 -1.330 -15.122 9.412 1.00 0.90 C ATOM 1661 OD1 ASN A 133 -0.559 -15.970 9.844 1.00 1.61 O ATOM 1662 ND2 ASN A 133 -0.954 -13.877 9.244 1.00 2.12 N ATOM 0 H ASN A 133 -1.333 -14.692 6.721 1.00 0.56 H new ATOM 0 HA ASN A 133 -2.888 -17.068 7.483 1.00 0.73 H new ATOM 0 HB2 ASN A 133 -3.362 -14.602 9.039 1.00 0.99 H new ATOM 0 HB3 ASN A 133 -3.129 -16.248 9.595 1.00 0.99 H new ATOM 0 HD21 ASN A 133 -0.001 -13.597 9.475 1.00 2.12 H new ATOM 0 HD22 ASN A 133 -1.615 -13.189 8.883 1.00 2.12 H new ATOM 1669 N LEU A 134 -3.958 -14.731 5.676 1.00 0.53 N ATOM 1670 CA LEU A 134 -5.123 -14.253 4.938 1.00 0.47 C ATOM 1671 C LEU A 134 -5.774 -15.335 4.061 1.00 0.56 C ATOM 1672 O LEU A 134 -5.080 -15.972 3.268 1.00 0.78 O ATOM 1673 CB LEU A 134 -4.765 -13.037 4.065 1.00 0.40 C ATOM 1674 CG LEU A 134 -4.656 -11.676 4.770 1.00 0.40 C ATOM 1675 CD1 LEU A 134 -5.600 -11.506 5.960 1.00 0.50 C ATOM 1676 CD2 LEU A 134 -3.231 -11.382 5.206 1.00 0.43 C ATOM 0 H LEU A 134 -3.064 -14.442 5.278 1.00 0.53 H new ATOM 0 HA LEU A 134 -5.851 -13.964 5.696 1.00 0.47 H new ATOM 0 HB2 LEU A 134 -3.813 -13.241 3.575 1.00 0.40 H new ATOM 0 HB3 LEU A 134 -5.516 -12.952 3.280 1.00 0.40 H new ATOM 0 HG LEU A 134 -4.966 -10.953 4.015 1.00 0.40 H new ATOM 0 HD11 LEU A 134 -5.458 -10.518 6.399 1.00 0.50 H new ATOM 0 HD12 LEU A 134 -6.632 -11.608 5.624 1.00 0.50 H new ATOM 0 HD13 LEU A 134 -5.385 -12.270 6.707 1.00 0.50 H new ATOM 0 HD21 LEU A 134 -3.195 -10.411 5.700 1.00 0.43 H new ATOM 0 HD22 LEU A 134 -2.896 -12.154 5.898 1.00 0.43 H new ATOM 0 HD23 LEU A 134 -2.579 -11.369 4.333 1.00 0.43 H new ATOM 1688 N PRO A 135 -7.110 -15.495 4.120 1.00 0.59 N ATOM 1689 CA PRO A 135 -7.841 -16.326 3.172 1.00 0.72 C ATOM 1690 C PRO A 135 -7.906 -15.661 1.789 1.00 0.83 C ATOM 1691 O PRO A 135 -7.620 -14.468 1.631 1.00 0.80 O ATOM 1692 CB PRO A 135 -9.231 -16.511 3.777 1.00 0.81 C ATOM 1693 CG PRO A 135 -9.444 -15.201 4.545 1.00 0.80 C ATOM 1694 CD PRO A 135 -8.038 -14.804 5.007 1.00 0.64 C ATOM 0 HA PRO A 135 -7.350 -17.286 3.013 1.00 0.72 H new ATOM 0 HB2 PRO A 135 -9.990 -16.658 3.009 1.00 0.81 H new ATOM 0 HB3 PRO A 135 -9.273 -17.378 4.436 1.00 0.81 H new ATOM 0 HG2 PRO A 135 -9.886 -14.434 3.909 1.00 0.80 H new ATOM 0 HG3 PRO A 135 -10.117 -15.340 5.391 1.00 0.80 H new ATOM 0 HD2 PRO A 135 -7.900 -13.724 4.951 1.00 0.64 H new ATOM 0 HD3 PRO A 135 -7.873 -15.093 6.045 1.00 0.64 H new ATOM 1702 N ALA A 136 -8.339 -16.436 0.795 1.00 1.01 N ATOM 1703 CA ALA A 136 -8.448 -16.064 -0.606 1.00 1.20 C ATOM 1704 C ALA A 136 -9.592 -15.065 -0.820 1.00 1.31 C ATOM 1705 O ALA A 136 -10.713 -15.444 -1.176 1.00 1.53 O ATOM 1706 CB ALA A 136 -8.657 -17.353 -1.399 1.00 1.43 C ATOM 0 H ALA A 136 -8.640 -17.396 0.961 1.00 1.01 H new ATOM 0 HA ALA A 136 -7.543 -15.562 -0.948 1.00 1.20 H new ATOM 0 HB1 ALA A 136 -8.744 -17.118 -2.460 1.00 1.43 H new ATOM 0 HB2 ALA A 136 -7.807 -18.018 -1.243 1.00 1.43 H new ATOM 0 HB3 ALA A 136 -9.569 -17.845 -1.060 1.00 1.43 H new ATOM 1712 N ALA A 137 -9.291 -13.795 -0.578 1.00 1.18 N ATOM 1713 CA ALA A 137 -10.156 -12.661 -0.836 1.00 1.20 C ATOM 1714 C ALA A 137 -9.361 -11.521 -1.504 1.00 0.98 C ATOM 1715 O ALA A 137 -8.130 -11.583 -1.593 1.00 0.93 O ATOM 1716 CB ALA A 137 -10.764 -12.217 0.501 1.00 1.21 C ATOM 0 H ALA A 137 -8.394 -13.520 -0.178 1.00 1.18 H new ATOM 0 HA ALA A 137 -10.956 -12.936 -1.524 1.00 1.20 H new ATOM 0 HB1 ALA A 137 -11.421 -11.363 0.336 1.00 1.21 H new ATOM 0 HB2 ALA A 137 -11.337 -13.038 0.931 1.00 1.21 H new ATOM 0 HB3 ALA A 137 -9.966 -11.934 1.187 1.00 1.21 H new ATOM 1722 N LYS A 138 -10.051 -10.456 -1.924 1.00 0.92 N ATOM 1723 CA LYS A 138 -9.420 -9.197 -2.344 1.00 0.74 C ATOM 1724 C LYS A 138 -9.336 -8.207 -1.182 1.00 0.69 C ATOM 1725 O LYS A 138 -10.255 -8.047 -0.374 1.00 0.87 O ATOM 1726 CB LYS A 138 -10.082 -8.591 -3.593 1.00 0.74 C ATOM 1727 CG LYS A 138 -9.560 -9.267 -4.865 1.00 0.81 C ATOM 1728 CD LYS A 138 -10.114 -8.671 -6.164 1.00 1.14 C ATOM 1729 CE LYS A 138 -9.606 -7.243 -6.383 1.00 2.85 C ATOM 1730 NZ LYS A 138 -10.041 -6.729 -7.697 1.00 3.44 N ATOM 0 H LYS A 138 -11.069 -10.441 -1.983 1.00 0.92 H new ATOM 0 HA LYS A 138 -8.398 -9.432 -2.641 1.00 0.74 H new ATOM 0 HB2 LYS A 138 -11.164 -8.709 -3.531 1.00 0.74 H new ATOM 0 HB3 LYS A 138 -9.880 -7.521 -3.635 1.00 0.74 H new ATOM 0 HG2 LYS A 138 -8.472 -9.197 -4.881 1.00 0.81 H new ATOM 0 HG3 LYS A 138 -9.810 -10.327 -4.829 1.00 0.81 H new ATOM 0 HD2 LYS A 138 -9.821 -9.297 -7.007 1.00 1.14 H new ATOM 0 HD3 LYS A 138 -11.203 -8.670 -6.131 1.00 1.14 H new ATOM 0 HE2 LYS A 138 -9.980 -6.594 -5.591 1.00 2.85 H new ATOM 0 HE3 LYS A 138 -8.518 -7.226 -6.322 1.00 2.85 H new ATOM 0 HZ1 LYS A 138 -9.835 -5.711 -7.757 1.00 3.44 H new ATOM 0 HZ2 LYS A 138 -9.531 -7.231 -8.452 1.00 3.44 H new ATOM 0 HZ3 LYS A 138 -11.064 -6.882 -7.809 1.00 3.44 H new ATOM 1744 N TYR A 139 -8.205 -7.521 -1.139 1.00 0.59 N ATOM 1745 CA TYR A 139 -7.805 -6.576 -0.109 1.00 0.55 C ATOM 1746 C TYR A 139 -7.433 -5.243 -0.758 1.00 0.50 C ATOM 1747 O TYR A 139 -7.237 -5.155 -1.974 1.00 0.55 O ATOM 1748 CB TYR A 139 -6.634 -7.155 0.701 1.00 0.53 C ATOM 1749 CG TYR A 139 -6.937 -8.472 1.385 1.00 0.56 C ATOM 1750 CD1 TYR A 139 -6.813 -9.674 0.662 1.00 0.56 C ATOM 1751 CD2 TYR A 139 -7.360 -8.500 2.729 1.00 0.67 C ATOM 1752 CE1 TYR A 139 -7.160 -10.895 1.263 1.00 0.63 C ATOM 1753 CE2 TYR A 139 -7.695 -9.730 3.332 1.00 0.70 C ATOM 1754 CZ TYR A 139 -7.612 -10.921 2.591 1.00 0.66 C ATOM 1755 OH TYR A 139 -7.977 -12.092 3.158 1.00 0.72 O ATOM 0 H TYR A 139 -7.498 -7.615 -1.868 1.00 0.59 H new ATOM 0 HA TYR A 139 -8.633 -6.401 0.578 1.00 0.55 H new ATOM 0 HB2 TYR A 139 -5.781 -7.293 0.036 1.00 0.53 H new ATOM 0 HB3 TYR A 139 -6.336 -6.428 1.456 1.00 0.53 H new ATOM 0 HD1 TYR A 139 -6.451 -9.657 -0.355 1.00 0.56 H new ATOM 0 HD2 TYR A 139 -7.427 -7.583 3.295 1.00 0.67 H new ATOM 0 HE1 TYR A 139 -7.079 -11.815 0.703 1.00 0.63 H new ATOM 0 HE2 TYR A 139 -8.015 -9.757 4.363 1.00 0.70 H new ATOM 0 HH TYR A 139 -7.805 -12.826 2.532 1.00 0.72 H new ATOM 1765 N LYS A 140 -7.324 -4.195 0.056 1.00 0.46 N ATOM 1766 CA LYS A 140 -6.889 -2.865 -0.385 1.00 0.42 C ATOM 1767 C LYS A 140 -5.990 -2.193 0.646 1.00 0.41 C ATOM 1768 O LYS A 140 -6.129 -2.462 1.838 1.00 0.46 O ATOM 1769 CB LYS A 140 -8.096 -1.968 -0.721 1.00 0.42 C ATOM 1770 CG LYS A 140 -8.938 -2.435 -1.904 1.00 0.46 C ATOM 1771 CD LYS A 140 -10.115 -1.484 -2.116 1.00 0.50 C ATOM 1772 CE LYS A 140 -10.971 -2.112 -3.212 1.00 0.62 C ATOM 1773 NZ LYS A 140 -12.237 -1.382 -3.454 1.00 1.63 N ATOM 0 H LYS A 140 -7.537 -4.243 1.052 1.00 0.46 H new ATOM 0 HA LYS A 140 -6.303 -3.004 -1.293 1.00 0.42 H new ATOM 0 HB2 LYS A 140 -8.737 -1.903 0.158 1.00 0.42 H new ATOM 0 HB3 LYS A 140 -7.734 -0.961 -0.927 1.00 0.42 H new ATOM 0 HG2 LYS A 140 -8.325 -2.474 -2.804 1.00 0.46 H new ATOM 0 HG3 LYS A 140 -9.304 -3.446 -1.724 1.00 0.46 H new ATOM 0 HD2 LYS A 140 -10.687 -1.360 -1.197 1.00 0.50 H new ATOM 0 HD3 LYS A 140 -9.768 -0.494 -2.411 1.00 0.50 H new ATOM 0 HE2 LYS A 140 -10.397 -2.147 -4.138 1.00 0.62 H new ATOM 0 HE3 LYS A 140 -11.200 -3.142 -2.940 1.00 0.62 H new ATOM 0 HZ1 LYS A 140 -12.552 -1.547 -4.431 1.00 1.63 H new ATOM 0 HZ2 LYS A 140 -12.965 -1.721 -2.794 1.00 1.63 H new ATOM 0 HZ3 LYS A 140 -12.084 -0.364 -3.307 1.00 1.63 H new ATOM 1787 N ILE A 141 -5.113 -1.291 0.213 1.00 0.40 N ATOM 1788 CA ILE A 141 -4.283 -0.466 1.107 1.00 0.39 C ATOM 1789 C ILE A 141 -4.755 0.997 1.080 1.00 0.39 C ATOM 1790 O ILE A 141 -5.083 1.529 0.018 1.00 0.39 O ATOM 1791 CB ILE A 141 -2.771 -0.631 0.815 1.00 0.41 C ATOM 1792 CG1 ILE A 141 -2.286 -2.099 0.934 1.00 0.40 C ATOM 1793 CG2 ILE A 141 -1.933 0.200 1.797 1.00 0.42 C ATOM 1794 CD1 ILE A 141 -2.305 -2.842 -0.402 1.00 0.44 C ATOM 0 H ILE A 141 -4.952 -1.105 -0.777 1.00 0.40 H new ATOM 0 HA ILE A 141 -4.416 -0.824 2.128 1.00 0.39 H new ATOM 0 HB ILE A 141 -2.637 -0.292 -0.212 1.00 0.41 H new ATOM 0 HG12 ILE A 141 -1.273 -2.110 1.336 1.00 0.40 H new ATOM 0 HG13 ILE A 141 -2.918 -2.628 1.647 1.00 0.40 H new ATOM 0 HG21 ILE A 141 -0.874 0.069 1.573 1.00 0.42 H new ATOM 0 HG22 ILE A 141 -2.197 1.253 1.700 1.00 0.42 H new ATOM 0 HG23 ILE A 141 -2.132 -0.131 2.816 1.00 0.42 H new ATOM 0 HD11 ILE A 141 -1.955 -3.864 -0.255 1.00 0.44 H new ATOM 0 HD12 ILE A 141 -3.322 -2.859 -0.794 1.00 0.44 H new ATOM 0 HD13 ILE A 141 -1.651 -2.333 -1.111 1.00 0.44 H new ATOM 1806 N TYR A 142 -4.774 1.629 2.255 1.00 0.39 N ATOM 1807 CA TYR A 142 -5.155 3.028 2.488 1.00 0.40 C ATOM 1808 C TYR A 142 -4.058 3.760 3.278 1.00 0.42 C ATOM 1809 O TYR A 142 -3.477 3.184 4.193 1.00 0.42 O ATOM 1810 CB TYR A 142 -6.507 3.072 3.218 1.00 0.38 C ATOM 1811 CG TYR A 142 -7.698 2.812 2.315 1.00 0.37 C ATOM 1812 CD1 TYR A 142 -7.996 1.515 1.849 1.00 1.78 C ATOM 1813 CD2 TYR A 142 -8.500 3.894 1.913 1.00 1.79 C ATOM 1814 CE1 TYR A 142 -9.057 1.312 0.951 1.00 1.82 C ATOM 1815 CE2 TYR A 142 -9.574 3.690 1.030 1.00 1.77 C ATOM 1816 CZ TYR A 142 -9.830 2.404 0.520 1.00 0.47 C ATOM 1817 OH TYR A 142 -10.807 2.216 -0.400 1.00 0.63 O ATOM 0 H TYR A 142 -4.510 1.155 3.118 1.00 0.39 H new ATOM 0 HA TYR A 142 -5.262 3.543 1.533 1.00 0.40 H new ATOM 0 HB2 TYR A 142 -6.501 2.332 4.019 1.00 0.38 H new ATOM 0 HB3 TYR A 142 -6.625 4.049 3.687 1.00 0.38 H new ATOM 0 HD1 TYR A 142 -7.406 0.674 2.184 1.00 1.78 H new ATOM 0 HD2 TYR A 142 -8.290 4.886 2.284 1.00 1.79 H new ATOM 0 HE1 TYR A 142 -9.279 0.318 0.592 1.00 1.82 H new ATOM 0 HE2 TYR A 142 -10.203 4.520 0.743 1.00 1.77 H new ATOM 0 HH TYR A 142 -11.367 1.457 -0.132 1.00 0.63 H new ATOM 1827 N GLU A 143 -3.763 5.019 2.942 1.00 0.53 N ATOM 1828 CA GLU A 143 -2.671 5.821 3.531 1.00 0.57 C ATOM 1829 C GLU A 143 -3.214 6.826 4.555 1.00 0.61 C ATOM 1830 O GLU A 143 -4.164 7.545 4.255 1.00 0.81 O ATOM 1831 CB GLU A 143 -1.912 6.539 2.406 1.00 0.67 C ATOM 1832 CG GLU A 143 -0.621 7.213 2.871 1.00 0.77 C ATOM 1833 CD GLU A 143 0.081 7.860 1.678 1.00 0.85 C ATOM 1834 OE1 GLU A 143 0.825 7.150 0.966 1.00 1.68 O ATOM 1835 OE2 GLU A 143 -0.120 9.075 1.421 1.00 1.81 O ATOM 0 H GLU A 143 -4.289 5.529 2.232 1.00 0.53 H new ATOM 0 HA GLU A 143 -1.987 5.158 4.061 1.00 0.57 H new ATOM 0 HB2 GLU A 143 -1.674 5.819 1.623 1.00 0.67 H new ATOM 0 HB3 GLU A 143 -2.564 7.290 1.961 1.00 0.67 H new ATOM 0 HG2 GLU A 143 -0.844 7.967 3.626 1.00 0.77 H new ATOM 0 HG3 GLU A 143 0.036 6.479 3.338 1.00 0.77 H new ATOM 1842 N ILE A 144 -2.634 6.894 5.756 1.00 0.81 N ATOM 1843 CA ILE A 144 -3.193 7.644 6.893 1.00 0.80 C ATOM 1844 C ILE A 144 -2.105 8.544 7.512 1.00 0.84 C ATOM 1845 O ILE A 144 -1.155 8.053 8.117 1.00 0.92 O ATOM 1846 CB ILE A 144 -3.787 6.628 7.908 1.00 0.82 C ATOM 1847 CG1 ILE A 144 -4.777 5.599 7.294 1.00 0.82 C ATOM 1848 CG2 ILE A 144 -4.459 7.330 9.097 1.00 0.88 C ATOM 1849 CD1 ILE A 144 -6.058 6.144 6.637 1.00 0.81 C ATOM 0 H ILE A 144 -1.754 6.426 5.973 1.00 0.81 H new ATOM 0 HA ILE A 144 -3.997 8.306 6.570 1.00 0.80 H new ATOM 0 HB ILE A 144 -2.919 6.065 8.251 1.00 0.82 H new ATOM 0 HG12 ILE A 144 -4.237 5.019 6.546 1.00 0.82 H new ATOM 0 HG13 ILE A 144 -5.073 4.906 8.082 1.00 0.82 H new ATOM 0 HG21 ILE A 144 -4.860 6.583 9.781 1.00 0.88 H new ATOM 0 HG22 ILE A 144 -3.725 7.944 9.619 1.00 0.88 H new ATOM 0 HG23 ILE A 144 -5.269 7.963 8.735 1.00 0.88 H new ATOM 0 HD11 ILE A 144 -6.651 5.314 6.253 1.00 0.81 H new ATOM 0 HD12 ILE A 144 -6.640 6.695 7.376 1.00 0.81 H new ATOM 0 HD13 ILE A 144 -5.791 6.809 5.816 1.00 0.81 H new ATOM 1861 N HIS A 145 -2.254 9.869 7.420 1.00 0.97 N ATOM 1862 CA HIS A 145 -1.260 10.849 7.900 1.00 1.10 C ATOM 1863 C HIS A 145 -1.258 11.051 9.435 1.00 1.09 C ATOM 1864 O HIS A 145 -0.371 11.716 9.966 1.00 1.33 O ATOM 1865 CB HIS A 145 -1.475 12.194 7.180 1.00 1.55 C ATOM 1866 CG HIS A 145 -1.146 12.201 5.704 1.00 1.53 C ATOM 1867 ND1 HIS A 145 0.090 12.450 5.146 1.00 2.39 N ATOM 1868 CD2 HIS A 145 -2.036 12.103 4.667 1.00 2.81 C ATOM 1869 CE1 HIS A 145 -0.056 12.504 3.812 1.00 3.29 C ATOM 1870 NE2 HIS A 145 -1.340 12.299 3.465 1.00 3.51 N ATOM 0 H HIS A 145 -3.079 10.303 7.005 1.00 0.97 H new ATOM 0 HA HIS A 145 -0.279 10.439 7.660 1.00 1.10 H new ATOM 0 HB2 HIS A 145 -2.517 12.490 7.304 1.00 1.55 H new ATOM 0 HB3 HIS A 145 -0.867 12.952 7.674 1.00 1.55 H new ATOM 0 HD2 HIS A 145 -3.094 11.908 4.759 1.00 2.81 H new ATOM 0 HE1 HIS A 145 0.747 12.687 3.113 1.00 3.29 H new ATOM 0 HE2 HIS A 145 -1.728 12.288 2.522 1.00 3.51 H new ATOM 1878 N SER A 146 -2.223 10.490 10.170 1.00 1.05 N ATOM 1879 CA SER A 146 -2.373 10.670 11.629 1.00 1.23 C ATOM 1880 C SER A 146 -1.195 10.142 12.481 1.00 1.27 C ATOM 1881 O SER A 146 -0.927 10.676 13.563 1.00 1.51 O ATOM 1882 CB SER A 146 -3.693 9.999 12.032 1.00 1.44 C ATOM 1883 OG SER A 146 -3.991 10.132 13.405 1.00 3.13 O ATOM 0 H SER A 146 -2.938 9.886 9.766 1.00 1.05 H new ATOM 0 HA SER A 146 -2.377 11.740 11.836 1.00 1.23 H new ATOM 0 HB2 SER A 146 -4.505 10.431 11.448 1.00 1.44 H new ATOM 0 HB3 SER A 146 -3.646 8.940 11.778 1.00 1.44 H new ATOM 0 HG SER A 146 -4.842 9.687 13.600 1.00 3.13 H new ATOM 2086 N LYS A 162 -2.151 13.918 -2.696 1.00 1.14 N ATOM 2087 CA LYS A 162 -2.820 12.867 -1.897 1.00 1.11 C ATOM 2088 C LYS A 162 -2.759 11.482 -2.552 1.00 0.90 C ATOM 2089 O LYS A 162 -2.763 11.379 -3.777 1.00 1.02 O ATOM 2090 CB LYS A 162 -4.253 13.312 -1.518 1.00 1.39 C ATOM 2091 CG LYS A 162 -5.155 13.926 -2.618 1.00 1.69 C ATOM 2092 CD LYS A 162 -5.665 12.984 -3.721 1.00 1.84 C ATOM 2093 CE LYS A 162 -6.439 11.762 -3.211 1.00 1.44 C ATOM 2094 NZ LYS A 162 -7.801 12.096 -2.730 1.00 1.84 N ATOM 0 HA LYS A 162 -2.262 12.746 -0.969 1.00 1.11 H new ATOM 0 HB2 LYS A 162 -4.772 12.444 -1.111 1.00 1.39 H new ATOM 0 HB3 LYS A 162 -4.171 14.041 -0.712 1.00 1.39 H new ATOM 0 HG2 LYS A 162 -6.021 14.375 -2.132 1.00 1.69 H new ATOM 0 HG3 LYS A 162 -4.602 14.735 -3.095 1.00 1.69 H new ATOM 0 HD2 LYS A 162 -6.309 13.550 -4.395 1.00 1.84 H new ATOM 0 HD3 LYS A 162 -4.814 12.639 -4.308 1.00 1.84 H new ATOM 0 HE2 LYS A 162 -6.513 11.026 -4.012 1.00 1.44 H new ATOM 0 HE3 LYS A 162 -5.878 11.296 -2.401 1.00 1.44 H new ATOM 0 HZ1 LYS A 162 -8.157 11.324 -2.131 1.00 1.84 H new ATOM 0 HZ2 LYS A 162 -7.768 12.976 -2.177 1.00 1.84 H new ATOM 0 HZ3 LYS A 162 -8.435 12.222 -3.544 1.00 1.84 H new ATOM 2108 N ALA A 163 -2.698 10.411 -1.762 1.00 0.79 N ATOM 2109 CA ALA A 163 -2.655 9.038 -2.282 1.00 0.67 C ATOM 2110 C ALA A 163 -4.028 8.537 -2.774 1.00 0.55 C ATOM 2111 O ALA A 163 -5.075 8.997 -2.309 1.00 0.65 O ATOM 2112 CB ALA A 163 -2.044 8.120 -1.220 1.00 0.83 C ATOM 0 H ALA A 163 -2.677 10.467 -0.744 1.00 0.79 H new ATOM 0 HA ALA A 163 -2.021 9.025 -3.169 1.00 0.67 H new ATOM 0 HB1 ALA A 163 -2.009 7.099 -1.599 1.00 0.83 H new ATOM 0 HB2 ALA A 163 -1.034 8.456 -0.987 1.00 0.83 H new ATOM 0 HB3 ALA A 163 -2.654 8.151 -0.317 1.00 0.83 H new ATOM 2118 N VAL A 164 -4.027 7.569 -3.698 1.00 0.52 N ATOM 2119 CA VAL A 164 -5.233 6.836 -4.139 1.00 0.47 C ATOM 2120 C VAL A 164 -5.144 5.337 -3.820 1.00 0.44 C ATOM 2121 O VAL A 164 -4.050 4.768 -3.864 1.00 0.50 O ATOM 2122 CB VAL A 164 -5.608 7.078 -5.615 1.00 0.50 C ATOM 2123 CG1 VAL A 164 -6.476 8.334 -5.717 1.00 0.56 C ATOM 2124 CG2 VAL A 164 -4.402 7.209 -6.545 1.00 0.56 C ATOM 0 H VAL A 164 -3.177 7.263 -4.172 1.00 0.52 H new ATOM 0 HA VAL A 164 -6.051 7.256 -3.554 1.00 0.47 H new ATOM 0 HB VAL A 164 -6.155 6.196 -5.947 1.00 0.50 H new ATOM 0 HG11 VAL A 164 -6.743 8.508 -6.759 1.00 0.56 H new ATOM 0 HG12 VAL A 164 -7.383 8.198 -5.128 1.00 0.56 H new ATOM 0 HG13 VAL A 164 -5.921 9.192 -5.336 1.00 0.56 H new ATOM 0 HG21 VAL A 164 -4.746 7.378 -7.565 1.00 0.56 H new ATOM 0 HG22 VAL A 164 -3.786 8.050 -6.226 1.00 0.56 H new ATOM 0 HG23 VAL A 164 -3.812 6.293 -6.508 1.00 0.56 H new ATOM 2134 N PRO A 165 -6.276 4.685 -3.485 1.00 0.40 N ATOM 2135 CA PRO A 165 -6.289 3.335 -2.925 1.00 0.41 C ATOM 2136 C PRO A 165 -5.943 2.251 -3.947 1.00 0.41 C ATOM 2137 O PRO A 165 -6.261 2.343 -5.141 1.00 0.50 O ATOM 2138 CB PRO A 165 -7.667 3.159 -2.285 1.00 0.41 C ATOM 2139 CG PRO A 165 -8.561 4.102 -3.089 1.00 0.40 C ATOM 2140 CD PRO A 165 -7.629 5.224 -3.545 1.00 0.41 C ATOM 0 HA PRO A 165 -5.504 3.217 -2.178 1.00 0.41 H new ATOM 0 HB2 PRO A 165 -8.011 2.127 -2.352 1.00 0.41 H new ATOM 0 HB3 PRO A 165 -7.654 3.423 -1.228 1.00 0.41 H new ATOM 0 HG2 PRO A 165 -9.012 3.591 -3.940 1.00 0.40 H new ATOM 0 HG3 PRO A 165 -9.378 4.489 -2.480 1.00 0.40 H new ATOM 0 HD2 PRO A 165 -7.874 5.545 -4.557 1.00 0.41 H new ATOM 0 HD3 PRO A 165 -7.728 6.097 -2.900 1.00 0.41 H new ATOM 2148 N ILE A 166 -5.281 1.212 -3.446 1.00 0.40 N ATOM 2149 CA ILE A 166 -4.624 0.147 -4.213 1.00 0.38 C ATOM 2150 C ILE A 166 -5.300 -1.177 -3.892 1.00 0.43 C ATOM 2151 O ILE A 166 -5.422 -1.507 -2.717 1.00 0.53 O ATOM 2152 CB ILE A 166 -3.113 0.054 -3.866 1.00 0.42 C ATOM 2153 CG1 ILE A 166 -2.420 1.424 -3.709 1.00 0.59 C ATOM 2154 CG2 ILE A 166 -2.394 -0.765 -4.950 1.00 0.46 C ATOM 2155 CD1 ILE A 166 -2.474 1.960 -2.269 1.00 1.35 C ATOM 0 H ILE A 166 -5.180 1.079 -2.440 1.00 0.40 H new ATOM 0 HA ILE A 166 -4.714 0.374 -5.275 1.00 0.38 H new ATOM 0 HB ILE A 166 -3.047 -0.434 -2.893 1.00 0.42 H new ATOM 0 HG12 ILE A 166 -1.379 1.337 -4.020 1.00 0.59 H new ATOM 0 HG13 ILE A 166 -2.893 2.144 -4.377 1.00 0.59 H new ATOM 0 HG21 ILE A 166 -1.333 -0.833 -4.711 1.00 0.46 H new ATOM 0 HG22 ILE A 166 -2.821 -1.767 -4.992 1.00 0.46 H new ATOM 0 HG23 ILE A 166 -2.517 -0.277 -5.917 1.00 0.46 H new ATOM 0 HD11 ILE A 166 -1.971 2.926 -2.221 1.00 1.35 H new ATOM 0 HD12 ILE A 166 -3.514 2.077 -1.963 1.00 1.35 H new ATOM 0 HD13 ILE A 166 -1.976 1.258 -1.600 1.00 1.35 H new ATOM 2167 N GLU A 167 -5.706 -1.939 -4.905 1.00 0.53 N ATOM 2168 CA GLU A 167 -6.277 -3.285 -4.753 1.00 0.62 C ATOM 2169 C GLU A 167 -5.217 -4.393 -4.912 1.00 0.69 C ATOM 2170 O GLU A 167 -4.283 -4.270 -5.710 1.00 0.83 O ATOM 2171 CB GLU A 167 -7.474 -3.480 -5.700 1.00 0.78 C ATOM 2172 CG GLU A 167 -7.162 -3.165 -7.171 1.00 1.61 C ATOM 2173 CD GLU A 167 -8.320 -3.457 -8.131 1.00 1.90 C ATOM 2174 OE1 GLU A 167 -9.385 -3.972 -7.716 1.00 2.34 O ATOM 2175 OE2 GLU A 167 -8.168 -3.166 -9.348 1.00 2.94 O ATOM 0 H GLU A 167 -5.648 -1.636 -5.877 1.00 0.53 H new ATOM 0 HA GLU A 167 -6.647 -3.372 -3.732 1.00 0.62 H new ATOM 0 HB2 GLU A 167 -7.820 -4.511 -5.625 1.00 0.78 H new ATOM 0 HB3 GLU A 167 -8.294 -2.844 -5.368 1.00 0.78 H new ATOM 0 HG2 GLU A 167 -6.889 -2.113 -7.257 1.00 1.61 H new ATOM 0 HG3 GLU A 167 -6.293 -3.746 -7.480 1.00 1.61 H new ATOM 2182 N ILE A 168 -5.364 -5.484 -4.157 1.00 0.63 N ATOM 2183 CA ILE A 168 -4.436 -6.621 -4.107 1.00 0.66 C ATOM 2184 C ILE A 168 -5.193 -7.924 -3.762 1.00 0.72 C ATOM 2185 O ILE A 168 -6.284 -7.889 -3.192 1.00 0.61 O ATOM 2186 CB ILE A 168 -3.281 -6.273 -3.131 1.00 0.60 C ATOM 2187 CG1 ILE A 168 -2.124 -7.284 -3.226 1.00 0.70 C ATOM 2188 CG2 ILE A 168 -3.758 -6.147 -1.673 1.00 0.54 C ATOM 2189 CD1 ILE A 168 -0.812 -6.790 -2.601 1.00 0.56 C ATOM 0 H ILE A 168 -6.165 -5.606 -3.538 1.00 0.63 H new ATOM 0 HA ILE A 168 -3.986 -6.807 -5.082 1.00 0.66 H new ATOM 0 HB ILE A 168 -2.911 -5.297 -3.444 1.00 0.60 H new ATOM 0 HG12 ILE A 168 -2.423 -8.210 -2.735 1.00 0.70 H new ATOM 0 HG13 ILE A 168 -1.948 -7.522 -4.275 1.00 0.70 H new ATOM 0 HG21 ILE A 168 -2.910 -5.903 -1.033 1.00 0.54 H new ATOM 0 HG22 ILE A 168 -4.506 -5.357 -1.602 1.00 0.54 H new ATOM 0 HG23 ILE A 168 -4.196 -7.092 -1.350 1.00 0.54 H new ATOM 0 HD11 ILE A 168 -0.046 -7.558 -2.708 1.00 0.56 H new ATOM 0 HD12 ILE A 168 -0.487 -5.881 -3.107 1.00 0.56 H new ATOM 0 HD13 ILE A 168 -0.969 -6.580 -1.543 1.00 0.56 H new ATOM 2201 N GLU A 169 -4.642 -9.085 -4.114 1.00 0.92 N ATOM 2202 CA GLU A 169 -5.198 -10.418 -3.830 1.00 0.94 C ATOM 2203 C GLU A 169 -4.071 -11.362 -3.353 1.00 1.04 C ATOM 2204 O GLU A 169 -2.919 -10.947 -3.223 1.00 1.41 O ATOM 2205 CB GLU A 169 -5.917 -10.935 -5.093 1.00 0.95 C ATOM 2206 CG GLU A 169 -7.088 -11.883 -4.774 1.00 1.19 C ATOM 2207 CD GLU A 169 -7.792 -12.399 -6.037 1.00 1.30 C ATOM 2208 OE1 GLU A 169 -7.089 -12.777 -7.005 1.00 1.53 O ATOM 2209 OE2 GLU A 169 -9.046 -12.435 -6.094 1.00 2.55 O ATOM 0 H GLU A 169 -3.761 -9.130 -4.626 1.00 0.92 H new ATOM 0 HA GLU A 169 -5.932 -10.372 -3.025 1.00 0.94 H new ATOM 0 HB2 GLU A 169 -6.290 -10.086 -5.665 1.00 0.95 H new ATOM 0 HB3 GLU A 169 -5.198 -11.455 -5.726 1.00 0.95 H new ATOM 0 HG2 GLU A 169 -6.718 -12.731 -4.197 1.00 1.19 H new ATOM 0 HG3 GLU A 169 -7.811 -11.362 -4.147 1.00 1.19 H new ATOM 2216 N LEU A 170 -4.377 -12.632 -3.071 1.00 0.90 N ATOM 2217 CA LEU A 170 -3.394 -13.613 -2.596 1.00 1.07 C ATOM 2218 C LEU A 170 -2.356 -13.984 -3.689 1.00 0.79 C ATOM 2219 O LEU A 170 -2.615 -13.829 -4.890 1.00 0.54 O ATOM 2220 CB LEU A 170 -4.131 -14.815 -1.961 1.00 1.29 C ATOM 2221 CG LEU A 170 -4.430 -14.686 -0.446 1.00 1.57 C ATOM 2222 CD1 LEU A 170 -3.194 -14.877 0.436 1.00 1.15 C ATOM 2223 CD2 LEU A 170 -5.027 -13.334 -0.061 1.00 2.10 C ATOM 0 H LEU A 170 -5.319 -13.012 -3.166 1.00 0.90 H new ATOM 0 HA LEU A 170 -2.785 -13.169 -1.809 1.00 1.07 H new ATOM 0 HB2 LEU A 170 -5.073 -14.962 -2.489 1.00 1.29 H new ATOM 0 HB3 LEU A 170 -3.533 -15.712 -2.121 1.00 1.29 H new ATOM 0 HG LEU A 170 -5.150 -15.485 -0.270 1.00 1.57 H new ATOM 0 HD11 LEU A 170 -3.475 -14.774 1.484 1.00 1.15 H new ATOM 0 HD12 LEU A 170 -2.777 -15.870 0.268 1.00 1.15 H new ATOM 0 HD13 LEU A 170 -2.448 -14.123 0.185 1.00 1.15 H new ATOM 0 HD21 LEU A 170 -5.212 -13.311 1.013 1.00 2.10 H new ATOM 0 HD22 LEU A 170 -4.330 -12.539 -0.326 1.00 2.10 H new ATOM 0 HD23 LEU A 170 -5.966 -13.186 -0.594 1.00 2.10 H new ATOM 2235 N PRO A 171 -1.159 -14.463 -3.291 1.00 1.03 N ATOM 2236 CA PRO A 171 -0.001 -14.604 -4.170 1.00 0.86 C ATOM 2237 C PRO A 171 0.004 -15.894 -5.003 1.00 0.62 C ATOM 2238 O PRO A 171 0.743 -16.832 -4.699 1.00 0.81 O ATOM 2239 CB PRO A 171 1.204 -14.507 -3.226 1.00 1.18 C ATOM 2240 CG PRO A 171 0.685 -15.222 -1.980 1.00 1.55 C ATOM 2241 CD PRO A 171 -0.755 -14.735 -1.918 1.00 1.60 C ATOM 0 HA PRO A 171 0.003 -13.830 -4.938 1.00 0.86 H new ATOM 0 HB2 PRO A 171 2.087 -14.995 -3.639 1.00 1.18 H new ATOM 0 HB3 PRO A 171 1.479 -13.473 -3.019 1.00 1.18 H new ATOM 0 HG2 PRO A 171 0.746 -16.306 -2.076 1.00 1.55 H new ATOM 0 HG3 PRO A 171 1.248 -14.948 -1.088 1.00 1.55 H new ATOM 0 HD2 PRO A 171 -1.400 -15.488 -1.466 1.00 1.60 H new ATOM 0 HD3 PRO A 171 -0.835 -13.837 -1.305 1.00 1.60 H new ATOM 2249 N LEU A 172 -0.809 -15.960 -6.057 1.00 0.66 N ATOM 2250 CA LEU A 172 -0.679 -16.999 -7.085 1.00 0.59 C ATOM 2251 C LEU A 172 0.188 -16.387 -8.195 1.00 0.84 C ATOM 2252 O LEU A 172 -0.303 -15.825 -9.180 1.00 1.50 O ATOM 2253 CB LEU A 172 -2.062 -17.521 -7.505 1.00 0.84 C ATOM 2254 CG LEU A 172 -2.016 -18.883 -8.238 1.00 1.53 C ATOM 2255 CD1 LEU A 172 -3.433 -19.391 -8.500 1.00 2.23 C ATOM 2256 CD2 LEU A 172 -1.286 -18.842 -9.580 1.00 3.25 C ATOM 0 H LEU A 172 -1.571 -15.302 -6.224 1.00 0.66 H new ATOM 0 HA LEU A 172 -0.179 -17.903 -6.737 1.00 0.59 H new ATOM 0 HB2 LEU A 172 -2.689 -17.616 -6.619 1.00 0.84 H new ATOM 0 HB3 LEU A 172 -2.537 -16.785 -8.154 1.00 0.84 H new ATOM 0 HG LEU A 172 -1.463 -19.546 -7.573 1.00 1.53 H new ATOM 0 HD11 LEU A 172 -3.386 -20.350 -9.016 1.00 2.23 H new ATOM 0 HD12 LEU A 172 -3.956 -19.514 -7.552 1.00 2.23 H new ATOM 0 HD13 LEU A 172 -3.969 -18.671 -9.119 1.00 2.23 H new ATOM 0 HD21 LEU A 172 -1.297 -19.834 -10.031 1.00 3.25 H new ATOM 0 HD22 LEU A 172 -1.785 -18.136 -10.244 1.00 3.25 H new ATOM 0 HD23 LEU A 172 -0.255 -18.526 -9.424 1.00 3.25 H new ATOM 2268 N ASN A 173 1.502 -16.417 -7.948 1.00 1.05 N ATOM 2269 CA ASN A 173 2.518 -15.703 -8.718 1.00 1.44 C ATOM 2270 C ASN A 173 3.853 -16.472 -8.780 1.00 1.48 C ATOM 2271 O ASN A 173 4.146 -17.319 -7.930 1.00 2.20 O ATOM 2272 CB ASN A 173 2.721 -14.313 -8.077 1.00 1.91 C ATOM 2273 CG ASN A 173 1.542 -13.386 -8.226 1.00 2.19 C ATOM 2274 OD1 ASN A 173 0.684 -13.280 -7.359 1.00 3.83 O ATOM 2275 ND2 ASN A 173 1.494 -12.661 -9.306 1.00 1.48 N ATOM 0 H ASN A 173 1.898 -16.959 -7.179 1.00 1.05 H new ATOM 0 HA ASN A 173 2.173 -15.604 -9.747 1.00 1.44 H new ATOM 0 HB2 ASN A 173 2.935 -14.442 -7.016 1.00 1.91 H new ATOM 0 HB3 ASN A 173 3.597 -13.843 -8.524 1.00 1.91 H new ATOM 0 HD21 ASN A 173 0.734 -11.993 -9.439 1.00 1.48 H new ATOM 0 HD22 ASN A 173 2.216 -12.760 -10.020 1.00 1.48 H new ATOM 2282 N ASP A 174 4.699 -16.137 -9.758 1.00 1.44 N ATOM 2283 CA ASP A 174 6.056 -16.693 -9.929 1.00 1.55 C ATOM 2284 C ASP A 174 7.079 -16.146 -8.912 1.00 1.56 C ATOM 2285 O ASP A 174 8.134 -16.754 -8.691 1.00 2.07 O ATOM 2286 CB ASP A 174 6.539 -16.408 -11.358 1.00 1.98 C ATOM 2287 CG ASP A 174 5.863 -17.304 -12.395 1.00 2.03 C ATOM 2288 OD1 ASP A 174 6.331 -18.453 -12.596 1.00 2.54 O ATOM 2289 OD2 ASP A 174 4.869 -16.862 -13.019 1.00 3.21 O ATOM 0 H ASP A 174 4.458 -15.453 -10.476 1.00 1.44 H new ATOM 0 HA ASP A 174 5.987 -17.765 -9.747 1.00 1.55 H new ATOM 0 HB2 ASP A 174 6.344 -15.364 -11.602 1.00 1.98 H new ATOM 0 HB3 ASP A 174 7.618 -16.550 -11.408 1.00 1.98 H new ATOM 2294 N VAL A 175 6.764 -15.017 -8.277 1.00 1.31 N ATOM 2295 CA VAL A 175 7.647 -14.259 -7.374 1.00 1.30 C ATOM 2296 C VAL A 175 7.999 -15.005 -6.090 1.00 1.21 C ATOM 2297 O VAL A 175 7.218 -15.810 -5.580 1.00 1.13 O ATOM 2298 CB VAL A 175 7.085 -12.864 -7.057 1.00 1.29 C ATOM 2299 CG1 VAL A 175 6.692 -12.127 -8.336 1.00 1.55 C ATOM 2300 CG2 VAL A 175 5.867 -12.911 -6.138 1.00 0.90 C ATOM 0 H VAL A 175 5.847 -14.582 -8.379 1.00 1.31 H new ATOM 0 HA VAL A 175 8.579 -14.137 -7.926 1.00 1.30 H new ATOM 0 HB VAL A 175 7.887 -12.334 -6.543 1.00 1.29 H new ATOM 0 HG11 VAL A 175 6.298 -11.143 -8.082 1.00 1.55 H new ATOM 0 HG12 VAL A 175 7.568 -12.013 -8.974 1.00 1.55 H new ATOM 0 HG13 VAL A 175 5.929 -12.698 -8.865 1.00 1.55 H new ATOM 0 HG21 VAL A 175 5.514 -11.897 -5.949 1.00 0.90 H new ATOM 0 HG22 VAL A 175 5.074 -13.488 -6.614 1.00 0.90 H new ATOM 0 HG23 VAL A 175 6.142 -13.381 -5.194 1.00 0.90 H new ATOM 2310 N VAL A 176 9.179 -14.714 -5.546 1.00 1.32 N ATOM 2311 CA VAL A 176 9.643 -15.214 -4.242 1.00 1.35 C ATOM 2312 C VAL A 176 9.084 -14.340 -3.120 1.00 1.19 C ATOM 2313 O VAL A 176 8.601 -14.848 -2.107 1.00 1.19 O ATOM 2314 CB VAL A 176 11.181 -15.264 -4.207 1.00 1.65 C ATOM 2315 CG1 VAL A 176 11.708 -15.789 -2.870 1.00 2.05 C ATOM 2316 CG2 VAL A 176 11.710 -16.175 -5.319 1.00 1.79 C ATOM 0 H VAL A 176 9.860 -14.110 -6.006 1.00 1.32 H new ATOM 0 HA VAL A 176 9.276 -16.229 -4.093 1.00 1.35 H new ATOM 0 HB VAL A 176 11.531 -14.241 -4.348 1.00 1.65 H new ATOM 0 HG11 VAL A 176 12.798 -15.807 -2.890 1.00 2.05 H new ATOM 0 HG12 VAL A 176 11.371 -15.137 -2.065 1.00 2.05 H new ATOM 0 HG13 VAL A 176 11.331 -16.798 -2.701 1.00 2.05 H new ATOM 0 HG21 VAL A 176 12.799 -16.200 -5.281 1.00 1.79 H new ATOM 0 HG22 VAL A 176 11.319 -17.183 -5.181 1.00 1.79 H new ATOM 0 HG23 VAL A 176 11.389 -15.791 -6.287 1.00 1.79 H new ATOM 2326 N ASP A 177 9.063 -13.028 -3.332 1.00 1.18 N ATOM 2327 CA ASP A 177 8.441 -12.039 -2.458 1.00 1.04 C ATOM 2328 C ASP A 177 7.580 -11.082 -3.297 1.00 0.79 C ATOM 2329 O ASP A 177 7.966 -10.706 -4.409 1.00 0.89 O ATOM 2330 CB ASP A 177 9.507 -11.253 -1.689 1.00 1.32 C ATOM 2331 CG ASP A 177 10.446 -12.093 -0.824 1.00 1.85 C ATOM 2332 OD1 ASP A 177 10.073 -12.427 0.326 1.00 2.90 O ATOM 2333 OD2 ASP A 177 11.604 -12.332 -1.249 1.00 2.77 O ATOM 0 H ASP A 177 9.498 -12.607 -4.153 1.00 1.18 H new ATOM 0 HA ASP A 177 7.809 -12.554 -1.735 1.00 1.04 H new ATOM 0 HB2 ASP A 177 10.106 -10.691 -2.405 1.00 1.32 H new ATOM 0 HB3 ASP A 177 9.007 -10.525 -1.051 1.00 1.32 H new ATOM 2338 N ALA A 178 6.420 -10.685 -2.768 1.00 0.56 N ATOM 2339 CA ALA A 178 5.503 -9.764 -3.441 1.00 0.41 C ATOM 2340 C ALA A 178 5.766 -8.304 -3.041 1.00 0.39 C ATOM 2341 O ALA A 178 6.274 -8.044 -1.944 1.00 0.42 O ATOM 2342 CB ALA A 178 4.063 -10.176 -3.124 1.00 0.37 C ATOM 0 H ALA A 178 6.089 -10.996 -1.855 1.00 0.56 H new ATOM 0 HA ALA A 178 5.669 -9.824 -4.517 1.00 0.41 H new ATOM 0 HB1 ALA A 178 3.372 -9.495 -3.621 1.00 0.37 H new ATOM 0 HB2 ALA A 178 3.889 -11.192 -3.478 1.00 0.37 H new ATOM 0 HB3 ALA A 178 3.901 -10.134 -2.047 1.00 0.37 H new ATOM 2348 N HIS A 179 5.379 -7.348 -3.893 1.00 0.37 N ATOM 2349 CA HIS A 179 5.547 -5.919 -3.613 1.00 0.36 C ATOM 2350 C HIS A 179 4.333 -5.039 -3.981 1.00 0.36 C ATOM 2351 O HIS A 179 3.430 -5.456 -4.709 1.00 0.41 O ATOM 2352 CB HIS A 179 6.841 -5.399 -4.267 1.00 0.36 C ATOM 2353 CG HIS A 179 8.101 -6.117 -3.845 1.00 0.41 C ATOM 2354 ND1 HIS A 179 9.006 -5.651 -2.929 1.00 0.47 N ATOM 2355 CD2 HIS A 179 8.572 -7.327 -4.283 1.00 0.47 C ATOM 2356 CE1 HIS A 179 9.993 -6.545 -2.807 1.00 0.54 C ATOM 2357 NE2 HIS A 179 9.778 -7.598 -3.615 1.00 0.54 N ATOM 0 H HIS A 179 4.942 -7.543 -4.794 1.00 0.37 H new ATOM 0 HA HIS A 179 5.624 -5.834 -2.529 1.00 0.36 H new ATOM 0 HB2 HIS A 179 6.741 -5.478 -5.349 1.00 0.36 H new ATOM 0 HB3 HIS A 179 6.948 -4.340 -4.033 1.00 0.36 H new ATOM 0 HD1 HIS A 179 8.938 -4.768 -2.423 1.00 0.47 H new ATOM 0 HD2 HIS A 179 8.098 -7.963 -5.016 1.00 0.47 H new ATOM 0 HE1 HIS A 179 10.844 -6.436 -2.151 1.00 0.54 H new ATOM 2365 N VAL A 180 4.320 -3.802 -3.465 1.00 0.34 N ATOM 2366 CA VAL A 180 3.296 -2.764 -3.710 1.00 0.35 C ATOM 2367 C VAL A 180 3.946 -1.407 -3.974 1.00 0.35 C ATOM 2368 O VAL A 180 4.885 -1.051 -3.260 1.00 0.36 O ATOM 2369 CB VAL A 180 2.350 -2.548 -2.508 1.00 0.41 C ATOM 2370 CG1 VAL A 180 0.950 -2.192 -2.991 1.00 0.51 C ATOM 2371 CG2 VAL A 180 2.259 -3.682 -1.491 1.00 0.49 C ATOM 0 H VAL A 180 5.055 -3.478 -2.836 1.00 0.34 H new ATOM 0 HA VAL A 180 2.732 -3.127 -4.569 1.00 0.35 H new ATOM 0 HB VAL A 180 2.814 -1.725 -1.965 1.00 0.41 H new ATOM 0 HG11 VAL A 180 0.296 -2.043 -2.132 1.00 0.51 H new ATOM 0 HG12 VAL A 180 0.990 -1.276 -3.580 1.00 0.51 H new ATOM 0 HG13 VAL A 180 0.561 -3.002 -3.607 1.00 0.51 H new ATOM 0 HG21 VAL A 180 1.563 -3.405 -0.699 1.00 0.49 H new ATOM 0 HG22 VAL A 180 1.905 -4.587 -1.985 1.00 0.49 H new ATOM 0 HG23 VAL A 180 3.244 -3.865 -1.061 1.00 0.49 H new ATOM 2381 N TYR A 181 3.392 -0.610 -4.895 1.00 0.40 N ATOM 2382 CA TYR A 181 3.938 0.704 -5.266 1.00 0.42 C ATOM 2383 C TYR A 181 2.865 1.810 -5.356 1.00 0.47 C ATOM 2384 O TYR A 181 2.500 2.230 -6.457 1.00 0.61 O ATOM 2385 CB TYR A 181 4.732 0.556 -6.564 1.00 0.44 C ATOM 2386 CG TYR A 181 5.937 -0.348 -6.406 1.00 0.48 C ATOM 2387 CD1 TYR A 181 7.134 0.179 -5.885 1.00 1.58 C ATOM 2388 CD2 TYR A 181 5.838 -1.721 -6.706 1.00 1.79 C ATOM 2389 CE1 TYR A 181 8.243 -0.662 -5.673 1.00 1.54 C ATOM 2390 CE2 TYR A 181 6.931 -2.569 -6.460 1.00 1.93 C ATOM 2391 CZ TYR A 181 8.132 -2.041 -5.941 1.00 0.78 C ATOM 2392 OH TYR A 181 9.184 -2.871 -5.747 1.00 1.00 O ATOM 0 H TYR A 181 2.546 -0.859 -5.408 1.00 0.40 H new ATOM 0 HA TYR A 181 4.603 1.037 -4.469 1.00 0.42 H new ATOM 0 HB2 TYR A 181 4.081 0.156 -7.341 1.00 0.44 H new ATOM 0 HB3 TYR A 181 5.061 1.540 -6.899 1.00 0.44 H new ATOM 0 HD1 TYR A 181 7.202 1.230 -5.648 1.00 1.58 H new ATOM 0 HD2 TYR A 181 4.925 -2.120 -7.123 1.00 1.79 H new ATOM 0 HE1 TYR A 181 9.173 -0.253 -5.307 1.00 1.54 H new ATOM 0 HE2 TYR A 181 6.852 -3.626 -6.668 1.00 1.93 H new ATOM 0 HH TYR A 181 8.898 -3.643 -5.215 1.00 1.00 H new ATOM 2402 N PRO A 182 2.310 2.269 -4.217 1.00 0.43 N ATOM 2403 CA PRO A 182 1.238 3.265 -4.172 1.00 0.46 C ATOM 2404 C PRO A 182 1.636 4.631 -4.749 1.00 0.46 C ATOM 2405 O PRO A 182 2.771 5.082 -4.577 1.00 0.51 O ATOM 2406 CB PRO A 182 0.823 3.366 -2.701 1.00 0.51 C ATOM 2407 CG PRO A 182 1.993 2.788 -1.915 1.00 0.51 C ATOM 2408 CD PRO A 182 2.613 1.785 -2.883 1.00 0.44 C ATOM 0 HA PRO A 182 0.411 2.949 -4.808 1.00 0.46 H new ATOM 0 HB2 PRO A 182 0.630 4.400 -2.416 1.00 0.51 H new ATOM 0 HB3 PRO A 182 -0.093 2.807 -2.511 1.00 0.51 H new ATOM 0 HG2 PRO A 182 2.705 3.562 -1.628 1.00 0.51 H new ATOM 0 HG3 PRO A 182 1.660 2.305 -0.996 1.00 0.51 H new ATOM 0 HD2 PRO A 182 3.690 1.712 -2.731 1.00 0.44 H new ATOM 0 HD3 PRO A 182 2.201 0.788 -2.728 1.00 0.44 H new ATOM 2416 N LYS A 183 0.667 5.283 -5.408 1.00 0.51 N ATOM 2417 CA LYS A 183 0.806 6.518 -6.197 1.00 0.56 C ATOM 2418 C LYS A 183 -0.074 7.656 -5.654 1.00 0.58 C ATOM 2419 O LYS A 183 -1.090 7.413 -4.995 1.00 0.93 O ATOM 2420 CB LYS A 183 0.442 6.217 -7.665 1.00 0.77 C ATOM 2421 CG LYS A 183 1.387 5.204 -8.338 1.00 0.83 C ATOM 2422 CD LYS A 183 0.993 4.923 -9.802 1.00 1.36 C ATOM 2423 CE LYS A 183 0.463 3.502 -10.055 1.00 1.16 C ATOM 2424 NZ LYS A 183 -0.817 3.209 -9.368 1.00 1.55 N ATOM 0 H LYS A 183 -0.294 4.942 -5.405 1.00 0.51 H new ATOM 0 HA LYS A 183 1.840 6.855 -6.125 1.00 0.56 H new ATOM 0 HB2 LYS A 183 -0.578 5.834 -7.707 1.00 0.77 H new ATOM 0 HB3 LYS A 183 0.456 7.147 -8.233 1.00 0.77 H new ATOM 0 HG2 LYS A 183 2.408 5.585 -8.305 1.00 0.83 H new ATOM 0 HG3 LYS A 183 1.377 4.271 -7.775 1.00 0.83 H new ATOM 0 HD2 LYS A 183 0.231 5.641 -10.105 1.00 1.36 H new ATOM 0 HD3 LYS A 183 1.862 5.092 -10.438 1.00 1.36 H new ATOM 0 HE2 LYS A 183 0.330 3.360 -11.127 1.00 1.16 H new ATOM 0 HE3 LYS A 183 1.213 2.781 -9.729 1.00 1.16 H new ATOM 0 HZ1 LYS A 183 -1.112 2.235 -9.584 1.00 1.55 H new ATOM 0 HZ2 LYS A 183 -0.691 3.313 -8.341 1.00 1.55 H new ATOM 0 HZ3 LYS A 183 -1.547 3.873 -9.696 1.00 1.55 H new ATOM 2438 N ASN A 184 0.290 8.902 -5.978 0.49 0.47 N ATOM 2439 CA ASN A 184 -0.482 10.100 -5.625 0.49 0.57 C ATOM 2440 C ASN A 184 -1.137 10.785 -6.835 0.49 0.67 C ATOM 2441 O ASN A 184 -0.724 10.629 -7.983 0.49 0.85 O ATOM 2442 CB ASN A 184 0.362 11.094 -4.795 0.49 0.82 C ATOM 2443 CG ASN A 184 0.569 10.669 -3.361 0.49 2.09 C ATOM 2444 OD1 ASN A 184 0.560 9.502 -3.019 0.49 3.12 O ATOM 2445 ND2 ASN A 184 0.795 11.601 -2.469 0.49 2.64 N ATOM 0 H ASN A 184 1.141 9.110 -6.500 0.49 0.47 H new ATOM 0 HA ASN A 184 -1.305 9.752 -5.000 0.49 0.57 H new ATOM 0 HB2 ASN A 184 1.335 11.217 -5.272 0.49 0.82 H new ATOM 0 HB3 ASN A 184 -0.125 12.069 -4.808 0.49 0.82 H new ATOM 0 HD21 ASN A 184 0.962 11.346 -1.496 0.49 2.64 H new ATOM 0 HD22 ASN A 184 0.804 12.582 -2.748 0.49 2.64 H new ATOM 2452 N THR A 185 -2.164 11.576 -6.534 0.49 0.80 N ATOM 2453 CA THR A 185 -2.928 12.436 -7.442 0.49 1.09 C ATOM 2454 C THR A 185 -3.371 13.701 -6.684 0.49 1.60 C ATOM 2455 O THR A 185 -2.930 13.955 -5.560 0.49 3.00 O ATOM 2456 CB THR A 185 -4.099 11.625 -8.033 0.49 0.95 C ATOM 2457 OG1 THR A 185 -4.649 12.257 -9.166 0.49 1.30 O ATOM 2458 CG2 THR A 185 -5.245 11.366 -7.057 0.49 0.92 C ATOM 0 H THR A 185 -2.512 11.639 -5.577 0.49 0.80 H new ATOM 0 HA THR A 185 -2.321 12.772 -8.283 0.49 1.09 H new ATOM 0 HB THR A 185 -3.646 10.668 -8.292 0.49 0.95 H new ATOM 0 HG1 THR A 185 -5.387 11.716 -9.516 0.49 1.30 H new ATOM 0 HG21 THR A 185 -6.024 10.790 -7.556 0.49 0.92 H new ATOM 0 HG22 THR A 185 -4.873 10.806 -6.199 0.49 0.92 H new ATOM 0 HG23 THR A 185 -5.657 12.317 -6.719 0.49 0.92 H new