USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1052 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 40 HIS : no HE2:sc= 2.09 K(o=2.3,f=-10!) USER MOD Set 1.2: A 179 HIS : no HE2:sc= 0.216 K(o=2.3,f=-6.8!) USER MOD Set 2.1: A 130 ASN :FLIP amide:sc= -0.142 F(o=-0.97!,f=-0.14) USER MOD Set 2.2: A 133 ASN : amide:sc= 0 X(o=-0.14,f=-0.2) USER MOD Set 3.1: A 88 ASN : amide:sc= 0.204 X(o=0.44,f=0.35) USER MOD Set 3.2: A 142 TYR OH : rot 180:sc= 0.232 USER MOD Set 4.1: A 85 ASN : amide:sc= 0.0555 K(o=0.046,f=-2.1!) USER MOD Set 4.2: A 86 THR OG1 : rot 180:sc=-0.00948 USER MOD Single : A 32 THR OG1 : rot -30:sc= 0.127 USER MOD Single : A 33 THR OG1 : rot 172:sc= 1.26 USER MOD Single : A 34 THR OG1 : rot -160:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.00568 USER MOD Single : A 36 SER OG : rot 8:sc= 0.389 USER MOD Single : A 38 THR OG1 : rot 70:sc= 0.29 USER MOD Single : A 41 LYS NZ :NH3+ -177:sc= 1.97 (180deg=1.85) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 172:sc= -0.478 (180deg=-0.649) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.841 K(o=0.84,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=-0.0049) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.312 X(o=-0.31,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.234 X(o=-0.23,f=-0.63) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -161:sc= 0.77 USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 94 ASN : amide:sc= 0.296 K(o=0.3,f=-1.8) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.358 X(o=-0.36,f=-0.24) USER MOD Single : A 105 GLN : amide:sc= -0.0527 X(o=-0.053,f=-0.28) USER MOD Single : A 106 THR OG1 : rot -170:sc= -0.513 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 170:sc= 0.67 USER MOD Single : A 113 MET CE :methyl 154:sc= 0 (180deg=-0.35) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl 149:sc= -0.172 (180deg=-1.97!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 178:sc= 0.425 (180deg=0.422) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.164 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc=-0.00888 USER MOD Single : A 138 LYS NZ :NH3+ 175:sc= 0.747 (180deg=0.731) USER MOD Single : A 139 TYR OH : rot 4:sc= 0.748 USER MOD Single : A 140 LYS NZ :NH3+ 174:sc= -1.33 (180deg=-1.46) 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=-0.000538 USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 ASN : amide:sc= -0.0279 K(o=-0.028,f=-4.6!) USER MOD Single : A 181 TYR OH : rot 120:sc= 0.31 USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 184 ASN : amide:sc= -0.932 K(o=-0.93,f=-4.6!) USER MOD Single : A 185 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 167 N THR A 32 -1.383 -19.854 -1.361 1.00 1.18 N ATOM 168 CA THR A 32 -0.686 -18.760 -2.058 1.00 1.00 C ATOM 169 C THR A 32 0.722 -19.179 -2.497 1.00 0.96 C ATOM 170 O THR A 32 1.270 -20.160 -1.986 1.00 1.01 O ATOM 171 CB THR A 32 -0.542 -17.528 -1.153 1.00 0.91 C ATOM 172 OG1 THR A 32 0.032 -17.861 0.090 1.00 1.03 O ATOM 173 CG2 THR A 32 -1.853 -16.794 -0.900 1.00 0.99 C ATOM 0 HA THR A 32 -1.292 -18.519 -2.931 1.00 1.00 H new ATOM 0 HB THR A 32 0.116 -16.857 -1.705 1.00 0.91 H new ATOM 0 HG1 THR A 32 -0.206 -18.782 0.324 1.00 1.03 H new ATOM 0 HG21 THR A 32 -1.671 -15.936 -0.253 1.00 0.99 H new ATOM 0 HG22 THR A 32 -2.267 -16.452 -1.848 1.00 0.99 H new ATOM 0 HG23 THR A 32 -2.560 -17.468 -0.417 1.00 0.99 H new ATOM 181 N THR A 33 1.350 -18.424 -3.408 1.00 1.00 N ATOM 182 CA THR A 33 2.722 -18.708 -3.882 1.00 1.08 C ATOM 183 C THR A 33 3.807 -18.044 -3.031 1.00 1.02 C ATOM 184 O THR A 33 4.967 -18.460 -3.090 1.00 1.21 O ATOM 185 CB THR A 33 2.910 -18.320 -5.356 1.00 1.28 C ATOM 186 OG1 THR A 33 2.518 -16.989 -5.594 1.00 1.80 O ATOM 187 CG2 THR A 33 2.105 -19.216 -6.294 1.00 1.51 C ATOM 0 H THR A 33 0.928 -17.601 -3.839 1.00 1.00 H new ATOM 0 HA THR A 33 2.840 -19.787 -3.780 1.00 1.08 H new ATOM 0 HB THR A 33 3.974 -18.441 -5.558 1.00 1.28 H new ATOM 0 HG1 THR A 33 2.769 -16.732 -6.506 1.00 1.80 H new ATOM 0 HG21 THR A 33 2.269 -18.904 -7.325 1.00 1.51 H new ATOM 0 HG22 THR A 33 2.425 -20.251 -6.173 1.00 1.51 H new ATOM 0 HG23 THR A 33 1.045 -19.134 -6.055 1.00 1.51 H new ATOM 195 N THR A 34 3.441 -17.043 -2.222 1.00 0.93 N ATOM 196 CA THR A 34 4.345 -16.238 -1.395 1.00 0.95 C ATOM 197 C THR A 34 3.650 -15.839 -0.087 1.00 0.76 C ATOM 198 O THR A 34 2.555 -15.278 -0.118 1.00 0.95 O ATOM 199 CB THR A 34 4.753 -14.981 -2.176 1.00 1.32 C ATOM 200 OG1 THR A 34 5.381 -15.326 -3.390 1.00 2.80 O ATOM 201 CG2 THR A 34 5.756 -14.137 -1.414 1.00 0.93 C ATOM 0 H THR A 34 2.466 -16.761 -2.122 1.00 0.93 H new ATOM 0 HA THR A 34 5.232 -16.823 -1.152 1.00 0.95 H new ATOM 0 HB THR A 34 3.830 -14.425 -2.341 1.00 1.32 H new ATOM 0 HG1 THR A 34 5.905 -14.565 -3.715 1.00 2.80 H new ATOM 0 HG21 THR A 34 6.016 -13.259 -2.005 1.00 0.93 H new ATOM 0 HG22 THR A 34 5.320 -13.821 -0.466 1.00 0.93 H new ATOM 0 HG23 THR A 34 6.654 -14.724 -1.222 1.00 0.93 H new ATOM 209 N THR A 35 4.281 -16.083 1.067 1.00 0.73 N ATOM 210 CA THR A 35 3.667 -15.882 2.402 1.00 0.68 C ATOM 211 C THR A 35 3.822 -14.479 3.014 1.00 0.54 C ATOM 212 O THR A 35 3.449 -14.259 4.169 1.00 0.53 O ATOM 213 CB THR A 35 4.099 -16.985 3.390 1.00 0.94 C ATOM 214 OG1 THR A 35 5.467 -17.326 3.257 1.00 1.26 O ATOM 215 CG2 THR A 35 3.295 -18.262 3.142 1.00 1.22 C ATOM 0 H THR A 35 5.240 -16.428 1.111 1.00 0.73 H new ATOM 0 HA THR A 35 2.596 -15.965 2.216 1.00 0.68 H new ATOM 0 HB THR A 35 3.921 -16.584 4.388 1.00 0.94 H new ATOM 0 HG1 THR A 35 5.694 -18.026 3.904 1.00 1.26 H new ATOM 0 HG21 THR A 35 3.610 -19.033 3.846 1.00 1.22 H new ATOM 0 HG22 THR A 35 2.234 -18.056 3.280 1.00 1.22 H new ATOM 0 HG23 THR A 35 3.468 -18.609 2.123 1.00 1.22 H new ATOM 223 N SER A 36 4.342 -13.500 2.272 1.00 0.55 N ATOM 224 CA SER A 36 4.384 -12.078 2.644 1.00 0.52 C ATOM 225 C SER A 36 4.349 -11.164 1.410 1.00 0.51 C ATOM 226 O SER A 36 4.528 -11.613 0.279 1.00 0.70 O ATOM 227 CB SER A 36 5.628 -11.779 3.487 1.00 0.60 C ATOM 228 OG SER A 36 5.538 -12.435 4.737 1.00 1.77 O ATOM 0 H SER A 36 4.762 -13.679 1.360 1.00 0.55 H new ATOM 0 HA SER A 36 3.493 -11.871 3.237 1.00 0.52 H new ATOM 0 HB2 SER A 36 6.523 -12.108 2.958 1.00 0.60 H new ATOM 0 HB3 SER A 36 5.725 -10.704 3.638 1.00 0.60 H new ATOM 0 HG SER A 36 4.764 -13.036 4.736 1.00 1.77 H new ATOM 234 N VAL A 37 4.088 -9.875 1.634 1.00 0.40 N ATOM 235 CA VAL A 37 3.990 -8.816 0.615 1.00 0.44 C ATOM 236 C VAL A 37 4.690 -7.538 1.085 1.00 0.47 C ATOM 237 O VAL A 37 4.668 -7.208 2.271 1.00 0.42 O ATOM 238 CB VAL A 37 2.524 -8.578 0.208 1.00 0.46 C ATOM 239 CG1 VAL A 37 1.678 -8.116 1.384 1.00 0.45 C ATOM 240 CG2 VAL A 37 2.363 -7.584 -0.948 1.00 0.52 C ATOM 0 H VAL A 37 3.931 -9.518 2.577 1.00 0.40 H new ATOM 0 HA VAL A 37 4.513 -9.146 -0.282 1.00 0.44 H new ATOM 0 HB VAL A 37 2.170 -9.549 -0.137 1.00 0.46 H new ATOM 0 HG11 VAL A 37 0.651 -7.960 1.054 1.00 0.45 H new ATOM 0 HG12 VAL A 37 1.696 -8.875 2.166 1.00 0.45 H new ATOM 0 HG13 VAL A 37 2.079 -7.182 1.776 1.00 0.45 H new ATOM 0 HG21 VAL A 37 1.305 -7.465 -1.181 1.00 0.52 H new ATOM 0 HG22 VAL A 37 2.782 -6.620 -0.660 1.00 0.52 H new ATOM 0 HG23 VAL A 37 2.888 -7.959 -1.826 1.00 0.52 H new ATOM 250 N THR A 38 5.315 -6.819 0.151 1.00 0.59 N ATOM 251 CA THR A 38 6.209 -5.682 0.421 1.00 0.58 C ATOM 252 C THR A 38 5.674 -4.403 -0.237 1.00 0.48 C ATOM 253 O THR A 38 5.630 -4.301 -1.458 1.00 0.49 O ATOM 254 CB THR A 38 7.648 -5.983 -0.053 1.00 0.89 C ATOM 255 OG1 THR A 38 7.967 -7.366 -0.011 1.00 1.46 O ATOM 256 CG2 THR A 38 8.663 -5.260 0.831 1.00 1.01 C ATOM 0 H THR A 38 5.213 -7.014 -0.845 1.00 0.59 H new ATOM 0 HA THR A 38 6.238 -5.525 1.499 1.00 0.58 H new ATOM 0 HB THR A 38 7.696 -5.638 -1.086 1.00 0.89 H new ATOM 0 HG1 THR A 38 7.468 -7.838 -0.710 1.00 1.46 H new ATOM 0 HG21 THR A 38 9.672 -5.483 0.484 1.00 1.01 H new ATOM 0 HG22 THR A 38 8.490 -4.185 0.779 1.00 1.01 H new ATOM 0 HG23 THR A 38 8.552 -5.596 1.862 1.00 1.01 H new ATOM 264 N VAL A 39 5.218 -3.420 0.538 1.00 0.46 N ATOM 265 CA VAL A 39 4.623 -2.167 0.018 1.00 0.46 C ATOM 266 C VAL A 39 5.657 -1.032 0.024 1.00 0.50 C ATOM 267 O VAL A 39 6.369 -0.832 1.010 1.00 0.54 O ATOM 268 CB VAL A 39 3.310 -1.831 0.752 1.00 0.45 C ATOM 269 CG1 VAL A 39 3.432 -1.845 2.269 1.00 0.50 C ATOM 270 CG2 VAL A 39 2.722 -0.482 0.329 1.00 0.48 C ATOM 0 H VAL A 39 5.247 -3.461 1.557 1.00 0.46 H new ATOM 0 HA VAL A 39 4.343 -2.307 -1.026 1.00 0.46 H new ATOM 0 HB VAL A 39 2.637 -2.634 0.452 1.00 0.45 H new ATOM 0 HG11 VAL A 39 2.468 -1.599 2.714 1.00 0.50 H new ATOM 0 HG12 VAL A 39 3.742 -2.836 2.600 1.00 0.50 H new ATOM 0 HG13 VAL A 39 4.174 -1.110 2.581 1.00 0.50 H new ATOM 0 HG21 VAL A 39 1.799 -0.299 0.879 1.00 0.48 H new ATOM 0 HG22 VAL A 39 3.437 0.311 0.547 1.00 0.48 H new ATOM 0 HG23 VAL A 39 2.511 -0.496 -0.740 1.00 0.48 H new ATOM 280 N HIS A 40 5.736 -0.292 -1.085 1.00 0.49 N ATOM 281 CA HIS A 40 6.769 0.720 -1.365 1.00 0.55 C ATOM 282 C HIS A 40 6.156 2.018 -1.936 1.00 0.82 C ATOM 283 O HIS A 40 5.766 2.074 -3.100 1.00 1.81 O ATOM 284 CB HIS A 40 7.767 0.132 -2.378 1.00 0.58 C ATOM 285 CG HIS A 40 8.341 -1.225 -2.051 1.00 0.58 C ATOM 286 ND1 HIS A 40 9.500 -1.481 -1.362 1.00 0.71 N ATOM 287 CD2 HIS A 40 7.870 -2.430 -2.499 1.00 0.57 C ATOM 288 CE1 HIS A 40 9.733 -2.800 -1.399 1.00 0.76 C ATOM 289 NE2 HIS A 40 8.758 -3.429 -2.075 1.00 0.67 N ATOM 0 H HIS A 40 5.059 -0.381 -1.843 1.00 0.49 H new ATOM 0 HA HIS A 40 7.270 0.975 -0.431 1.00 0.55 H new ATOM 0 HB2 HIS A 40 7.271 0.068 -3.347 1.00 0.58 H new ATOM 0 HB3 HIS A 40 8.594 0.834 -2.489 1.00 0.58 H new ATOM 0 HD1 HIS A 40 10.085 -0.785 -0.900 1.00 0.71 H new ATOM 0 HD2 HIS A 40 6.971 -2.584 -3.078 1.00 0.57 H new ATOM 0 HE1 HIS A 40 10.585 -3.288 -0.949 1.00 0.76 H new ATOM 297 N LYS A 41 6.054 3.095 -1.145 1.00 0.52 N ATOM 298 CA LYS A 41 5.352 4.331 -1.555 1.00 0.53 C ATOM 299 C LYS A 41 6.231 5.213 -2.452 1.00 0.48 C ATOM 300 O LYS A 41 7.340 5.573 -2.049 1.00 0.56 O ATOM 301 CB LYS A 41 4.841 5.072 -0.302 1.00 0.66 C ATOM 302 CG LYS A 41 3.585 5.928 -0.568 1.00 1.06 C ATOM 303 CD LYS A 41 3.854 7.337 -1.127 1.00 0.75 C ATOM 304 CE LYS A 41 2.865 7.724 -2.240 1.00 1.04 C ATOM 305 NZ LYS A 41 1.507 8.023 -1.731 1.00 1.17 N ATOM 0 H LYS A 41 6.452 3.140 -0.207 1.00 0.52 H new ATOM 0 HA LYS A 41 4.488 4.066 -2.164 1.00 0.53 H new ATOM 0 HB2 LYS A 41 4.617 4.343 0.476 1.00 0.66 H new ATOM 0 HB3 LYS A 41 5.635 5.713 0.081 1.00 0.66 H new ATOM 0 HG2 LYS A 41 2.943 5.394 -1.269 1.00 1.06 H new ATOM 0 HG3 LYS A 41 3.028 6.025 0.364 1.00 1.06 H new ATOM 0 HD2 LYS A 41 3.789 8.065 -0.318 1.00 0.75 H new ATOM 0 HD3 LYS A 41 4.871 7.383 -1.516 1.00 0.75 H new ATOM 0 HE2 LYS A 41 3.248 8.596 -2.771 1.00 1.04 H new ATOM 0 HE3 LYS A 41 2.805 6.911 -2.963 1.00 1.04 H new ATOM 0 HZ1 LYS A 41 0.874 8.227 -2.530 1.00 1.17 H new ATOM 0 HZ2 LYS A 41 1.145 7.203 -1.204 1.00 1.17 H new ATOM 0 HZ3 LYS A 41 1.547 8.849 -1.101 1.00 1.17 H new ATOM 319 N LEU A 42 5.728 5.584 -3.633 1.00 0.41 N ATOM 320 CA LEU A 42 6.445 6.381 -4.641 1.00 0.39 C ATOM 321 C LEU A 42 5.832 7.774 -4.838 1.00 0.39 C ATOM 322 O LEU A 42 4.641 7.979 -4.605 1.00 0.43 O ATOM 323 CB LEU A 42 6.480 5.635 -5.990 1.00 0.39 C ATOM 324 CG LEU A 42 7.037 4.204 -5.973 1.00 0.40 C ATOM 325 CD1 LEU A 42 7.251 3.741 -7.416 1.00 0.46 C ATOM 326 CD2 LEU A 42 8.379 4.067 -5.262 1.00 0.49 C ATOM 0 H LEU A 42 4.784 5.332 -3.926 1.00 0.41 H new ATOM 0 HA LEU A 42 7.460 6.519 -4.267 1.00 0.39 H new ATOM 0 HB2 LEU A 42 5.465 5.600 -6.386 1.00 0.39 H new ATOM 0 HB3 LEU A 42 7.075 6.223 -6.689 1.00 0.39 H new ATOM 0 HG LEU A 42 6.306 3.604 -5.431 1.00 0.40 H new ATOM 0 HD11 LEU A 42 7.647 2.725 -7.417 1.00 0.46 H new ATOM 0 HD12 LEU A 42 6.301 3.761 -7.949 1.00 0.46 H new ATOM 0 HD13 LEU A 42 7.958 4.407 -7.911 1.00 0.46 H new ATOM 0 HD21 LEU A 42 8.703 3.027 -5.294 1.00 0.49 H new ATOM 0 HD22 LEU A 42 9.120 4.693 -5.759 1.00 0.49 H new ATOM 0 HD23 LEU A 42 8.275 4.383 -4.224 1.00 0.49 H new ATOM 338 N LEU A 43 6.644 8.719 -5.317 1.00 0.42 N ATOM 339 CA LEU A 43 6.241 10.087 -5.657 1.00 0.46 C ATOM 340 C LEU A 43 6.891 10.544 -6.979 1.00 0.44 C ATOM 341 O LEU A 43 7.821 9.914 -7.487 1.00 0.43 O ATOM 342 CB LEU A 43 6.598 11.031 -4.481 1.00 0.60 C ATOM 343 CG LEU A 43 5.447 11.865 -3.889 1.00 0.79 C ATOM 344 CD1 LEU A 43 4.750 12.769 -4.908 1.00 1.92 C ATOM 345 CD2 LEU A 43 4.403 10.972 -3.227 1.00 0.90 C ATOM 0 H LEU A 43 7.635 8.547 -5.485 1.00 0.42 H new ATOM 0 HA LEU A 43 5.163 10.119 -5.813 1.00 0.46 H new ATOM 0 HB2 LEU A 43 7.029 10.429 -3.681 1.00 0.60 H new ATOM 0 HB3 LEU A 43 7.376 11.716 -4.819 1.00 0.60 H new ATOM 0 HG LEU A 43 5.919 12.510 -3.148 1.00 0.79 H new ATOM 0 HD11 LEU A 43 3.951 13.324 -4.416 1.00 1.92 H new ATOM 0 HD12 LEU A 43 5.473 13.469 -5.328 1.00 1.92 H new ATOM 0 HD13 LEU A 43 4.329 12.159 -5.707 1.00 1.92 H new ATOM 0 HD21 LEU A 43 3.603 11.589 -2.818 1.00 0.90 H new ATOM 0 HD22 LEU A 43 3.990 10.285 -3.966 1.00 0.90 H new ATOM 0 HD23 LEU A 43 4.869 10.402 -2.423 1.00 0.90 H new ATOM 357 N ALA A 44 6.409 11.662 -7.519 1.00 0.50 N ATOM 358 CA ALA A 44 6.966 12.340 -8.691 1.00 0.50 C ATOM 359 C ALA A 44 7.726 13.630 -8.313 1.00 0.57 C ATOM 360 O ALA A 44 7.639 14.094 -7.169 1.00 0.69 O ATOM 361 CB ALA A 44 5.820 12.602 -9.671 1.00 0.53 C ATOM 0 H ALA A 44 5.591 12.139 -7.140 1.00 0.50 H new ATOM 0 HA ALA A 44 7.713 11.703 -9.166 1.00 0.50 H new ATOM 0 HB1 ALA A 44 6.206 13.108 -10.556 1.00 0.53 H new ATOM 0 HB2 ALA A 44 5.367 11.654 -9.963 1.00 0.53 H new ATOM 0 HB3 ALA A 44 5.069 13.231 -9.193 1.00 0.53 H new ATOM 367 N THR A 45 8.468 14.210 -9.264 1.00 0.67 N ATOM 368 CA THR A 45 9.218 15.469 -9.067 1.00 0.76 C ATOM 369 C THR A 45 8.474 16.713 -9.571 1.00 0.83 C ATOM 370 O THR A 45 8.669 17.805 -9.028 1.00 0.95 O ATOM 371 CB THR A 45 10.623 15.402 -9.690 1.00 0.83 C ATOM 372 OG1 THR A 45 10.547 15.252 -11.088 1.00 0.93 O ATOM 373 CG2 THR A 45 11.466 14.237 -9.163 1.00 0.86 C ATOM 0 H THR A 45 8.569 13.820 -10.201 1.00 0.67 H new ATOM 0 HA THR A 45 9.316 15.574 -7.987 1.00 0.76 H new ATOM 0 HB THR A 45 11.099 16.342 -9.412 1.00 0.83 H new ATOM 0 HG1 THR A 45 11.452 15.213 -11.463 1.00 0.93 H new ATOM 0 HG21 THR A 45 12.444 14.249 -9.644 1.00 0.86 H new ATOM 0 HG22 THR A 45 11.590 14.336 -8.085 1.00 0.86 H new ATOM 0 HG23 THR A 45 10.964 13.295 -9.385 1.00 0.86 H new ATOM 381 N ASP A 46 7.597 16.582 -10.572 1.00 0.83 N ATOM 382 CA ASP A 46 6.710 17.656 -11.048 1.00 0.97 C ATOM 383 C ASP A 46 5.332 17.132 -11.517 1.00 0.95 C ATOM 384 O ASP A 46 4.762 17.632 -12.491 1.00 1.21 O ATOM 385 CB ASP A 46 7.438 18.494 -12.112 1.00 1.12 C ATOM 386 CG ASP A 46 6.749 19.833 -12.388 1.00 1.40 C ATOM 387 OD1 ASP A 46 6.641 20.669 -11.459 1.00 2.47 O ATOM 388 OD2 ASP A 46 6.349 20.077 -13.552 1.00 1.86 O ATOM 0 H ASP A 46 7.479 15.709 -11.087 1.00 0.83 H new ATOM 0 HA ASP A 46 6.478 18.311 -10.208 1.00 0.97 H new ATOM 0 HB2 ASP A 46 8.461 18.678 -11.785 1.00 1.12 H new ATOM 0 HB3 ASP A 46 7.497 17.924 -13.039 1.00 1.12 H new ATOM 393 N GLY A 47 4.782 16.126 -10.824 1.00 0.86 N ATOM 394 CA GLY A 47 3.455 15.543 -11.094 1.00 0.89 C ATOM 395 C GLY A 47 3.438 14.375 -12.089 1.00 0.79 C ATOM 396 O GLY A 47 2.383 13.976 -12.573 1.00 0.94 O ATOM 0 H GLY A 47 5.258 15.681 -10.039 1.00 0.86 H new ATOM 0 HA2 GLY A 47 3.029 15.201 -10.151 1.00 0.89 H new ATOM 0 HA3 GLY A 47 2.802 16.329 -11.472 1.00 0.89 H new ATOM 400 N ASP A 48 4.599 13.798 -12.394 1.00 0.65 N ATOM 401 CA ASP A 48 4.860 12.743 -13.392 1.00 0.64 C ATOM 402 C ASP A 48 4.234 11.357 -13.108 1.00 0.64 C ATOM 403 O ASP A 48 4.626 10.362 -13.719 1.00 0.65 O ATOM 404 CB ASP A 48 6.383 12.582 -13.537 1.00 0.64 C ATOM 405 CG ASP A 48 7.099 13.926 -13.632 1.00 0.76 C ATOM 406 OD1 ASP A 48 7.375 14.532 -12.572 1.00 1.97 O ATOM 407 OD2 ASP A 48 7.402 14.379 -14.758 1.00 1.74 O ATOM 0 H ASP A 48 5.456 14.073 -11.915 1.00 0.65 H new ATOM 0 HA ASP A 48 4.373 13.084 -14.306 1.00 0.64 H new ATOM 0 HB2 ASP A 48 6.771 12.026 -12.684 1.00 0.64 H new ATOM 0 HB3 ASP A 48 6.601 11.993 -14.428 1.00 0.64 H new ATOM 412 N MET A 49 3.282 11.243 -12.178 1.00 0.67 N ATOM 413 CA MET A 49 2.755 9.947 -11.731 1.00 0.71 C ATOM 414 C MET A 49 2.044 9.146 -12.838 1.00 0.78 C ATOM 415 O MET A 49 1.901 7.932 -12.699 1.00 0.78 O ATOM 416 CB MET A 49 1.789 10.138 -10.553 1.00 0.73 C ATOM 417 CG MET A 49 2.365 10.755 -9.274 1.00 0.65 C ATOM 418 SD MET A 49 2.999 9.616 -7.998 1.00 0.60 S ATOM 419 CE MET A 49 4.333 8.746 -8.855 1.00 0.59 C ATOM 0 H MET A 49 2.854 12.044 -11.713 1.00 0.67 H new ATOM 0 HA MET A 49 3.626 9.367 -11.426 1.00 0.71 H new ATOM 0 HB2 MET A 49 0.964 10.765 -10.890 1.00 0.73 H new ATOM 0 HB3 MET A 49 1.367 9.165 -10.300 1.00 0.73 H new ATOM 0 HG2 MET A 49 3.176 11.424 -9.560 1.00 0.65 H new ATOM 0 HG3 MET A 49 1.589 11.371 -8.819 1.00 0.65 H new ATOM 0 HE1 MET A 49 4.884 8.132 -8.142 1.00 0.59 H new ATOM 0 HE2 MET A 49 3.911 8.109 -9.633 1.00 0.59 H new ATOM 0 HE3 MET A 49 5.009 9.472 -9.307 1.00 0.59 H new ATOM 429 N ASP A 50 1.596 9.782 -13.924 1.00 0.86 N ATOM 430 CA ASP A 50 0.888 9.137 -15.036 1.00 0.94 C ATOM 431 C ASP A 50 1.846 8.524 -16.076 1.00 0.84 C ATOM 432 O ASP A 50 1.616 7.401 -16.535 1.00 0.91 O ATOM 433 CB ASP A 50 -0.085 10.126 -15.691 1.00 1.03 C ATOM 434 CG ASP A 50 -1.019 10.826 -14.704 1.00 1.26 C ATOM 435 OD1 ASP A 50 -2.100 10.281 -14.380 1.00 2.46 O ATOM 436 OD2 ASP A 50 -0.678 11.941 -14.240 1.00 1.77 O ATOM 0 H ASP A 50 1.718 10.786 -14.059 1.00 0.86 H new ATOM 0 HA ASP A 50 0.319 8.306 -14.619 1.00 0.94 H new ATOM 0 HB2 ASP A 50 0.488 10.880 -16.230 1.00 1.03 H new ATOM 0 HB3 ASP A 50 -0.686 9.594 -16.429 1.00 1.03 H new ATOM 441 N LYS A 51 2.973 9.183 -16.396 1.00 0.74 N ATOM 442 CA LYS A 51 4.037 8.568 -17.198 1.00 0.74 C ATOM 443 C LYS A 51 4.711 7.456 -16.405 1.00 0.72 C ATOM 444 O LYS A 51 4.902 6.380 -16.953 1.00 0.78 O ATOM 445 CB LYS A 51 5.006 9.612 -17.768 1.00 0.74 C ATOM 446 CG LYS A 51 5.628 10.540 -16.718 1.00 0.66 C ATOM 447 CD LYS A 51 6.461 11.658 -17.355 1.00 0.85 C ATOM 448 CE LYS A 51 7.797 11.076 -17.806 1.00 2.28 C ATOM 449 NZ LYS A 51 8.646 12.086 -18.472 1.00 2.62 N ATOM 0 H LYS A 51 3.168 10.142 -16.110 1.00 0.74 H new ATOM 0 HA LYS A 51 3.595 8.101 -18.078 1.00 0.74 H new ATOM 0 HB2 LYS A 51 5.806 9.096 -18.298 1.00 0.74 H new ATOM 0 HB3 LYS A 51 4.476 10.218 -18.503 1.00 0.74 H new ATOM 0 HG2 LYS A 51 4.837 10.980 -16.110 1.00 0.66 H new ATOM 0 HG3 LYS A 51 6.259 9.956 -16.047 1.00 0.66 H new ATOM 0 HD2 LYS A 51 5.930 12.088 -18.204 1.00 0.85 H new ATOM 0 HD3 LYS A 51 6.622 12.464 -16.639 1.00 0.85 H new ATOM 0 HE2 LYS A 51 8.325 10.671 -16.943 1.00 2.28 H new ATOM 0 HE3 LYS A 51 7.618 10.246 -18.489 1.00 2.28 H new ATOM 0 HZ1 LYS A 51 9.544 11.648 -18.762 1.00 2.62 H new ATOM 0 HZ2 LYS A 51 8.154 12.455 -19.311 1.00 2.62 H new ATOM 0 HZ3 LYS A 51 8.839 12.867 -17.813 1.00 2.62 H new ATOM 463 N ILE A 52 4.952 7.644 -15.100 1.00 0.65 N ATOM 464 CA ILE A 52 5.365 6.568 -14.188 1.00 0.64 C ATOM 465 C ILE A 52 4.359 5.404 -14.242 1.00 0.70 C ATOM 466 O ILE A 52 4.778 4.272 -14.440 1.00 0.72 O ATOM 467 CB ILE A 52 5.567 7.109 -12.754 1.00 0.61 C ATOM 468 CG1 ILE A 52 6.721 8.143 -12.755 1.00 0.56 C ATOM 469 CG2 ILE A 52 5.877 5.965 -11.767 1.00 0.65 C ATOM 470 CD1 ILE A 52 6.886 8.944 -11.470 1.00 0.52 C ATOM 0 H ILE A 52 4.865 8.553 -14.645 1.00 0.65 H new ATOM 0 HA ILE A 52 6.329 6.177 -14.514 1.00 0.64 H new ATOM 0 HB ILE A 52 4.645 7.589 -12.428 1.00 0.61 H new ATOM 0 HG12 ILE A 52 7.655 7.619 -12.958 1.00 0.56 H new ATOM 0 HG13 ILE A 52 6.561 8.839 -13.578 1.00 0.56 H new ATOM 0 HG21 ILE A 52 6.014 6.375 -10.766 1.00 0.65 H new ATOM 0 HG22 ILE A 52 5.048 5.257 -11.759 1.00 0.65 H new ATOM 0 HG23 ILE A 52 6.788 5.453 -12.078 1.00 0.65 H new ATOM 0 HD11 ILE A 52 7.720 9.637 -11.578 1.00 0.52 H new ATOM 0 HD12 ILE A 52 5.972 9.504 -11.271 1.00 0.52 H new ATOM 0 HD13 ILE A 52 7.083 8.265 -10.641 1.00 0.52 H new ATOM 482 N ALA A 53 3.044 5.643 -14.181 1.00 0.75 N ATOM 483 CA ALA A 53 2.048 4.570 -14.302 1.00 0.86 C ATOM 484 C ALA A 53 2.112 3.812 -15.651 1.00 0.93 C ATOM 485 O ALA A 53 1.853 2.605 -15.691 1.00 0.97 O ATOM 486 CB ALA A 53 0.659 5.162 -14.040 1.00 0.94 C ATOM 0 H ALA A 53 2.643 6.572 -14.048 1.00 0.75 H new ATOM 0 HA ALA A 53 2.275 3.810 -13.554 1.00 0.86 H new ATOM 0 HB1 ALA A 53 -0.093 4.378 -14.126 1.00 0.94 H new ATOM 0 HB2 ALA A 53 0.628 5.586 -13.036 1.00 0.94 H new ATOM 0 HB3 ALA A 53 0.453 5.944 -14.771 1.00 0.94 H new ATOM 492 N ASN A 54 2.540 4.478 -16.732 1.00 0.98 N ATOM 493 CA ASN A 54 2.841 3.845 -18.023 1.00 1.10 C ATOM 494 C ASN A 54 4.199 3.114 -18.045 1.00 1.09 C ATOM 495 O ASN A 54 4.355 2.117 -18.753 1.00 1.26 O ATOM 496 CB ASN A 54 2.746 4.882 -19.148 1.00 1.14 C ATOM 497 CG ASN A 54 1.311 5.143 -19.562 1.00 1.25 C ATOM 498 OD1 ASN A 54 0.823 4.592 -20.543 1.00 1.41 O ATOM 499 ND2 ASN A 54 0.584 5.963 -18.844 1.00 1.21 N ATOM 0 H ASN A 54 2.689 5.487 -16.734 1.00 0.98 H new ATOM 0 HA ASN A 54 2.091 3.071 -18.183 1.00 1.10 H new ATOM 0 HB2 ASN A 54 3.204 5.815 -18.820 1.00 1.14 H new ATOM 0 HB3 ASN A 54 3.314 4.534 -20.011 1.00 1.14 H new ATOM 0 HD21 ASN A 54 -0.387 6.142 -19.101 1.00 1.21 H new ATOM 0 HD22 ASN A 54 0.989 6.422 -18.028 1.00 1.21 H new ATOM 506 N GLU A 55 5.183 3.568 -17.266 1.00 0.96 N ATOM 507 CA GLU A 55 6.416 2.816 -17.007 1.00 0.96 C ATOM 508 C GLU A 55 6.115 1.513 -16.237 1.00 0.90 C ATOM 509 O GLU A 55 6.851 0.537 -16.383 1.00 0.98 O ATOM 510 CB GLU A 55 7.443 3.649 -16.225 1.00 0.92 C ATOM 511 CG GLU A 55 7.986 4.905 -16.922 1.00 1.06 C ATOM 512 CD GLU A 55 8.513 4.657 -18.339 1.00 1.24 C ATOM 513 OE1 GLU A 55 9.471 3.861 -18.515 1.00 2.47 O ATOM 514 OE2 GLU A 55 8.017 5.305 -19.291 1.00 1.66 O ATOM 0 H GLU A 55 5.148 4.472 -16.794 1.00 0.96 H new ATOM 0 HA GLU A 55 6.845 2.570 -17.979 1.00 0.96 H new ATOM 0 HB2 GLU A 55 6.988 3.953 -15.282 1.00 0.92 H new ATOM 0 HB3 GLU A 55 8.287 3.005 -15.979 1.00 0.92 H new ATOM 0 HG2 GLU A 55 7.195 5.653 -16.966 1.00 1.06 H new ATOM 0 HG3 GLU A 55 8.789 5.325 -16.316 1.00 1.06 H new ATOM 521 N LEU A 56 5.042 1.467 -15.432 1.00 0.84 N ATOM 522 CA LEU A 56 4.643 0.274 -14.678 1.00 0.87 C ATOM 523 C LEU A 56 3.722 -0.686 -15.447 1.00 1.10 C ATOM 524 O LEU A 56 3.896 -1.900 -15.337 1.00 1.18 O ATOM 525 CB LEU A 56 4.023 0.668 -13.329 1.00 0.85 C ATOM 526 CG LEU A 56 4.864 1.609 -12.443 1.00 0.72 C ATOM 527 CD1 LEU A 56 4.331 1.546 -11.028 1.00 0.90 C ATOM 528 CD2 LEU A 56 6.367 1.320 -12.383 1.00 0.59 C ATOM 0 H LEU A 56 4.423 2.265 -15.287 1.00 0.84 H new ATOM 0 HA LEU A 56 5.562 -0.286 -14.507 1.00 0.87 H new ATOM 0 HB2 LEU A 56 3.062 1.145 -13.520 1.00 0.85 H new ATOM 0 HB3 LEU A 56 3.820 -0.243 -12.766 1.00 0.85 H new ATOM 0 HG LEU A 56 4.766 2.589 -12.909 1.00 0.72 H new ATOM 0 HD11 LEU A 56 4.916 2.207 -10.389 1.00 0.90 H new ATOM 0 HD12 LEU A 56 3.288 1.862 -11.018 1.00 0.90 H new ATOM 0 HD13 LEU A 56 4.404 0.524 -10.657 1.00 0.90 H new ATOM 0 HD21 LEU A 56 6.851 2.046 -11.730 1.00 0.59 H new ATOM 0 HD22 LEU A 56 6.529 0.316 -11.992 1.00 0.59 H new ATOM 0 HD23 LEU A 56 6.792 1.392 -13.384 1.00 0.59 H new ATOM 540 N GLU A 57 2.765 -0.186 -16.239 1.00 1.23 N ATOM 541 CA GLU A 57 1.795 -1.048 -16.959 1.00 1.45 C ATOM 542 C GLU A 57 2.446 -2.002 -17.975 1.00 1.52 C ATOM 543 O GLU A 57 1.902 -3.072 -18.268 1.00 1.64 O ATOM 544 CB GLU A 57 0.678 -0.217 -17.619 1.00 1.74 C ATOM 545 CG GLU A 57 1.089 0.484 -18.923 1.00 1.92 C ATOM 546 CD GLU A 57 -0.030 1.365 -19.489 1.00 2.12 C ATOM 547 OE1 GLU A 57 -0.614 2.208 -18.769 1.00 2.51 O ATOM 548 OE2 GLU A 57 -0.395 1.221 -20.679 1.00 3.12 O ATOM 0 H GLU A 57 2.635 0.812 -16.403 1.00 1.23 H new ATOM 0 HA GLU A 57 1.349 -1.682 -16.193 1.00 1.45 H new ATOM 0 HB2 GLU A 57 -0.170 -0.870 -17.825 1.00 1.74 H new ATOM 0 HB3 GLU A 57 0.335 0.536 -16.909 1.00 1.74 H new ATOM 0 HG2 GLU A 57 1.973 1.096 -18.741 1.00 1.92 H new ATOM 0 HG3 GLU A 57 1.367 -0.266 -19.664 1.00 1.92 H new ATOM 555 N THR A 58 3.622 -1.635 -18.491 1.00 1.49 N ATOM 556 CA THR A 58 4.416 -2.486 -19.387 1.00 1.59 C ATOM 557 C THR A 58 5.118 -3.642 -18.652 1.00 1.45 C ATOM 558 O THR A 58 5.365 -4.695 -19.249 1.00 1.50 O ATOM 559 CB THR A 58 5.392 -1.616 -20.196 1.00 1.72 C ATOM 560 OG1 THR A 58 5.816 -2.326 -21.332 1.00 1.88 O ATOM 561 CG2 THR A 58 6.622 -1.153 -19.428 1.00 1.64 C ATOM 0 H THR A 58 4.055 -0.732 -18.298 1.00 1.49 H new ATOM 0 HA THR A 58 3.734 -2.975 -20.083 1.00 1.59 H new ATOM 0 HB THR A 58 4.835 -0.716 -20.457 1.00 1.72 H new ATOM 0 HG1 THR A 58 6.437 -1.773 -21.850 1.00 1.88 H new ATOM 0 HG21 THR A 58 7.251 -0.546 -20.080 1.00 1.64 H new ATOM 0 HG22 THR A 58 6.312 -0.560 -18.568 1.00 1.64 H new ATOM 0 HG23 THR A 58 7.185 -2.021 -19.086 1.00 1.64 H new ATOM 569 N GLY A 59 5.398 -3.487 -17.352 1.00 1.30 N ATOM 570 CA GLY A 59 5.990 -4.513 -16.487 1.00 1.17 C ATOM 571 C GLY A 59 4.953 -5.459 -15.870 1.00 1.12 C ATOM 572 O GLY A 59 3.754 -5.176 -15.890 1.00 1.20 O ATOM 0 H GLY A 59 5.212 -2.614 -16.858 1.00 1.30 H new ATOM 0 HA2 GLY A 59 6.706 -5.097 -17.066 1.00 1.17 H new ATOM 0 HA3 GLY A 59 6.548 -4.026 -15.687 1.00 1.17 H new ATOM 576 N ASN A 60 5.393 -6.583 -15.292 1.00 1.06 N ATOM 577 CA ASN A 60 4.522 -7.503 -14.540 1.00 1.00 C ATOM 578 C ASN A 60 4.442 -7.177 -13.035 1.00 0.88 C ATOM 579 O ASN A 60 4.280 -8.085 -12.215 1.00 0.87 O ATOM 580 CB ASN A 60 4.884 -8.973 -14.827 1.00 1.07 C ATOM 581 CG ASN A 60 4.706 -9.345 -16.285 1.00 1.27 C ATOM 582 OD1 ASN A 60 3.624 -9.202 -16.849 1.00 1.65 O ATOM 583 ND2 ASN A 60 5.714 -9.872 -16.930 1.00 1.67 N ATOM 0 H ASN A 60 6.367 -6.884 -15.331 1.00 1.06 H new ATOM 0 HA ASN A 60 3.507 -7.348 -14.906 1.00 1.00 H new ATOM 0 HB2 ASN A 60 5.919 -9.152 -14.534 1.00 1.07 H new ATOM 0 HB3 ASN A 60 4.262 -9.623 -14.212 1.00 1.07 H new ATOM 0 HD21 ASN A 60 5.602 -10.164 -17.901 1.00 1.67 H new ATOM 0 HD22 ASN A 60 6.613 -9.991 -16.462 1.00 1.67 H new ATOM 590 N TYR A 61 4.559 -5.898 -12.656 1.00 0.88 N ATOM 591 CA TYR A 61 4.724 -5.456 -11.260 1.00 0.81 C ATOM 592 C TYR A 61 3.486 -5.648 -10.359 1.00 0.81 C ATOM 593 O TYR A 61 3.479 -5.232 -9.197 1.00 0.80 O ATOM 594 CB TYR A 61 5.273 -4.024 -11.203 1.00 0.77 C ATOM 595 CG TYR A 61 6.427 -3.709 -12.145 1.00 0.76 C ATOM 596 CD1 TYR A 61 7.463 -4.636 -12.389 1.00 2.19 C ATOM 597 CD2 TYR A 61 6.457 -2.457 -12.781 1.00 1.66 C ATOM 598 CE1 TYR A 61 8.481 -4.332 -13.314 1.00 2.18 C ATOM 599 CE2 TYR A 61 7.495 -2.129 -13.672 1.00 1.70 C ATOM 600 CZ TYR A 61 8.497 -3.082 -13.969 1.00 0.82 C ATOM 601 OH TYR A 61 9.462 -2.814 -14.891 1.00 0.91 O ATOM 0 H TYR A 61 4.542 -5.125 -13.321 1.00 0.88 H new ATOM 0 HA TYR A 61 5.462 -6.131 -10.827 1.00 0.81 H new ATOM 0 HB2 TYR A 61 4.456 -3.335 -11.419 1.00 0.77 H new ATOM 0 HB3 TYR A 61 5.599 -3.822 -10.183 1.00 0.77 H new ATOM 0 HD1 TYR A 61 7.475 -5.580 -11.865 1.00 2.19 H new ATOM 0 HD2 TYR A 61 5.675 -1.739 -12.584 1.00 1.66 H new ATOM 0 HE1 TYR A 61 9.252 -5.058 -13.523 1.00 2.18 H new ATOM 0 HE2 TYR A 61 7.527 -1.151 -14.129 1.00 1.70 H new ATOM 0 HH TYR A 61 9.330 -1.911 -15.249 1.00 0.91 H new ATOM 611 N ALA A 62 2.430 -6.292 -10.869 1.00 0.87 N ATOM 612 CA ALA A 62 1.322 -6.801 -10.064 1.00 0.92 C ATOM 613 C ALA A 62 1.790 -7.914 -9.094 1.00 0.86 C ATOM 614 O ALA A 62 1.130 -8.146 -8.078 1.00 0.92 O ATOM 615 CB ALA A 62 0.243 -7.324 -11.017 1.00 1.08 C ATOM 0 H ALA A 62 2.323 -6.475 -11.867 1.00 0.87 H new ATOM 0 HA ALA A 62 0.920 -5.998 -9.447 1.00 0.92 H new ATOM 0 HB1 ALA A 62 -0.597 -7.710 -10.439 1.00 1.08 H new ATOM 0 HB2 ALA A 62 -0.101 -6.512 -11.658 1.00 1.08 H new ATOM 0 HB3 ALA A 62 0.657 -8.122 -11.633 1.00 1.08 H new ATOM 621 N GLY A 63 2.922 -8.575 -9.398 1.00 0.80 N ATOM 622 CA GLY A 63 3.633 -9.514 -8.520 1.00 0.77 C ATOM 623 C GLY A 63 4.997 -8.994 -8.043 1.00 0.63 C ATOM 624 O GLY A 63 5.123 -8.509 -6.919 1.00 0.53 O ATOM 0 H GLY A 63 3.383 -8.463 -10.301 1.00 0.80 H new ATOM 0 HA2 GLY A 63 3.011 -9.729 -7.651 1.00 0.77 H new ATOM 0 HA3 GLY A 63 3.777 -10.456 -9.049 1.00 0.77 H new ATOM 628 N ASN A 64 6.020 -9.136 -8.892 1.00 0.79 N ATOM 629 CA ASN A 64 7.418 -8.792 -8.594 1.00 0.74 C ATOM 630 C ASN A 64 7.718 -7.272 -8.576 1.00 0.60 C ATOM 631 O ASN A 64 6.864 -6.448 -8.898 1.00 0.59 O ATOM 632 CB ASN A 64 8.387 -9.639 -9.438 1.00 1.08 C ATOM 633 CG ASN A 64 8.698 -8.961 -10.740 1.00 1.17 C ATOM 634 OD1 ASN A 64 9.787 -8.468 -10.978 1.00 1.61 O ATOM 635 ND2 ASN A 64 7.708 -8.845 -11.574 1.00 1.29 N ATOM 0 H ASN A 64 5.896 -9.505 -9.835 1.00 0.79 H new ATOM 0 HA ASN A 64 7.597 -9.068 -7.555 1.00 0.74 H new ATOM 0 HB2 ASN A 64 9.309 -9.806 -8.881 1.00 1.08 H new ATOM 0 HB3 ASN A 64 7.948 -10.618 -9.629 1.00 1.08 H new ATOM 0 HD21 ASN A 64 7.834 -8.334 -12.447 1.00 1.29 H new ATOM 0 HD22 ASN A 64 6.805 -9.265 -11.355 1.00 1.29 H new ATOM 642 N LYS A 65 8.933 -6.899 -8.153 1.00 0.62 N ATOM 643 CA LYS A 65 9.321 -5.508 -7.860 1.00 0.51 C ATOM 644 C LYS A 65 9.582 -4.626 -9.091 1.00 0.54 C ATOM 645 O LYS A 65 9.867 -5.126 -10.179 1.00 0.62 O ATOM 646 CB LYS A 65 10.499 -5.509 -6.872 1.00 0.53 C ATOM 647 CG LYS A 65 11.889 -5.701 -7.491 1.00 1.08 C ATOM 648 CD LYS A 65 12.942 -5.752 -6.372 1.00 1.40 C ATOM 649 CE LYS A 65 14.276 -5.190 -6.854 1.00 1.87 C ATOM 650 NZ LYS A 65 14.950 -6.058 -7.850 1.00 3.33 N ATOM 0 H LYS A 65 9.690 -7.566 -8.001 1.00 0.62 H new ATOM 0 HA LYS A 65 8.455 -5.031 -7.400 1.00 0.51 H new ATOM 0 HB2 LYS A 65 10.492 -4.565 -6.327 1.00 0.53 H new ATOM 0 HB3 LYS A 65 10.335 -6.301 -6.141 1.00 0.53 H new ATOM 0 HG2 LYS A 65 11.916 -6.622 -8.074 1.00 1.08 H new ATOM 0 HG3 LYS A 65 12.110 -4.883 -8.177 1.00 1.08 H new ATOM 0 HD2 LYS A 65 12.592 -5.182 -5.512 1.00 1.40 H new ATOM 0 HD3 LYS A 65 13.075 -6.781 -6.039 1.00 1.40 H new ATOM 0 HE2 LYS A 65 14.111 -4.206 -7.292 1.00 1.87 H new ATOM 0 HE3 LYS A 65 14.935 -5.051 -5.997 1.00 1.87 H new ATOM 0 HZ1 LYS A 65 15.849 -5.622 -8.138 1.00 3.33 H new ATOM 0 HZ2 LYS A 65 15.136 -6.990 -7.428 1.00 3.33 H new ATOM 0 HZ3 LYS A 65 14.338 -6.171 -8.683 1.00 3.33 H new ATOM 664 N VAL A 66 9.567 -3.305 -8.886 1.00 0.55 N ATOM 665 CA VAL A 66 9.950 -2.294 -9.902 1.00 0.69 C ATOM 666 C VAL A 66 11.364 -2.573 -10.433 1.00 0.70 C ATOM 667 O VAL A 66 12.302 -2.743 -9.650 1.00 0.82 O ATOM 668 CB VAL A 66 9.867 -0.860 -9.327 1.00 0.92 C ATOM 669 CG1 VAL A 66 10.604 0.243 -10.110 1.00 1.35 C ATOM 670 CG2 VAL A 66 8.400 -0.434 -9.296 1.00 0.96 C ATOM 0 H VAL A 66 9.285 -2.892 -7.997 1.00 0.55 H new ATOM 0 HA VAL A 66 9.243 -2.368 -10.728 1.00 0.69 H new ATOM 0 HB VAL A 66 10.352 -0.937 -8.354 1.00 0.92 H new ATOM 0 HG11 VAL A 66 10.469 1.200 -9.605 1.00 1.35 H new ATOM 0 HG12 VAL A 66 11.667 0.006 -10.160 1.00 1.35 H new ATOM 0 HG13 VAL A 66 10.198 0.305 -11.120 1.00 1.35 H new ATOM 0 HG21 VAL A 66 8.323 0.576 -8.893 1.00 0.96 H new ATOM 0 HG22 VAL A 66 7.994 -0.453 -10.307 1.00 0.96 H new ATOM 0 HG23 VAL A 66 7.835 -1.121 -8.665 1.00 0.96 H new ATOM 680 N GLY A 67 11.540 -2.592 -11.757 1.00 0.83 N ATOM 681 CA GLY A 67 12.826 -2.897 -12.398 1.00 0.89 C ATOM 682 C GLY A 67 13.856 -1.771 -12.283 1.00 0.91 C ATOM 683 O GLY A 67 15.016 -2.012 -11.942 1.00 0.97 O ATOM 0 H GLY A 67 10.790 -2.395 -12.420 1.00 0.83 H new ATOM 0 HA2 GLY A 67 13.239 -3.801 -11.951 1.00 0.89 H new ATOM 0 HA3 GLY A 67 12.654 -3.113 -13.452 1.00 0.89 H new ATOM 687 N VAL A 68 13.436 -0.538 -12.565 1.00 1.08 N ATOM 688 CA VAL A 68 14.224 0.705 -12.483 1.00 1.31 C ATOM 689 C VAL A 68 13.291 1.923 -12.418 1.00 1.20 C ATOM 690 O VAL A 68 12.257 1.947 -13.097 1.00 1.19 O ATOM 691 CB VAL A 68 15.209 0.785 -13.672 1.00 1.79 C ATOM 692 CG1 VAL A 68 14.533 0.813 -15.051 1.00 1.62 C ATOM 693 CG2 VAL A 68 16.173 1.970 -13.555 1.00 3.19 C ATOM 0 H VAL A 68 12.480 -0.363 -12.876 1.00 1.08 H new ATOM 0 HA VAL A 68 14.815 0.703 -11.567 1.00 1.31 H new ATOM 0 HB VAL A 68 15.772 -0.146 -13.606 1.00 1.79 H new ATOM 0 HG11 VAL A 68 15.295 0.870 -15.829 1.00 1.62 H new ATOM 0 HG12 VAL A 68 13.944 -0.094 -15.186 1.00 1.62 H new ATOM 0 HG13 VAL A 68 13.880 1.683 -15.119 1.00 1.62 H new ATOM 0 HG21 VAL A 68 16.843 1.980 -14.415 1.00 3.19 H new ATOM 0 HG22 VAL A 68 15.605 2.900 -13.527 1.00 3.19 H new ATOM 0 HG23 VAL A 68 16.758 1.874 -12.640 1.00 3.19 H new ATOM 703 N LEU A 69 13.624 2.941 -11.617 1.00 1.18 N ATOM 704 CA LEU A 69 12.856 4.188 -11.541 1.00 1.05 C ATOM 705 C LEU A 69 13.257 5.202 -12.630 1.00 0.96 C ATOM 706 O LEU A 69 14.434 5.289 -12.998 1.00 1.05 O ATOM 707 CB LEU A 69 12.985 4.820 -10.140 1.00 1.11 C ATOM 708 CG LEU A 69 12.289 4.049 -9.004 1.00 1.20 C ATOM 709 CD1 LEU A 69 12.466 4.802 -7.688 1.00 1.40 C ATOM 710 CD2 LEU A 69 10.782 3.903 -9.222 1.00 1.02 C ATOM 0 H LEU A 69 14.437 2.923 -11.001 1.00 1.18 H new ATOM 0 HA LEU A 69 11.813 3.927 -11.721 1.00 1.05 H new ATOM 0 HB2 LEU A 69 14.044 4.914 -9.898 1.00 1.11 H new ATOM 0 HB3 LEU A 69 12.576 5.830 -10.176 1.00 1.11 H new ATOM 0 HG LEU A 69 12.748 3.060 -8.984 1.00 1.20 H new ATOM 0 HD11 LEU A 69 11.972 4.254 -6.886 1.00 1.40 H new ATOM 0 HD12 LEU A 69 13.528 4.896 -7.463 1.00 1.40 H new ATOM 0 HD13 LEU A 69 12.024 5.795 -7.774 1.00 1.40 H new ATOM 0 HD21 LEU A 69 10.346 3.351 -8.389 1.00 1.02 H new ATOM 0 HD22 LEU A 69 10.326 4.891 -9.281 1.00 1.02 H new ATOM 0 HD23 LEU A 69 10.599 3.363 -10.151 1.00 1.02 H new ATOM 722 N PRO A 70 12.309 6.024 -13.117 1.00 0.82 N ATOM 723 CA PRO A 70 12.630 7.161 -13.975 1.00 0.81 C ATOM 724 C PRO A 70 13.294 8.297 -13.181 1.00 0.81 C ATOM 725 O PRO A 70 13.089 8.427 -11.971 1.00 0.77 O ATOM 726 CB PRO A 70 11.294 7.572 -14.587 1.00 0.71 C ATOM 727 CG PRO A 70 10.246 7.166 -13.570 1.00 0.61 C ATOM 728 CD PRO A 70 10.872 5.971 -12.837 1.00 0.71 C ATOM 0 HA PRO A 70 13.358 6.909 -14.746 1.00 0.81 H new ATOM 0 HB2 PRO A 70 11.262 8.645 -14.778 1.00 0.71 H new ATOM 0 HB3 PRO A 70 11.129 7.073 -15.542 1.00 0.71 H new ATOM 0 HG2 PRO A 70 10.022 7.982 -12.882 1.00 0.61 H new ATOM 0 HG3 PRO A 70 9.309 6.890 -14.053 1.00 0.61 H new ATOM 0 HD2 PRO A 70 10.682 6.029 -11.765 1.00 0.71 H new ATOM 0 HD3 PRO A 70 10.442 5.032 -13.186 1.00 0.71 H new ATOM 736 N ALA A 71 14.036 9.187 -13.847 1.00 0.90 N ATOM 737 CA ALA A 71 14.684 10.339 -13.196 1.00 0.96 C ATOM 738 C ALA A 71 13.671 11.362 -12.628 1.00 0.86 C ATOM 739 O ALA A 71 14.001 12.140 -11.730 1.00 1.00 O ATOM 740 CB ALA A 71 15.656 10.984 -14.191 1.00 1.11 C ATOM 0 H ALA A 71 14.207 9.133 -14.851 1.00 0.90 H new ATOM 0 HA ALA A 71 15.236 9.979 -12.328 1.00 0.96 H new ATOM 0 HB1 ALA A 71 16.143 11.839 -13.722 1.00 1.11 H new ATOM 0 HB2 ALA A 71 16.410 10.255 -14.488 1.00 1.11 H new ATOM 0 HB3 ALA A 71 15.107 11.318 -15.072 1.00 1.11 H new ATOM 746 N ASN A 72 12.427 11.319 -13.119 1.00 0.71 N ATOM 747 CA ASN A 72 11.270 12.080 -12.636 1.00 0.62 C ATOM 748 C ASN A 72 10.447 11.383 -11.526 1.00 0.54 C ATOM 749 O ASN A 72 9.436 11.926 -11.081 1.00 0.59 O ATOM 750 CB ASN A 72 10.420 12.485 -13.848 1.00 0.59 C ATOM 751 CG ASN A 72 9.960 11.315 -14.699 1.00 0.62 C ATOM 752 OD1 ASN A 72 10.522 11.043 -15.747 1.00 1.40 O ATOM 753 ND2 ASN A 72 8.983 10.555 -14.269 1.00 1.22 N ATOM 0 H ASN A 72 12.188 10.719 -13.908 1.00 0.71 H new ATOM 0 HA ASN A 72 11.644 12.970 -12.129 1.00 0.62 H new ATOM 0 HB2 ASN A 72 9.545 13.033 -13.498 1.00 0.59 H new ATOM 0 HB3 ASN A 72 10.996 13.169 -14.471 1.00 0.59 H new ATOM 0 HD21 ASN A 72 8.695 9.740 -14.810 1.00 1.22 H new ATOM 0 HD22 ASN A 72 8.510 10.779 -13.393 1.00 1.22 H new ATOM 760 N ALA A 73 10.842 10.184 -11.087 1.00 0.53 N ATOM 761 CA ALA A 73 10.307 9.526 -9.886 1.00 0.50 C ATOM 762 C ALA A 73 11.233 9.711 -8.671 1.00 0.53 C ATOM 763 O ALA A 73 12.422 10.013 -8.820 1.00 0.67 O ATOM 764 CB ALA A 73 10.123 8.035 -10.168 1.00 0.50 C ATOM 0 H ALA A 73 11.555 9.632 -11.563 1.00 0.53 H new ATOM 0 HA ALA A 73 9.349 9.988 -9.646 1.00 0.50 H new ATOM 0 HB1 ALA A 73 9.726 7.543 -9.280 1.00 0.50 H new ATOM 0 HB2 ALA A 73 9.427 7.905 -10.997 1.00 0.50 H new ATOM 0 HB3 ALA A 73 11.084 7.593 -10.429 1.00 0.50 H new ATOM 770 N LYS A 74 10.703 9.476 -7.466 1.00 0.48 N ATOM 771 CA LYS A 74 11.460 9.376 -6.206 1.00 0.56 C ATOM 772 C LYS A 74 10.704 8.557 -5.160 1.00 0.50 C ATOM 773 O LYS A 74 9.529 8.224 -5.336 1.00 0.46 O ATOM 774 CB LYS A 74 11.787 10.780 -5.675 1.00 0.81 C ATOM 775 CG LYS A 74 10.559 11.457 -5.056 1.00 0.75 C ATOM 776 CD LYS A 74 10.776 12.969 -5.048 1.00 0.93 C ATOM 777 CE LYS A 74 9.558 13.689 -4.484 1.00 1.31 C ATOM 778 NZ LYS A 74 9.816 15.137 -4.389 1.00 2.02 N ATOM 0 H LYS A 74 9.700 9.345 -7.333 1.00 0.48 H new ATOM 0 HA LYS A 74 12.394 8.853 -6.411 1.00 0.56 H new ATOM 0 HB2 LYS A 74 12.578 10.711 -4.929 1.00 0.81 H new ATOM 0 HB3 LYS A 74 12.170 11.396 -6.489 1.00 0.81 H new ATOM 0 HG2 LYS A 74 9.664 11.208 -5.627 1.00 0.75 H new ATOM 0 HG3 LYS A 74 10.401 11.094 -4.040 1.00 0.75 H new ATOM 0 HD2 LYS A 74 11.655 13.211 -4.451 1.00 0.93 H new ATOM 0 HD3 LYS A 74 10.973 13.318 -6.062 1.00 0.93 H new ATOM 0 HE2 LYS A 74 8.693 13.508 -5.122 1.00 1.31 H new ATOM 0 HE3 LYS A 74 9.316 13.291 -3.499 1.00 1.31 H new ATOM 0 HZ1 LYS A 74 8.977 15.615 -4.003 1.00 2.02 H new ATOM 0 HZ2 LYS A 74 10.629 15.304 -3.762 1.00 2.02 H new ATOM 0 HZ3 LYS A 74 10.025 15.515 -5.335 1.00 2.02 H new ATOM 792 N GLU A 75 11.377 8.263 -4.058 1.00 0.58 N ATOM 793 CA GLU A 75 10.871 7.419 -2.974 1.00 0.60 C ATOM 794 C GLU A 75 10.901 8.179 -1.638 1.00 0.67 C ATOM 795 O GLU A 75 11.779 9.023 -1.421 1.00 0.83 O ATOM 796 CB GLU A 75 11.716 6.143 -2.895 1.00 0.72 C ATOM 797 CG GLU A 75 11.781 5.376 -4.222 1.00 0.67 C ATOM 798 CD GLU A 75 12.924 4.363 -4.180 1.00 0.88 C ATOM 799 OE1 GLU A 75 14.087 4.730 -4.463 1.00 1.66 O ATOM 800 OE2 GLU A 75 12.700 3.185 -3.810 1.00 2.08 O ATOM 0 H GLU A 75 12.319 8.613 -3.883 1.00 0.58 H new ATOM 0 HA GLU A 75 9.835 7.150 -3.178 1.00 0.60 H new ATOM 0 HB2 GLU A 75 12.728 6.404 -2.584 1.00 0.72 H new ATOM 0 HB3 GLU A 75 11.304 5.490 -2.125 1.00 0.72 H new ATOM 0 HG2 GLU A 75 10.836 4.864 -4.403 1.00 0.67 H new ATOM 0 HG3 GLU A 75 11.930 6.072 -5.048 1.00 0.67 H new ATOM 807 N ILE A 76 9.962 7.873 -0.740 1.00 0.60 N ATOM 808 CA ILE A 76 9.892 8.429 0.622 1.00 0.61 C ATOM 809 C ILE A 76 9.551 7.330 1.641 1.00 0.55 C ATOM 810 O ILE A 76 8.664 6.505 1.399 1.00 0.61 O ATOM 811 CB ILE A 76 8.903 9.624 0.714 1.00 0.60 C ATOM 812 CG1 ILE A 76 7.471 9.262 0.243 1.00 0.58 C ATOM 813 CG2 ILE A 76 9.458 10.852 -0.036 1.00 0.66 C ATOM 814 CD1 ILE A 76 6.496 10.446 0.209 1.00 0.69 C ATOM 0 H ILE A 76 9.208 7.216 -0.940 1.00 0.60 H new ATOM 0 HA ILE A 76 10.878 8.822 0.868 1.00 0.61 H new ATOM 0 HB ILE A 76 8.813 9.880 1.770 1.00 0.60 H new ATOM 0 HG12 ILE A 76 7.529 8.826 -0.754 1.00 0.58 H new ATOM 0 HG13 ILE A 76 7.068 8.494 0.903 1.00 0.58 H new ATOM 0 HG21 ILE A 76 8.749 11.677 0.042 1.00 0.66 H new ATOM 0 HG22 ILE A 76 10.409 11.149 0.405 1.00 0.66 H new ATOM 0 HG23 ILE A 76 9.608 10.600 -1.086 1.00 0.66 H new ATOM 0 HD11 ILE A 76 5.519 10.103 -0.132 1.00 0.69 H new ATOM 0 HD12 ILE A 76 6.403 10.870 1.209 1.00 0.69 H new ATOM 0 HD13 ILE A 76 6.872 11.207 -0.475 1.00 0.69 H new ATOM 826 N ALA A 77 10.231 7.325 2.790 1.00 0.53 N ATOM 827 CA ALA A 77 9.914 6.467 3.933 1.00 0.50 C ATOM 828 C ALA A 77 9.234 7.273 5.057 1.00 0.47 C ATOM 829 O ALA A 77 9.304 8.504 5.089 1.00 0.57 O ATOM 830 CB ALA A 77 11.168 5.707 4.389 1.00 0.57 C ATOM 0 H ALA A 77 11.035 7.931 2.955 1.00 0.53 H new ATOM 0 HA ALA A 77 9.187 5.713 3.632 1.00 0.50 H new ATOM 0 HB1 ALA A 77 10.920 5.072 5.240 1.00 0.57 H new ATOM 0 HB2 ALA A 77 11.537 5.089 3.570 1.00 0.57 H new ATOM 0 HB3 ALA A 77 11.939 6.420 4.681 1.00 0.57 H new ATOM 836 N GLY A 78 8.557 6.593 5.983 1.00 0.45 N ATOM 837 CA GLY A 78 7.852 7.227 7.104 1.00 0.46 C ATOM 838 C GLY A 78 6.417 7.659 6.796 1.00 0.42 C ATOM 839 O GLY A 78 5.848 8.445 7.553 1.00 0.51 O ATOM 0 H GLY A 78 8.480 5.576 5.978 1.00 0.45 H new ATOM 0 HA2 GLY A 78 7.835 6.533 7.944 1.00 0.46 H new ATOM 0 HA3 GLY A 78 8.419 8.101 7.424 1.00 0.46 H new ATOM 843 N VAL A 79 5.830 7.158 5.708 1.00 0.42 N ATOM 844 CA VAL A 79 4.397 7.272 5.380 1.00 0.42 C ATOM 845 C VAL A 79 3.666 6.020 5.862 1.00 0.41 C ATOM 846 O VAL A 79 4.218 4.926 5.778 1.00 0.46 O ATOM 847 CB VAL A 79 4.182 7.538 3.877 1.00 0.51 C ATOM 848 CG1 VAL A 79 4.937 6.597 2.937 1.00 0.68 C ATOM 849 CG2 VAL A 79 2.705 7.567 3.485 1.00 0.51 C ATOM 0 H VAL A 79 6.354 6.642 5.001 1.00 0.42 H new ATOM 0 HA VAL A 79 3.976 8.133 5.900 1.00 0.42 H new ATOM 0 HB VAL A 79 4.612 8.530 3.743 1.00 0.51 H new ATOM 0 HG11 VAL A 79 4.721 6.865 1.903 1.00 0.68 H new ATOM 0 HG12 VAL A 79 6.008 6.684 3.118 1.00 0.68 H new ATOM 0 HG13 VAL A 79 4.621 5.570 3.119 1.00 0.68 H new ATOM 0 HG21 VAL A 79 2.616 7.758 2.416 1.00 0.51 H new ATOM 0 HG22 VAL A 79 2.247 6.607 3.721 1.00 0.51 H new ATOM 0 HG23 VAL A 79 2.197 8.357 4.038 1.00 0.51 H new ATOM 859 N MET A 80 2.453 6.190 6.395 1.00 0.40 N ATOM 860 CA MET A 80 1.657 5.142 7.040 1.00 0.37 C ATOM 861 C MET A 80 0.499 4.638 6.171 1.00 0.32 C ATOM 862 O MET A 80 -0.239 5.427 5.580 1.00 0.34 O ATOM 863 CB MET A 80 1.148 5.702 8.375 1.00 0.42 C ATOM 864 CG MET A 80 0.199 4.770 9.128 1.00 0.46 C ATOM 865 SD MET A 80 0.788 3.084 9.402 1.00 0.53 S ATOM 866 CE MET A 80 0.587 2.992 11.191 1.00 0.43 C ATOM 0 H MET A 80 1.981 7.094 6.389 1.00 0.40 H new ATOM 0 HA MET A 80 2.289 4.269 7.199 1.00 0.37 H new ATOM 0 HB2 MET A 80 2.004 5.922 9.013 1.00 0.42 H new ATOM 0 HB3 MET A 80 0.638 6.647 8.188 1.00 0.42 H new ATOM 0 HG2 MET A 80 -0.023 5.217 10.097 1.00 0.46 H new ATOM 0 HG3 MET A 80 -0.740 4.720 8.577 1.00 0.46 H new ATOM 0 HE1 MET A 80 0.905 2.010 11.543 1.00 0.43 H new ATOM 0 HE2 MET A 80 1.195 3.762 11.666 1.00 0.43 H new ATOM 0 HE3 MET A 80 -0.461 3.148 11.448 1.00 0.43 H new ATOM 876 N PHE A 81 0.294 3.320 6.149 1.00 0.31 N ATOM 877 CA PHE A 81 -0.798 2.662 5.425 1.00 0.31 C ATOM 878 C PHE A 81 -1.387 1.464 6.189 1.00 0.31 C ATOM 879 O PHE A 81 -0.711 0.781 6.963 1.00 0.34 O ATOM 880 CB PHE A 81 -0.356 2.280 3.993 1.00 0.31 C ATOM 881 CG PHE A 81 1.126 1.995 3.885 1.00 0.32 C ATOM 882 CD1 PHE A 81 1.563 0.737 4.322 1.00 1.56 C ATOM 883 CD2 PHE A 81 2.069 2.996 3.541 1.00 1.56 C ATOM 884 CE1 PHE A 81 2.928 0.476 4.446 1.00 1.58 C ATOM 885 CE2 PHE A 81 3.439 2.704 3.637 1.00 1.58 C ATOM 886 CZ PHE A 81 3.870 1.447 4.093 1.00 0.54 C ATOM 0 H PHE A 81 0.896 2.664 6.646 1.00 0.31 H new ATOM 0 HA PHE A 81 -1.610 3.385 5.344 1.00 0.31 H new ATOM 0 HB2 PHE A 81 -0.913 1.401 3.670 1.00 0.31 H new ATOM 0 HB3 PHE A 81 -0.615 3.090 3.311 1.00 0.31 H new ATOM 0 HD1 PHE A 81 0.843 -0.031 4.563 1.00 1.56 H new ATOM 0 HD2 PHE A 81 1.738 3.969 3.210 1.00 1.56 H new ATOM 0 HE1 PHE A 81 3.259 -0.483 4.817 1.00 1.58 H new ATOM 0 HE2 PHE A 81 4.167 3.451 3.358 1.00 1.58 H new ATOM 0 HZ PHE A 81 4.925 1.231 4.171 1.00 0.54 H new ATOM 896 N VAL A 82 -2.674 1.208 5.940 1.00 0.28 N ATOM 897 CA VAL A 82 -3.511 0.176 6.576 1.00 0.27 C ATOM 898 C VAL A 82 -4.089 -0.771 5.507 1.00 0.24 C ATOM 899 O VAL A 82 -4.412 -0.325 4.401 1.00 0.24 O ATOM 900 CB VAL A 82 -4.636 0.814 7.431 1.00 0.29 C ATOM 901 CG1 VAL A 82 -4.140 1.951 8.340 1.00 0.34 C ATOM 902 CG2 VAL A 82 -5.776 1.418 6.606 1.00 0.29 C ATOM 0 H VAL A 82 -3.195 1.746 5.248 1.00 0.28 H new ATOM 0 HA VAL A 82 -2.885 -0.408 7.251 1.00 0.27 H new ATOM 0 HB VAL A 82 -4.992 -0.033 8.017 1.00 0.29 H new ATOM 0 HG11 VAL A 82 -4.978 2.353 8.910 1.00 0.34 H new ATOM 0 HG12 VAL A 82 -3.386 1.566 9.026 1.00 0.34 H new ATOM 0 HG13 VAL A 82 -3.705 2.742 7.729 1.00 0.34 H new ATOM 0 HG21 VAL A 82 -6.523 1.844 7.275 1.00 0.29 H new ATOM 0 HG22 VAL A 82 -5.381 2.200 5.958 1.00 0.29 H new ATOM 0 HG23 VAL A 82 -6.236 0.640 5.997 1.00 0.29 H new ATOM 912 N TRP A 83 -4.256 -2.062 5.812 1.00 0.23 N ATOM 913 CA TRP A 83 -4.994 -3.014 4.970 1.00 0.22 C ATOM 914 C TRP A 83 -6.508 -3.009 5.276 1.00 0.24 C ATOM 915 O TRP A 83 -6.949 -2.838 6.413 1.00 0.27 O ATOM 916 CB TRP A 83 -4.390 -4.427 5.076 1.00 0.22 C ATOM 917 CG TRP A 83 -3.241 -4.747 4.152 1.00 0.24 C ATOM 918 CD1 TRP A 83 -2.050 -4.101 4.082 1.00 0.30 C ATOM 919 CD2 TRP A 83 -3.155 -5.833 3.165 1.00 0.28 C ATOM 920 NE1 TRP A 83 -1.252 -4.701 3.124 1.00 0.34 N ATOM 921 CE2 TRP A 83 -1.882 -5.771 2.523 1.00 0.33 C ATOM 922 CE3 TRP A 83 -4.017 -6.879 2.755 1.00 0.29 C ATOM 923 CZ2 TRP A 83 -1.491 -6.686 1.528 1.00 0.38 C ATOM 924 CZ3 TRP A 83 -3.616 -7.831 1.796 1.00 0.35 C ATOM 925 CH2 TRP A 83 -2.353 -7.743 1.181 1.00 0.39 C ATOM 0 H TRP A 83 -3.878 -2.482 6.661 1.00 0.23 H new ATOM 0 HA TRP A 83 -4.888 -2.686 3.936 1.00 0.22 H new ATOM 0 HB2 TRP A 83 -4.053 -4.576 6.102 1.00 0.22 H new ATOM 0 HB3 TRP A 83 -5.184 -5.151 4.893 1.00 0.22 H new ATOM 0 HD1 TRP A 83 -1.768 -3.249 4.682 1.00 0.30 H new ATOM 0 HE1 TRP A 83 -0.310 -4.389 2.890 1.00 0.34 H new ATOM 0 HE3 TRP A 83 -5.004 -6.949 3.187 1.00 0.29 H new ATOM 0 HZ2 TRP A 83 -0.537 -6.578 1.034 1.00 0.38 H new ATOM 0 HZ3 TRP A 83 -4.285 -8.636 1.530 1.00 0.35 H new ATOM 0 HH2 TRP A 83 -2.049 -8.478 0.451 1.00 0.39 H new ATOM 936 N THR A 84 -7.311 -3.224 4.234 1.00 0.27 N ATOM 937 CA THR A 84 -8.786 -3.254 4.250 1.00 0.31 C ATOM 938 C THR A 84 -9.354 -4.351 3.340 1.00 0.36 C ATOM 939 O THR A 84 -8.624 -4.941 2.539 1.00 0.35 O ATOM 940 CB THR A 84 -9.391 -1.918 3.781 1.00 0.33 C ATOM 941 OG1 THR A 84 -8.839 -1.565 2.542 1.00 0.33 O ATOM 942 CG2 THR A 84 -9.188 -0.733 4.712 1.00 0.35 C ATOM 0 H THR A 84 -6.935 -3.392 3.301 1.00 0.27 H new ATOM 0 HA THR A 84 -9.056 -3.452 5.287 1.00 0.31 H new ATOM 0 HB THR A 84 -10.464 -2.109 3.743 1.00 0.33 H new ATOM 0 HG1 THR A 84 -8.970 -0.606 2.387 1.00 0.33 H new ATOM 0 HG21 THR A 84 -9.655 0.153 4.281 1.00 0.35 H new ATOM 0 HG22 THR A 84 -9.642 -0.948 5.679 1.00 0.35 H new ATOM 0 HG23 THR A 84 -8.121 -0.553 4.844 1.00 0.35 H new ATOM 950 N ASN A 85 -10.665 -4.614 3.420 1.00 0.43 N ATOM 951 CA ASN A 85 -11.353 -5.560 2.529 1.00 0.47 C ATOM 952 C ASN A 85 -11.934 -4.959 1.237 1.00 0.41 C ATOM 953 O ASN A 85 -11.644 -3.821 0.860 1.00 0.52 O ATOM 954 CB ASN A 85 -12.334 -6.437 3.330 1.00 0.56 C ATOM 955 CG ASN A 85 -12.207 -7.856 2.812 1.00 0.74 C ATOM 956 OD1 ASN A 85 -12.972 -8.310 1.975 1.00 1.91 O ATOM 957 ND2 ASN A 85 -11.110 -8.492 3.146 1.00 0.71 N ATOM 0 H ASN A 85 -11.280 -4.176 4.106 1.00 0.43 H new ATOM 0 HA ASN A 85 -10.582 -6.216 2.125 1.00 0.47 H new ATOM 0 HB2 ASN A 85 -12.103 -6.396 4.394 1.00 0.56 H new ATOM 0 HB3 ASN A 85 -13.356 -6.076 3.211 1.00 0.56 H new ATOM 0 HD21 ASN A 85 -10.882 -9.383 2.704 1.00 0.71 H new ATOM 0 HD22 ASN A 85 -10.484 -8.096 3.847 1.00 0.71 H new ATOM 964 N THR A 86 -12.729 -5.741 0.504 1.00 0.72 N ATOM 965 CA THR A 86 -13.517 -5.284 -0.652 1.00 0.92 C ATOM 966 C THR A 86 -14.421 -4.104 -0.288 1.00 0.74 C ATOM 967 O THR A 86 -14.428 -3.095 -0.991 1.00 0.71 O ATOM 968 CB THR A 86 -14.382 -6.437 -1.192 1.00 1.56 C ATOM 969 OG1 THR A 86 -15.195 -6.904 -0.142 1.00 2.31 O ATOM 970 CG2 THR A 86 -13.572 -7.636 -1.680 1.00 1.79 C ATOM 0 H THR A 86 -12.848 -6.735 0.699 1.00 0.72 H new ATOM 0 HA THR A 86 -12.814 -4.955 -1.418 1.00 0.92 H new ATOM 0 HB THR A 86 -14.942 -6.037 -2.037 1.00 1.56 H new ATOM 0 HG1 THR A 86 -15.757 -7.639 -0.465 1.00 2.31 H new ATOM 0 HG21 THR A 86 -14.249 -8.408 -2.046 1.00 1.79 H new ATOM 0 HG22 THR A 86 -12.909 -7.323 -2.487 1.00 1.79 H new ATOM 0 HG23 THR A 86 -12.979 -8.034 -0.857 1.00 1.79 H new ATOM 978 N ASN A 87 -15.064 -4.175 0.882 1.00 0.75 N ATOM 979 CA ASN A 87 -16.032 -3.179 1.376 1.00 0.75 C ATOM 980 C ASN A 87 -15.367 -2.044 2.178 1.00 0.66 C ATOM 981 O ASN A 87 -16.023 -1.358 2.969 1.00 0.72 O ATOM 982 CB ASN A 87 -17.172 -3.876 2.148 1.00 0.96 C ATOM 983 CG ASN A 87 -18.167 -4.607 1.266 1.00 1.33 C ATOM 984 OD1 ASN A 87 -17.942 -4.890 0.098 1.00 1.48 O ATOM 985 ND2 ASN A 87 -19.301 -4.967 1.813 1.00 2.27 N ATOM 0 H ASN A 87 -14.924 -4.948 1.533 1.00 0.75 H new ATOM 0 HA ASN A 87 -16.473 -2.686 0.510 1.00 0.75 H new ATOM 0 HB2 ASN A 87 -16.738 -4.586 2.852 1.00 0.96 H new ATOM 0 HB3 ASN A 87 -17.706 -3.130 2.737 1.00 0.96 H new ATOM 0 HD21 ASN A 87 -19.991 -5.481 1.265 1.00 2.27 H new ATOM 0 HD22 ASN A 87 -19.494 -4.734 2.787 1.00 2.27 H new ATOM 992 N ASN A 88 -14.054 -1.855 1.988 1.00 0.56 N ATOM 993 CA ASN A 88 -13.262 -0.772 2.571 1.00 0.51 C ATOM 994 C ASN A 88 -13.335 -0.775 4.114 1.00 0.52 C ATOM 995 O ASN A 88 -13.261 0.265 4.763 1.00 0.53 O ATOM 996 CB ASN A 88 -13.599 0.568 1.872 1.00 0.48 C ATOM 997 CG ASN A 88 -14.030 0.403 0.418 1.00 0.54 C ATOM 998 OD1 ASN A 88 -15.190 0.179 0.102 1.00 0.67 O ATOM 999 ND2 ASN A 88 -13.119 0.444 -0.522 1.00 0.59 N ATOM 0 H ASN A 88 -13.497 -2.477 1.402 1.00 0.56 H new ATOM 0 HA ASN A 88 -12.202 -0.934 2.375 1.00 0.51 H new ATOM 0 HB2 ASN A 88 -14.395 1.067 2.425 1.00 0.48 H new ATOM 0 HB3 ASN A 88 -12.726 1.220 1.912 1.00 0.48 H new ATOM 0 HD21 ASN A 88 -13.383 0.291 -1.495 1.00 0.59 H new ATOM 0 HD22 ASN A 88 -12.145 0.629 -0.281 1.00 0.59 H new ATOM 1006 N GLU A 89 -13.530 -1.964 4.696 1.00 0.54 N ATOM 1007 CA GLU A 89 -13.511 -2.229 6.135 1.00 0.54 C ATOM 1008 C GLU A 89 -12.078 -2.450 6.601 1.00 0.49 C ATOM 1009 O GLU A 89 -11.315 -3.120 5.906 1.00 0.46 O ATOM 1010 CB GLU A 89 -14.319 -3.493 6.477 1.00 0.57 C ATOM 1011 CG GLU A 89 -15.813 -3.196 6.654 1.00 0.59 C ATOM 1012 CD GLU A 89 -16.571 -4.386 7.257 1.00 1.02 C ATOM 1013 OE1 GLU A 89 -17.047 -5.279 6.513 1.00 1.64 O ATOM 1014 OE2 GLU A 89 -16.712 -4.402 8.505 1.00 2.55 O ATOM 0 H GLU A 89 -13.714 -2.805 4.149 1.00 0.54 H new ATOM 0 HA GLU A 89 -13.953 -1.367 6.635 1.00 0.54 H new ATOM 0 HB2 GLU A 89 -14.188 -4.231 5.685 1.00 0.57 H new ATOM 0 HB3 GLU A 89 -13.927 -3.936 7.393 1.00 0.57 H new ATOM 0 HG2 GLU A 89 -15.935 -2.325 7.298 1.00 0.59 H new ATOM 0 HG3 GLU A 89 -16.248 -2.941 5.688 1.00 0.59 H new ATOM 1021 N ILE A 90 -11.730 -1.950 7.787 1.00 0.49 N ATOM 1022 CA ILE A 90 -10.401 -2.142 8.375 1.00 0.45 C ATOM 1023 C ILE A 90 -10.313 -3.547 8.985 1.00 0.45 C ATOM 1024 O ILE A 90 -11.141 -3.916 9.820 1.00 0.50 O ATOM 1025 CB ILE A 90 -10.057 -1.048 9.407 1.00 0.48 C ATOM 1026 CG1 ILE A 90 -10.405 0.356 8.863 1.00 0.48 C ATOM 1027 CG2 ILE A 90 -8.559 -1.164 9.769 1.00 0.50 C ATOM 1028 CD1 ILE A 90 -9.972 1.492 9.786 1.00 0.52 C ATOM 0 H ILE A 90 -12.361 -1.400 8.369 1.00 0.49 H new ATOM 0 HA ILE A 90 -9.656 -2.052 7.584 1.00 0.45 H new ATOM 0 HB ILE A 90 -10.654 -1.190 10.308 1.00 0.48 H new ATOM 0 HG12 ILE A 90 -9.931 0.488 7.891 1.00 0.48 H new ATOM 0 HG13 ILE A 90 -11.481 0.418 8.704 1.00 0.48 H new ATOM 0 HG21 ILE A 90 -8.300 -0.396 10.498 1.00 0.50 H new ATOM 0 HG22 ILE A 90 -8.362 -2.149 10.193 1.00 0.50 H new ATOM 0 HG23 ILE A 90 -7.956 -1.029 8.871 1.00 0.50 H new ATOM 0 HD11 ILE A 90 -10.248 2.448 9.341 1.00 0.52 H new ATOM 0 HD12 ILE A 90 -10.467 1.385 10.751 1.00 0.52 H new ATOM 0 HD13 ILE A 90 -8.892 1.455 9.926 1.00 0.52 H new ATOM 1040 N ILE A 91 -9.307 -4.320 8.574 1.00 0.39 N ATOM 1041 CA ILE A 91 -9.084 -5.710 9.015 1.00 0.36 C ATOM 1042 C ILE A 91 -7.726 -5.941 9.708 1.00 0.33 C ATOM 1043 O ILE A 91 -6.761 -5.200 9.519 1.00 0.33 O ATOM 1044 CB ILE A 91 -9.362 -6.710 7.867 1.00 0.38 C ATOM 1045 CG1 ILE A 91 -8.338 -6.642 6.710 1.00 0.35 C ATOM 1046 CG2 ILE A 91 -10.757 -6.470 7.274 1.00 0.45 C ATOM 1047 CD1 ILE A 91 -7.964 -8.027 6.181 1.00 0.55 C ATOM 0 H ILE A 91 -8.604 -3.995 7.910 1.00 0.39 H new ATOM 0 HA ILE A 91 -9.814 -5.904 9.800 1.00 0.36 H new ATOM 0 HB ILE A 91 -9.284 -7.696 8.325 1.00 0.38 H new ATOM 0 HG12 ILE A 91 -8.751 -6.045 5.897 1.00 0.35 H new ATOM 0 HG13 ILE A 91 -7.438 -6.132 7.054 1.00 0.35 H new ATOM 0 HG21 ILE A 91 -10.937 -7.181 6.468 1.00 0.45 H new ATOM 0 HG22 ILE A 91 -11.510 -6.603 8.050 1.00 0.45 H new ATOM 0 HG23 ILE A 91 -10.816 -5.455 6.882 1.00 0.45 H new ATOM 0 HD11 ILE A 91 -7.243 -7.924 5.370 1.00 0.55 H new ATOM 0 HD12 ILE A 91 -7.524 -8.617 6.985 1.00 0.55 H new ATOM 0 HD13 ILE A 91 -8.858 -8.528 5.810 1.00 0.55 H new ATOM 1059 N ASP A 92 -7.671 -6.969 10.552 1.00 0.34 N ATOM 1060 CA ASP A 92 -6.454 -7.544 11.150 1.00 0.35 C ATOM 1061 C ASP A 92 -5.839 -8.604 10.207 1.00 0.37 C ATOM 1062 O ASP A 92 -6.487 -9.075 9.276 1.00 0.37 O ATOM 1063 CB ASP A 92 -6.818 -8.119 12.533 1.00 0.42 C ATOM 1064 CG ASP A 92 -5.650 -8.688 13.348 1.00 0.64 C ATOM 1065 OD1 ASP A 92 -4.466 -8.346 13.132 1.00 1.47 O ATOM 1066 OD2 ASP A 92 -5.899 -9.509 14.259 1.00 1.37 O ATOM 0 H ASP A 92 -8.515 -7.453 10.857 1.00 0.34 H new ATOM 0 HA ASP A 92 -5.691 -6.777 11.286 1.00 0.35 H new ATOM 0 HB2 ASP A 92 -7.296 -7.333 13.118 1.00 0.42 H new ATOM 0 HB3 ASP A 92 -7.558 -8.907 12.394 1.00 0.42 H new ATOM 1071 N GLU A 93 -4.597 -9.021 10.450 1.00 0.42 N ATOM 1072 CA GLU A 93 -3.825 -9.939 9.588 1.00 0.48 C ATOM 1073 C GLU A 93 -4.465 -11.318 9.375 1.00 0.53 C ATOM 1074 O GLU A 93 -4.161 -11.972 8.389 1.00 0.70 O ATOM 1075 CB GLU A 93 -2.402 -10.093 10.147 1.00 0.70 C ATOM 1076 CG GLU A 93 -2.339 -10.834 11.495 1.00 0.88 C ATOM 1077 CD GLU A 93 -1.046 -10.540 12.265 1.00 1.23 C ATOM 1078 OE1 GLU A 93 -0.783 -9.349 12.560 1.00 2.05 O ATOM 1079 OE2 GLU A 93 -0.300 -11.487 12.615 1.00 2.14 O ATOM 0 H GLU A 93 -4.077 -8.725 11.276 1.00 0.42 H new ATOM 0 HA GLU A 93 -3.809 -9.478 8.600 1.00 0.48 H new ATOM 0 HB2 GLU A 93 -1.792 -10.629 9.420 1.00 0.70 H new ATOM 0 HB3 GLU A 93 -1.960 -9.104 10.266 1.00 0.70 H new ATOM 0 HG2 GLU A 93 -3.195 -10.546 12.105 1.00 0.88 H new ATOM 0 HG3 GLU A 93 -2.419 -11.907 11.321 1.00 0.88 H new ATOM 1086 N ASN A 94 -5.366 -11.754 10.257 1.00 0.54 N ATOM 1087 CA ASN A 94 -6.144 -12.997 10.122 1.00 0.60 C ATOM 1088 C ASN A 94 -7.496 -12.784 9.393 1.00 0.57 C ATOM 1089 O ASN A 94 -8.317 -13.702 9.311 1.00 0.70 O ATOM 1090 CB ASN A 94 -6.301 -13.671 11.494 1.00 0.68 C ATOM 1091 CG ASN A 94 -6.784 -12.678 12.517 1.00 1.49 C ATOM 1092 OD1 ASN A 94 -7.914 -12.223 12.485 1.00 2.82 O ATOM 1093 ND2 ASN A 94 -5.894 -12.210 13.351 1.00 1.25 N ATOM 0 H ASN A 94 -5.584 -11.241 11.111 1.00 0.54 H new ATOM 0 HA ASN A 94 -5.586 -13.677 9.478 1.00 0.60 H new ATOM 0 HB2 ASN A 94 -7.006 -14.499 11.421 1.00 0.68 H new ATOM 0 HB3 ASN A 94 -5.347 -14.093 11.810 1.00 0.68 H new ATOM 0 HD21 ASN A 94 -6.141 -11.453 13.988 1.00 1.25 H new ATOM 0 HD22 ASN A 94 -4.952 -12.602 13.365 1.00 1.25 H new ATOM 1100 N GLY A 95 -7.777 -11.573 8.893 1.00 0.46 N ATOM 1101 CA GLY A 95 -9.016 -11.224 8.195 1.00 0.47 C ATOM 1102 C GLY A 95 -10.210 -10.928 9.110 1.00 0.48 C ATOM 1103 O GLY A 95 -11.330 -10.802 8.606 1.00 0.55 O ATOM 0 H GLY A 95 -7.129 -10.789 8.966 1.00 0.46 H new ATOM 0 HA2 GLY A 95 -8.830 -10.350 7.570 1.00 0.47 H new ATOM 0 HA3 GLY A 95 -9.283 -12.043 7.527 1.00 0.47 H new ATOM 1107 N GLN A 96 -9.995 -10.813 10.428 1.00 0.46 N ATOM 1108 CA GLN A 96 -10.988 -10.301 11.376 1.00 0.48 C ATOM 1109 C GLN A 96 -11.188 -8.802 11.135 1.00 0.46 C ATOM 1110 O GLN A 96 -10.240 -8.086 10.824 1.00 0.37 O ATOM 1111 CB GLN A 96 -10.539 -10.583 12.822 1.00 0.51 C ATOM 1112 CG GLN A 96 -11.481 -9.963 13.866 1.00 0.59 C ATOM 1113 CD GLN A 96 -11.234 -10.404 15.305 1.00 1.43 C ATOM 1114 OE1 GLN A 96 -10.447 -11.288 15.628 1.00 2.23 O ATOM 1115 NE2 GLN A 96 -11.937 -9.805 16.233 1.00 1.87 N ATOM 0 H GLN A 96 -9.114 -11.077 10.869 1.00 0.46 H new ATOM 0 HA GLN A 96 -11.941 -10.808 11.223 1.00 0.48 H new ATOM 0 HB2 GLN A 96 -10.488 -11.660 12.979 1.00 0.51 H new ATOM 0 HB3 GLN A 96 -9.532 -10.191 12.969 1.00 0.51 H new ATOM 0 HG2 GLN A 96 -11.391 -8.878 13.815 1.00 0.59 H new ATOM 0 HG3 GLN A 96 -12.508 -10.211 13.598 1.00 0.59 H new ATOM 0 HE21 GLN A 96 -12.595 -9.068 15.979 1.00 1.87 H new ATOM 0 HE22 GLN A 96 -11.827 -10.075 17.210 1.00 1.87 H new ATOM 1124 N THR A 97 -12.413 -8.317 11.291 1.00 0.60 N ATOM 1125 CA THR A 97 -12.826 -6.953 10.962 1.00 0.56 C ATOM 1126 C THR A 97 -13.017 -6.100 12.217 1.00 0.57 C ATOM 1127 O THR A 97 -13.532 -6.581 13.228 1.00 0.65 O ATOM 1128 CB THR A 97 -14.090 -6.970 10.096 1.00 0.64 C ATOM 1129 OG1 THR A 97 -15.237 -7.344 10.836 1.00 0.81 O ATOM 1130 CG2 THR A 97 -13.990 -7.919 8.897 1.00 0.65 C ATOM 0 H THR A 97 -13.177 -8.881 11.664 1.00 0.60 H new ATOM 0 HA THR A 97 -12.025 -6.490 10.386 1.00 0.56 H new ATOM 0 HB THR A 97 -14.184 -5.945 9.737 1.00 0.64 H new ATOM 0 HG1 THR A 97 -16.021 -7.341 10.248 1.00 0.81 H new ATOM 0 HG21 THR A 97 -14.918 -7.883 8.326 1.00 0.65 H new ATOM 0 HG22 THR A 97 -13.160 -7.614 8.260 1.00 0.65 H new ATOM 0 HG23 THR A 97 -13.821 -8.936 9.251 1.00 0.65 H new ATOM 1138 N LEU A 98 -12.594 -4.835 12.168 1.00 0.53 N ATOM 1139 CA LEU A 98 -12.518 -3.954 13.342 1.00 0.56 C ATOM 1140 C LEU A 98 -13.760 -3.056 13.522 1.00 0.62 C ATOM 1141 O LEU A 98 -13.802 -2.238 14.440 1.00 0.76 O ATOM 1142 CB LEU A 98 -11.195 -3.154 13.309 1.00 0.55 C ATOM 1143 CG LEU A 98 -9.892 -3.910 13.657 1.00 0.51 C ATOM 1144 CD1 LEU A 98 -9.880 -4.463 15.080 1.00 0.54 C ATOM 1145 CD2 LEU A 98 -9.535 -5.060 12.721 1.00 0.44 C ATOM 0 H LEU A 98 -12.291 -4.386 11.304 1.00 0.53 H new ATOM 0 HA LEU A 98 -12.517 -4.585 14.231 1.00 0.56 H new ATOM 0 HB2 LEU A 98 -11.082 -2.733 12.310 1.00 0.55 H new ATOM 0 HB3 LEU A 98 -11.292 -2.316 13.999 1.00 0.55 H new ATOM 0 HG LEU A 98 -9.142 -3.127 13.541 1.00 0.51 H new ATOM 0 HD11 LEU A 98 -8.939 -4.982 15.261 1.00 0.54 H new ATOM 0 HD12 LEU A 98 -9.984 -3.643 15.790 1.00 0.54 H new ATOM 0 HD13 LEU A 98 -10.709 -5.160 15.207 1.00 0.54 H new ATOM 0 HD21 LEU A 98 -8.606 -5.523 13.052 1.00 0.44 H new ATOM 0 HD22 LEU A 98 -10.334 -5.801 12.733 1.00 0.44 H new ATOM 0 HD23 LEU A 98 -9.409 -4.679 11.708 1.00 0.44 H new ATOM 1157 N GLY A 99 -14.784 -3.182 12.671 1.00 0.57 N ATOM 1158 CA GLY A 99 -16.032 -2.416 12.776 1.00 0.61 C ATOM 1159 C GLY A 99 -15.893 -0.952 12.346 1.00 0.64 C ATOM 1160 O GLY A 99 -16.648 -0.107 12.826 1.00 0.73 O ATOM 0 H GLY A 99 -14.770 -3.826 11.880 1.00 0.57 H new ATOM 0 HA2 GLY A 99 -16.795 -2.895 12.162 1.00 0.61 H new ATOM 0 HA3 GLY A 99 -16.384 -2.451 13.807 1.00 0.61 H new ATOM 1164 N VAL A 100 -14.916 -0.651 11.478 1.00 0.61 N ATOM 1165 CA VAL A 100 -14.607 0.683 10.935 1.00 0.63 C ATOM 1166 C VAL A 100 -14.454 0.590 9.412 1.00 0.59 C ATOM 1167 O VAL A 100 -14.020 -0.443 8.891 1.00 0.54 O ATOM 1168 CB VAL A 100 -13.333 1.277 11.581 1.00 0.62 C ATOM 1169 CG1 VAL A 100 -13.000 2.694 11.081 1.00 1.09 C ATOM 1170 CG2 VAL A 100 -13.452 1.366 13.110 1.00 1.16 C ATOM 0 H VAL A 100 -14.287 -1.368 11.116 1.00 0.61 H new ATOM 0 HA VAL A 100 -15.431 1.355 11.174 1.00 0.63 H new ATOM 0 HB VAL A 100 -12.540 0.588 11.288 1.00 0.62 H new ATOM 0 HG11 VAL A 100 -12.096 3.051 11.574 1.00 1.09 H new ATOM 0 HG12 VAL A 100 -12.841 2.671 10.003 1.00 1.09 H new ATOM 0 HG13 VAL A 100 -13.828 3.365 11.311 1.00 1.09 H new ATOM 0 HG21 VAL A 100 -12.536 1.788 13.522 1.00 1.16 H new ATOM 0 HG22 VAL A 100 -14.296 2.004 13.373 1.00 1.16 H new ATOM 0 HG23 VAL A 100 -13.609 0.369 13.521 1.00 1.16 H new ATOM 1180 N ASN A 101 -14.799 1.662 8.699 1.00 0.64 N ATOM 1181 CA ASN A 101 -14.772 1.822 7.261 1.00 0.63 C ATOM 1182 C ASN A 101 -14.047 3.118 6.850 1.00 0.61 C ATOM 1183 O ASN A 101 -13.933 4.058 7.643 1.00 0.66 O ATOM 1184 CB ASN A 101 -16.249 1.831 6.835 1.00 0.74 C ATOM 1185 CG ASN A 101 -16.464 2.282 5.414 1.00 0.96 C ATOM 1186 OD1 ASN A 101 -17.004 3.345 5.144 1.00 1.42 O ATOM 1187 ND2 ASN A 101 -15.982 1.546 4.452 1.00 0.94 N ATOM 0 H ASN A 101 -15.132 2.508 9.161 1.00 0.64 H new ATOM 0 HA ASN A 101 -14.218 1.021 6.772 1.00 0.63 H new ATOM 0 HB2 ASN A 101 -16.659 0.828 6.955 1.00 0.74 H new ATOM 0 HB3 ASN A 101 -16.807 2.486 7.504 1.00 0.74 H new ATOM 0 HD21 ASN A 101 -16.057 1.859 3.484 1.00 0.94 H new ATOM 0 HD22 ASN A 101 -15.530 0.658 4.667 1.00 0.94 H new ATOM 1194 N ILE A 102 -13.568 3.153 5.603 1.00 0.57 N ATOM 1195 CA ILE A 102 -12.828 4.268 5.003 1.00 0.52 C ATOM 1196 C ILE A 102 -13.349 4.533 3.576 1.00 0.50 C ATOM 1197 O ILE A 102 -13.413 3.621 2.753 1.00 0.59 O ATOM 1198 CB ILE A 102 -11.304 3.964 5.015 1.00 0.49 C ATOM 1199 CG1 ILE A 102 -10.778 3.543 6.413 1.00 0.48 C ATOM 1200 CG2 ILE A 102 -10.569 5.219 4.533 1.00 0.48 C ATOM 1201 CD1 ILE A 102 -9.344 2.989 6.424 1.00 0.44 C ATOM 0 H ILE A 102 -13.690 2.373 4.957 1.00 0.57 H new ATOM 0 HA ILE A 102 -12.987 5.173 5.590 1.00 0.52 H new ATOM 0 HB ILE A 102 -11.119 3.116 4.355 1.00 0.49 H new ATOM 0 HG12 ILE A 102 -10.824 4.406 7.078 1.00 0.48 H new ATOM 0 HG13 ILE A 102 -11.447 2.788 6.825 1.00 0.48 H new ATOM 0 HG21 ILE A 102 -9.495 5.034 4.531 1.00 0.48 H new ATOM 0 HG22 ILE A 102 -10.896 5.467 3.523 1.00 0.48 H new ATOM 0 HG23 ILE A 102 -10.793 6.051 5.201 1.00 0.48 H new ATOM 0 HD11 ILE A 102 -9.065 2.722 7.443 1.00 0.44 H new ATOM 0 HD12 ILE A 102 -9.291 2.104 5.790 1.00 0.44 H new ATOM 0 HD13 ILE A 102 -8.658 3.747 6.047 1.00 0.44 H new ATOM 1213 N ASP A 103 -13.703 5.781 3.254 1.00 0.49 N ATOM 1214 CA ASP A 103 -14.101 6.191 1.894 1.00 0.51 C ATOM 1215 C ASP A 103 -12.894 6.151 0.927 1.00 0.47 C ATOM 1216 O ASP A 103 -11.818 6.586 1.340 1.00 0.46 O ATOM 1217 CB ASP A 103 -14.598 7.640 1.937 1.00 0.57 C ATOM 1218 CG ASP A 103 -15.427 7.989 0.713 1.00 0.75 C ATOM 1219 OD1 ASP A 103 -14.803 8.359 -0.299 1.00 1.81 O ATOM 1220 OD2 ASP A 103 -16.677 7.898 0.752 1.00 1.59 O ATOM 0 H ASP A 103 -13.723 6.544 3.931 1.00 0.49 H new ATOM 0 HA ASP A 103 -14.875 5.506 1.547 1.00 0.51 H new ATOM 0 HB2 ASP A 103 -15.195 7.793 2.836 1.00 0.57 H new ATOM 0 HB3 ASP A 103 -13.745 8.315 2.003 1.00 0.57 H new ATOM 1225 N PRO A 104 -12.995 5.732 -0.354 1.00 0.48 N ATOM 1226 CA PRO A 104 -11.834 5.737 -1.248 1.00 0.48 C ATOM 1227 C PRO A 104 -11.436 7.148 -1.719 1.00 0.52 C ATOM 1228 O PRO A 104 -10.279 7.362 -2.080 1.00 0.58 O ATOM 1229 CB PRO A 104 -12.215 4.800 -2.391 1.00 0.51 C ATOM 1230 CG PRO A 104 -13.730 4.949 -2.495 1.00 0.61 C ATOM 1231 CD PRO A 104 -14.191 5.335 -1.088 1.00 0.54 C ATOM 0 HA PRO A 104 -10.934 5.394 -0.737 1.00 0.48 H new ATOM 0 HB2 PRO A 104 -11.721 5.082 -3.321 1.00 0.51 H new ATOM 0 HB3 PRO A 104 -11.928 3.770 -2.177 1.00 0.51 H new ATOM 0 HG2 PRO A 104 -14.002 5.714 -3.222 1.00 0.61 H new ATOM 0 HG3 PRO A 104 -14.196 4.019 -2.821 1.00 0.61 H new ATOM 0 HD2 PRO A 104 -14.911 6.152 -1.126 1.00 0.54 H new ATOM 0 HD3 PRO A 104 -14.686 4.496 -0.598 1.00 0.54 H new ATOM 1239 N GLN A 105 -12.363 8.108 -1.680 1.00 0.54 N ATOM 1240 CA GLN A 105 -12.196 9.511 -2.063 1.00 0.61 C ATOM 1241 C GLN A 105 -11.825 10.394 -0.871 1.00 0.66 C ATOM 1242 O GLN A 105 -10.808 11.090 -0.899 1.00 0.76 O ATOM 1243 CB GLN A 105 -13.496 9.999 -2.733 1.00 0.66 C ATOM 1244 CG GLN A 105 -13.964 9.049 -3.832 1.00 0.67 C ATOM 1245 CD GLN A 105 -12.872 8.781 -4.863 1.00 0.73 C ATOM 1246 OE1 GLN A 105 -12.067 9.637 -5.221 1.00 1.41 O ATOM 1247 NE2 GLN A 105 -12.743 7.553 -5.295 1.00 0.79 N ATOM 0 H GLN A 105 -13.311 7.913 -1.359 1.00 0.54 H new ATOM 0 HA GLN A 105 -11.367 9.586 -2.767 1.00 0.61 H new ATOM 0 HB2 GLN A 105 -14.278 10.095 -1.980 1.00 0.66 H new ATOM 0 HB3 GLN A 105 -13.336 10.991 -3.155 1.00 0.66 H new ATOM 0 HG2 GLN A 105 -14.279 8.106 -3.385 1.00 0.67 H new ATOM 0 HG3 GLN A 105 -14.836 9.473 -4.330 1.00 0.67 H new ATOM 0 HE21 GLN A 105 -13.408 6.837 -5.002 1.00 0.79 H new ATOM 0 HE22 GLN A 105 -11.978 7.312 -5.925 1.00 0.79 H new ATOM 1256 N THR A 106 -12.621 10.336 0.199 1.00 0.68 N ATOM 1257 CA THR A 106 -12.429 11.183 1.394 1.00 0.73 C ATOM 1258 C THR A 106 -11.310 10.671 2.295 1.00 0.69 C ATOM 1259 O THR A 106 -10.733 11.440 3.065 1.00 0.76 O ATOM 1260 CB THR A 106 -13.731 11.367 2.206 1.00 0.78 C ATOM 1261 OG1 THR A 106 -13.999 10.313 3.090 1.00 0.74 O ATOM 1262 CG2 THR A 106 -14.952 11.508 1.314 1.00 0.81 C ATOM 0 H THR A 106 -13.418 9.703 0.268 1.00 0.68 H new ATOM 0 HA THR A 106 -12.133 12.161 1.014 1.00 0.73 H new ATOM 0 HB THR A 106 -13.552 12.281 2.772 1.00 0.78 H new ATOM 0 HG1 THR A 106 -14.904 10.412 3.452 1.00 0.74 H new ATOM 0 HG21 THR A 106 -15.841 11.635 1.932 1.00 0.81 H new ATOM 0 HG22 THR A 106 -14.832 12.378 0.668 1.00 0.81 H new ATOM 0 HG23 THR A 106 -15.060 10.613 0.701 1.00 0.81 H new ATOM 1270 N PHE A 107 -11.009 9.365 2.218 1.00 0.59 N ATOM 1271 CA PHE A 107 -10.098 8.659 3.134 1.00 0.56 C ATOM 1272 C PHE A 107 -10.484 8.845 4.623 1.00 0.59 C ATOM 1273 O PHE A 107 -9.672 8.587 5.515 1.00 0.63 O ATOM 1274 CB PHE A 107 -8.630 9.009 2.792 1.00 0.64 C ATOM 1275 CG PHE A 107 -7.865 8.105 1.830 1.00 0.53 C ATOM 1276 CD1 PHE A 107 -8.478 7.269 0.870 1.00 1.59 C ATOM 1277 CD2 PHE A 107 -6.461 8.125 1.901 1.00 1.60 C ATOM 1278 CE1 PHE A 107 -7.693 6.438 0.060 1.00 1.56 C ATOM 1279 CE2 PHE A 107 -5.677 7.326 1.054 1.00 1.63 C ATOM 1280 CZ PHE A 107 -6.293 6.457 0.145 1.00 0.56 C ATOM 0 H PHE A 107 -11.401 8.756 1.500 1.00 0.59 H new ATOM 0 HA PHE A 107 -10.203 7.585 2.981 1.00 0.56 H new ATOM 0 HB2 PHE A 107 -8.619 10.017 2.377 1.00 0.64 H new ATOM 0 HB3 PHE A 107 -8.072 9.043 3.728 1.00 0.64 H new ATOM 0 HD1 PHE A 107 -9.552 7.271 0.761 1.00 1.59 H new ATOM 0 HD2 PHE A 107 -5.976 8.768 2.621 1.00 1.60 H new ATOM 0 HE1 PHE A 107 -8.174 5.772 -0.641 1.00 1.56 H new ATOM 0 HE2 PHE A 107 -4.600 7.381 1.103 1.00 1.63 H new ATOM 0 HZ PHE A 107 -5.698 5.810 -0.482 1.00 0.56 H new ATOM 1290 N LYS A 108 -11.725 9.281 4.910 1.00 0.60 N ATOM 1291 CA LYS A 108 -12.189 9.604 6.264 1.00 0.67 C ATOM 1292 C LYS A 108 -12.740 8.366 6.971 1.00 0.63 C ATOM 1293 O LYS A 108 -13.457 7.556 6.368 1.00 0.68 O ATOM 1294 CB LYS A 108 -13.118 10.844 6.252 1.00 0.81 C ATOM 1295 CG LYS A 108 -14.635 10.583 6.138 1.00 0.86 C ATOM 1296 CD LYS A 108 -15.327 10.600 7.512 1.00 1.15 C ATOM 1297 CE LYS A 108 -16.699 9.912 7.541 1.00 1.52 C ATOM 1298 NZ LYS A 108 -17.630 10.446 6.519 1.00 2.57 N ATOM 0 H LYS A 108 -12.440 9.419 4.195 1.00 0.60 H new ATOM 0 HA LYS A 108 -11.342 9.906 6.880 1.00 0.67 H new ATOM 0 HB2 LYS A 108 -12.940 11.410 7.167 1.00 0.81 H new ATOM 0 HB3 LYS A 108 -12.821 11.482 5.420 1.00 0.81 H new ATOM 0 HG2 LYS A 108 -15.086 11.339 5.496 1.00 0.86 H new ATOM 0 HG3 LYS A 108 -14.802 9.618 5.660 1.00 0.86 H new ATOM 0 HD2 LYS A 108 -14.676 10.115 8.239 1.00 1.15 H new ATOM 0 HD3 LYS A 108 -15.447 11.635 7.832 1.00 1.15 H new ATOM 0 HE2 LYS A 108 -16.567 8.842 7.382 1.00 1.52 H new ATOM 0 HE3 LYS A 108 -17.142 10.036 8.529 1.00 1.52 H new ATOM 0 HZ1 LYS A 108 -18.540 9.946 6.583 1.00 2.57 H new ATOM 0 HZ2 LYS A 108 -17.780 11.462 6.683 1.00 2.57 H new ATOM 0 HZ3 LYS A 108 -17.224 10.305 5.572 1.00 2.57 H new ATOM 1312 N LEU A 109 -12.405 8.220 8.250 1.00 0.68 N ATOM 1313 CA LEU A 109 -12.798 7.076 9.074 1.00 0.73 C ATOM 1314 C LEU A 109 -14.250 7.196 9.539 1.00 0.81 C ATOM 1315 O LEU A 109 -14.712 8.270 9.926 1.00 0.86 O ATOM 1316 CB LEU A 109 -11.859 6.967 10.292 1.00 0.78 C ATOM 1317 CG LEU A 109 -10.444 6.475 9.942 1.00 0.66 C ATOM 1318 CD1 LEU A 109 -9.421 6.848 11.014 1.00 0.69 C ATOM 1319 CD2 LEU A 109 -10.421 4.956 9.848 1.00 0.59 C ATOM 0 H LEU A 109 -11.842 8.905 8.754 1.00 0.68 H new ATOM 0 HA LEU A 109 -12.716 6.174 8.467 1.00 0.73 H new ATOM 0 HB2 LEU A 109 -11.786 7.943 10.771 1.00 0.78 H new ATOM 0 HB3 LEU A 109 -12.301 6.286 11.020 1.00 0.78 H new ATOM 0 HG LEU A 109 -10.187 6.949 8.995 1.00 0.66 H new ATOM 0 HD11 LEU A 109 -8.438 6.479 10.722 1.00 0.69 H new ATOM 0 HD12 LEU A 109 -9.385 7.932 11.121 1.00 0.69 H new ATOM 0 HD13 LEU A 109 -9.710 6.399 11.964 1.00 0.69 H new ATOM 0 HD21 LEU A 109 -9.414 4.622 9.600 1.00 0.59 H new ATOM 0 HD22 LEU A 109 -10.720 4.528 10.805 1.00 0.59 H new ATOM 0 HD23 LEU A 109 -11.113 4.629 9.072 1.00 0.59 H new ATOM 1331 N SER A 110 -14.949 6.066 9.619 1.00 0.85 N ATOM 1332 CA SER A 110 -16.276 5.986 10.246 1.00 0.98 C ATOM 1333 C SER A 110 -16.247 6.089 11.790 1.00 1.13 C ATOM 1334 O SER A 110 -17.288 5.976 12.441 1.00 1.35 O ATOM 1335 CB SER A 110 -16.989 4.719 9.761 1.00 1.03 C ATOM 1336 OG SER A 110 -16.311 3.579 10.237 1.00 1.47 O ATOM 0 H SER A 110 -14.615 5.175 9.251 1.00 0.85 H new ATOM 0 HA SER A 110 -16.842 6.862 9.930 1.00 0.98 H new ATOM 0 HB2 SER A 110 -18.021 4.714 10.113 1.00 1.03 H new ATOM 0 HB3 SER A 110 -17.024 4.704 8.672 1.00 1.03 H new ATOM 0 HG SER A 110 -16.853 2.781 10.065 1.00 1.47 H new ATOM 1342 N GLY A 111 -15.076 6.316 12.398 1.00 1.12 N ATOM 1343 CA GLY A 111 -14.896 6.424 13.846 1.00 1.26 C ATOM 1344 C GLY A 111 -13.445 6.667 14.276 1.00 1.20 C ATOM 1345 O GLY A 111 -12.638 7.212 13.520 1.00 1.19 O ATOM 0 H GLY A 111 -14.205 6.432 11.879 1.00 1.12 H new ATOM 0 HA2 GLY A 111 -15.516 7.239 14.219 1.00 1.26 H new ATOM 0 HA3 GLY A 111 -15.255 5.509 14.316 1.00 1.26 H new ATOM 1349 N ALA A 112 -13.116 6.251 15.499 1.00 1.19 N ATOM 1350 CA ALA A 112 -11.773 6.317 16.076 1.00 1.14 C ATOM 1351 C ALA A 112 -10.884 5.125 15.656 1.00 0.98 C ATOM 1352 O ALA A 112 -11.384 4.065 15.265 1.00 0.97 O ATOM 1353 CB ALA A 112 -11.914 6.425 17.599 1.00 1.26 C ATOM 0 H ALA A 112 -13.800 5.845 16.137 1.00 1.19 H new ATOM 0 HA ALA A 112 -11.260 7.198 15.690 1.00 1.14 H new ATOM 0 HB1 ALA A 112 -10.924 6.476 18.053 1.00 1.26 H new ATOM 0 HB2 ALA A 112 -12.475 7.325 17.850 1.00 1.26 H new ATOM 0 HB3 ALA A 112 -12.443 5.551 17.978 1.00 1.26 H new ATOM 1359 N MET A 113 -9.562 5.290 15.778 1.00 0.96 N ATOM 1360 CA MET A 113 -8.536 4.310 15.382 1.00 0.87 C ATOM 1361 C MET A 113 -8.766 2.887 15.955 1.00 0.75 C ATOM 1362 O MET A 113 -9.154 2.744 17.121 1.00 0.85 O ATOM 1363 CB MET A 113 -7.149 4.846 15.792 1.00 1.05 C ATOM 1364 CG MET A 113 -6.476 5.642 14.667 1.00 1.08 C ATOM 1365 SD MET A 113 -5.496 4.617 13.528 1.00 1.58 S ATOM 1366 CE MET A 113 -5.752 5.523 11.984 1.00 1.25 C ATOM 0 H MET A 113 -9.159 6.141 16.170 1.00 0.96 H new ATOM 0 HA MET A 113 -8.601 4.196 14.300 1.00 0.87 H new ATOM 0 HB2 MET A 113 -7.253 5.481 16.671 1.00 1.05 H new ATOM 0 HB3 MET A 113 -6.509 4.011 16.076 1.00 1.05 H new ATOM 0 HG2 MET A 113 -7.242 6.169 14.099 1.00 1.08 H new ATOM 0 HG3 MET A 113 -5.828 6.400 15.108 1.00 1.08 H new ATOM 0 HE1 MET A 113 -4.911 5.345 11.314 1.00 1.25 H new ATOM 0 HE2 MET A 113 -6.672 5.182 11.510 1.00 1.25 H new ATOM 0 HE3 MET A 113 -5.827 6.589 12.196 1.00 1.25 H new ATOM 1376 N PRO A 114 -8.504 1.820 15.175 1.00 0.63 N ATOM 1377 CA PRO A 114 -8.768 0.425 15.555 1.00 0.53 C ATOM 1378 C PRO A 114 -7.820 -0.126 16.635 1.00 0.66 C ATOM 1379 O PRO A 114 -6.753 0.437 16.892 1.00 0.91 O ATOM 1380 CB PRO A 114 -8.592 -0.370 14.259 1.00 0.53 C ATOM 1381 CG PRO A 114 -7.541 0.436 13.510 1.00 0.72 C ATOM 1382 CD PRO A 114 -7.918 1.866 13.841 1.00 0.76 C ATOM 0 HA PRO A 114 -9.762 0.347 15.996 1.00 0.53 H new ATOM 0 HB2 PRO A 114 -8.258 -1.390 14.452 1.00 0.53 H new ATOM 0 HB3 PRO A 114 -9.524 -0.440 13.698 1.00 0.53 H new ATOM 0 HG2 PRO A 114 -6.532 0.196 13.845 1.00 0.72 H new ATOM 0 HG3 PRO A 114 -7.574 0.247 12.437 1.00 0.72 H new ATOM 0 HD2 PRO A 114 -7.044 2.517 13.820 1.00 0.76 H new ATOM 0 HD3 PRO A 114 -8.628 2.262 13.115 1.00 0.76 H new ATOM 1390 N ALA A 115 -8.172 -1.283 17.203 1.00 0.67 N ATOM 1391 CA ALA A 115 -7.427 -1.944 18.276 1.00 0.90 C ATOM 1392 C ALA A 115 -6.196 -2.755 17.843 1.00 0.96 C ATOM 1393 O ALA A 115 -5.135 -2.624 18.452 1.00 1.72 O ATOM 1394 CB ALA A 115 -8.411 -2.859 19.008 1.00 1.06 C ATOM 0 H ALA A 115 -9.006 -1.799 16.921 1.00 0.67 H new ATOM 0 HA ALA A 115 -7.016 -1.154 18.904 1.00 0.90 H new ATOM 0 HB1 ALA A 115 -7.895 -3.373 19.819 1.00 1.06 H new ATOM 0 HB2 ALA A 115 -9.227 -2.263 19.417 1.00 1.06 H new ATOM 0 HB3 ALA A 115 -8.813 -3.594 18.310 1.00 1.06 H new ATOM 1400 N THR A 116 -6.339 -3.608 16.823 1.00 0.58 N ATOM 1401 CA THR A 116 -5.327 -4.612 16.424 1.00 0.66 C ATOM 1402 C THR A 116 -5.064 -4.663 14.911 1.00 0.66 C ATOM 1403 O THR A 116 -4.401 -5.584 14.433 1.00 0.82 O ATOM 1404 CB THR A 116 -5.728 -6.008 16.938 1.00 0.72 C ATOM 1405 OG1 THR A 116 -7.025 -6.334 16.484 1.00 0.77 O ATOM 1406 CG2 THR A 116 -5.762 -6.077 18.464 1.00 0.80 C ATOM 0 H THR A 116 -7.173 -3.626 16.237 1.00 0.58 H new ATOM 0 HA THR A 116 -4.392 -4.296 16.886 1.00 0.66 H new ATOM 0 HB THR A 116 -4.978 -6.702 16.559 1.00 0.72 H new ATOM 0 HG1 THR A 116 -7.273 -7.223 16.813 1.00 0.77 H new ATOM 0 HG21 THR A 116 -6.050 -7.081 18.777 1.00 0.80 H new ATOM 0 HG22 THR A 116 -4.774 -5.843 18.861 1.00 0.80 H new ATOM 0 HG23 THR A 116 -6.486 -5.357 18.845 1.00 0.80 H new ATOM 1414 N ALA A 117 -5.579 -3.685 14.159 1.00 0.55 N ATOM 1415 CA ALA A 117 -5.598 -3.651 12.683 1.00 0.49 C ATOM 1416 C ALA A 117 -4.227 -3.812 11.981 1.00 0.41 C ATOM 1417 O ALA A 117 -3.197 -3.383 12.501 1.00 0.42 O ATOM 1418 CB ALA A 117 -6.235 -2.335 12.224 1.00 0.44 C ATOM 0 H ALA A 117 -6.013 -2.860 14.573 1.00 0.55 H new ATOM 0 HA ALA A 117 -6.176 -4.527 12.388 1.00 0.49 H new ATOM 0 HB1 ALA A 117 -6.254 -2.300 11.135 1.00 0.44 H new ATOM 0 HB2 ALA A 117 -7.254 -2.271 12.607 1.00 0.44 H new ATOM 0 HB3 ALA A 117 -5.651 -1.496 12.604 1.00 0.44 H new ATOM 1424 N MET A 118 -4.248 -4.337 10.750 1.00 0.34 N ATOM 1425 CA MET A 118 -3.101 -4.610 9.870 1.00 0.28 C ATOM 1426 C MET A 118 -2.541 -3.320 9.239 1.00 0.28 C ATOM 1427 O MET A 118 -3.059 -2.836 8.232 1.00 0.31 O ATOM 1428 CB MET A 118 -3.595 -5.599 8.794 1.00 0.28 C ATOM 1429 CG MET A 118 -2.541 -6.125 7.816 1.00 0.38 C ATOM 1430 SD MET A 118 -1.164 -7.052 8.546 1.00 1.52 S ATOM 1431 CE MET A 118 -0.781 -8.191 7.179 1.00 0.66 C ATOM 0 H MET A 118 -5.129 -4.602 10.310 1.00 0.34 H new ATOM 0 HA MET A 118 -2.276 -5.037 10.440 1.00 0.28 H new ATOM 0 HB2 MET A 118 -4.050 -6.452 9.297 1.00 0.28 H new ATOM 0 HB3 MET A 118 -4.382 -5.112 8.218 1.00 0.28 H new ATOM 0 HG2 MET A 118 -3.038 -6.766 7.088 1.00 0.38 H new ATOM 0 HG3 MET A 118 -2.131 -5.278 7.266 1.00 0.38 H new ATOM 0 HE1 MET A 118 0.284 -8.425 7.188 1.00 0.66 H new ATOM 0 HE2 MET A 118 -1.355 -9.110 7.299 1.00 0.66 H new ATOM 0 HE3 MET A 118 -1.042 -7.722 6.230 1.00 0.66 H new ATOM 1441 N LYS A 119 -1.488 -2.735 9.820 1.00 0.38 N ATOM 1442 CA LYS A 119 -0.907 -1.434 9.403 1.00 0.43 C ATOM 1443 C LYS A 119 0.596 -1.321 9.688 1.00 0.54 C ATOM 1444 O LYS A 119 1.082 -1.896 10.666 1.00 0.69 O ATOM 1445 CB LYS A 119 -1.677 -0.302 10.101 1.00 0.46 C ATOM 1446 CG LYS A 119 -1.669 -0.350 11.641 1.00 0.54 C ATOM 1447 CD LYS A 119 -2.901 0.382 12.188 1.00 0.64 C ATOM 1448 CE LYS A 119 -3.094 0.216 13.700 1.00 0.75 C ATOM 1449 NZ LYS A 119 -1.916 0.609 14.519 1.00 1.16 N ATOM 0 H LYS A 119 -0.998 -3.154 10.611 1.00 0.38 H new ATOM 0 HA LYS A 119 -1.010 -1.356 8.321 1.00 0.43 H new ATOM 0 HB2 LYS A 119 -1.256 0.652 9.782 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -2.712 -0.324 9.759 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -1.668 -1.385 11.982 1.00 0.54 H new ATOM 0 HG3 LYS A 119 -0.759 0.113 12.024 1.00 0.54 H new ATOM 0 HD2 LYS A 119 -2.815 1.443 11.956 1.00 0.64 H new ATOM 0 HD3 LYS A 119 -3.789 0.014 11.674 1.00 0.64 H new ATOM 0 HE2 LYS A 119 -3.952 0.812 14.012 1.00 0.75 H new ATOM 0 HE3 LYS A 119 -3.336 -0.826 13.910 1.00 0.75 H new ATOM 0 HZ1 LYS A 119 -2.130 0.466 15.527 1.00 1.16 H new ATOM 0 HZ2 LYS A 119 -1.098 0.025 14.253 1.00 1.16 H new ATOM 0 HZ3 LYS A 119 -1.695 1.611 14.351 1.00 1.16 H new ATOM 1463 N LYS A 120 1.325 -0.548 8.874 1.00 0.48 N ATOM 1464 CA LYS A 120 2.750 -0.212 9.087 1.00 0.48 C ATOM 1465 C LYS A 120 3.166 1.024 8.292 1.00 0.42 C ATOM 1466 O LYS A 120 2.514 1.389 7.317 1.00 0.49 O ATOM 1467 CB LYS A 120 3.672 -1.387 8.674 1.00 0.69 C ATOM 1468 CG LYS A 120 4.882 -1.520 9.623 1.00 0.49 C ATOM 1469 CD LYS A 120 6.092 -2.266 9.046 1.00 0.88 C ATOM 1470 CE LYS A 120 5.794 -3.627 8.410 1.00 1.89 C ATOM 1471 NZ LYS A 120 5.323 -4.637 9.383 1.00 3.20 N ATOM 0 H LYS A 120 0.938 -0.127 8.029 1.00 0.48 H new ATOM 0 HA LYS A 120 2.860 -0.010 10.153 1.00 0.48 H new ATOM 0 HB2 LYS A 120 3.102 -2.316 8.678 1.00 0.69 H new ATOM 0 HB3 LYS A 120 4.024 -1.233 7.654 1.00 0.69 H new ATOM 0 HG2 LYS A 120 5.201 -0.521 9.920 1.00 0.49 H new ATOM 0 HG3 LYS A 120 4.558 -2.034 10.528 1.00 0.49 H new ATOM 0 HD2 LYS A 120 6.563 -1.631 8.296 1.00 0.88 H new ATOM 0 HD3 LYS A 120 6.820 -2.411 9.844 1.00 0.88 H new ATOM 0 HE2 LYS A 120 5.039 -3.500 7.634 1.00 1.89 H new ATOM 0 HE3 LYS A 120 6.695 -3.997 7.921 1.00 1.89 H new ATOM 0 HZ1 LYS A 120 5.107 -5.524 8.885 1.00 3.20 H new ATOM 0 HZ2 LYS A 120 6.065 -4.809 10.091 1.00 3.20 H new ATOM 0 HZ3 LYS A 120 4.466 -4.289 9.857 1.00 3.20 H new ATOM 1485 N LEU A 121 4.286 1.622 8.689 1.00 0.43 N ATOM 1486 CA LEU A 121 4.991 2.644 7.914 1.00 0.46 C ATOM 1487 C LEU A 121 6.094 2.036 7.031 1.00 0.52 C ATOM 1488 O LEU A 121 6.683 1.018 7.407 1.00 0.60 O ATOM 1489 CB LEU A 121 5.597 3.701 8.848 1.00 0.52 C ATOM 1490 CG LEU A 121 4.532 4.491 9.625 1.00 0.50 C ATOM 1491 CD1 LEU A 121 4.367 4.026 11.068 1.00 0.61 C ATOM 1492 CD2 LEU A 121 4.896 5.969 9.626 1.00 0.63 C ATOM 0 H LEU A 121 4.740 1.407 9.577 1.00 0.43 H new ATOM 0 HA LEU A 121 4.258 3.115 7.258 1.00 0.46 H new ATOM 0 HB2 LEU A 121 6.268 3.213 9.555 1.00 0.52 H new ATOM 0 HB3 LEU A 121 6.201 4.394 8.262 1.00 0.52 H new ATOM 0 HG LEU A 121 3.584 4.316 9.117 1.00 0.50 H new ATOM 0 HD11 LEU A 121 3.600 4.626 11.558 1.00 0.61 H new ATOM 0 HD12 LEU A 121 4.071 2.977 11.081 1.00 0.61 H new ATOM 0 HD13 LEU A 121 5.312 4.142 11.598 1.00 0.61 H new ATOM 0 HD21 LEU A 121 4.141 6.529 10.177 1.00 0.63 H new ATOM 0 HD22 LEU A 121 5.867 6.104 10.102 1.00 0.63 H new ATOM 0 HD23 LEU A 121 4.941 6.333 8.600 1.00 0.63 H new ATOM 1504 N THR A 122 6.434 2.668 5.899 1.00 0.51 N ATOM 1505 CA THR A 122 7.656 2.306 5.145 1.00 0.53 C ATOM 1506 C THR A 122 8.882 2.689 5.979 1.00 0.54 C ATOM 1507 O THR A 122 8.972 3.820 6.465 1.00 0.57 O ATOM 1508 CB THR A 122 7.745 2.944 3.738 1.00 0.53 C ATOM 1509 OG1 THR A 122 7.236 4.260 3.730 1.00 0.54 O ATOM 1510 CG2 THR A 122 7.008 2.163 2.645 1.00 0.60 C ATOM 0 H THR A 122 5.891 3.425 5.484 1.00 0.51 H new ATOM 0 HA THR A 122 7.617 1.230 4.974 1.00 0.53 H new ATOM 0 HB THR A 122 8.811 2.931 3.512 1.00 0.53 H new ATOM 0 HG1 THR A 122 7.309 4.634 2.827 1.00 0.54 H new ATOM 0 HG21 THR A 122 7.120 2.678 1.691 1.00 0.60 H new ATOM 0 HG22 THR A 122 7.429 1.160 2.568 1.00 0.60 H new ATOM 0 HG23 THR A 122 5.950 2.094 2.898 1.00 0.60 H new ATOM 1518 N GLU A 123 9.824 1.764 6.187 1.00 0.54 N ATOM 1519 CA GLU A 123 10.968 2.012 7.091 1.00 0.58 C ATOM 1520 C GLU A 123 12.085 2.832 6.451 1.00 0.57 C ATOM 1521 O GLU A 123 12.413 3.916 6.929 1.00 0.68 O ATOM 1522 CB GLU A 123 11.554 0.736 7.716 1.00 0.62 C ATOM 1523 CG GLU A 123 11.550 -0.515 6.849 1.00 0.68 C ATOM 1524 CD GLU A 123 12.416 -1.620 7.481 1.00 1.05 C ATOM 1525 OE1 GLU A 123 12.281 -1.883 8.702 1.00 1.93 O ATOM 1526 OE2 GLU A 123 13.193 -2.284 6.752 1.00 2.10 O ATOM 0 H GLU A 123 9.824 0.843 5.750 1.00 0.54 H new ATOM 0 HA GLU A 123 10.531 2.605 7.894 1.00 0.58 H new ATOM 0 HB2 GLU A 123 12.583 0.943 8.010 1.00 0.62 H new ATOM 0 HB3 GLU A 123 10.999 0.519 8.629 1.00 0.62 H new ATOM 0 HG2 GLU A 123 10.528 -0.874 6.725 1.00 0.68 H new ATOM 0 HG3 GLU A 123 11.927 -0.275 5.855 1.00 0.68 H new ATOM 1533 N ALA A 124 12.660 2.311 5.371 1.00 0.55 N ATOM 1534 CA ALA A 124 13.737 2.943 4.618 1.00 0.66 C ATOM 1535 C ALA A 124 13.677 2.560 3.134 1.00 0.72 C ATOM 1536 O ALA A 124 13.926 3.416 2.287 1.00 1.04 O ATOM 1537 CB ALA A 124 15.071 2.531 5.246 1.00 0.78 C ATOM 0 H ALA A 124 12.380 1.410 4.984 1.00 0.55 H new ATOM 0 HA ALA A 124 13.630 4.027 4.665 1.00 0.66 H new ATOM 0 HB1 ALA A 124 15.890 2.994 4.696 1.00 0.78 H new ATOM 0 HB2 ALA A 124 15.100 2.858 6.285 1.00 0.78 H new ATOM 0 HB3 ALA A 124 15.173 1.447 5.204 1.00 0.78 H new ATOM 1543 N GLU A 125 13.319 1.305 2.823 1.00 0.76 N ATOM 1544 CA GLU A 125 13.146 0.823 1.449 1.00 1.14 C ATOM 1545 C GLU A 125 11.744 0.268 1.135 1.00 1.12 C ATOM 1546 O GLU A 125 11.445 -0.005 -0.031 1.00 1.90 O ATOM 1547 CB GLU A 125 14.220 -0.232 1.165 1.00 1.48 C ATOM 1548 CG GLU A 125 15.642 0.345 1.179 1.00 1.74 C ATOM 1549 CD GLU A 125 16.662 -0.657 0.632 1.00 2.70 C ATOM 1550 OE1 GLU A 125 16.795 -1.779 1.184 1.00 3.22 O ATOM 1551 OE2 GLU A 125 17.386 -0.338 -0.339 1.00 3.83 O ATOM 0 H GLU A 125 13.140 0.590 3.528 1.00 0.76 H new ATOM 0 HA GLU A 125 13.255 1.686 0.792 1.00 1.14 H new ATOM 0 HB2 GLU A 125 14.148 -1.026 1.909 1.00 1.48 H new ATOM 0 HB3 GLU A 125 14.027 -0.687 0.193 1.00 1.48 H new ATOM 0 HG2 GLU A 125 15.671 1.257 0.583 1.00 1.74 H new ATOM 0 HG3 GLU A 125 15.913 0.622 2.198 1.00 1.74 H new ATOM 1558 N GLY A 126 10.884 0.092 2.142 1.00 0.51 N ATOM 1559 CA GLY A 126 9.565 -0.537 2.025 1.00 0.53 C ATOM 1560 C GLY A 126 8.973 -0.926 3.388 1.00 0.53 C ATOM 1561 O GLY A 126 9.472 -0.492 4.426 1.00 0.61 O ATOM 0 H GLY A 126 11.094 0.394 3.094 1.00 0.51 H new ATOM 0 HA2 GLY A 126 8.884 0.147 1.519 1.00 0.53 H new ATOM 0 HA3 GLY A 126 9.645 -1.427 1.400 1.00 0.53 H new ATOM 1565 N ALA A 127 7.896 -1.714 3.385 1.00 0.53 N ATOM 1566 CA ALA A 127 7.302 -2.370 4.560 1.00 0.54 C ATOM 1567 C ALA A 127 6.785 -3.794 4.251 1.00 0.53 C ATOM 1568 O ALA A 127 6.057 -3.974 3.274 1.00 0.55 O ATOM 1569 CB ALA A 127 6.171 -1.490 5.097 1.00 0.52 C ATOM 0 H ALA A 127 7.388 -1.924 2.526 1.00 0.53 H new ATOM 0 HA ALA A 127 8.081 -2.486 5.314 1.00 0.54 H new ATOM 0 HB1 ALA A 127 5.722 -1.966 5.969 1.00 0.52 H new ATOM 0 HB2 ALA A 127 6.571 -0.516 5.381 1.00 0.52 H new ATOM 0 HB3 ALA A 127 5.413 -1.360 4.324 1.00 0.52 H new ATOM 1575 N LYS A 128 7.094 -4.785 5.104 1.00 0.53 N ATOM 1576 CA LYS A 128 6.639 -6.191 5.006 1.00 0.51 C ATOM 1577 C LYS A 128 5.315 -6.431 5.750 1.00 0.47 C ATOM 1578 O LYS A 128 5.178 -6.045 6.908 1.00 0.51 O ATOM 1579 CB LYS A 128 7.741 -7.129 5.550 1.00 0.53 C ATOM 1580 CG LYS A 128 7.386 -8.623 5.404 1.00 1.02 C ATOM 1581 CD LYS A 128 8.387 -9.553 6.108 1.00 0.98 C ATOM 1582 CE LYS A 128 7.915 -11.002 5.926 1.00 1.25 C ATOM 1583 NZ LYS A 128 8.744 -11.977 6.668 1.00 1.53 N ATOM 0 H LYS A 128 7.692 -4.627 5.915 1.00 0.53 H new ATOM 0 HA LYS A 128 6.454 -6.409 3.954 1.00 0.51 H new ATOM 0 HB2 LYS A 128 8.674 -6.929 5.022 1.00 0.53 H new ATOM 0 HB3 LYS A 128 7.916 -6.904 6.602 1.00 0.53 H new ATOM 0 HG2 LYS A 128 6.390 -8.795 5.813 1.00 1.02 H new ATOM 0 HG3 LYS A 128 7.345 -8.879 4.345 1.00 1.02 H new ATOM 0 HD2 LYS A 128 9.384 -9.424 5.688 1.00 0.98 H new ATOM 0 HD3 LYS A 128 8.453 -9.306 7.168 1.00 0.98 H new ATOM 0 HE2 LYS A 128 6.880 -11.086 6.258 1.00 1.25 H new ATOM 0 HE3 LYS A 128 7.930 -11.253 4.865 1.00 1.25 H new ATOM 0 HZ1 LYS A 128 8.378 -12.937 6.507 1.00 1.53 H new ATOM 0 HZ2 LYS A 128 9.728 -11.921 6.335 1.00 1.53 H new ATOM 0 HZ3 LYS A 128 8.710 -11.759 7.684 1.00 1.53 H new ATOM 1597 N PHE A 129 4.375 -7.130 5.115 1.00 0.45 N ATOM 1598 CA PHE A 129 3.110 -7.593 5.682 1.00 0.40 C ATOM 1599 C PHE A 129 3.001 -9.104 5.449 1.00 0.43 C ATOM 1600 O PHE A 129 3.171 -9.570 4.322 1.00 0.46 O ATOM 1601 CB PHE A 129 1.944 -6.847 5.012 1.00 0.39 C ATOM 1602 CG PHE A 129 1.821 -5.377 5.370 1.00 0.35 C ATOM 1603 CD1 PHE A 129 2.799 -4.461 4.948 1.00 1.63 C ATOM 1604 CD2 PHE A 129 0.728 -4.915 6.126 1.00 1.65 C ATOM 1605 CE1 PHE A 129 2.719 -3.120 5.342 1.00 1.70 C ATOM 1606 CE2 PHE A 129 0.622 -3.560 6.481 1.00 1.58 C ATOM 1607 CZ PHE A 129 1.626 -2.658 6.094 1.00 0.39 C ATOM 0 H PHE A 129 4.482 -7.403 4.138 1.00 0.45 H new ATOM 0 HA PHE A 129 3.070 -7.391 6.752 1.00 0.40 H new ATOM 0 HB2 PHE A 129 2.053 -6.932 3.931 1.00 0.39 H new ATOM 0 HB3 PHE A 129 1.013 -7.348 5.279 1.00 0.39 H new ATOM 0 HD1 PHE A 129 3.613 -4.791 4.319 1.00 1.63 H new ATOM 0 HD2 PHE A 129 -0.038 -5.610 6.437 1.00 1.65 H new ATOM 0 HE1 PHE A 129 3.506 -2.434 5.065 1.00 1.70 H new ATOM 0 HE2 PHE A 129 -0.228 -3.213 7.049 1.00 1.58 H new ATOM 0 HZ PHE A 129 1.559 -1.617 6.372 1.00 0.39 H new ATOM 1617 N ASN A 130 2.725 -9.885 6.490 1.00 0.50 N ATOM 1618 CA ASN A 130 2.621 -11.340 6.391 1.00 0.52 C ATOM 1619 C ASN A 130 1.223 -11.761 5.902 1.00 0.53 C ATOM 1620 O ASN A 130 0.214 -11.440 6.526 1.00 0.68 O ATOM 1621 CB ASN A 130 2.983 -11.937 7.755 1.00 0.64 C ATOM 1622 CG ASN A 130 3.148 -13.439 7.687 1.00 0.89 C ATOM 1623 OD1 ASN A 130 2.176 -14.202 8.113 1.00 1.67 O flip ATOM 1624 ND2 ASN A 130 4.166 -13.948 7.237 1.00 1.12 N flip ATOM 0 H ASN A 130 2.566 -9.525 7.431 1.00 0.50 H new ATOM 0 HA ASN A 130 3.318 -11.726 5.647 1.00 0.52 H new ATOM 0 HB2 ASN A 130 3.908 -11.486 8.115 1.00 0.64 H new ATOM 0 HB3 ASN A 130 2.205 -11.689 8.478 1.00 0.64 H new ATOM 0 HD21 ASN A 130 4.927 -13.357 6.903 1.00 1.12 H new ATOM 0 HD22 ASN A 130 4.253 -14.963 7.196 1.00 1.12 H new ATOM 1631 N THR A 131 1.155 -12.500 4.793 1.00 0.53 N ATOM 1632 CA THR A 131 -0.103 -12.918 4.141 1.00 0.54 C ATOM 1633 C THR A 131 -0.460 -14.382 4.400 1.00 0.56 C ATOM 1634 O THR A 131 -1.539 -14.822 3.999 1.00 0.61 O ATOM 1635 CB THR A 131 -0.039 -12.696 2.621 1.00 0.60 C ATOM 1636 OG1 THR A 131 1.152 -13.258 2.116 1.00 0.62 O ATOM 1637 CG2 THR A 131 -0.056 -11.212 2.268 1.00 0.65 C ATOM 0 H THR A 131 1.987 -12.835 4.307 1.00 0.53 H new ATOM 0 HA THR A 131 -0.879 -12.295 4.585 1.00 0.54 H new ATOM 0 HB THR A 131 -0.915 -13.172 2.179 1.00 0.60 H new ATOM 0 HG1 THR A 131 1.194 -13.119 1.147 1.00 0.62 H new ATOM 0 HG21 THR A 131 -0.009 -11.095 1.185 1.00 0.65 H new ATOM 0 HG22 THR A 131 -0.974 -10.759 2.643 1.00 0.65 H new ATOM 0 HG23 THR A 131 0.803 -10.720 2.723 1.00 0.65 H new ATOM 1645 N ALA A 132 0.388 -15.135 5.114 1.00 0.55 N ATOM 1646 CA ALA A 132 0.147 -16.535 5.501 1.00 0.56 C ATOM 1647 C ALA A 132 -1.165 -16.749 6.288 1.00 0.57 C ATOM 1648 O ALA A 132 -1.647 -17.877 6.419 1.00 0.74 O ATOM 1649 CB ALA A 132 1.330 -16.989 6.364 1.00 0.58 C ATOM 0 H ALA A 132 1.284 -14.780 5.448 1.00 0.55 H new ATOM 0 HA ALA A 132 0.050 -17.119 4.586 1.00 0.56 H new ATOM 0 HB1 ALA A 132 1.182 -18.025 6.668 1.00 0.58 H new ATOM 0 HB2 ALA A 132 2.252 -16.908 5.789 1.00 0.58 H new ATOM 0 HB3 ALA A 132 1.398 -16.357 7.250 1.00 0.58 H new ATOM 1655 N ASN A 133 -1.714 -15.665 6.834 1.00 0.57 N ATOM 1656 CA ASN A 133 -2.895 -15.625 7.686 1.00 0.66 C ATOM 1657 C ASN A 133 -4.209 -15.332 6.930 1.00 0.63 C ATOM 1658 O ASN A 133 -5.281 -15.587 7.483 1.00 0.74 O ATOM 1659 CB ASN A 133 -2.612 -14.554 8.748 1.00 0.94 C ATOM 1660 CG ASN A 133 -1.382 -14.825 9.582 1.00 0.92 C ATOM 1661 OD1 ASN A 133 -0.375 -14.134 9.491 1.00 1.89 O ATOM 1662 ND2 ASN A 133 -1.415 -15.837 10.404 1.00 1.53 N ATOM 0 H ASN A 133 -1.320 -14.736 6.682 1.00 0.57 H new ATOM 0 HA ASN A 133 -3.060 -16.610 8.124 1.00 0.66 H new ATOM 0 HB2 ASN A 133 -2.498 -13.589 8.254 1.00 0.94 H new ATOM 0 HB3 ASN A 133 -3.476 -14.475 9.408 1.00 0.94 H new ATOM 0 HD21 ASN A 133 -0.599 -16.057 10.976 1.00 1.53 H new ATOM 0 HD22 ASN A 133 -2.257 -16.409 10.475 1.00 1.53 H new ATOM 1669 N LEU A 134 -4.150 -14.803 5.695 1.00 0.59 N ATOM 1670 CA LEU A 134 -5.334 -14.450 4.909 1.00 0.59 C ATOM 1671 C LEU A 134 -5.861 -15.582 4.006 1.00 0.64 C ATOM 1672 O LEU A 134 -5.063 -16.329 3.431 1.00 0.68 O ATOM 1673 CB LEU A 134 -5.038 -13.229 4.014 1.00 0.53 C ATOM 1674 CG LEU A 134 -4.972 -11.839 4.661 1.00 0.49 C ATOM 1675 CD1 LEU A 134 -5.985 -11.650 5.786 1.00 0.54 C ATOM 1676 CD2 LEU A 134 -3.571 -11.487 5.136 1.00 0.50 C ATOM 0 H LEU A 134 -3.271 -14.609 5.216 1.00 0.59 H new ATOM 0 HA LEU A 134 -6.106 -14.234 5.647 1.00 0.59 H new ATOM 0 HB2 LEU A 134 -4.085 -13.407 3.516 1.00 0.53 H new ATOM 0 HB3 LEU A 134 -5.802 -13.196 3.237 1.00 0.53 H new ATOM 0 HG LEU A 134 -5.243 -11.143 3.867 1.00 0.49 H new ATOM 0 HD11 LEU A 134 -5.886 -10.647 6.200 1.00 0.54 H new ATOM 0 HD12 LEU A 134 -6.993 -11.782 5.394 1.00 0.54 H new ATOM 0 HD13 LEU A 134 -5.801 -12.386 6.569 1.00 0.54 H new ATOM 0 HD21 LEU A 134 -3.578 -10.494 5.586 1.00 0.50 H new ATOM 0 HD22 LEU A 134 -3.243 -12.218 5.875 1.00 0.50 H new ATOM 0 HD23 LEU A 134 -2.886 -11.496 4.288 1.00 0.50 H new ATOM 1688 N PRO A 135 -7.191 -15.648 3.794 1.00 0.66 N ATOM 1689 CA PRO A 135 -7.810 -16.486 2.770 1.00 0.73 C ATOM 1690 C PRO A 135 -7.830 -15.794 1.392 1.00 0.77 C ATOM 1691 O PRO A 135 -7.559 -14.593 1.261 1.00 0.71 O ATOM 1692 CB PRO A 135 -9.223 -16.752 3.279 1.00 0.76 C ATOM 1693 CG PRO A 135 -9.569 -15.452 4.012 1.00 0.73 C ATOM 1694 CD PRO A 135 -8.225 -14.983 4.581 1.00 0.66 C ATOM 0 HA PRO A 135 -7.249 -17.408 2.617 1.00 0.73 H new ATOM 0 HB2 PRO A 135 -9.916 -16.953 2.462 1.00 0.76 H new ATOM 0 HB3 PRO A 135 -9.257 -17.614 3.945 1.00 0.76 H new ATOM 0 HG2 PRO A 135 -9.996 -14.713 3.335 1.00 0.73 H new ATOM 0 HG3 PRO A 135 -10.301 -15.621 4.802 1.00 0.73 H new ATOM 0 HD2 PRO A 135 -8.130 -13.899 4.511 1.00 0.66 H new ATOM 0 HD3 PRO A 135 -8.138 -15.243 5.636 1.00 0.66 H new ATOM 1702 N ALA A 136 -8.196 -16.562 0.366 1.00 0.91 N ATOM 1703 CA ALA A 136 -8.155 -16.211 -1.050 1.00 0.97 C ATOM 1704 C ALA A 136 -9.289 -15.250 -1.455 1.00 0.98 C ATOM 1705 O ALA A 136 -10.316 -15.633 -2.027 1.00 1.17 O ATOM 1706 CB ALA A 136 -8.186 -17.534 -1.814 1.00 1.08 C ATOM 0 H ALA A 136 -8.552 -17.507 0.513 1.00 0.91 H new ATOM 0 HA ALA A 136 -7.249 -15.654 -1.289 1.00 0.97 H new ATOM 0 HB1 ALA A 136 -8.157 -17.336 -2.886 1.00 1.08 H new ATOM 0 HB2 ALA A 136 -7.322 -18.137 -1.533 1.00 1.08 H new ATOM 0 HB3 ALA A 136 -9.100 -18.074 -1.569 1.00 1.08 H new ATOM 1712 N ALA A 137 -9.092 -13.972 -1.142 1.00 0.85 N ATOM 1713 CA ALA A 137 -10.044 -12.896 -1.374 1.00 0.84 C ATOM 1714 C ALA A 137 -9.334 -11.649 -1.938 1.00 0.76 C ATOM 1715 O ALA A 137 -8.105 -11.622 -2.077 1.00 0.72 O ATOM 1716 CB ALA A 137 -10.774 -12.613 -0.052 1.00 0.80 C ATOM 0 H ALA A 137 -8.230 -13.648 -0.703 1.00 0.85 H new ATOM 0 HA ALA A 137 -10.778 -13.187 -2.125 1.00 0.84 H new ATOM 0 HB1 ALA A 137 -11.495 -11.809 -0.199 1.00 0.80 H new ATOM 0 HB2 ALA A 137 -11.296 -13.512 0.275 1.00 0.80 H new ATOM 0 HB3 ALA A 137 -10.050 -12.317 0.707 1.00 0.80 H new ATOM 1722 N LYS A 138 -10.108 -10.604 -2.244 1.00 0.76 N ATOM 1723 CA LYS A 138 -9.599 -9.282 -2.624 1.00 0.66 C ATOM 1724 C LYS A 138 -9.584 -8.313 -1.446 1.00 0.62 C ATOM 1725 O LYS A 138 -10.497 -8.239 -0.628 1.00 0.78 O ATOM 1726 CB LYS A 138 -10.352 -8.738 -3.844 1.00 0.65 C ATOM 1727 CG LYS A 138 -9.856 -9.467 -5.105 1.00 0.65 C ATOM 1728 CD LYS A 138 -10.594 -9.046 -6.374 1.00 0.80 C ATOM 1729 CE LYS A 138 -10.331 -7.574 -6.705 1.00 2.34 C ATOM 1730 NZ LYS A 138 -10.737 -7.257 -8.087 1.00 2.85 N ATOM 0 H LYS A 138 -11.127 -10.654 -2.234 1.00 0.76 H new ATOM 0 HA LYS A 138 -8.556 -9.394 -2.921 1.00 0.66 H new ATOM 0 HB2 LYS A 138 -11.425 -8.886 -3.721 1.00 0.65 H new ATOM 0 HB3 LYS A 138 -10.187 -7.665 -3.940 1.00 0.65 H new ATOM 0 HG2 LYS A 138 -8.790 -9.275 -5.232 1.00 0.65 H new ATOM 0 HG3 LYS A 138 -9.972 -10.542 -4.965 1.00 0.65 H new ATOM 0 HD2 LYS A 138 -10.275 -9.672 -7.208 1.00 0.80 H new ATOM 0 HD3 LYS A 138 -11.664 -9.207 -6.246 1.00 0.80 H new ATOM 0 HE2 LYS A 138 -10.877 -6.939 -6.008 1.00 2.34 H new ATOM 0 HE3 LYS A 138 -9.272 -7.353 -6.575 1.00 2.34 H new ATOM 0 HZ1 LYS A 138 -10.627 -6.237 -8.256 1.00 2.85 H new ATOM 0 HZ2 LYS A 138 -10.139 -7.785 -8.754 1.00 2.85 H new ATOM 0 HZ3 LYS A 138 -11.732 -7.525 -8.227 1.00 2.85 H new ATOM 1744 N TYR A 139 -8.520 -7.528 -1.400 1.00 0.47 N ATOM 1745 CA TYR A 139 -8.184 -6.605 -0.320 1.00 0.42 C ATOM 1746 C TYR A 139 -7.890 -5.215 -0.894 1.00 0.43 C ATOM 1747 O TYR A 139 -7.982 -4.986 -2.105 1.00 0.63 O ATOM 1748 CB TYR A 139 -7.007 -7.176 0.491 1.00 0.42 C ATOM 1749 CG TYR A 139 -7.273 -8.540 1.099 1.00 0.43 C ATOM 1750 CD1 TYR A 139 -6.991 -9.713 0.367 1.00 0.47 C ATOM 1751 CD2 TYR A 139 -7.821 -8.632 2.391 1.00 0.46 C ATOM 1752 CE1 TYR A 139 -7.290 -10.975 0.915 1.00 0.51 C ATOM 1753 CE2 TYR A 139 -8.110 -9.896 2.937 1.00 0.49 C ATOM 1754 CZ TYR A 139 -7.861 -11.065 2.197 1.00 0.51 C ATOM 1755 OH TYR A 139 -8.192 -12.268 2.730 1.00 0.55 O ATOM 0 H TYR A 139 -7.830 -7.514 -2.151 1.00 0.47 H new ATOM 0 HA TYR A 139 -9.027 -6.493 0.362 1.00 0.42 H new ATOM 0 HB2 TYR A 139 -6.133 -7.244 -0.157 1.00 0.42 H new ATOM 0 HB3 TYR A 139 -6.758 -6.477 1.290 1.00 0.42 H new ATOM 0 HD1 TYR A 139 -6.545 -9.643 -0.614 1.00 0.47 H new ATOM 0 HD2 TYR A 139 -8.019 -7.737 2.961 1.00 0.46 H new ATOM 0 HE1 TYR A 139 -7.081 -11.872 0.352 1.00 0.51 H new ATOM 0 HE2 TYR A 139 -8.526 -9.969 3.931 1.00 0.49 H new ATOM 0 HH TYR A 139 -7.917 -12.983 2.119 1.00 0.55 H new ATOM 1765 N LYS A 140 -7.612 -4.249 -0.023 1.00 0.35 N ATOM 1766 CA LYS A 140 -7.217 -2.877 -0.398 1.00 0.35 C ATOM 1767 C LYS A 140 -6.216 -2.273 0.586 1.00 0.30 C ATOM 1768 O LYS A 140 -6.257 -2.607 1.767 1.00 0.36 O ATOM 1769 CB LYS A 140 -8.466 -1.980 -0.496 1.00 0.47 C ATOM 1770 CG LYS A 140 -9.001 -1.785 -1.923 1.00 0.75 C ATOM 1771 CD LYS A 140 -10.519 -1.567 -1.967 1.00 0.63 C ATOM 1772 CE LYS A 140 -11.209 -2.788 -2.575 1.00 1.23 C ATOM 1773 NZ LYS A 140 -10.745 -4.057 -1.969 1.00 3.65 N ATOM 0 H LYS A 140 -7.653 -4.392 0.986 1.00 0.35 H new ATOM 0 HA LYS A 140 -6.725 -2.933 -1.369 1.00 0.35 H new ATOM 0 HB2 LYS A 140 -9.256 -2.411 0.119 1.00 0.47 H new ATOM 0 HB3 LYS A 140 -8.230 -1.003 -0.073 1.00 0.47 H new ATOM 0 HG2 LYS A 140 -8.503 -0.929 -2.379 1.00 0.75 H new ATOM 0 HG3 LYS A 140 -8.747 -2.659 -2.523 1.00 0.75 H new ATOM 0 HD2 LYS A 140 -10.898 -1.390 -0.960 1.00 0.63 H new ATOM 0 HD3 LYS A 140 -10.750 -0.679 -2.556 1.00 0.63 H new ATOM 0 HE2 LYS A 140 -12.287 -2.697 -2.441 1.00 1.23 H new ATOM 0 HE3 LYS A 140 -11.022 -2.811 -3.649 1.00 1.23 H new ATOM 0 HZ1 LYS A 140 -11.312 -4.846 -2.340 1.00 3.65 H new ATOM 0 HZ2 LYS A 140 -9.744 -4.209 -2.205 1.00 3.65 H new ATOM 0 HZ3 LYS A 140 -10.853 -4.008 -0.936 1.00 3.65 H new ATOM 1787 N ILE A 141 -5.379 -1.342 0.129 1.00 0.27 N ATOM 1788 CA ILE A 141 -4.467 -0.562 0.983 1.00 0.26 C ATOM 1789 C ILE A 141 -4.847 0.922 0.940 1.00 0.28 C ATOM 1790 O ILE A 141 -5.082 1.474 -0.137 1.00 0.32 O ATOM 1791 CB ILE A 141 -2.977 -0.804 0.638 1.00 0.26 C ATOM 1792 CG1 ILE A 141 -2.581 -2.295 0.732 1.00 0.29 C ATOM 1793 CG2 ILE A 141 -2.040 -0.046 1.591 1.00 0.31 C ATOM 1794 CD1 ILE A 141 -2.693 -2.994 -0.617 1.00 0.34 C ATOM 0 H ILE A 141 -5.310 -1.101 -0.860 1.00 0.27 H new ATOM 0 HA ILE A 141 -4.584 -0.911 2.009 1.00 0.26 H new ATOM 0 HB ILE A 141 -2.868 -0.447 -0.386 1.00 0.26 H new ATOM 0 HG12 ILE A 141 -1.559 -2.377 1.101 1.00 0.29 H new ATOM 0 HG13 ILE A 141 -3.223 -2.797 1.456 1.00 0.29 H new ATOM 0 HG21 ILE A 141 -1.004 -0.242 1.315 1.00 0.31 H new ATOM 0 HG22 ILE A 141 -2.238 1.024 1.521 1.00 0.31 H new ATOM 0 HG23 ILE A 141 -2.213 -0.381 2.614 1.00 0.31 H new ATOM 0 HD11 ILE A 141 -2.406 -4.040 -0.510 1.00 0.34 H new ATOM 0 HD12 ILE A 141 -3.721 -2.934 -0.973 1.00 0.34 H new ATOM 0 HD13 ILE A 141 -2.032 -2.508 -1.334 1.00 0.34 H new ATOM 1806 N TYR A 142 -4.891 1.545 2.119 1.00 0.27 N ATOM 1807 CA TYR A 142 -5.236 2.951 2.355 1.00 0.30 C ATOM 1808 C TYR A 142 -4.091 3.672 3.072 1.00 0.32 C ATOM 1809 O TYR A 142 -3.482 3.098 3.969 1.00 0.37 O ATOM 1810 CB TYR A 142 -6.520 3.023 3.193 1.00 0.35 C ATOM 1811 CG TYR A 142 -7.781 2.867 2.383 1.00 0.38 C ATOM 1812 CD1 TYR A 142 -8.198 1.595 1.945 1.00 1.69 C ATOM 1813 CD2 TYR A 142 -8.543 4.005 2.076 1.00 1.88 C ATOM 1814 CE1 TYR A 142 -9.380 1.458 1.194 1.00 1.67 C ATOM 1815 CE2 TYR A 142 -9.729 3.870 1.340 1.00 1.93 C ATOM 1816 CZ TYR A 142 -10.146 2.602 0.896 1.00 0.51 C ATOM 1817 OH TYR A 142 -11.293 2.494 0.186 1.00 0.62 O ATOM 0 H TYR A 142 -4.674 1.054 2.986 1.00 0.27 H new ATOM 0 HA TYR A 142 -5.400 3.446 1.398 1.00 0.30 H new ATOM 0 HB2 TYR A 142 -6.490 2.245 3.956 1.00 0.35 H new ATOM 0 HB3 TYR A 142 -6.550 3.980 3.715 1.00 0.35 H new ATOM 0 HD1 TYR A 142 -7.609 0.722 2.186 1.00 1.69 H new ATOM 0 HD2 TYR A 142 -8.217 4.981 2.405 1.00 1.88 H new ATOM 0 HE1 TYR A 142 -9.697 0.485 0.849 1.00 1.67 H new ATOM 0 HE2 TYR A 142 -10.324 4.742 1.113 1.00 1.93 H new ATOM 0 HH TYR A 142 -11.693 3.382 0.074 1.00 0.62 H new ATOM 1827 N GLU A 143 -3.812 4.924 2.706 1.00 0.38 N ATOM 1828 CA GLU A 143 -2.682 5.716 3.221 1.00 0.41 C ATOM 1829 C GLU A 143 -3.194 6.808 4.175 1.00 0.46 C ATOM 1830 O GLU A 143 -3.925 7.707 3.757 1.00 0.63 O ATOM 1831 CB GLU A 143 -1.894 6.261 2.019 1.00 0.49 C ATOM 1832 CG GLU A 143 -0.555 6.905 2.383 1.00 0.60 C ATOM 1833 CD GLU A 143 0.189 7.347 1.115 1.00 0.85 C ATOM 1834 OE1 GLU A 143 0.463 6.494 0.240 1.00 2.05 O ATOM 1835 OE2 GLU A 143 0.493 8.553 0.954 1.00 1.46 O ATOM 0 H GLU A 143 -4.377 5.433 2.026 1.00 0.38 H new ATOM 0 HA GLU A 143 -2.001 5.105 3.814 1.00 0.41 H new ATOM 0 HB2 GLU A 143 -1.713 5.446 1.318 1.00 0.49 H new ATOM 0 HB3 GLU A 143 -2.508 6.997 1.500 1.00 0.49 H new ATOM 0 HG2 GLU A 143 -0.722 7.764 3.032 1.00 0.60 H new ATOM 0 HG3 GLU A 143 0.056 6.197 2.943 1.00 0.60 H new ATOM 1842 N ILE A 144 -2.847 6.720 5.462 1.00 0.55 N ATOM 1843 CA ILE A 144 -3.435 7.533 6.542 1.00 0.55 C ATOM 1844 C ILE A 144 -2.352 8.409 7.183 1.00 0.61 C ATOM 1845 O ILE A 144 -1.440 7.904 7.835 1.00 0.70 O ATOM 1846 CB ILE A 144 -4.125 6.615 7.583 1.00 0.54 C ATOM 1847 CG1 ILE A 144 -5.108 5.581 6.978 1.00 0.53 C ATOM 1848 CG2 ILE A 144 -4.832 7.458 8.658 1.00 0.57 C ATOM 1849 CD1 ILE A 144 -6.298 6.142 6.184 1.00 0.51 C ATOM 0 H ILE A 144 -2.135 6.069 5.794 1.00 0.55 H new ATOM 0 HA ILE A 144 -4.197 8.194 6.130 1.00 0.55 H new ATOM 0 HB ILE A 144 -3.323 6.030 8.032 1.00 0.54 H new ATOM 0 HG12 ILE A 144 -4.543 4.918 6.322 1.00 0.53 H new ATOM 0 HG13 ILE A 144 -5.499 4.968 7.790 1.00 0.53 H new ATOM 0 HG21 ILE A 144 -5.311 6.798 9.381 1.00 0.57 H new ATOM 0 HG22 ILE A 144 -4.101 8.085 9.168 1.00 0.57 H new ATOM 0 HG23 ILE A 144 -5.586 8.089 8.188 1.00 0.57 H new ATOM 0 HD11 ILE A 144 -6.909 5.319 5.814 1.00 0.51 H new ATOM 0 HD12 ILE A 144 -6.900 6.778 6.832 1.00 0.51 H new ATOM 0 HD13 ILE A 144 -5.930 6.728 5.342 1.00 0.51 H new ATOM 1861 N HIS A 145 -2.456 9.730 7.042 1.00 0.75 N ATOM 1862 CA HIS A 145 -1.398 10.658 7.453 1.00 0.86 C ATOM 1863 C HIS A 145 -1.384 10.978 8.953 1.00 0.84 C ATOM 1864 O HIS A 145 -0.369 11.474 9.445 1.00 1.11 O ATOM 1865 CB HIS A 145 -1.441 11.927 6.587 1.00 1.20 C ATOM 1866 CG HIS A 145 -0.735 11.721 5.273 1.00 1.49 C ATOM 1867 ND1 HIS A 145 -1.220 11.043 4.181 1.00 3.18 N ATOM 1868 CD2 HIS A 145 0.556 12.074 4.985 1.00 2.34 C ATOM 1869 CE1 HIS A 145 -0.249 10.974 3.258 1.00 3.92 C ATOM 1870 NE2 HIS A 145 0.860 11.588 3.707 1.00 3.26 N ATOM 0 H HIS A 145 -3.274 10.188 6.640 1.00 0.75 H new ATOM 0 HA HIS A 145 -0.452 10.145 7.282 1.00 0.86 H new ATOM 0 HB2 HIS A 145 -2.478 12.209 6.404 1.00 1.20 H new ATOM 0 HB3 HIS A 145 -0.976 12.753 7.126 1.00 1.20 H new ATOM 0 HD2 HIS A 145 1.222 12.629 5.629 1.00 2.34 H new ATOM 0 HE1 HIS A 145 -0.344 10.495 2.295 1.00 3.92 H new ATOM 0 HE2 HIS A 145 1.748 11.681 3.214 1.00 3.26 H new ATOM 1878 N SER A 146 -2.435 10.651 9.712 1.00 0.81 N ATOM 1879 CA SER A 146 -2.459 10.880 11.167 1.00 0.96 C ATOM 1880 C SER A 146 -1.351 10.140 11.927 1.00 1.03 C ATOM 1881 O SER A 146 -0.833 10.664 12.913 1.00 1.42 O ATOM 1882 CB SER A 146 -3.829 10.545 11.755 1.00 1.17 C ATOM 1883 OG SER A 146 -4.244 9.232 11.456 1.00 2.05 O ATOM 0 H SER A 146 -3.286 10.225 9.344 1.00 0.81 H new ATOM 0 HA SER A 146 -2.263 11.944 11.300 1.00 0.96 H new ATOM 0 HB2 SER A 146 -3.797 10.674 12.837 1.00 1.17 H new ATOM 0 HB3 SER A 146 -4.566 11.251 11.372 1.00 1.17 H new ATOM 0 HG SER A 146 -5.124 9.068 11.856 1.00 2.05 H new ATOM 2086 N LYS A 162 -3.129 14.517 -2.484 1.00 1.53 N ATOM 2087 CA LYS A 162 -3.677 13.354 -1.766 1.00 1.35 C ATOM 2088 C LYS A 162 -3.330 12.009 -2.424 1.00 1.15 C ATOM 2089 O LYS A 162 -3.305 11.882 -3.652 1.00 1.23 O ATOM 2090 CB LYS A 162 -5.174 13.522 -1.418 1.00 1.58 C ATOM 2091 CG LYS A 162 -6.136 14.144 -2.447 1.00 1.89 C ATOM 2092 CD LYS A 162 -6.309 13.389 -3.772 1.00 1.98 C ATOM 2093 CE LYS A 162 -6.848 11.956 -3.631 1.00 1.35 C ATOM 2094 NZ LYS A 162 -8.249 11.906 -3.159 1.00 1.66 N ATOM 0 HA LYS A 162 -3.162 13.322 -0.806 1.00 1.35 H new ATOM 0 HB2 LYS A 162 -5.562 12.535 -1.166 1.00 1.58 H new ATOM 0 HB3 LYS A 162 -5.231 14.127 -0.513 1.00 1.58 H new ATOM 0 HG2 LYS A 162 -7.116 14.242 -1.981 1.00 1.89 H new ATOM 0 HG3 LYS A 162 -5.788 15.152 -2.673 1.00 1.89 H new ATOM 0 HD2 LYS A 162 -6.986 13.956 -4.411 1.00 1.98 H new ATOM 0 HD3 LYS A 162 -5.346 13.352 -4.281 1.00 1.98 H new ATOM 0 HE2 LYS A 162 -6.777 11.451 -4.595 1.00 1.35 H new ATOM 0 HE3 LYS A 162 -6.217 11.404 -2.935 1.00 1.35 H new ATOM 0 HZ1 LYS A 162 -8.555 10.915 -3.084 1.00 1.66 H new ATOM 0 HZ2 LYS A 162 -8.318 12.361 -2.226 1.00 1.66 H new ATOM 0 HZ3 LYS A 162 -8.861 12.407 -3.834 1.00 1.66 H new ATOM 2108 N ALA A 163 -3.077 10.991 -1.601 1.00 1.05 N ATOM 2109 CA ALA A 163 -2.934 9.607 -2.053 1.00 0.94 C ATOM 2110 C ALA A 163 -4.296 8.958 -2.340 1.00 0.86 C ATOM 2111 O ALA A 163 -5.335 9.370 -1.814 1.00 0.91 O ATOM 2112 CB ALA A 163 -2.117 8.793 -1.042 1.00 1.05 C ATOM 0 H ALA A 163 -2.965 11.105 -0.594 1.00 1.05 H new ATOM 0 HA ALA A 163 -2.388 9.616 -2.997 1.00 0.94 H new ATOM 0 HB1 ALA A 163 -2.021 7.766 -1.395 1.00 1.05 H new ATOM 0 HB2 ALA A 163 -1.126 9.234 -0.935 1.00 1.05 H new ATOM 0 HB3 ALA A 163 -2.623 8.799 -0.076 1.00 1.05 H new ATOM 2118 N VAL A 164 -4.256 7.917 -3.170 1.00 0.82 N ATOM 2119 CA VAL A 164 -5.400 7.109 -3.618 1.00 0.69 C ATOM 2120 C VAL A 164 -5.201 5.638 -3.246 1.00 0.70 C ATOM 2121 O VAL A 164 -4.054 5.195 -3.120 1.00 0.89 O ATOM 2122 CB VAL A 164 -5.669 7.262 -5.129 1.00 0.64 C ATOM 2123 CG1 VAL A 164 -6.592 8.453 -5.359 1.00 0.61 C ATOM 2124 CG2 VAL A 164 -4.396 7.437 -5.960 1.00 0.81 C ATOM 0 H VAL A 164 -3.377 7.593 -3.573 1.00 0.82 H new ATOM 0 HA VAL A 164 -6.282 7.485 -3.099 1.00 0.69 H new ATOM 0 HB VAL A 164 -6.136 6.335 -5.462 1.00 0.64 H new ATOM 0 HG11 VAL A 164 -6.784 8.564 -6.426 1.00 0.61 H new ATOM 0 HG12 VAL A 164 -7.534 8.290 -4.836 1.00 0.61 H new ATOM 0 HG13 VAL A 164 -6.119 9.359 -4.980 1.00 0.61 H new ATOM 0 HG21 VAL A 164 -4.660 7.539 -7.013 1.00 0.81 H new ATOM 0 HG22 VAL A 164 -3.866 8.331 -5.631 1.00 0.81 H new ATOM 0 HG23 VAL A 164 -3.754 6.566 -5.829 1.00 0.81 H new ATOM 2134 N PRO A 165 -6.286 4.874 -3.032 1.00 0.54 N ATOM 2135 CA PRO A 165 -6.200 3.514 -2.511 1.00 0.50 C ATOM 2136 C PRO A 165 -5.809 2.518 -3.613 1.00 0.48 C ATOM 2137 O PRO A 165 -6.044 2.766 -4.801 1.00 0.63 O ATOM 2138 CB PRO A 165 -7.574 3.254 -1.888 1.00 0.48 C ATOM 2139 CG PRO A 165 -8.521 4.065 -2.773 1.00 0.46 C ATOM 2140 CD PRO A 165 -7.679 5.259 -3.229 1.00 0.45 C ATOM 0 HA PRO A 165 -5.416 3.387 -1.765 1.00 0.50 H new ATOM 0 HB2 PRO A 165 -7.825 2.193 -1.896 1.00 0.48 H new ATOM 0 HB3 PRO A 165 -7.613 3.583 -0.850 1.00 0.48 H new ATOM 0 HG2 PRO A 165 -8.873 3.479 -3.622 1.00 0.46 H new ATOM 0 HG3 PRO A 165 -9.404 4.388 -2.221 1.00 0.46 H new ATOM 0 HD2 PRO A 165 -7.873 5.495 -4.275 1.00 0.45 H new ATOM 0 HD3 PRO A 165 -7.922 6.150 -2.650 1.00 0.45 H new ATOM 2148 N ILE A 166 -5.212 1.392 -3.220 1.00 0.40 N ATOM 2149 CA ILE A 166 -4.784 0.311 -4.130 1.00 0.40 C ATOM 2150 C ILE A 166 -5.686 -0.915 -3.934 1.00 0.44 C ATOM 2151 O ILE A 166 -5.882 -1.327 -2.793 1.00 0.49 O ATOM 2152 CB ILE A 166 -3.314 -0.115 -3.878 1.00 0.45 C ATOM 2153 CG1 ILE A 166 -2.313 1.018 -3.529 1.00 0.59 C ATOM 2154 CG2 ILE A 166 -2.810 -0.912 -5.098 1.00 0.57 C ATOM 2155 CD1 ILE A 166 -0.964 0.426 -3.104 1.00 1.90 C ATOM 0 H ILE A 166 -5.005 1.195 -2.241 1.00 0.40 H new ATOM 0 HA ILE A 166 -4.863 0.694 -5.147 1.00 0.40 H new ATOM 0 HB ILE A 166 -3.344 -0.721 -2.973 1.00 0.45 H new ATOM 0 HG12 ILE A 166 -2.176 1.670 -4.392 1.00 0.59 H new ATOM 0 HG13 ILE A 166 -2.717 1.634 -2.725 1.00 0.59 H new ATOM 0 HG21 ILE A 166 -1.777 -1.217 -4.932 1.00 0.57 H new ATOM 0 HG22 ILE A 166 -3.432 -1.797 -5.237 1.00 0.57 H new ATOM 0 HG23 ILE A 166 -2.865 -0.287 -5.989 1.00 0.57 H new ATOM 0 HD11 ILE A 166 -0.272 1.233 -2.862 1.00 1.90 H new ATOM 0 HD12 ILE A 166 -1.104 -0.206 -2.227 1.00 1.90 H new ATOM 0 HD13 ILE A 166 -0.555 -0.170 -3.920 1.00 1.90 H new ATOM 2167 N GLU A 167 -6.185 -1.535 -5.008 1.00 0.54 N ATOM 2168 CA GLU A 167 -6.856 -2.845 -4.963 1.00 0.58 C ATOM 2169 C GLU A 167 -5.862 -3.989 -5.248 1.00 0.59 C ATOM 2170 O GLU A 167 -5.028 -3.897 -6.157 1.00 0.67 O ATOM 2171 CB GLU A 167 -8.074 -2.868 -5.905 1.00 0.69 C ATOM 2172 CG GLU A 167 -8.901 -4.156 -5.758 1.00 1.93 C ATOM 2173 CD GLU A 167 -10.198 -4.110 -6.575 1.00 2.48 C ATOM 2174 OE1 GLU A 167 -10.179 -4.424 -7.790 1.00 2.75 O ATOM 2175 OE2 GLU A 167 -11.271 -3.826 -5.990 1.00 3.63 O ATOM 0 H GLU A 167 -6.135 -1.139 -5.947 1.00 0.54 H new ATOM 0 HA GLU A 167 -7.234 -3.007 -3.953 1.00 0.58 H new ATOM 0 HB2 GLU A 167 -8.708 -2.006 -5.697 1.00 0.69 H new ATOM 0 HB3 GLU A 167 -7.735 -2.772 -6.936 1.00 0.69 H new ATOM 0 HG2 GLU A 167 -8.302 -5.008 -6.079 1.00 1.93 H new ATOM 0 HG3 GLU A 167 -9.142 -4.313 -4.707 1.00 1.93 H new ATOM 2182 N ILE A 168 -5.950 -5.073 -4.467 1.00 0.57 N ATOM 2183 CA ILE A 168 -5.028 -6.217 -4.510 1.00 0.59 C ATOM 2184 C ILE A 168 -5.774 -7.550 -4.313 1.00 0.63 C ATOM 2185 O ILE A 168 -6.800 -7.613 -3.639 1.00 0.63 O ATOM 2186 CB ILE A 168 -3.884 -5.989 -3.484 1.00 0.54 C ATOM 2187 CG1 ILE A 168 -2.733 -6.997 -3.675 1.00 0.61 C ATOM 2188 CG2 ILE A 168 -4.395 -6.033 -2.031 1.00 0.51 C ATOM 2189 CD1 ILE A 168 -1.444 -6.628 -2.928 1.00 0.56 C ATOM 0 H ILE A 168 -6.685 -5.182 -3.768 1.00 0.57 H new ATOM 0 HA ILE A 168 -4.574 -6.289 -5.499 1.00 0.59 H new ATOM 0 HB ILE A 168 -3.496 -4.989 -3.675 1.00 0.54 H new ATOM 0 HG12 ILE A 168 -3.066 -7.979 -3.340 1.00 0.61 H new ATOM 0 HG13 ILE A 168 -2.512 -7.082 -4.739 1.00 0.61 H new ATOM 0 HG21 ILE A 168 -3.562 -5.869 -1.347 1.00 0.51 H new ATOM 0 HG22 ILE A 168 -5.143 -5.254 -1.885 1.00 0.51 H new ATOM 0 HG23 ILE A 168 -4.842 -7.007 -1.832 1.00 0.51 H new ATOM 0 HD11 ILE A 168 -0.685 -7.388 -3.115 1.00 0.56 H new ATOM 0 HD12 ILE A 168 -1.084 -5.661 -3.279 1.00 0.56 H new ATOM 0 HD13 ILE A 168 -1.646 -6.573 -1.858 1.00 0.56 H new ATOM 2201 N GLU A 169 -5.242 -8.627 -4.885 1.00 0.70 N ATOM 2202 CA GLU A 169 -5.646 -10.023 -4.658 1.00 0.71 C ATOM 2203 C GLU A 169 -4.417 -10.797 -4.136 1.00 0.73 C ATOM 2204 O GLU A 169 -3.284 -10.358 -4.348 1.00 0.80 O ATOM 2205 CB GLU A 169 -6.202 -10.600 -5.974 1.00 0.67 C ATOM 2206 CG GLU A 169 -6.988 -11.911 -5.819 1.00 0.79 C ATOM 2207 CD GLU A 169 -7.459 -12.446 -7.188 1.00 0.87 C ATOM 2208 OE1 GLU A 169 -6.666 -12.475 -8.164 1.00 1.75 O ATOM 2209 OE2 GLU A 169 -8.647 -12.828 -7.333 1.00 1.84 O ATOM 0 H GLU A 169 -4.477 -8.552 -5.555 1.00 0.70 H new ATOM 0 HA GLU A 169 -6.436 -10.104 -3.912 1.00 0.71 H new ATOM 0 HB2 GLU A 169 -6.851 -9.856 -6.436 1.00 0.67 H new ATOM 0 HB3 GLU A 169 -5.372 -10.769 -6.660 1.00 0.67 H new ATOM 0 HG2 GLU A 169 -6.362 -12.657 -5.330 1.00 0.79 H new ATOM 0 HG3 GLU A 169 -7.851 -11.746 -5.174 1.00 0.79 H new ATOM 2216 N LEU A 170 -4.589 -11.924 -3.439 1.00 0.71 N ATOM 2217 CA LEU A 170 -3.451 -12.663 -2.866 1.00 0.72 C ATOM 2218 C LEU A 170 -2.500 -13.259 -3.927 1.00 0.67 C ATOM 2219 O LEU A 170 -2.933 -13.519 -5.051 1.00 0.68 O ATOM 2220 CB LEU A 170 -3.959 -13.757 -1.919 1.00 0.73 C ATOM 2221 CG LEU A 170 -4.573 -13.268 -0.593 1.00 0.86 C ATOM 2222 CD1 LEU A 170 -4.435 -14.370 0.450 1.00 1.07 C ATOM 2223 CD2 LEU A 170 -3.930 -12.015 0.018 1.00 0.93 C ATOM 0 H LEU A 170 -5.499 -12.346 -3.256 1.00 0.71 H new ATOM 0 HA LEU A 170 -2.858 -11.937 -2.309 1.00 0.72 H new ATOM 0 HB2 LEU A 170 -4.707 -14.349 -2.447 1.00 0.73 H new ATOM 0 HB3 LEU A 170 -3.129 -14.425 -1.688 1.00 0.73 H new ATOM 0 HG LEU A 170 -5.603 -13.013 -0.845 1.00 0.86 H new ATOM 0 HD11 LEU A 170 -4.867 -14.035 1.393 1.00 1.07 H new ATOM 0 HD12 LEU A 170 -4.959 -15.262 0.108 1.00 1.07 H new ATOM 0 HD13 LEU A 170 -3.380 -14.603 0.596 1.00 1.07 H new ATOM 0 HD21 LEU A 170 -4.440 -11.761 0.947 1.00 0.93 H new ATOM 0 HD22 LEU A 170 -2.877 -12.209 0.223 1.00 0.93 H new ATOM 0 HD23 LEU A 170 -4.016 -11.184 -0.682 1.00 0.93 H new ATOM 2235 N PRO A 171 -1.214 -13.507 -3.598 1.00 0.68 N ATOM 2236 CA PRO A 171 -0.239 -13.990 -4.569 1.00 0.66 C ATOM 2237 C PRO A 171 -0.531 -15.428 -5.001 1.00 0.74 C ATOM 2238 O PRO A 171 -0.413 -16.367 -4.214 1.00 1.07 O ATOM 2239 CB PRO A 171 1.136 -13.859 -3.901 1.00 0.68 C ATOM 2240 CG PRO A 171 0.821 -13.906 -2.411 1.00 0.77 C ATOM 2241 CD PRO A 171 -0.566 -13.281 -2.313 1.00 0.77 C ATOM 0 HA PRO A 171 -0.280 -13.403 -5.487 1.00 0.66 H new ATOM 0 HB2 PRO A 171 1.803 -14.670 -4.195 1.00 0.68 H new ATOM 0 HB3 PRO A 171 1.628 -12.926 -4.177 1.00 0.68 H new ATOM 0 HG2 PRO A 171 0.827 -14.928 -2.033 1.00 0.77 H new ATOM 0 HG3 PRO A 171 1.554 -13.347 -1.829 1.00 0.77 H new ATOM 0 HD2 PRO A 171 -1.139 -13.734 -1.504 1.00 0.77 H new ATOM 0 HD3 PRO A 171 -0.497 -12.215 -2.096 1.00 0.77 H new ATOM 2249 N LEU A 172 -0.873 -15.583 -6.278 1.00 0.61 N ATOM 2250 CA LEU A 172 -0.970 -16.857 -7.005 1.00 0.66 C ATOM 2251 C LEU A 172 -0.032 -16.850 -8.237 1.00 0.74 C ATOM 2252 O LEU A 172 -0.246 -17.552 -9.226 1.00 1.35 O ATOM 2253 CB LEU A 172 -2.459 -17.115 -7.322 1.00 0.88 C ATOM 2254 CG LEU A 172 -2.833 -18.559 -7.711 1.00 1.30 C ATOM 2255 CD1 LEU A 172 -2.578 -19.549 -6.571 1.00 1.79 C ATOM 2256 CD2 LEU A 172 -4.319 -18.610 -8.068 1.00 2.89 C ATOM 0 H LEU A 172 -1.103 -14.784 -6.869 1.00 0.61 H new ATOM 0 HA LEU A 172 -0.622 -17.695 -6.402 1.00 0.66 H new ATOM 0 HB2 LEU A 172 -3.049 -16.832 -6.450 1.00 0.88 H new ATOM 0 HB3 LEU A 172 -2.755 -16.453 -8.136 1.00 0.88 H new ATOM 0 HG LEU A 172 -2.209 -18.844 -8.558 1.00 1.30 H new ATOM 0 HD11 LEU A 172 -2.856 -20.553 -6.892 1.00 1.79 H new ATOM 0 HD12 LEU A 172 -1.521 -19.533 -6.305 1.00 1.79 H new ATOM 0 HD13 LEU A 172 -3.175 -19.267 -5.704 1.00 1.79 H new ATOM 0 HD21 LEU A 172 -4.592 -19.628 -8.345 1.00 2.89 H new ATOM 0 HD22 LEU A 172 -4.911 -18.296 -7.208 1.00 2.89 H new ATOM 0 HD23 LEU A 172 -4.515 -17.942 -8.906 1.00 2.89 H new ATOM 2268 N ASN A 173 0.998 -16.003 -8.193 1.00 0.80 N ATOM 2269 CA ASN A 173 1.905 -15.641 -9.286 1.00 0.89 C ATOM 2270 C ASN A 173 3.276 -16.324 -9.104 1.00 1.09 C ATOM 2271 O ASN A 173 3.712 -16.532 -7.970 1.00 1.96 O ATOM 2272 CB ASN A 173 1.954 -14.100 -9.287 1.00 0.95 C ATOM 2273 CG ASN A 173 2.614 -13.434 -10.474 1.00 1.72 C ATOM 2274 OD1 ASN A 173 3.478 -13.963 -11.149 1.00 3.22 O ATOM 2275 ND2 ASN A 173 2.260 -12.200 -10.727 1.00 1.54 N ATOM 0 H ASN A 173 1.238 -15.516 -7.330 1.00 0.80 H new ATOM 0 HA ASN A 173 1.564 -15.991 -10.261 1.00 0.89 H new ATOM 0 HB2 ASN A 173 0.932 -13.729 -9.216 1.00 0.95 H new ATOM 0 HB3 ASN A 173 2.474 -13.777 -8.385 1.00 0.95 H new ATOM 0 HD21 ASN A 173 2.707 -11.687 -11.486 1.00 1.54 H new ATOM 0 HD22 ASN A 173 1.537 -11.751 -10.165 1.00 1.54 H new ATOM 2282 N ASP A 174 3.965 -16.661 -10.197 1.00 1.02 N ATOM 2283 CA ASP A 174 5.262 -17.356 -10.200 1.00 1.22 C ATOM 2284 C ASP A 174 6.428 -16.410 -9.814 1.00 1.04 C ATOM 2285 O ASP A 174 7.328 -16.158 -10.620 1.00 1.34 O ATOM 2286 CB ASP A 174 5.493 -18.035 -11.568 1.00 1.68 C ATOM 2287 CG ASP A 174 4.499 -19.144 -11.924 1.00 2.93 C ATOM 2288 OD1 ASP A 174 4.561 -20.251 -11.336 1.00 4.11 O ATOM 2289 OD2 ASP A 174 3.687 -18.950 -12.862 1.00 3.76 O ATOM 0 H ASP A 174 3.628 -16.452 -11.137 1.00 1.02 H new ATOM 0 HA ASP A 174 5.238 -18.132 -9.434 1.00 1.22 H new ATOM 0 HB2 ASP A 174 5.454 -17.272 -12.345 1.00 1.68 H new ATOM 0 HB3 ASP A 174 6.499 -18.453 -11.582 1.00 1.68 H new ATOM 2294 N VAL A 175 6.396 -15.852 -8.596 1.00 1.06 N ATOM 2295 CA VAL A 175 7.373 -14.913 -8.011 1.00 0.97 C ATOM 2296 C VAL A 175 7.981 -15.440 -6.707 1.00 0.98 C ATOM 2297 O VAL A 175 7.379 -16.279 -6.029 1.00 1.09 O ATOM 2298 CB VAL A 175 6.763 -13.514 -7.813 1.00 0.88 C ATOM 2299 CG1 VAL A 175 6.112 -12.976 -9.092 1.00 1.03 C ATOM 2300 CG2 VAL A 175 5.729 -13.466 -6.690 1.00 0.77 C ATOM 0 H VAL A 175 5.637 -16.056 -7.946 1.00 1.06 H new ATOM 0 HA VAL A 175 8.188 -14.825 -8.730 1.00 0.97 H new ATOM 0 HB VAL A 175 7.609 -12.883 -7.540 1.00 0.88 H new ATOM 0 HG11 VAL A 175 5.696 -11.987 -8.900 1.00 1.03 H new ATOM 0 HG12 VAL A 175 6.861 -12.908 -9.881 1.00 1.03 H new ATOM 0 HG13 VAL A 175 5.315 -13.650 -9.406 1.00 1.03 H new ATOM 0 HG21 VAL A 175 5.336 -12.453 -6.600 1.00 0.77 H new ATOM 0 HG22 VAL A 175 4.914 -14.153 -6.917 1.00 0.77 H new ATOM 0 HG23 VAL A 175 6.198 -13.758 -5.750 1.00 0.77 H new ATOM 2310 N VAL A 176 9.155 -14.931 -6.327 1.00 0.95 N ATOM 2311 CA VAL A 176 9.816 -15.252 -5.045 1.00 1.01 C ATOM 2312 C VAL A 176 9.260 -14.393 -3.910 1.00 0.80 C ATOM 2313 O VAL A 176 9.074 -14.878 -2.795 1.00 0.85 O ATOM 2314 CB VAL A 176 11.342 -15.066 -5.158 1.00 1.22 C ATOM 2315 CG1 VAL A 176 12.080 -15.408 -3.858 1.00 1.62 C ATOM 2316 CG2 VAL A 176 11.899 -15.974 -6.257 1.00 1.53 C ATOM 0 H VAL A 176 9.685 -14.276 -6.902 1.00 0.95 H new ATOM 0 HA VAL A 176 9.608 -16.297 -4.815 1.00 1.01 H new ATOM 0 HB VAL A 176 11.505 -14.013 -5.386 1.00 1.22 H new ATOM 0 HG11 VAL A 176 13.151 -15.258 -3.997 1.00 1.62 H new ATOM 0 HG12 VAL A 176 11.724 -14.760 -3.057 1.00 1.62 H new ATOM 0 HG13 VAL A 176 11.890 -16.449 -3.595 1.00 1.62 H new ATOM 0 HG21 VAL A 176 12.978 -15.837 -6.330 1.00 1.53 H new ATOM 0 HG22 VAL A 176 11.681 -17.014 -6.015 1.00 1.53 H new ATOM 0 HG23 VAL A 176 11.435 -15.719 -7.210 1.00 1.53 H new ATOM 2326 N ASP A 177 8.949 -13.129 -4.197 1.00 0.65 N ATOM 2327 CA ASP A 177 8.413 -12.170 -3.228 1.00 0.58 C ATOM 2328 C ASP A 177 7.359 -11.263 -3.887 1.00 0.46 C ATOM 2329 O ASP A 177 7.457 -10.976 -5.084 1.00 0.56 O ATOM 2330 CB ASP A 177 9.567 -11.368 -2.593 1.00 0.76 C ATOM 2331 CG ASP A 177 9.304 -10.959 -1.141 1.00 1.65 C ATOM 2332 OD1 ASP A 177 8.148 -11.047 -0.662 1.00 2.99 O ATOM 2333 OD2 ASP A 177 10.289 -10.627 -0.434 1.00 2.42 O ATOM 0 H ASP A 177 9.065 -12.733 -5.130 1.00 0.65 H new ATOM 0 HA ASP A 177 7.906 -12.707 -2.427 1.00 0.58 H new ATOM 0 HB2 ASP A 177 10.478 -11.965 -2.634 1.00 0.76 H new ATOM 0 HB3 ASP A 177 9.745 -10.472 -3.187 1.00 0.76 H new ATOM 2338 N ALA A 178 6.346 -10.829 -3.135 1.00 0.38 N ATOM 2339 CA ALA A 178 5.272 -9.968 -3.640 1.00 0.35 C ATOM 2340 C ALA A 178 5.531 -8.501 -3.284 1.00 0.33 C ATOM 2341 O ALA A 178 6.015 -8.209 -2.184 1.00 0.34 O ATOM 2342 CB ALA A 178 3.919 -10.436 -3.092 1.00 0.37 C ATOM 0 H ALA A 178 6.246 -11.067 -2.148 1.00 0.38 H new ATOM 0 HA ALA A 178 5.250 -10.044 -4.727 1.00 0.35 H new ATOM 0 HB1 ALA A 178 3.129 -9.789 -3.473 1.00 0.37 H new ATOM 0 HB2 ALA A 178 3.733 -11.462 -3.409 1.00 0.37 H new ATOM 0 HB3 ALA A 178 3.932 -10.390 -2.003 1.00 0.37 H new ATOM 2348 N HIS A 179 5.160 -7.577 -4.176 1.00 0.37 N ATOM 2349 CA HIS A 179 5.328 -6.140 -3.948 1.00 0.41 C ATOM 2350 C HIS A 179 4.086 -5.295 -4.286 1.00 0.42 C ATOM 2351 O HIS A 179 3.151 -5.768 -4.940 1.00 0.49 O ATOM 2352 CB HIS A 179 6.585 -5.607 -4.664 1.00 0.52 C ATOM 2353 CG HIS A 179 7.851 -6.378 -4.376 1.00 0.62 C ATOM 2354 ND1 HIS A 179 8.889 -5.977 -3.569 1.00 0.69 N ATOM 2355 CD2 HIS A 179 8.196 -7.594 -4.896 1.00 0.69 C ATOM 2356 CE1 HIS A 179 9.834 -6.933 -3.593 1.00 0.81 C ATOM 2357 NE2 HIS A 179 9.453 -7.951 -4.388 1.00 0.80 N ATOM 0 H HIS A 179 4.735 -7.805 -5.075 1.00 0.37 H new ATOM 0 HA HIS A 179 5.464 -6.029 -2.872 1.00 0.41 H new ATOM 0 HB2 HIS A 179 6.406 -5.618 -5.739 1.00 0.52 H new ATOM 0 HB3 HIS A 179 6.736 -4.567 -4.377 1.00 0.52 H new ATOM 0 HD1 HIS A 179 8.934 -5.104 -3.043 1.00 0.69 H new ATOM 0 HD2 HIS A 179 7.602 -8.180 -5.581 1.00 0.69 H new ATOM 0 HE1 HIS A 179 10.767 -6.891 -3.051 1.00 0.81 H new ATOM 2365 N VAL A 180 4.089 -4.033 -3.834 1.00 0.42 N ATOM 2366 CA VAL A 180 3.055 -3.004 -4.060 1.00 0.43 C ATOM 2367 C VAL A 180 3.674 -1.611 -4.205 1.00 0.41 C ATOM 2368 O VAL A 180 4.620 -1.306 -3.480 1.00 0.43 O ATOM 2369 CB VAL A 180 2.052 -2.891 -2.889 1.00 0.48 C ATOM 2370 CG1 VAL A 180 0.658 -2.726 -3.457 1.00 0.70 C ATOM 2371 CG2 VAL A 180 2.012 -4.020 -1.861 1.00 0.42 C ATOM 0 H VAL A 180 4.858 -3.678 -3.266 1.00 0.42 H new ATOM 0 HA VAL A 180 2.547 -3.323 -4.970 1.00 0.43 H new ATOM 0 HB VAL A 180 2.416 -2.031 -2.327 1.00 0.48 H new ATOM 0 HG11 VAL A 180 -0.060 -2.645 -2.641 1.00 0.70 H new ATOM 0 HG12 VAL A 180 0.618 -1.823 -4.067 1.00 0.70 H new ATOM 0 HG13 VAL A 180 0.411 -3.591 -4.073 1.00 0.70 H new ATOM 0 HG21 VAL A 180 1.260 -3.796 -1.104 1.00 0.42 H new ATOM 0 HG22 VAL A 180 1.759 -4.956 -2.358 1.00 0.42 H new ATOM 0 HG23 VAL A 180 2.989 -4.114 -1.386 1.00 0.42 H new ATOM 2381 N TYR A 181 3.087 -0.736 -5.029 1.00 0.44 N ATOM 2382 CA TYR A 181 3.609 0.614 -5.298 1.00 0.45 C ATOM 2383 C TYR A 181 2.515 1.716 -5.281 1.00 0.51 C ATOM 2384 O TYR A 181 2.010 2.107 -6.339 1.00 0.62 O ATOM 2385 CB TYR A 181 4.400 0.565 -6.615 1.00 0.50 C ATOM 2386 CG TYR A 181 5.699 -0.223 -6.508 1.00 0.52 C ATOM 2387 CD1 TYR A 181 6.841 0.409 -5.982 1.00 1.87 C ATOM 2388 CD2 TYR A 181 5.771 -1.581 -6.879 1.00 2.04 C ATOM 2389 CE1 TYR A 181 8.051 -0.293 -5.835 1.00 1.90 C ATOM 2390 CE2 TYR A 181 6.958 -2.312 -6.667 1.00 2.08 C ATOM 2391 CZ TYR A 181 8.102 -1.666 -6.148 1.00 0.72 C ATOM 2392 OH TYR A 181 9.262 -2.356 -6.002 1.00 0.88 O ATOM 0 H TYR A 181 2.226 -0.945 -5.535 1.00 0.44 H new ATOM 0 HA TYR A 181 4.275 0.907 -4.486 1.00 0.45 H new ATOM 0 HB2 TYR A 181 3.776 0.120 -7.390 1.00 0.50 H new ATOM 0 HB3 TYR A 181 4.626 1.583 -6.933 1.00 0.50 H new ATOM 0 HD1 TYR A 181 6.788 1.447 -5.687 1.00 1.87 H new ATOM 0 HD2 TYR A 181 4.915 -2.063 -7.327 1.00 2.04 H new ATOM 0 HE1 TYR A 181 8.936 0.217 -5.484 1.00 1.90 H new ATOM 0 HE2 TYR A 181 6.993 -3.366 -6.901 1.00 2.08 H new ATOM 0 HH TYR A 181 9.130 -3.085 -5.360 1.00 0.88 H new ATOM 2402 N PRO A 182 2.105 2.237 -4.101 1.00 0.49 N ATOM 2403 CA PRO A 182 1.178 3.369 -3.995 1.00 0.54 C ATOM 2404 C PRO A 182 1.753 4.681 -4.551 1.00 0.54 C ATOM 2405 O PRO A 182 2.946 4.967 -4.418 1.00 0.57 O ATOM 2406 CB PRO A 182 0.786 3.522 -2.519 1.00 0.59 C ATOM 2407 CG PRO A 182 1.732 2.587 -1.751 1.00 0.63 C ATOM 2408 CD PRO A 182 2.388 1.675 -2.794 1.00 0.52 C ATOM 0 HA PRO A 182 0.303 3.157 -4.610 1.00 0.54 H new ATOM 0 HB2 PRO A 182 0.898 4.554 -2.187 1.00 0.59 H new ATOM 0 HB3 PRO A 182 -0.256 3.246 -2.358 1.00 0.59 H new ATOM 0 HG2 PRO A 182 2.485 3.158 -1.208 1.00 0.63 H new ATOM 0 HG3 PRO A 182 1.183 2.001 -1.014 1.00 0.63 H new ATOM 0 HD2 PRO A 182 3.463 1.613 -2.628 1.00 0.52 H new ATOM 0 HD3 PRO A 182 1.995 0.661 -2.719 1.00 0.52 H new ATOM 2416 N LYS A 183 0.863 5.495 -5.127 1.00 0.62 N ATOM 2417 CA LYS A 183 1.131 6.743 -5.867 1.00 0.62 C ATOM 2418 C LYS A 183 0.348 7.921 -5.256 1.00 0.84 C ATOM 2419 O LYS A 183 -0.121 7.852 -4.116 1.00 1.58 O ATOM 2420 CB LYS A 183 0.792 6.499 -7.362 1.00 0.68 C ATOM 2421 CG LYS A 183 1.737 5.475 -8.016 1.00 0.66 C ATOM 2422 CD LYS A 183 1.637 5.396 -9.551 1.00 1.25 C ATOM 2423 CE LYS A 183 0.562 4.457 -10.122 1.00 1.15 C ATOM 2424 NZ LYS A 183 -0.803 5.039 -10.181 1.00 2.31 N ATOM 0 H LYS A 183 -0.135 5.289 -5.089 1.00 0.62 H new ATOM 0 HA LYS A 183 2.183 7.019 -5.792 1.00 0.62 H new ATOM 0 HB2 LYS A 183 -0.236 6.147 -7.446 1.00 0.68 H new ATOM 0 HB3 LYS A 183 0.851 7.443 -7.904 1.00 0.68 H new ATOM 0 HG2 LYS A 183 2.763 5.723 -7.745 1.00 0.66 H new ATOM 0 HG3 LYS A 183 1.527 4.490 -7.601 1.00 0.66 H new ATOM 0 HD2 LYS A 183 1.450 6.400 -9.933 1.00 1.25 H new ATOM 0 HD3 LYS A 183 2.606 5.082 -9.940 1.00 1.25 H new ATOM 0 HE2 LYS A 183 0.858 4.157 -11.127 1.00 1.15 H new ATOM 0 HE3 LYS A 183 0.530 3.552 -9.515 1.00 1.15 H new ATOM 0 HZ1 LYS A 183 -1.462 4.339 -10.578 1.00 2.31 H new ATOM 0 HZ2 LYS A 183 -1.111 5.300 -9.223 1.00 2.31 H new ATOM 0 HZ3 LYS A 183 -0.793 5.886 -10.784 1.00 2.31 H new ATOM 2438 N ASN A 184 0.245 9.034 -5.981 0.49 0.47 N ATOM 2439 CA ASN A 184 -0.649 10.153 -5.679 0.49 0.53 C ATOM 2440 C ASN A 184 -1.393 10.613 -6.953 0.49 0.55 C ATOM 2441 O ASN A 184 -1.105 10.142 -8.057 0.49 0.61 O ATOM 2442 CB ASN A 184 0.083 11.221 -4.854 0.49 0.77 C ATOM 2443 CG ASN A 184 0.748 12.332 -5.625 0.49 1.90 C ATOM 2444 OD1 ASN A 184 0.748 12.433 -6.837 0.49 3.60 O ATOM 2445 ND2 ASN A 184 1.293 13.270 -4.916 0.49 2.09 N ATOM 0 H ASN A 184 0.800 9.187 -6.823 0.49 0.47 H new ATOM 0 HA ASN A 184 -1.460 9.847 -5.019 0.49 0.53 H new ATOM 0 HB2 ASN A 184 -0.632 11.667 -4.163 0.49 0.77 H new ATOM 0 HB3 ASN A 184 0.842 10.724 -4.250 0.49 0.77 H new ATOM 0 HD21 ASN A 184 1.714 14.078 -5.376 0.49 2.09 H new ATOM 0 HD22 ASN A 184 1.301 13.201 -3.898 0.49 2.09 H new ATOM 2452 N THR A 185 -2.390 11.481 -6.790 0.49 0.64 N ATOM 2453 CA THR A 185 -3.250 11.969 -7.883 0.49 0.80 C ATOM 2454 C THR A 185 -3.439 13.490 -7.788 0.49 1.01 C ATOM 2455 O THR A 185 -2.757 14.165 -7.018 0.49 2.09 O ATOM 2456 CB THR A 185 -4.575 11.173 -7.879 0.49 1.00 C ATOM 2457 OG1 THR A 185 -5.355 11.414 -9.030 0.49 1.36 O ATOM 2458 CG2 THR A 185 -5.453 11.485 -6.674 0.49 1.16 C ATOM 0 H THR A 185 -2.632 11.876 -5.881 0.49 0.64 H new ATOM 0 HA THR A 185 -2.775 11.796 -8.849 0.49 0.80 H new ATOM 0 HB THR A 185 -4.257 10.131 -7.847 0.49 1.00 H new ATOM 0 HG1 THR A 185 -6.180 10.888 -8.982 0.49 1.36 H new ATOM 0 HG21 THR A 185 -6.368 10.895 -6.728 0.49 1.16 H new ATOM 0 HG22 THR A 185 -4.916 11.238 -5.758 0.49 1.16 H new ATOM 0 HG23 THR A 185 -5.704 12.546 -6.672 0.49 1.16 H new