USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=35 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 41 LYS NZ :NH3+ -148:sc= 2.87 (180deg=-0.169) USER MOD Set 1.2: A 184 ASN : amide:sc= 1.01 K(o=3.9,f=-9.5!) USER MOD Set 2.1: A 40 HIS : no HE2:sc= 1.75 K(o=1.9,f=-7.7!) USER MOD Set 2.2: A 179 HIS : no HE2:sc= 0.18 K(o=1.9,f=-5.1!) USER MOD Set 3.1: A 88 ASN : amide:sc= 0.255 K(o=0.5,f=-0.098) USER MOD Set 3.2: A 142 TYR OH : rot 180:sc= 0.246 USER MOD Set 4.1: A 86 THR OG1 : rot 119:sc= 0.963 USER MOD Set 4.2: A 140 LYS NZ :NH3+ 158:sc= 0.322 (180deg=0.164) USER MOD Single : A 32 THR OG1 : rot -22:sc= 0.267 USER MOD Single : A 33 THR OG1 : rot 163:sc= 1.28 USER MOD Single : A 34 THR OG1 : rot 120:sc= -0.0552 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0147 USER MOD Single : A 36 SER OG : rot 9:sc= -0.474 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 170:sc= -0.485 (180deg=-0.72) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.707 K(o=0.71,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=-0.26) USER MOD Single : A 61 TYR OH : rot 180:sc= 0.179 USER MOD Single : A 64 ASN : amide:sc= 0.201 X(o=0.2,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 176:sc= 1.01 (180deg=1) USER MOD Single : A 72 ASN : amide:sc= 0.103 K(o=0.1,f=-3.3) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl -164:sc= 0 (180deg=-0.283) USER MOD Single : A 84 THR OG1 : rot -152:sc= 0.682 USER MOD Single : A 85 ASN : amide:sc= -0.0493 X(o=-0.049,f=-0.38) USER MOD Single : A 87 ASN : amide:sc= -0.0156 X(o=-0.016,f=-0.018) USER MOD Single : A 94 ASN : amide:sc= 1 K(o=1,f=0) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.826 X(o=-0.83,f=-0.5) USER MOD Single : A 105 GLN : amide:sc= -0.315 X(o=-0.31,f=-0.15) USER MOD Single : A 106 THR OG1 : rot -150:sc= -0.0196 USER MOD Single : A 108 LYS NZ :NH3+ 172:sc= 0.801 (180deg=0.77) USER MOD Single : A 110 SER OG : rot 180:sc= 0.383 USER MOD Single : A 113 MET CE :methyl 176:sc= -0.448 (180deg=-0.463) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.191 USER MOD Single : A 118 MET CE :methyl 152:sc= -0.191 (180deg=-1.77!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 THR OG1 : rot 163:sc= -0.0497 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 ASN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0.0144 USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 TYR OH : rot 14:sc= 1.15 USER MOD Single : A 145 HIS : no HD1:sc= -0.0775 X(o=-0.078,f=-0.11) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ 171:sc= 0.658 (180deg=0.582) USER MOD Single : A 173 ASN : amide:sc= 0 K(o=0,f=-3.1!) USER MOD Single : A 181 TYR OH : rot 130:sc= 0.332 USER MOD Single : A 183 LYS NZ :NH3+ 152:sc= -0.565 (180deg=-1.62!) USER MOD Single : A 185 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 167 N THR A 32 -1.185 -19.737 -1.521 1.00 1.06 N ATOM 168 CA THR A 32 -0.477 -18.662 -2.243 1.00 0.85 C ATOM 169 C THR A 32 0.970 -19.009 -2.616 1.00 0.84 C ATOM 170 O THR A 32 1.548 -19.978 -2.113 1.00 0.92 O ATOM 171 CB THR A 32 -0.442 -17.395 -1.376 1.00 0.86 C ATOM 172 OG1 THR A 32 -0.038 -17.694 -0.060 1.00 1.08 O ATOM 173 CG2 THR A 32 -1.779 -16.678 -1.286 1.00 0.89 C ATOM 0 HA THR A 32 -1.033 -18.514 -3.169 1.00 0.85 H new ATOM 0 HB THR A 32 0.272 -16.739 -1.873 1.00 0.86 H new ATOM 0 HG1 THR A 32 -0.197 -18.644 0.123 1.00 1.08 H new ATOM 0 HG21 THR A 32 -1.676 -15.793 -0.657 1.00 0.89 H new ATOM 0 HG22 THR A 32 -2.099 -16.379 -2.284 1.00 0.89 H new ATOM 0 HG23 THR A 32 -2.522 -17.347 -0.852 1.00 0.89 H new ATOM 181 N THR A 33 1.583 -18.205 -3.493 1.00 0.87 N ATOM 182 CA THR A 33 2.952 -18.417 -4.014 1.00 0.99 C ATOM 183 C THR A 33 4.048 -17.714 -3.203 1.00 0.99 C ATOM 184 O THR A 33 5.232 -17.972 -3.414 1.00 1.33 O ATOM 185 CB THR A 33 3.055 -18.029 -5.496 1.00 1.23 C ATOM 186 OG1 THR A 33 2.734 -16.672 -5.673 1.00 1.72 O ATOM 187 CG2 THR A 33 2.097 -18.847 -6.363 1.00 1.47 C ATOM 0 H THR A 33 1.138 -17.370 -3.872 1.00 0.87 H new ATOM 0 HA THR A 33 3.132 -19.487 -3.908 1.00 0.99 H new ATOM 0 HB THR A 33 4.083 -18.227 -5.800 1.00 1.23 H new ATOM 0 HG1 THR A 33 3.059 -16.370 -6.547 1.00 1.72 H new ATOM 0 HG21 THR A 33 2.200 -18.543 -7.405 1.00 1.47 H new ATOM 0 HG22 THR A 33 2.335 -19.906 -6.269 1.00 1.47 H new ATOM 0 HG23 THR A 33 1.072 -18.675 -6.034 1.00 1.47 H new ATOM 195 N THR A 34 3.681 -16.851 -2.252 1.00 0.81 N ATOM 196 CA THR A 34 4.566 -16.262 -1.233 1.00 0.76 C ATOM 197 C THR A 34 3.769 -16.022 0.058 1.00 0.61 C ATOM 198 O THR A 34 2.548 -15.876 0.006 1.00 0.65 O ATOM 199 CB THR A 34 5.257 -14.979 -1.735 1.00 0.92 C ATOM 200 OG1 THR A 34 6.188 -14.532 -0.778 1.00 1.80 O ATOM 201 CG2 THR A 34 4.300 -13.830 -2.019 1.00 1.42 C ATOM 0 H THR A 34 2.718 -16.527 -2.164 1.00 0.81 H new ATOM 0 HA THR A 34 5.370 -16.967 -1.021 1.00 0.76 H new ATOM 0 HB THR A 34 5.735 -15.255 -2.675 1.00 0.92 H new ATOM 0 HG1 THR A 34 7.084 -14.516 -1.175 1.00 1.80 H new ATOM 0 HG21 THR A 34 4.864 -12.965 -2.368 1.00 1.42 H new ATOM 0 HG22 THR A 34 3.587 -14.132 -2.786 1.00 1.42 H new ATOM 0 HG23 THR A 34 3.763 -13.570 -1.107 1.00 1.42 H new ATOM 209 N THR A 35 4.439 -15.993 1.212 1.00 0.58 N ATOM 210 CA THR A 35 3.840 -15.865 2.563 1.00 0.54 C ATOM 211 C THR A 35 3.862 -14.444 3.130 1.00 0.47 C ATOM 212 O THR A 35 3.419 -14.200 4.256 1.00 0.48 O ATOM 213 CB THR A 35 4.543 -16.806 3.550 1.00 0.69 C ATOM 214 OG1 THR A 35 5.947 -16.688 3.419 1.00 0.81 O ATOM 215 CG2 THR A 35 4.140 -18.259 3.299 1.00 0.86 C ATOM 0 H THR A 35 5.456 -16.060 1.243 1.00 0.58 H new ATOM 0 HA THR A 35 2.792 -16.139 2.440 1.00 0.54 H new ATOM 0 HB THR A 35 4.240 -16.522 4.558 1.00 0.69 H new ATOM 0 HG1 THR A 35 6.387 -17.291 4.054 1.00 0.81 H new ATOM 0 HG21 THR A 35 4.651 -18.907 4.011 1.00 0.86 H new ATOM 0 HG22 THR A 35 3.062 -18.364 3.422 1.00 0.86 H new ATOM 0 HG23 THR A 35 4.419 -18.544 2.284 1.00 0.86 H new ATOM 223 N SER A 36 4.411 -13.490 2.386 1.00 0.48 N ATOM 224 CA SER A 36 4.485 -12.075 2.746 1.00 0.45 C ATOM 225 C SER A 36 4.507 -11.202 1.493 1.00 0.44 C ATOM 226 O SER A 36 4.864 -11.657 0.406 1.00 0.56 O ATOM 227 CB SER A 36 5.734 -11.804 3.591 1.00 0.55 C ATOM 228 OG SER A 36 5.618 -12.429 4.856 1.00 1.79 O ATOM 0 H SER A 36 4.834 -13.687 1.479 1.00 0.48 H new ATOM 0 HA SER A 36 3.600 -11.826 3.331 1.00 0.45 H new ATOM 0 HB2 SER A 36 6.619 -12.176 3.074 1.00 0.55 H new ATOM 0 HB3 SER A 36 5.868 -10.730 3.720 1.00 0.55 H new ATOM 0 HG SER A 36 4.831 -13.013 4.861 1.00 1.79 H new ATOM 234 N VAL A 37 4.139 -9.938 1.668 1.00 0.40 N ATOM 235 CA VAL A 37 4.116 -8.888 0.643 1.00 0.40 C ATOM 236 C VAL A 37 4.870 -7.662 1.158 1.00 0.41 C ATOM 237 O VAL A 37 4.781 -7.326 2.344 1.00 0.40 O ATOM 238 CB VAL A 37 2.674 -8.578 0.202 1.00 0.39 C ATOM 239 CG1 VAL A 37 1.808 -8.139 1.369 1.00 0.40 C ATOM 240 CG2 VAL A 37 2.578 -7.528 -0.913 1.00 0.37 C ATOM 0 H VAL A 37 3.831 -9.594 2.577 1.00 0.40 H new ATOM 0 HA VAL A 37 4.629 -9.233 -0.255 1.00 0.40 H new ATOM 0 HB VAL A 37 2.303 -9.521 -0.199 1.00 0.39 H new ATOM 0 HG11 VAL A 37 0.799 -7.930 1.015 1.00 0.40 H new ATOM 0 HG12 VAL A 37 1.774 -8.933 2.115 1.00 0.40 H new ATOM 0 HG13 VAL A 37 2.229 -7.239 1.816 1.00 0.40 H new ATOM 0 HG21 VAL A 37 1.531 -7.364 -1.169 1.00 0.37 H new ATOM 0 HG22 VAL A 37 3.019 -6.592 -0.570 1.00 0.37 H new ATOM 0 HG23 VAL A 37 3.116 -7.881 -1.793 1.00 0.37 H new ATOM 250 N THR A 38 5.614 -6.994 0.275 1.00 0.47 N ATOM 251 CA THR A 38 6.437 -5.828 0.625 1.00 0.52 C ATOM 252 C THR A 38 5.920 -4.576 -0.095 1.00 0.48 C ATOM 253 O THR A 38 5.810 -4.549 -1.320 1.00 0.50 O ATOM 254 CB THR A 38 7.931 -6.081 0.351 1.00 0.70 C ATOM 255 OG1 THR A 38 8.349 -7.367 0.779 1.00 0.91 O ATOM 256 CG2 THR A 38 8.797 -5.096 1.135 1.00 0.80 C ATOM 0 H THR A 38 5.665 -7.247 -0.712 1.00 0.47 H new ATOM 0 HA THR A 38 6.348 -5.656 1.698 1.00 0.52 H new ATOM 0 HB THR A 38 8.049 -5.975 -0.727 1.00 0.70 H new ATOM 0 HG1 THR A 38 9.302 -7.483 0.583 1.00 0.91 H new ATOM 0 HG21 THR A 38 9.849 -5.292 0.928 1.00 0.80 H new ATOM 0 HG22 THR A 38 8.551 -4.077 0.835 1.00 0.80 H new ATOM 0 HG23 THR A 38 8.609 -5.216 2.202 1.00 0.80 H new ATOM 264 N VAL A 39 5.553 -3.536 0.657 1.00 0.51 N ATOM 265 CA VAL A 39 4.961 -2.288 0.134 1.00 0.51 C ATOM 266 C VAL A 39 5.992 -1.160 0.112 1.00 0.56 C ATOM 267 O VAL A 39 6.690 -0.921 1.099 1.00 0.60 O ATOM 268 CB VAL A 39 3.658 -1.921 0.877 1.00 0.53 C ATOM 269 CG1 VAL A 39 3.770 -1.999 2.395 1.00 0.62 C ATOM 270 CG2 VAL A 39 3.120 -0.531 0.513 1.00 0.54 C ATOM 0 H VAL A 39 5.659 -3.531 1.671 1.00 0.51 H new ATOM 0 HA VAL A 39 4.668 -2.453 -0.903 1.00 0.51 H new ATOM 0 HB VAL A 39 2.958 -2.683 0.534 1.00 0.53 H new ATOM 0 HG11 VAL A 39 2.815 -1.727 2.845 1.00 0.62 H new ATOM 0 HG12 VAL A 39 4.033 -3.015 2.689 1.00 0.62 H new ATOM 0 HG13 VAL A 39 4.542 -1.310 2.739 1.00 0.62 H new ATOM 0 HG21 VAL A 39 2.204 -0.338 1.071 1.00 0.54 H new ATOM 0 HG22 VAL A 39 3.864 0.225 0.765 1.00 0.54 H new ATOM 0 HG23 VAL A 39 2.910 -0.491 -0.556 1.00 0.54 H new ATOM 280 N HIS A 40 6.079 -0.467 -1.025 1.00 0.55 N ATOM 281 CA HIS A 40 7.098 0.550 -1.319 1.00 0.66 C ATOM 282 C HIS A 40 6.447 1.840 -1.844 1.00 0.89 C ATOM 283 O HIS A 40 6.070 1.927 -3.012 1.00 1.88 O ATOM 284 CB HIS A 40 8.090 -0.012 -2.352 1.00 0.75 C ATOM 285 CG HIS A 40 8.680 -1.353 -1.999 1.00 0.69 C ATOM 286 ND1 HIS A 40 9.832 -1.581 -1.284 1.00 0.78 N ATOM 287 CD2 HIS A 40 8.160 -2.572 -2.336 1.00 0.63 C ATOM 288 CE1 HIS A 40 10.015 -2.908 -1.199 1.00 0.81 C ATOM 289 NE2 HIS A 40 9.029 -3.557 -1.845 1.00 0.70 N ATOM 0 H HIS A 40 5.422 -0.601 -1.794 1.00 0.55 H new ATOM 0 HA HIS A 40 7.631 0.797 -0.401 1.00 0.66 H new ATOM 0 HB2 HIS A 40 7.583 -0.096 -3.313 1.00 0.75 H new ATOM 0 HB3 HIS A 40 8.902 0.704 -2.481 1.00 0.75 H new ATOM 0 HD1 HIS A 40 10.442 -0.866 -0.887 1.00 0.78 H new ATOM 0 HD2 HIS A 40 7.245 -2.745 -2.882 1.00 0.63 H new ATOM 0 HE1 HIS A 40 10.836 -3.386 -0.686 1.00 0.81 H new ATOM 297 N LYS A 41 6.285 2.861 -0.994 1.00 0.57 N ATOM 298 CA LYS A 41 5.561 4.088 -1.370 1.00 0.59 C ATOM 299 C LYS A 41 6.412 4.963 -2.300 1.00 0.59 C ATOM 300 O LYS A 41 7.506 5.394 -1.927 1.00 0.65 O ATOM 301 CB LYS A 41 5.060 4.806 -0.102 1.00 0.71 C ATOM 302 CG LYS A 41 3.860 5.742 -0.356 1.00 1.03 C ATOM 303 CD LYS A 41 4.266 7.115 -0.904 1.00 0.80 C ATOM 304 CE LYS A 41 3.091 8.056 -1.176 1.00 0.76 C ATOM 305 NZ LYS A 41 2.090 7.483 -2.102 1.00 1.54 N ATOM 0 H LYS A 41 6.645 2.865 -0.040 1.00 0.57 H new ATOM 0 HA LYS A 41 4.674 3.838 -1.951 1.00 0.59 H new ATOM 0 HB2 LYS A 41 4.777 4.060 0.640 1.00 0.71 H new ATOM 0 HB3 LYS A 41 5.879 5.386 0.325 1.00 0.71 H new ATOM 0 HG2 LYS A 41 3.179 5.265 -1.060 1.00 1.03 H new ATOM 0 HG3 LYS A 41 3.311 5.878 0.576 1.00 1.03 H new ATOM 0 HD2 LYS A 41 4.941 7.592 -0.193 1.00 0.80 H new ATOM 0 HD3 LYS A 41 4.825 6.973 -1.829 1.00 0.80 H new ATOM 0 HE2 LYS A 41 2.605 8.302 -0.232 1.00 0.76 H new ATOM 0 HE3 LYS A 41 3.470 8.989 -1.592 1.00 0.76 H new ATOM 0 HZ1 LYS A 41 1.658 8.246 -2.661 1.00 1.54 H new ATOM 0 HZ2 LYS A 41 2.555 6.807 -2.741 1.00 1.54 H new ATOM 0 HZ3 LYS A 41 1.353 6.993 -1.556 1.00 1.54 H new ATOM 319 N LEU A 42 5.890 5.230 -3.500 1.00 0.59 N ATOM 320 CA LEU A 42 6.551 6.014 -4.548 1.00 0.61 C ATOM 321 C LEU A 42 5.925 7.409 -4.712 1.00 0.60 C ATOM 322 O LEU A 42 4.741 7.608 -4.436 1.00 0.60 O ATOM 323 CB LEU A 42 6.545 5.235 -5.883 1.00 0.62 C ATOM 324 CG LEU A 42 7.293 3.891 -5.908 1.00 0.63 C ATOM 325 CD1 LEU A 42 7.449 3.435 -7.361 1.00 0.67 C ATOM 326 CD2 LEU A 42 8.689 3.948 -5.292 1.00 0.60 C ATOM 0 H LEU A 42 4.967 4.896 -3.778 1.00 0.59 H new ATOM 0 HA LEU A 42 7.585 6.172 -4.241 1.00 0.61 H new ATOM 0 HB2 LEU A 42 5.508 5.051 -6.164 1.00 0.62 H new ATOM 0 HB3 LEU A 42 6.975 5.877 -6.652 1.00 0.62 H new ATOM 0 HG LEU A 42 6.696 3.201 -5.312 1.00 0.63 H new ATOM 0 HD11 LEU A 42 7.978 2.483 -7.389 1.00 0.67 H new ATOM 0 HD12 LEU A 42 6.464 3.316 -7.813 1.00 0.67 H new ATOM 0 HD13 LEU A 42 8.016 4.181 -7.918 1.00 0.67 H new ATOM 0 HD21 LEU A 42 9.152 2.963 -5.347 1.00 0.60 H new ATOM 0 HD22 LEU A 42 9.299 4.667 -5.839 1.00 0.60 H new ATOM 0 HD23 LEU A 42 8.614 4.256 -4.249 1.00 0.60 H new ATOM 338 N LEU A 43 6.728 8.360 -5.193 1.00 0.64 N ATOM 339 CA LEU A 43 6.338 9.738 -5.509 1.00 0.67 C ATOM 340 C LEU A 43 7.045 10.230 -6.787 1.00 0.65 C ATOM 341 O LEU A 43 7.959 9.582 -7.300 1.00 0.63 O ATOM 342 CB LEU A 43 6.664 10.657 -4.303 1.00 0.82 C ATOM 343 CG LEU A 43 5.501 11.514 -3.765 1.00 0.65 C ATOM 344 CD1 LEU A 43 4.837 12.420 -4.803 1.00 1.82 C ATOM 345 CD2 LEU A 43 4.442 10.638 -3.114 1.00 1.07 C ATOM 0 H LEU A 43 7.715 8.183 -5.382 1.00 0.64 H new ATOM 0 HA LEU A 43 5.265 9.770 -5.697 1.00 0.67 H new ATOM 0 HB2 LEU A 43 7.036 10.035 -3.489 1.00 0.82 H new ATOM 0 HB3 LEU A 43 7.476 11.324 -4.591 1.00 0.82 H new ATOM 0 HG LEU A 43 5.962 12.175 -3.031 1.00 0.65 H new ATOM 0 HD11 LEU A 43 4.031 12.983 -4.332 1.00 1.82 H new ATOM 0 HD12 LEU A 43 5.576 13.112 -5.207 1.00 1.82 H new ATOM 0 HD13 LEU A 43 4.430 11.811 -5.610 1.00 1.82 H new ATOM 0 HD21 LEU A 43 3.631 11.264 -2.741 1.00 1.07 H new ATOM 0 HD22 LEU A 43 4.050 9.935 -3.849 1.00 1.07 H new ATOM 0 HD23 LEU A 43 4.885 10.087 -2.285 1.00 1.07 H new ATOM 357 N ALA A 44 6.641 11.404 -7.267 1.00 0.72 N ATOM 358 CA ALA A 44 7.294 12.142 -8.347 1.00 0.77 C ATOM 359 C ALA A 44 8.106 13.344 -7.824 1.00 0.90 C ATOM 360 O ALA A 44 7.831 13.864 -6.739 1.00 0.97 O ATOM 361 CB ALA A 44 6.217 12.591 -9.332 1.00 0.79 C ATOM 0 H ALA A 44 5.820 11.886 -6.901 1.00 0.72 H new ATOM 0 HA ALA A 44 8.012 11.489 -8.844 1.00 0.77 H new ATOM 0 HB1 ALA A 44 6.679 13.145 -10.149 1.00 0.79 H new ATOM 0 HB2 ALA A 44 5.702 11.717 -9.732 1.00 0.79 H new ATOM 0 HB3 ALA A 44 5.499 13.232 -8.819 1.00 0.79 H new ATOM 367 N THR A 45 9.075 13.819 -8.610 1.00 1.01 N ATOM 368 CA THR A 45 9.910 14.992 -8.283 1.00 1.13 C ATOM 369 C THR A 45 9.248 16.344 -8.581 1.00 1.29 C ATOM 370 O THR A 45 9.606 17.336 -7.949 1.00 1.44 O ATOM 371 CB THR A 45 11.262 14.928 -9.009 1.00 1.01 C ATOM 372 OG1 THR A 45 11.057 14.770 -10.394 1.00 0.95 O ATOM 373 CG2 THR A 45 12.141 13.767 -8.539 1.00 0.99 C ATOM 0 H THR A 45 9.311 13.397 -9.508 1.00 1.01 H new ATOM 0 HA THR A 45 10.052 14.937 -7.204 1.00 1.13 H new ATOM 0 HB THR A 45 11.771 15.864 -8.780 1.00 1.01 H new ATOM 0 HG1 THR A 45 11.923 14.732 -10.851 1.00 0.95 H new ATOM 0 HG21 THR A 45 13.082 13.777 -9.090 1.00 0.99 H new ATOM 0 HG22 THR A 45 12.343 13.872 -7.473 1.00 0.99 H new ATOM 0 HG23 THR A 45 11.625 12.824 -8.719 1.00 0.99 H new ATOM 381 N ASP A 46 8.297 16.418 -9.524 1.00 1.31 N ATOM 382 CA ASP A 46 7.540 17.640 -9.850 1.00 1.54 C ATOM 383 C ASP A 46 6.108 17.337 -10.356 1.00 1.43 C ATOM 384 O ASP A 46 5.625 17.961 -11.307 1.00 1.64 O ATOM 385 CB ASP A 46 8.352 18.489 -10.849 1.00 1.76 C ATOM 386 CG ASP A 46 7.856 19.936 -10.967 1.00 2.19 C ATOM 387 OD1 ASP A 46 7.713 20.626 -9.926 1.00 3.58 O ATOM 388 OD2 ASP A 46 7.682 20.411 -12.118 1.00 1.82 O ATOM 0 H ASP A 46 8.026 15.616 -10.093 1.00 1.31 H new ATOM 0 HA ASP A 46 7.400 18.216 -8.935 1.00 1.54 H new ATOM 0 HB2 ASP A 46 9.398 18.496 -10.542 1.00 1.76 H new ATOM 0 HB3 ASP A 46 8.311 18.018 -11.831 1.00 1.76 H new ATOM 393 N GLY A 47 5.436 16.331 -9.782 1.00 1.24 N ATOM 394 CA GLY A 47 4.072 15.916 -10.160 1.00 1.12 C ATOM 395 C GLY A 47 3.958 14.916 -11.323 1.00 1.01 C ATOM 396 O GLY A 47 2.852 14.646 -11.786 1.00 1.05 O ATOM 0 H GLY A 47 5.830 15.770 -9.027 1.00 1.24 H new ATOM 0 HA2 GLY A 47 3.594 15.477 -9.284 1.00 1.12 H new ATOM 0 HA3 GLY A 47 3.503 16.809 -10.420 1.00 1.12 H new ATOM 400 N ASP A 48 5.075 14.332 -11.770 1.00 0.96 N ATOM 401 CA ASP A 48 5.249 13.389 -12.897 1.00 0.96 C ATOM 402 C ASP A 48 4.486 12.040 -12.800 1.00 0.80 C ATOM 403 O ASP A 48 4.809 11.094 -13.525 1.00 0.79 O ATOM 404 CB ASP A 48 6.755 13.071 -13.084 1.00 1.01 C ATOM 405 CG ASP A 48 7.692 14.281 -13.097 1.00 1.22 C ATOM 406 OD1 ASP A 48 7.708 15.062 -12.120 1.00 2.18 O ATOM 407 OD2 ASP A 48 8.438 14.469 -14.086 1.00 1.80 O ATOM 0 H ASP A 48 5.968 14.521 -11.314 1.00 0.96 H new ATOM 0 HA ASP A 48 4.812 13.916 -13.745 1.00 0.96 H new ATOM 0 HB2 ASP A 48 7.068 12.401 -12.283 1.00 1.01 H new ATOM 0 HB3 ASP A 48 6.879 12.528 -14.021 1.00 1.01 H new ATOM 412 N MET A 49 3.505 11.897 -11.901 1.00 0.73 N ATOM 413 CA MET A 49 2.874 10.602 -11.610 1.00 0.66 C ATOM 414 C MET A 49 2.145 10.001 -12.822 1.00 0.73 C ATOM 415 O MET A 49 2.071 8.780 -12.915 1.00 0.75 O ATOM 416 CB MET A 49 1.924 10.678 -10.400 1.00 0.63 C ATOM 417 CG MET A 49 2.553 11.139 -9.076 1.00 0.61 C ATOM 418 SD MET A 49 3.200 9.861 -7.944 1.00 0.62 S ATOM 419 CE MET A 49 4.344 8.911 -8.978 1.00 0.55 C ATOM 0 H MET A 49 3.127 12.672 -11.356 1.00 0.73 H new ATOM 0 HA MET A 49 3.696 9.932 -11.360 1.00 0.66 H new ATOM 0 HB2 MET A 49 1.107 11.357 -10.647 1.00 0.63 H new ATOM 0 HB3 MET A 49 1.484 9.693 -10.246 1.00 0.63 H new ATOM 0 HG2 MET A 49 3.371 11.819 -9.314 1.00 0.61 H new ATOM 0 HG3 MET A 49 1.805 11.717 -8.534 1.00 0.61 H new ATOM 0 HE1 MET A 49 4.920 8.230 -8.352 1.00 0.55 H new ATOM 0 HE2 MET A 49 3.779 8.338 -9.714 1.00 0.55 H new ATOM 0 HE3 MET A 49 5.022 9.593 -9.492 1.00 0.55 H new ATOM 429 N ASP A 50 1.677 10.810 -13.781 1.00 0.83 N ATOM 430 CA ASP A 50 0.998 10.315 -14.990 1.00 0.92 C ATOM 431 C ASP A 50 1.959 9.631 -15.988 1.00 0.98 C ATOM 432 O ASP A 50 1.654 8.533 -16.471 1.00 1.04 O ATOM 433 CB ASP A 50 0.195 11.452 -15.649 1.00 0.99 C ATOM 434 CG ASP A 50 -1.072 11.811 -14.864 1.00 1.01 C ATOM 435 OD1 ASP A 50 -2.012 10.976 -14.822 1.00 2.04 O ATOM 436 OD2 ASP A 50 -1.165 12.927 -14.293 1.00 1.89 O ATOM 0 H ASP A 50 1.757 11.826 -13.743 1.00 0.83 H new ATOM 0 HA ASP A 50 0.304 9.535 -14.678 1.00 0.92 H new ATOM 0 HB2 ASP A 50 0.827 12.336 -15.735 1.00 0.99 H new ATOM 0 HB3 ASP A 50 -0.081 11.158 -16.662 1.00 0.99 H new ATOM 441 N LYS A 51 3.156 10.188 -16.259 1.00 0.99 N ATOM 442 CA LYS A 51 4.167 9.493 -17.071 1.00 1.02 C ATOM 443 C LYS A 51 4.766 8.299 -16.329 1.00 0.92 C ATOM 444 O LYS A 51 4.855 7.227 -16.923 1.00 0.93 O ATOM 445 CB LYS A 51 5.182 10.463 -17.661 1.00 1.08 C ATOM 446 CG LYS A 51 5.799 11.375 -16.610 1.00 1.03 C ATOM 447 CD LYS A 51 6.687 12.448 -17.214 1.00 1.18 C ATOM 448 CE LYS A 51 6.111 13.264 -18.383 1.00 2.20 C ATOM 449 NZ LYS A 51 6.965 14.427 -18.727 1.00 2.45 N ATOM 0 H LYS A 51 3.442 11.110 -15.929 1.00 0.99 H new ATOM 0 HA LYS A 51 3.672 9.056 -17.938 1.00 1.02 H new ATOM 0 HB2 LYS A 51 5.972 9.899 -18.157 1.00 1.08 H new ATOM 0 HB3 LYS A 51 4.697 11.071 -18.425 1.00 1.08 H new ATOM 0 HG2 LYS A 51 5.004 11.849 -16.034 1.00 1.03 H new ATOM 0 HG3 LYS A 51 6.384 10.775 -15.913 1.00 1.03 H new ATOM 0 HD2 LYS A 51 6.963 13.143 -16.421 1.00 1.18 H new ATOM 0 HD3 LYS A 51 7.606 11.972 -17.555 1.00 1.18 H new ATOM 0 HE2 LYS A 51 6.007 12.621 -19.257 1.00 2.20 H new ATOM 0 HE3 LYS A 51 5.112 13.613 -18.123 1.00 2.20 H new ATOM 0 HZ1 LYS A 51 6.539 14.948 -19.520 1.00 2.45 H new ATOM 0 HZ2 LYS A 51 7.044 15.055 -17.902 1.00 2.45 H new ATOM 0 HZ3 LYS A 51 7.911 14.094 -19.001 1.00 2.45 H new ATOM 463 N ILE A 52 5.070 8.418 -15.031 1.00 0.83 N ATOM 464 CA ILE A 52 5.439 7.294 -14.160 1.00 0.75 C ATOM 465 C ILE A 52 4.389 6.170 -14.184 1.00 0.77 C ATOM 466 O ILE A 52 4.769 5.017 -14.338 1.00 0.78 O ATOM 467 CB ILE A 52 5.724 7.811 -12.731 1.00 0.72 C ATOM 468 CG1 ILE A 52 6.999 8.685 -12.769 1.00 0.73 C ATOM 469 CG2 ILE A 52 5.891 6.651 -11.725 1.00 0.65 C ATOM 470 CD1 ILE A 52 7.366 9.375 -11.462 1.00 0.76 C ATOM 0 H ILE A 52 5.066 9.316 -14.547 1.00 0.83 H new ATOM 0 HA ILE A 52 6.354 6.844 -14.545 1.00 0.75 H new ATOM 0 HB ILE A 52 4.873 8.402 -12.393 1.00 0.72 H new ATOM 0 HG12 ILE A 52 7.837 8.059 -13.076 1.00 0.73 H new ATOM 0 HG13 ILE A 52 6.872 9.447 -13.538 1.00 0.73 H new ATOM 0 HG21 ILE A 52 6.090 7.056 -10.733 1.00 0.65 H new ATOM 0 HG22 ILE A 52 4.977 6.058 -11.698 1.00 0.65 H new ATOM 0 HG23 ILE A 52 6.724 6.019 -12.033 1.00 0.65 H new ATOM 0 HD11 ILE A 52 8.275 9.960 -11.602 1.00 0.76 H new ATOM 0 HD12 ILE A 52 6.553 10.034 -11.158 1.00 0.76 H new ATOM 0 HD13 ILE A 52 7.533 8.625 -10.689 1.00 0.76 H new ATOM 482 N ALA A 53 3.084 6.447 -14.117 1.00 0.79 N ATOM 483 CA ALA A 53 2.058 5.400 -14.204 1.00 0.85 C ATOM 484 C ALA A 53 2.117 4.616 -15.529 1.00 0.94 C ATOM 485 O ALA A 53 1.863 3.411 -15.529 1.00 0.96 O ATOM 486 CB ALA A 53 0.678 6.028 -13.976 1.00 0.90 C ATOM 0 H ALA A 53 2.711 7.389 -14.003 1.00 0.79 H new ATOM 0 HA ALA A 53 2.253 4.665 -13.423 1.00 0.85 H new ATOM 0 HB1 ALA A 53 -0.088 5.255 -14.039 1.00 0.90 H new ATOM 0 HB2 ALA A 53 0.647 6.490 -12.989 1.00 0.90 H new ATOM 0 HB3 ALA A 53 0.493 6.786 -14.737 1.00 0.90 H new ATOM 492 N ASN A 54 2.537 5.263 -16.623 1.00 1.01 N ATOM 493 CA ASN A 54 2.824 4.608 -17.902 1.00 1.14 C ATOM 494 C ASN A 54 4.169 3.846 -17.898 1.00 1.17 C ATOM 495 O ASN A 54 4.245 2.757 -18.468 1.00 1.24 O ATOM 496 CB ASN A 54 2.750 5.647 -19.033 1.00 1.22 C ATOM 497 CG ASN A 54 1.330 6.013 -19.411 1.00 1.30 C ATOM 498 OD1 ASN A 54 0.785 5.509 -20.384 1.00 1.40 O ATOM 499 ND2 ASN A 54 0.678 6.891 -18.687 1.00 1.33 N ATOM 0 H ASN A 54 2.689 6.271 -16.643 1.00 1.01 H new ATOM 0 HA ASN A 54 2.065 3.844 -18.072 1.00 1.14 H new ATOM 0 HB2 ASN A 54 3.282 6.548 -18.726 1.00 1.22 H new ATOM 0 HB3 ASN A 54 3.264 5.257 -19.911 1.00 1.22 H new ATOM 0 HD21 ASN A 54 -0.277 7.149 -18.936 1.00 1.33 H new ATOM 0 HD22 ASN A 54 1.126 7.315 -17.875 1.00 1.33 H new ATOM 506 N GLU A 55 5.199 4.357 -17.211 1.00 1.13 N ATOM 507 CA GLU A 55 6.462 3.636 -16.950 1.00 1.20 C ATOM 508 C GLU A 55 6.266 2.370 -16.090 1.00 1.18 C ATOM 509 O GLU A 55 7.102 1.463 -16.129 1.00 1.35 O ATOM 510 CB GLU A 55 7.486 4.541 -16.250 1.00 1.17 C ATOM 511 CG GLU A 55 7.949 5.764 -17.057 1.00 1.26 C ATOM 512 CD GLU A 55 8.425 5.415 -18.473 1.00 1.44 C ATOM 513 OE1 GLU A 55 9.383 4.623 -18.603 1.00 2.20 O ATOM 514 OE2 GLU A 55 7.878 5.970 -19.458 1.00 2.12 O ATOM 0 H GLU A 55 5.183 5.296 -16.813 1.00 1.13 H new ATOM 0 HA GLU A 55 6.831 3.335 -17.930 1.00 1.20 H new ATOM 0 HB2 GLU A 55 7.055 4.889 -15.311 1.00 1.17 H new ATOM 0 HB3 GLU A 55 8.361 3.942 -15.997 1.00 1.17 H new ATOM 0 HG2 GLU A 55 7.128 6.478 -17.123 1.00 1.26 H new ATOM 0 HG3 GLU A 55 8.759 6.258 -16.521 1.00 1.26 H new ATOM 521 N LEU A 56 5.178 2.301 -15.309 1.00 1.02 N ATOM 522 CA LEU A 56 4.790 1.120 -14.539 1.00 0.96 C ATOM 523 C LEU A 56 3.835 0.175 -15.280 1.00 1.13 C ATOM 524 O LEU A 56 4.043 -1.033 -15.228 1.00 1.25 O ATOM 525 CB LEU A 56 4.228 1.544 -13.176 1.00 0.82 C ATOM 526 CG LEU A 56 5.191 2.367 -12.298 1.00 0.69 C ATOM 527 CD1 LEU A 56 4.624 2.429 -10.894 1.00 0.64 C ATOM 528 CD2 LEU A 56 6.620 1.830 -12.201 1.00 0.67 C ATOM 0 H LEU A 56 4.533 3.083 -15.196 1.00 1.02 H new ATOM 0 HA LEU A 56 5.696 0.534 -14.387 1.00 0.96 H new ATOM 0 HB2 LEU A 56 3.322 2.128 -13.340 1.00 0.82 H new ATOM 0 HB3 LEU A 56 3.936 0.649 -12.627 1.00 0.82 H new ATOM 0 HG LEU A 56 5.266 3.340 -12.783 1.00 0.69 H new ATOM 0 HD11 LEU A 56 5.292 3.008 -10.257 1.00 0.64 H new ATOM 0 HD12 LEU A 56 3.643 2.904 -10.918 1.00 0.64 H new ATOM 0 HD13 LEU A 56 4.528 1.419 -10.496 1.00 0.64 H new ATOM 0 HD21 LEU A 56 7.212 2.484 -11.560 1.00 0.67 H new ATOM 0 HD22 LEU A 56 6.603 0.825 -11.778 1.00 0.67 H new ATOM 0 HD23 LEU A 56 7.065 1.798 -13.196 1.00 0.67 H new ATOM 540 N GLU A 57 2.830 0.680 -16.005 1.00 1.20 N ATOM 541 CA GLU A 57 1.823 -0.179 -16.665 1.00 1.36 C ATOM 542 C GLU A 57 2.407 -1.081 -17.770 1.00 1.45 C ATOM 543 O GLU A 57 1.799 -2.091 -18.131 1.00 1.55 O ATOM 544 CB GLU A 57 0.627 0.664 -17.157 1.00 1.49 C ATOM 545 CG GLU A 57 0.839 1.418 -18.483 1.00 1.61 C ATOM 546 CD GLU A 57 0.479 0.615 -19.746 1.00 2.61 C ATOM 547 OE1 GLU A 57 -0.635 0.037 -19.835 1.00 2.84 O ATOM 548 OE2 GLU A 57 1.284 0.605 -20.707 1.00 4.13 O ATOM 0 H GLU A 57 2.687 1.679 -16.153 1.00 1.20 H new ATOM 0 HA GLU A 57 1.457 -0.874 -15.909 1.00 1.36 H new ATOM 0 HB2 GLU A 57 -0.235 0.007 -17.269 1.00 1.49 H new ATOM 0 HB3 GLU A 57 0.376 1.390 -16.384 1.00 1.49 H new ATOM 0 HG2 GLU A 57 0.241 2.329 -18.466 1.00 1.61 H new ATOM 0 HG3 GLU A 57 1.883 1.723 -18.549 1.00 1.61 H new ATOM 555 N THR A 58 3.597 -0.746 -18.281 1.00 1.44 N ATOM 556 CA THR A 58 4.371 -1.579 -19.216 1.00 1.55 C ATOM 557 C THR A 58 5.070 -2.776 -18.551 1.00 1.42 C ATOM 558 O THR A 58 5.353 -3.768 -19.227 1.00 1.48 O ATOM 559 CB THR A 58 5.366 -0.706 -20.003 1.00 1.70 C ATOM 560 OG1 THR A 58 6.002 -1.453 -21.017 1.00 2.01 O ATOM 561 CG2 THR A 58 6.456 -0.088 -19.133 1.00 1.56 C ATOM 0 H THR A 58 4.062 0.132 -18.052 1.00 1.44 H new ATOM 0 HA THR A 58 3.655 -2.020 -19.909 1.00 1.55 H new ATOM 0 HB THR A 58 4.762 0.098 -20.425 1.00 1.70 H new ATOM 0 HG1 THR A 58 6.628 -0.877 -21.504 1.00 2.01 H new ATOM 0 HG21 THR A 58 7.120 0.513 -19.754 1.00 1.56 H new ATOM 0 HG22 THR A 58 5.999 0.545 -18.372 1.00 1.56 H new ATOM 0 HG23 THR A 58 7.029 -0.880 -18.650 1.00 1.56 H new ATOM 569 N GLY A 59 5.338 -2.724 -17.244 1.00 1.27 N ATOM 570 CA GLY A 59 5.938 -3.820 -16.479 1.00 1.15 C ATOM 571 C GLY A 59 4.894 -4.671 -15.755 1.00 1.10 C ATOM 572 O GLY A 59 3.796 -4.202 -15.453 1.00 1.23 O ATOM 0 H GLY A 59 5.140 -1.901 -16.676 1.00 1.27 H new ATOM 0 HA2 GLY A 59 6.516 -4.454 -17.152 1.00 1.15 H new ATOM 0 HA3 GLY A 59 6.636 -3.410 -15.750 1.00 1.15 H new ATOM 576 N ASN A 60 5.242 -5.917 -15.420 1.00 1.01 N ATOM 577 CA ASN A 60 4.361 -6.870 -14.722 1.00 1.02 C ATOM 578 C ASN A 60 4.244 -6.587 -13.205 1.00 0.89 C ATOM 579 O ASN A 60 4.312 -7.491 -12.368 1.00 0.92 O ATOM 580 CB ASN A 60 4.821 -8.307 -15.037 1.00 1.11 C ATOM 581 CG ASN A 60 4.697 -8.669 -16.506 1.00 1.34 C ATOM 582 OD1 ASN A 60 3.758 -8.293 -17.198 1.00 1.62 O ATOM 583 ND2 ASN A 60 5.618 -9.434 -17.032 1.00 1.71 N ATOM 0 H ASN A 60 6.163 -6.303 -15.629 1.00 1.01 H new ATOM 0 HA ASN A 60 3.345 -6.743 -15.096 1.00 1.02 H new ATOM 0 HB2 ASN A 60 5.859 -8.425 -14.727 1.00 1.11 H new ATOM 0 HB3 ASN A 60 4.231 -9.008 -14.446 1.00 1.11 H new ATOM 0 HD21 ASN A 60 5.551 -9.713 -18.011 1.00 1.71 H new ATOM 0 HD22 ASN A 60 6.403 -9.752 -16.463 1.00 1.71 H new ATOM 590 N TYR A 61 4.094 -5.318 -12.821 1.00 0.81 N ATOM 591 CA TYR A 61 4.161 -4.855 -11.426 1.00 0.76 C ATOM 592 C TYR A 61 2.874 -5.117 -10.616 1.00 0.84 C ATOM 593 O TYR A 61 2.690 -4.594 -9.510 1.00 0.98 O ATOM 594 CB TYR A 61 4.688 -3.415 -11.380 1.00 0.71 C ATOM 595 CG TYR A 61 5.952 -3.151 -12.196 1.00 0.64 C ATOM 596 CD1 TYR A 61 6.967 -4.123 -12.341 1.00 1.71 C ATOM 597 CD2 TYR A 61 6.110 -1.900 -12.815 1.00 2.06 C ATOM 598 CE1 TYR A 61 8.105 -3.851 -13.127 1.00 1.78 C ATOM 599 CE2 TYR A 61 7.272 -1.601 -13.553 1.00 2.04 C ATOM 600 CZ TYR A 61 8.269 -2.581 -13.720 1.00 0.71 C ATOM 601 OH TYR A 61 9.405 -2.294 -14.406 1.00 0.84 O ATOM 0 H TYR A 61 3.918 -4.563 -13.484 1.00 0.81 H new ATOM 0 HA TYR A 61 4.887 -5.470 -10.894 1.00 0.76 H new ATOM 0 HB2 TYR A 61 3.902 -2.748 -11.734 1.00 0.71 H new ATOM 0 HB3 TYR A 61 4.886 -3.152 -10.341 1.00 0.71 H new ATOM 0 HD1 TYR A 61 6.871 -5.079 -11.847 1.00 1.71 H new ATOM 0 HD2 TYR A 61 5.331 -1.158 -12.724 1.00 2.06 H new ATOM 0 HE1 TYR A 61 8.853 -4.616 -13.276 1.00 1.78 H new ATOM 0 HE2 TYR A 61 7.398 -0.621 -13.990 1.00 2.04 H new ATOM 0 HH TYR A 61 9.356 -1.378 -14.751 1.00 0.84 H new ATOM 611 N ALA A 62 1.983 -5.953 -11.158 1.00 0.90 N ATOM 612 CA ALA A 62 0.866 -6.568 -10.449 1.00 1.04 C ATOM 613 C ALA A 62 1.346 -7.741 -9.561 1.00 1.05 C ATOM 614 O ALA A 62 0.616 -8.156 -8.657 1.00 1.28 O ATOM 615 CB ALA A 62 -0.166 -7.043 -11.478 1.00 1.23 C ATOM 0 H ALA A 62 2.025 -6.228 -12.139 1.00 0.90 H new ATOM 0 HA ALA A 62 0.409 -5.834 -9.786 1.00 1.04 H new ATOM 0 HB1 ALA A 62 -1.008 -7.505 -10.962 1.00 1.23 H new ATOM 0 HB2 ALA A 62 -0.520 -6.191 -12.058 1.00 1.23 H new ATOM 0 HB3 ALA A 62 0.295 -7.771 -12.146 1.00 1.23 H new ATOM 621 N GLY A 63 2.554 -8.275 -9.801 1.00 0.90 N ATOM 622 CA GLY A 63 3.198 -9.296 -8.966 1.00 0.88 C ATOM 623 C GLY A 63 4.637 -8.931 -8.586 1.00 0.82 C ATOM 624 O GLY A 63 4.909 -8.583 -7.435 1.00 0.78 O ATOM 0 H GLY A 63 3.123 -8.000 -10.602 1.00 0.90 H new ATOM 0 HA2 GLY A 63 2.612 -9.439 -8.058 1.00 0.88 H new ATOM 0 HA3 GLY A 63 3.198 -10.247 -9.498 1.00 0.88 H new ATOM 628 N ASN A 64 5.552 -9.040 -9.553 1.00 0.89 N ATOM 629 CA ASN A 64 6.997 -8.873 -9.345 1.00 0.87 C ATOM 630 C ASN A 64 7.450 -7.404 -9.146 1.00 0.81 C ATOM 631 O ASN A 64 6.724 -6.465 -9.483 1.00 0.80 O ATOM 632 CB ASN A 64 7.773 -9.667 -10.415 1.00 1.04 C ATOM 633 CG ASN A 64 8.128 -8.841 -11.622 1.00 1.11 C ATOM 634 OD1 ASN A 64 9.283 -8.711 -12.007 1.00 1.56 O ATOM 635 ND2 ASN A 64 7.164 -8.208 -12.230 1.00 1.32 N ATOM 0 H ASN A 64 5.307 -9.251 -10.521 1.00 0.89 H new ATOM 0 HA ASN A 64 7.254 -9.309 -8.379 1.00 0.87 H new ATOM 0 HB2 ASN A 64 8.687 -10.064 -9.973 1.00 1.04 H new ATOM 0 HB3 ASN A 64 7.174 -10.521 -10.730 1.00 1.04 H new ATOM 0 HD21 ASN A 64 7.372 -7.605 -13.026 1.00 1.32 H new ATOM 0 HD22 ASN A 64 6.202 -8.316 -11.910 1.00 1.32 H new ATOM 642 N LYS A 65 8.651 -7.201 -8.580 1.00 0.82 N ATOM 643 CA LYS A 65 9.175 -5.872 -8.194 1.00 0.71 C ATOM 644 C LYS A 65 9.442 -4.939 -9.384 1.00 0.62 C ATOM 645 O LYS A 65 9.654 -5.410 -10.503 1.00 0.69 O ATOM 646 CB LYS A 65 10.385 -6.025 -7.247 1.00 0.74 C ATOM 647 CG LYS A 65 11.684 -6.608 -7.836 1.00 1.45 C ATOM 648 CD LYS A 65 12.646 -5.609 -8.502 1.00 2.17 C ATOM 649 CE LYS A 65 13.186 -4.547 -7.525 1.00 1.75 C ATOM 650 NZ LYS A 65 14.044 -3.542 -8.199 1.00 3.14 N ATOM 0 H LYS A 65 9.297 -7.963 -8.373 1.00 0.82 H new ATOM 0 HA LYS A 65 8.386 -5.362 -7.641 1.00 0.71 H new ATOM 0 HB2 LYS A 65 10.615 -5.043 -6.834 1.00 0.74 H new ATOM 0 HB3 LYS A 65 10.081 -6.658 -6.413 1.00 0.74 H new ATOM 0 HG2 LYS A 65 12.222 -7.118 -7.037 1.00 1.45 H new ATOM 0 HG3 LYS A 65 11.415 -7.365 -8.573 1.00 1.45 H new ATOM 0 HD2 LYS A 65 13.484 -6.155 -8.936 1.00 2.17 H new ATOM 0 HD3 LYS A 65 12.131 -5.110 -9.323 1.00 2.17 H new ATOM 0 HE2 LYS A 65 12.349 -4.042 -7.043 1.00 1.75 H new ATOM 0 HE3 LYS A 65 13.757 -5.039 -6.738 1.00 1.75 H new ATOM 0 HZ1 LYS A 65 14.327 -2.812 -7.514 1.00 3.14 H new ATOM 0 HZ2 LYS A 65 14.892 -4.009 -8.579 1.00 3.14 H new ATOM 0 HZ3 LYS A 65 13.515 -3.100 -8.977 1.00 3.14 H new ATOM 664 N VAL A 66 9.491 -3.621 -9.150 1.00 0.58 N ATOM 665 CA VAL A 66 9.725 -2.628 -10.222 1.00 0.53 C ATOM 666 C VAL A 66 11.120 -2.822 -10.827 1.00 0.65 C ATOM 667 O VAL A 66 12.129 -2.721 -10.126 1.00 0.81 O ATOM 668 CB VAL A 66 9.504 -1.162 -9.793 1.00 0.54 C ATOM 669 CG1 VAL A 66 9.997 -0.163 -10.855 1.00 0.60 C ATOM 670 CG2 VAL A 66 8.007 -0.888 -9.641 1.00 0.51 C ATOM 0 H VAL A 66 9.372 -3.210 -8.224 1.00 0.58 H new ATOM 0 HA VAL A 66 8.965 -2.818 -10.980 1.00 0.53 H new ATOM 0 HB VAL A 66 10.056 -1.032 -8.862 1.00 0.54 H new ATOM 0 HG11 VAL A 66 9.820 0.855 -10.507 1.00 0.60 H new ATOM 0 HG12 VAL A 66 11.064 -0.308 -11.024 1.00 0.60 H new ATOM 0 HG13 VAL A 66 9.457 -0.327 -11.787 1.00 0.60 H new ATOM 0 HG21 VAL A 66 7.856 0.148 -9.338 1.00 0.51 H new ATOM 0 HG22 VAL A 66 7.506 -1.065 -10.593 1.00 0.51 H new ATOM 0 HG23 VAL A 66 7.591 -1.552 -8.883 1.00 0.51 H new ATOM 680 N GLY A 67 11.186 -3.112 -12.127 1.00 0.70 N ATOM 681 CA GLY A 67 12.434 -3.408 -12.834 1.00 0.86 C ATOM 682 C GLY A 67 13.240 -2.169 -13.226 1.00 0.97 C ATOM 683 O GLY A 67 14.471 -2.243 -13.286 1.00 1.36 O ATOM 0 H GLY A 67 10.362 -3.149 -12.728 1.00 0.70 H new ATOM 0 HA2 GLY A 67 13.053 -4.046 -12.204 1.00 0.86 H new ATOM 0 HA3 GLY A 67 12.203 -3.977 -13.734 1.00 0.86 H new ATOM 687 N VAL A 68 12.570 -1.034 -13.466 1.00 0.83 N ATOM 688 CA VAL A 68 13.187 0.271 -13.771 1.00 1.01 C ATOM 689 C VAL A 68 12.361 1.428 -13.198 1.00 0.72 C ATOM 690 O VAL A 68 11.175 1.555 -13.507 1.00 0.81 O ATOM 691 CB VAL A 68 13.350 0.478 -15.295 1.00 1.57 C ATOM 692 CG1 VAL A 68 13.938 1.853 -15.637 1.00 1.86 C ATOM 693 CG2 VAL A 68 14.272 -0.576 -15.919 1.00 2.20 C ATOM 0 H VAL A 68 11.551 -0.994 -13.454 1.00 0.83 H new ATOM 0 HA VAL A 68 14.171 0.266 -13.303 1.00 1.01 H new ATOM 0 HB VAL A 68 12.343 0.392 -15.702 1.00 1.57 H new ATOM 0 HG11 VAL A 68 14.033 1.949 -16.719 1.00 1.86 H new ATOM 0 HG12 VAL A 68 13.279 2.635 -15.259 1.00 1.86 H new ATOM 0 HG13 VAL A 68 14.921 1.953 -15.176 1.00 1.86 H new ATOM 0 HG21 VAL A 68 14.359 -0.394 -16.990 1.00 2.20 H new ATOM 0 HG22 VAL A 68 15.258 -0.515 -15.459 1.00 2.20 H new ATOM 0 HG23 VAL A 68 13.855 -1.569 -15.752 1.00 2.20 H new ATOM 703 N LEU A 69 13.010 2.292 -12.408 1.00 0.71 N ATOM 704 CA LEU A 69 12.505 3.585 -11.957 1.00 0.63 C ATOM 705 C LEU A 69 13.033 4.720 -12.853 1.00 0.67 C ATOM 706 O LEU A 69 14.240 4.779 -13.126 1.00 0.79 O ATOM 707 CB LEU A 69 12.924 3.837 -10.495 1.00 0.85 C ATOM 708 CG LEU A 69 12.279 2.882 -9.482 1.00 0.91 C ATOM 709 CD1 LEU A 69 12.842 3.132 -8.083 1.00 1.22 C ATOM 710 CD2 LEU A 69 10.768 3.073 -9.433 1.00 0.81 C ATOM 0 H LEU A 69 13.945 2.095 -12.052 1.00 0.71 H new ATOM 0 HA LEU A 69 11.417 3.568 -12.022 1.00 0.63 H new ATOM 0 HB2 LEU A 69 14.008 3.751 -10.420 1.00 0.85 H new ATOM 0 HB3 LEU A 69 12.666 4.862 -10.226 1.00 0.85 H new ATOM 0 HG LEU A 69 12.505 1.865 -9.802 1.00 0.91 H new ATOM 0 HD11 LEU A 69 12.375 2.447 -7.375 1.00 1.22 H new ATOM 0 HD12 LEU A 69 13.920 2.968 -8.090 1.00 1.22 H new ATOM 0 HD13 LEU A 69 12.633 4.160 -7.785 1.00 1.22 H new ATOM 0 HD21 LEU A 69 10.337 2.383 -8.707 1.00 0.81 H new ATOM 0 HD22 LEU A 69 10.540 4.098 -9.140 1.00 0.81 H new ATOM 0 HD23 LEU A 69 10.344 2.875 -10.417 1.00 0.81 H new ATOM 722 N PRO A 70 12.174 5.663 -13.278 1.00 0.63 N ATOM 723 CA PRO A 70 12.618 6.833 -14.029 1.00 0.69 C ATOM 724 C PRO A 70 13.341 7.846 -13.118 1.00 0.72 C ATOM 725 O PRO A 70 13.162 7.837 -11.897 1.00 0.69 O ATOM 726 CB PRO A 70 11.328 7.381 -14.630 1.00 0.68 C ATOM 727 CG PRO A 70 10.263 7.084 -13.589 1.00 0.61 C ATOM 728 CD PRO A 70 10.748 5.763 -12.970 1.00 0.57 C ATOM 0 HA PRO A 70 13.355 6.601 -14.798 1.00 0.69 H new ATOM 0 HB2 PRO A 70 11.405 8.451 -14.824 1.00 0.68 H new ATOM 0 HB3 PRO A 70 11.098 6.900 -15.581 1.00 0.68 H new ATOM 0 HG2 PRO A 70 10.193 7.877 -12.845 1.00 0.61 H new ATOM 0 HG3 PRO A 70 9.276 6.981 -14.039 1.00 0.61 H new ATOM 0 HD2 PRO A 70 10.582 5.754 -11.893 1.00 0.57 H new ATOM 0 HD3 PRO A 70 10.201 4.916 -13.384 1.00 0.57 H new ATOM 736 N ALA A 71 14.140 8.755 -13.687 1.00 0.87 N ATOM 737 CA ALA A 71 14.890 9.754 -12.911 1.00 1.02 C ATOM 738 C ALA A 71 13.990 10.771 -12.172 1.00 1.08 C ATOM 739 O ALA A 71 14.411 11.348 -11.164 1.00 1.25 O ATOM 740 CB ALA A 71 15.869 10.460 -13.854 1.00 1.23 C ATOM 0 H ALA A 71 14.286 8.821 -14.694 1.00 0.87 H new ATOM 0 HA ALA A 71 15.428 9.232 -12.120 1.00 1.02 H new ATOM 0 HB1 ALA A 71 16.436 11.206 -13.298 1.00 1.23 H new ATOM 0 HB2 ALA A 71 16.554 9.728 -14.282 1.00 1.23 H new ATOM 0 HB3 ALA A 71 15.314 10.949 -14.655 1.00 1.23 H new ATOM 746 N ASN A 72 12.745 10.946 -12.630 1.00 1.00 N ATOM 747 CA ASN A 72 11.706 11.761 -11.992 1.00 1.05 C ATOM 748 C ASN A 72 10.853 11.007 -10.950 1.00 0.90 C ATOM 749 O ASN A 72 10.020 11.626 -10.288 1.00 1.04 O ATOM 750 CB ASN A 72 10.843 12.432 -13.075 1.00 1.13 C ATOM 751 CG ASN A 72 10.125 11.476 -14.012 1.00 1.04 C ATOM 752 OD1 ASN A 72 10.222 10.266 -13.920 1.00 1.76 O ATOM 753 ND2 ASN A 72 9.404 11.986 -14.976 1.00 1.62 N ATOM 0 H ASN A 72 12.421 10.505 -13.491 1.00 1.00 H new ATOM 0 HA ASN A 72 12.216 12.527 -11.408 1.00 1.05 H new ATOM 0 HB2 ASN A 72 10.101 13.063 -12.586 1.00 1.13 H new ATOM 0 HB3 ASN A 72 11.479 13.089 -13.669 1.00 1.13 H new ATOM 0 HD21 ASN A 72 8.931 11.372 -15.639 1.00 1.62 H new ATOM 0 HD22 ASN A 72 9.314 12.998 -15.065 1.00 1.62 H new ATOM 760 N ALA A 73 11.041 9.693 -10.783 1.00 0.69 N ATOM 761 CA ALA A 73 10.471 8.943 -9.663 1.00 0.66 C ATOM 762 C ALA A 73 11.387 9.003 -8.435 1.00 0.74 C ATOM 763 O ALA A 73 12.606 9.154 -8.559 1.00 0.78 O ATOM 764 CB ALA A 73 10.245 7.487 -10.072 1.00 0.60 C ATOM 0 H ALA A 73 11.593 9.121 -11.422 1.00 0.69 H new ATOM 0 HA ALA A 73 9.517 9.399 -9.399 1.00 0.66 H new ATOM 0 HB1 ALA A 73 9.821 6.935 -9.233 1.00 0.60 H new ATOM 0 HB2 ALA A 73 9.557 7.449 -10.917 1.00 0.60 H new ATOM 0 HB3 ALA A 73 11.196 7.038 -10.358 1.00 0.60 H new ATOM 770 N LYS A 74 10.801 8.828 -7.249 1.00 0.79 N ATOM 771 CA LYS A 74 11.526 8.628 -5.986 1.00 0.96 C ATOM 772 C LYS A 74 10.705 7.819 -4.981 1.00 0.84 C ATOM 773 O LYS A 74 9.515 7.571 -5.176 1.00 0.76 O ATOM 774 CB LYS A 74 11.963 9.988 -5.416 1.00 1.23 C ATOM 775 CG LYS A 74 10.786 10.756 -4.802 1.00 0.94 C ATOM 776 CD LYS A 74 11.053 12.262 -4.861 1.00 1.12 C ATOM 777 CE LYS A 74 9.922 13.035 -4.185 1.00 1.27 C ATOM 778 NZ LYS A 74 10.378 14.382 -3.781 1.00 1.79 N ATOM 0 H LYS A 74 9.788 8.821 -7.134 1.00 0.79 H new ATOM 0 HA LYS A 74 12.421 8.039 -6.188 1.00 0.96 H new ATOM 0 HB2 LYS A 74 12.731 9.834 -4.658 1.00 1.23 H new ATOM 0 HB3 LYS A 74 12.413 10.586 -6.208 1.00 1.23 H new ATOM 0 HG2 LYS A 74 9.868 10.520 -5.340 1.00 0.94 H new ATOM 0 HG3 LYS A 74 10.639 10.445 -3.768 1.00 0.94 H new ATOM 0 HD2 LYS A 74 12.000 12.489 -4.370 1.00 1.12 H new ATOM 0 HD3 LYS A 74 11.148 12.580 -5.899 1.00 1.12 H new ATOM 0 HE2 LYS A 74 9.076 13.121 -4.867 1.00 1.27 H new ATOM 0 HE3 LYS A 74 9.572 12.487 -3.310 1.00 1.27 H new ATOM 0 HZ1 LYS A 74 9.595 14.891 -3.324 1.00 1.79 H new ATOM 0 HZ2 LYS A 74 11.171 14.294 -3.113 1.00 1.79 H new ATOM 0 HZ3 LYS A 74 10.690 14.910 -4.621 1.00 1.79 H new ATOM 792 N GLU A 75 11.355 7.417 -3.900 1.00 0.88 N ATOM 793 CA GLU A 75 10.838 6.508 -2.876 1.00 0.87 C ATOM 794 C GLU A 75 10.840 7.238 -1.521 1.00 0.84 C ATOM 795 O GLU A 75 11.822 7.920 -1.223 1.00 0.93 O ATOM 796 CB GLU A 75 11.751 5.261 -2.824 1.00 0.94 C ATOM 797 CG GLU A 75 12.067 4.599 -4.185 1.00 0.92 C ATOM 798 CD GLU A 75 13.402 3.835 -4.130 1.00 1.12 C ATOM 799 OE1 GLU A 75 13.429 2.633 -3.763 1.00 2.02 O ATOM 800 OE2 GLU A 75 14.458 4.439 -4.446 1.00 1.95 O ATOM 0 H GLU A 75 12.305 7.729 -3.698 1.00 0.88 H new ATOM 0 HA GLU A 75 9.819 6.196 -3.107 1.00 0.87 H new ATOM 0 HB2 GLU A 75 12.692 5.543 -2.352 1.00 0.94 H new ATOM 0 HB3 GLU A 75 11.281 4.517 -2.180 1.00 0.94 H new ATOM 0 HG2 GLU A 75 11.263 3.915 -4.456 1.00 0.92 H new ATOM 0 HG3 GLU A 75 12.112 5.361 -4.963 1.00 0.92 H new ATOM 807 N ILE A 76 9.796 7.111 -0.689 1.00 0.75 N ATOM 808 CA ILE A 76 9.759 7.768 0.638 1.00 0.70 C ATOM 809 C ILE A 76 9.473 6.794 1.797 1.00 0.67 C ATOM 810 O ILE A 76 8.538 5.985 1.765 1.00 0.77 O ATOM 811 CB ILE A 76 8.855 9.031 0.672 1.00 0.67 C ATOM 812 CG1 ILE A 76 7.367 8.736 0.387 1.00 0.76 C ATOM 813 CG2 ILE A 76 9.388 10.139 -0.265 1.00 0.81 C ATOM 814 CD1 ILE A 76 6.489 9.997 0.390 1.00 0.76 C ATOM 0 H ILE A 76 8.964 6.562 -0.906 1.00 0.75 H new ATOM 0 HA ILE A 76 10.774 8.127 0.805 1.00 0.70 H new ATOM 0 HB ILE A 76 8.902 9.394 1.699 1.00 0.67 H new ATOM 0 HG12 ILE A 76 7.280 8.243 -0.581 1.00 0.76 H new ATOM 0 HG13 ILE A 76 6.992 8.038 1.135 1.00 0.76 H new ATOM 0 HG21 ILE A 76 8.730 11.006 -0.214 1.00 0.81 H new ATOM 0 HG22 ILE A 76 10.392 10.427 0.046 1.00 0.81 H new ATOM 0 HG23 ILE A 76 9.419 9.766 -1.289 1.00 0.81 H new ATOM 0 HD11 ILE A 76 5.455 9.721 0.183 1.00 0.76 H new ATOM 0 HD12 ILE A 76 6.548 10.479 1.366 1.00 0.76 H new ATOM 0 HD13 ILE A 76 6.840 10.687 -0.377 1.00 0.76 H new ATOM 826 N ALA A 77 10.288 6.898 2.848 1.00 0.67 N ATOM 827 CA ALA A 77 10.084 6.237 4.136 1.00 0.65 C ATOM 828 C ALA A 77 9.341 7.158 5.127 1.00 0.54 C ATOM 829 O ALA A 77 9.322 8.379 4.958 1.00 0.59 O ATOM 830 CB ALA A 77 11.424 5.713 4.663 1.00 0.68 C ATOM 0 H ALA A 77 11.136 7.464 2.824 1.00 0.67 H new ATOM 0 HA ALA A 77 9.433 5.373 4.008 1.00 0.65 H new ATOM 0 HB1 ALA A 77 11.270 5.221 5.623 1.00 0.68 H new ATOM 0 HB2 ALA A 77 11.841 5.000 3.952 1.00 0.68 H new ATOM 0 HB3 ALA A 77 12.116 6.546 4.789 1.00 0.68 H new ATOM 836 N GLY A 78 8.731 6.588 6.168 1.00 0.51 N ATOM 837 CA GLY A 78 8.043 7.335 7.229 1.00 0.47 C ATOM 838 C GLY A 78 6.597 7.731 6.912 1.00 0.46 C ATOM 839 O GLY A 78 6.035 8.589 7.595 1.00 0.56 O ATOM 0 H GLY A 78 8.699 5.577 6.302 1.00 0.51 H new ATOM 0 HA2 GLY A 78 8.048 6.733 8.138 1.00 0.47 H new ATOM 0 HA3 GLY A 78 8.612 8.239 7.443 1.00 0.47 H new ATOM 843 N VAL A 79 5.990 7.108 5.896 1.00 0.46 N ATOM 844 CA VAL A 79 4.554 7.191 5.577 1.00 0.45 C ATOM 845 C VAL A 79 3.831 5.935 6.059 1.00 0.40 C ATOM 846 O VAL A 79 4.382 4.839 5.971 1.00 0.41 O ATOM 847 CB VAL A 79 4.328 7.461 4.075 1.00 0.52 C ATOM 848 CG1 VAL A 79 5.012 6.475 3.133 1.00 0.64 C ATOM 849 CG2 VAL A 79 2.847 7.574 3.709 1.00 0.54 C ATOM 0 H VAL A 79 6.501 6.509 5.247 1.00 0.46 H new ATOM 0 HA VAL A 79 4.126 8.040 6.110 1.00 0.45 H new ATOM 0 HB VAL A 79 4.810 8.427 3.924 1.00 0.52 H new ATOM 0 HG11 VAL A 79 4.794 6.748 2.100 1.00 0.64 H new ATOM 0 HG12 VAL A 79 6.089 6.503 3.296 1.00 0.64 H new ATOM 0 HG13 VAL A 79 4.642 5.469 3.328 1.00 0.64 H new ATOM 0 HG21 VAL A 79 2.750 7.764 2.640 1.00 0.54 H new ATOM 0 HG22 VAL A 79 2.338 6.643 3.960 1.00 0.54 H new ATOM 0 HG23 VAL A 79 2.396 8.395 4.266 1.00 0.54 H new ATOM 859 N MET A 80 2.611 6.105 6.576 1.00 0.42 N ATOM 860 CA MET A 80 1.765 5.044 7.128 1.00 0.41 C ATOM 861 C MET A 80 0.691 4.574 6.143 1.00 0.43 C ATOM 862 O MET A 80 0.070 5.371 5.439 1.00 0.51 O ATOM 863 CB MET A 80 1.146 5.539 8.448 1.00 0.43 C ATOM 864 CG MET A 80 0.144 4.562 9.079 1.00 0.48 C ATOM 865 SD MET A 80 0.772 2.892 9.384 1.00 0.56 S ATOM 866 CE MET A 80 0.761 2.865 11.189 1.00 0.54 C ATOM 0 H MET A 80 2.168 7.023 6.623 1.00 0.42 H new ATOM 0 HA MET A 80 2.387 4.170 7.321 1.00 0.41 H new ATOM 0 HB2 MET A 80 1.947 5.732 9.162 1.00 0.43 H new ATOM 0 HB3 MET A 80 0.644 6.490 8.267 1.00 0.43 H new ATOM 0 HG2 MET A 80 -0.199 4.981 10.025 1.00 0.48 H new ATOM 0 HG3 MET A 80 -0.727 4.491 8.428 1.00 0.48 H new ATOM 0 HE1 MET A 80 1.373 2.036 11.544 1.00 0.54 H new ATOM 0 HE2 MET A 80 1.165 3.803 11.569 1.00 0.54 H new ATOM 0 HE3 MET A 80 -0.262 2.739 11.545 1.00 0.54 H new ATOM 876 N PHE A 81 0.436 3.267 6.140 1.00 0.39 N ATOM 877 CA PHE A 81 -0.640 2.622 5.392 1.00 0.40 C ATOM 878 C PHE A 81 -1.235 1.440 6.170 1.00 0.39 C ATOM 879 O PHE A 81 -0.559 0.750 6.938 1.00 0.43 O ATOM 880 CB PHE A 81 -0.168 2.208 3.983 1.00 0.43 C ATOM 881 CG PHE A 81 1.316 1.923 3.904 1.00 0.43 C ATOM 882 CD1 PHE A 81 1.749 0.674 4.369 1.00 1.60 C ATOM 883 CD2 PHE A 81 2.263 2.916 3.549 1.00 1.57 C ATOM 884 CE1 PHE A 81 3.112 0.413 4.504 1.00 1.63 C ATOM 885 CE2 PHE A 81 3.632 2.623 3.660 1.00 1.58 C ATOM 886 CZ PHE A 81 4.059 1.377 4.146 1.00 0.63 C ATOM 0 H PHE A 81 0.994 2.604 6.678 1.00 0.39 H new ATOM 0 HA PHE A 81 -1.440 3.351 5.263 1.00 0.40 H new ATOM 0 HB2 PHE A 81 -0.718 1.320 3.670 1.00 0.43 H new ATOM 0 HB3 PHE A 81 -0.416 3.001 3.278 1.00 0.43 H new ATOM 0 HD1 PHE A 81 1.026 -0.087 4.623 1.00 1.60 H new ATOM 0 HD2 PHE A 81 1.937 3.884 3.198 1.00 1.57 H new ATOM 0 HE1 PHE A 81 3.439 -0.542 4.888 1.00 1.63 H new ATOM 0 HE2 PHE A 81 4.363 3.363 3.369 1.00 1.58 H new ATOM 0 HZ PHE A 81 5.113 1.164 4.243 1.00 0.63 H new ATOM 896 N VAL A 82 -2.525 1.207 5.936 1.00 0.36 N ATOM 897 CA VAL A 82 -3.359 0.183 6.576 1.00 0.34 C ATOM 898 C VAL A 82 -3.916 -0.766 5.503 1.00 0.32 C ATOM 899 O VAL A 82 -4.214 -0.331 4.386 1.00 0.32 O ATOM 900 CB VAL A 82 -4.496 0.817 7.418 1.00 0.36 C ATOM 901 CG1 VAL A 82 -4.027 2.011 8.269 1.00 0.39 C ATOM 902 CG2 VAL A 82 -5.667 1.334 6.579 1.00 0.35 C ATOM 0 H VAL A 82 -3.049 1.758 5.256 1.00 0.36 H new ATOM 0 HA VAL A 82 -2.742 -0.390 7.268 1.00 0.34 H new ATOM 0 HB VAL A 82 -4.817 -0.011 8.051 1.00 0.36 H new ATOM 0 HG11 VAL A 82 -4.870 2.409 8.834 1.00 0.39 H new ATOM 0 HG12 VAL A 82 -3.250 1.683 8.960 1.00 0.39 H new ATOM 0 HG13 VAL A 82 -3.628 2.788 7.617 1.00 0.39 H new ATOM 0 HG21 VAL A 82 -6.423 1.763 7.236 1.00 0.35 H new ATOM 0 HG22 VAL A 82 -5.310 2.098 5.888 1.00 0.35 H new ATOM 0 HG23 VAL A 82 -6.102 0.509 6.015 1.00 0.35 H new ATOM 912 N TRP A 83 -4.082 -2.049 5.823 1.00 0.31 N ATOM 913 CA TRP A 83 -4.819 -3.003 4.993 1.00 0.28 C ATOM 914 C TRP A 83 -6.319 -2.980 5.331 1.00 0.32 C ATOM 915 O TRP A 83 -6.744 -2.833 6.478 1.00 0.38 O ATOM 916 CB TRP A 83 -4.233 -4.418 5.111 1.00 0.26 C ATOM 917 CG TRP A 83 -3.104 -4.760 4.175 1.00 0.25 C ATOM 918 CD1 TRP A 83 -1.917 -4.115 4.060 1.00 0.31 C ATOM 919 CD2 TRP A 83 -3.050 -5.863 3.210 1.00 0.26 C ATOM 920 NE1 TRP A 83 -1.143 -4.740 3.098 1.00 0.35 N ATOM 921 CE2 TRP A 83 -1.795 -5.818 2.534 1.00 0.32 C ATOM 922 CE3 TRP A 83 -3.932 -6.905 2.843 1.00 0.30 C ATOM 923 CZ2 TRP A 83 -1.438 -6.750 1.546 1.00 0.39 C ATOM 924 CZ3 TRP A 83 -3.575 -7.858 1.868 1.00 0.36 C ATOM 925 CH2 TRP A 83 -2.329 -7.790 1.220 1.00 0.40 C ATOM 0 H TRP A 83 -3.704 -2.461 6.676 1.00 0.31 H new ATOM 0 HA TRP A 83 -4.710 -2.697 3.953 1.00 0.28 H new ATOM 0 HB2 TRP A 83 -3.882 -4.557 6.133 1.00 0.26 H new ATOM 0 HB3 TRP A 83 -5.038 -5.135 4.950 1.00 0.26 H new ATOM 0 HD1 TRP A 83 -1.621 -3.247 4.631 1.00 0.31 H new ATOM 0 HE1 TRP A 83 -0.204 -4.440 2.837 1.00 0.35 H new ATOM 0 HE3 TRP A 83 -4.899 -6.972 3.319 1.00 0.30 H new ATOM 0 HZ2 TRP A 83 -0.487 -6.669 1.040 1.00 0.39 H new ATOM 0 HZ3 TRP A 83 -4.266 -8.649 1.616 1.00 0.36 H new ATOM 0 HH2 TRP A 83 -2.058 -8.528 0.480 1.00 0.40 H new ATOM 936 N THR A 84 -7.126 -3.164 4.295 1.00 0.33 N ATOM 937 CA THR A 84 -8.589 -3.246 4.317 1.00 0.37 C ATOM 938 C THR A 84 -9.075 -4.375 3.408 1.00 0.38 C ATOM 939 O THR A 84 -8.302 -4.942 2.633 1.00 0.39 O ATOM 940 CB THR A 84 -9.241 -1.939 3.815 1.00 0.36 C ATOM 941 OG1 THR A 84 -8.667 -1.552 2.594 1.00 0.40 O ATOM 942 CG2 THR A 84 -9.133 -0.742 4.748 1.00 0.37 C ATOM 0 H THR A 84 -6.755 -3.268 3.350 1.00 0.33 H new ATOM 0 HA THR A 84 -8.875 -3.427 5.353 1.00 0.37 H new ATOM 0 HB THR A 84 -10.298 -2.192 3.735 1.00 0.36 H new ATOM 0 HG1 THR A 84 -8.724 -0.578 2.500 1.00 0.40 H new ATOM 0 HG21 THR A 84 -9.625 0.119 4.294 1.00 0.37 H new ATOM 0 HG22 THR A 84 -9.615 -0.976 5.697 1.00 0.37 H new ATOM 0 HG23 THR A 84 -8.082 -0.510 4.922 1.00 0.37 H new ATOM 950 N ASN A 85 -10.362 -4.703 3.469 1.00 0.41 N ATOM 951 CA ASN A 85 -10.997 -5.568 2.480 1.00 0.43 C ATOM 952 C ASN A 85 -11.513 -4.767 1.274 1.00 0.51 C ATOM 953 O ASN A 85 -11.557 -3.537 1.316 1.00 0.54 O ATOM 954 CB ASN A 85 -12.099 -6.405 3.143 1.00 0.45 C ATOM 955 CG ASN A 85 -12.002 -7.790 2.562 1.00 0.76 C ATOM 956 OD1 ASN A 85 -12.664 -8.129 1.591 1.00 2.09 O ATOM 957 ND2 ASN A 85 -11.026 -8.526 3.033 1.00 0.63 N ATOM 0 H ASN A 85 -10.992 -4.378 4.202 1.00 0.41 H new ATOM 0 HA ASN A 85 -10.248 -6.256 2.087 1.00 0.43 H new ATOM 0 HB2 ASN A 85 -11.968 -6.430 4.225 1.00 0.45 H new ATOM 0 HB3 ASN A 85 -13.081 -5.973 2.951 1.00 0.45 H new ATOM 0 HD21 ASN A 85 -10.797 -9.414 2.588 1.00 0.63 H new ATOM 0 HD22 ASN A 85 -10.496 -8.211 3.845 1.00 0.63 H new ATOM 964 N THR A 86 -11.970 -5.439 0.209 1.00 0.60 N ATOM 965 CA THR A 86 -12.533 -4.723 -0.954 1.00 0.74 C ATOM 966 C THR A 86 -13.783 -3.885 -0.608 1.00 0.65 C ATOM 967 O THR A 86 -13.988 -2.829 -1.202 1.00 0.73 O ATOM 968 CB THR A 86 -12.687 -5.630 -2.185 1.00 1.12 C ATOM 969 OG1 THR A 86 -12.997 -4.865 -3.331 1.00 3.01 O ATOM 970 CG2 THR A 86 -13.792 -6.653 -1.987 1.00 1.62 C ATOM 0 H THR A 86 -11.964 -6.455 0.124 1.00 0.60 H new ATOM 0 HA THR A 86 -11.793 -3.978 -1.248 1.00 0.74 H new ATOM 0 HB THR A 86 -11.736 -6.145 -2.320 1.00 1.12 H new ATOM 0 HG1 THR A 86 -12.293 -4.983 -4.003 1.00 3.01 H new ATOM 0 HG21 THR A 86 -13.873 -7.277 -2.877 1.00 1.62 H new ATOM 0 HG22 THR A 86 -13.559 -7.278 -1.125 1.00 1.62 H new ATOM 0 HG23 THR A 86 -14.738 -6.139 -1.817 1.00 1.62 H new ATOM 978 N ASN A 87 -14.509 -4.252 0.465 1.00 0.58 N ATOM 979 CA ASN A 87 -15.605 -3.492 1.109 1.00 0.61 C ATOM 980 C ASN A 87 -15.162 -2.204 1.855 1.00 0.48 C ATOM 981 O ASN A 87 -15.925 -1.643 2.647 1.00 0.51 O ATOM 982 CB ASN A 87 -16.333 -4.426 2.101 1.00 0.93 C ATOM 983 CG ASN A 87 -16.795 -5.729 1.495 1.00 1.60 C ATOM 984 OD1 ASN A 87 -16.151 -6.755 1.653 1.00 3.29 O ATOM 985 ND2 ASN A 87 -17.888 -5.711 0.782 1.00 1.75 N ATOM 0 H ASN A 87 -14.338 -5.140 0.936 1.00 0.58 H new ATOM 0 HA ASN A 87 -16.255 -3.154 0.302 1.00 0.61 H new ATOM 0 HB2 ASN A 87 -15.666 -4.642 2.936 1.00 0.93 H new ATOM 0 HB3 ASN A 87 -17.197 -3.902 2.510 1.00 0.93 H new ATOM 0 HD21 ASN A 87 -18.223 -6.567 0.341 1.00 1.75 H new ATOM 0 HD22 ASN A 87 -18.407 -4.841 0.666 1.00 1.75 H new ATOM 992 N ASN A 88 -13.905 -1.783 1.678 1.00 0.45 N ATOM 993 CA ASN A 88 -13.208 -0.699 2.373 1.00 0.43 C ATOM 994 C ASN A 88 -13.210 -0.856 3.911 1.00 0.42 C ATOM 995 O ASN A 88 -13.071 0.125 4.637 1.00 0.48 O ATOM 996 CB ASN A 88 -13.659 0.688 1.854 1.00 0.47 C ATOM 997 CG ASN A 88 -14.375 0.674 0.510 1.00 0.52 C ATOM 998 OD1 ASN A 88 -15.596 0.590 0.437 1.00 0.69 O ATOM 999 ND2 ASN A 88 -13.658 0.716 -0.586 1.00 0.48 N ATOM 0 H ASN A 88 -13.301 -2.229 0.988 1.00 0.45 H new ATOM 0 HA ASN A 88 -12.151 -0.773 2.119 1.00 0.43 H new ATOM 0 HB2 ASN A 88 -14.319 1.139 2.595 1.00 0.47 H new ATOM 0 HB3 ASN A 88 -12.783 1.331 1.775 1.00 0.47 H new ATOM 0 HD21 ASN A 88 -14.116 0.679 -1.497 1.00 0.48 H new ATOM 0 HD22 ASN A 88 -12.642 0.786 -0.528 1.00 0.48 H new ATOM 1006 N GLU A 89 -13.391 -2.088 4.407 1.00 0.37 N ATOM 1007 CA GLU A 89 -13.413 -2.438 5.833 1.00 0.36 C ATOM 1008 C GLU A 89 -12.005 -2.621 6.372 1.00 0.32 C ATOM 1009 O GLU A 89 -11.208 -3.318 5.750 1.00 0.32 O ATOM 1010 CB GLU A 89 -14.172 -3.752 6.097 1.00 0.41 C ATOM 1011 CG GLU A 89 -15.674 -3.531 6.293 1.00 0.50 C ATOM 1012 CD GLU A 89 -16.344 -4.741 6.959 1.00 0.93 C ATOM 1013 OE1 GLU A 89 -16.502 -5.812 6.320 1.00 1.97 O ATOM 1014 OE2 GLU A 89 -16.715 -4.607 8.151 1.00 2.23 O ATOM 0 H GLU A 89 -13.531 -2.898 3.803 1.00 0.37 H new ATOM 0 HA GLU A 89 -13.918 -1.612 6.333 1.00 0.36 H new ATOM 0 HB2 GLU A 89 -14.014 -4.433 5.261 1.00 0.41 H new ATOM 0 HB3 GLU A 89 -13.760 -4.234 6.983 1.00 0.41 H new ATOM 0 HG2 GLU A 89 -15.834 -2.644 6.905 1.00 0.50 H new ATOM 0 HG3 GLU A 89 -16.143 -3.341 5.328 1.00 0.50 H new ATOM 1021 N ILE A 90 -11.713 -2.086 7.555 1.00 0.33 N ATOM 1022 CA ILE A 90 -10.413 -2.284 8.196 1.00 0.31 C ATOM 1023 C ILE A 90 -10.322 -3.710 8.746 1.00 0.29 C ATOM 1024 O ILE A 90 -11.193 -4.131 9.509 1.00 0.33 O ATOM 1025 CB ILE A 90 -10.134 -1.244 9.295 1.00 0.37 C ATOM 1026 CG1 ILE A 90 -10.485 0.182 8.826 1.00 0.41 C ATOM 1027 CG2 ILE A 90 -8.649 -1.366 9.682 1.00 0.40 C ATOM 1028 CD1 ILE A 90 -10.141 1.271 9.843 1.00 0.49 C ATOM 0 H ILE A 90 -12.361 -1.510 8.092 1.00 0.33 H new ATOM 0 HA ILE A 90 -9.641 -2.141 7.439 1.00 0.31 H new ATOM 0 HB ILE A 90 -10.763 -1.436 10.164 1.00 0.37 H new ATOM 0 HG12 ILE A 90 -9.957 0.388 7.895 1.00 0.41 H new ATOM 0 HG13 ILE A 90 -11.551 0.229 8.605 1.00 0.41 H new ATOM 0 HG21 ILE A 90 -8.415 -0.641 10.462 1.00 0.40 H new ATOM 0 HG22 ILE A 90 -8.451 -2.372 10.051 1.00 0.40 H new ATOM 0 HG23 ILE A 90 -8.028 -1.171 8.808 1.00 0.40 H new ATOM 0 HD11 ILE A 90 -10.417 2.245 9.440 1.00 0.49 H new ATOM 0 HD12 ILE A 90 -10.690 1.092 10.768 1.00 0.49 H new ATOM 0 HD13 ILE A 90 -9.070 1.253 10.047 1.00 0.49 H new ATOM 1040 N ILE A 91 -9.260 -4.437 8.384 1.00 0.27 N ATOM 1041 CA ILE A 91 -9.015 -5.808 8.853 1.00 0.26 C ATOM 1042 C ILE A 91 -7.699 -6.010 9.629 1.00 0.28 C ATOM 1043 O ILE A 91 -6.699 -5.316 9.439 1.00 0.29 O ATOM 1044 CB ILE A 91 -9.195 -6.841 7.719 1.00 0.27 C ATOM 1045 CG1 ILE A 91 -8.132 -6.754 6.601 1.00 0.29 C ATOM 1046 CG2 ILE A 91 -10.568 -6.708 7.057 1.00 0.31 C ATOM 1047 CD1 ILE A 91 -7.748 -8.141 6.093 1.00 0.50 C ATOM 0 H ILE A 91 -8.539 -4.089 7.752 1.00 0.27 H new ATOM 0 HA ILE A 91 -9.789 -5.988 9.599 1.00 0.26 H new ATOM 0 HB ILE A 91 -9.085 -7.803 8.219 1.00 0.27 H new ATOM 0 HG12 ILE A 91 -8.517 -6.156 5.775 1.00 0.29 H new ATOM 0 HG13 ILE A 91 -7.245 -6.244 6.978 1.00 0.29 H new ATOM 0 HG21 ILE A 91 -10.663 -7.449 6.263 1.00 0.31 H new ATOM 0 HG22 ILE A 91 -11.348 -6.871 7.801 1.00 0.31 H new ATOM 0 HG23 ILE A 91 -10.673 -5.709 6.635 1.00 0.31 H new ATOM 0 HD11 ILE A 91 -6.999 -8.046 5.307 1.00 0.50 H new ATOM 0 HD12 ILE A 91 -7.340 -8.729 6.915 1.00 0.50 H new ATOM 0 HD13 ILE A 91 -8.631 -8.640 5.694 1.00 0.50 H new ATOM 1059 N ASP A 92 -7.736 -6.975 10.543 1.00 0.36 N ATOM 1060 CA ASP A 92 -6.592 -7.590 11.228 1.00 0.43 C ATOM 1061 C ASP A 92 -5.922 -8.612 10.285 1.00 0.44 C ATOM 1062 O ASP A 92 -6.540 -9.116 9.345 1.00 0.43 O ATOM 1063 CB ASP A 92 -7.107 -8.237 12.529 1.00 0.51 C ATOM 1064 CG ASP A 92 -6.291 -9.419 13.061 1.00 0.95 C ATOM 1065 OD1 ASP A 92 -5.143 -9.223 13.515 1.00 1.31 O ATOM 1066 OD2 ASP A 92 -6.781 -10.569 12.986 1.00 2.10 O ATOM 0 H ASP A 92 -8.622 -7.378 10.848 1.00 0.36 H new ATOM 0 HA ASP A 92 -5.835 -6.851 11.488 1.00 0.43 H new ATOM 0 HB2 ASP A 92 -7.145 -7.470 13.302 1.00 0.51 H new ATOM 0 HB3 ASP A 92 -8.131 -8.573 12.363 1.00 0.51 H new ATOM 1071 N GLU A 93 -4.664 -8.961 10.542 1.00 0.48 N ATOM 1072 CA GLU A 93 -3.851 -9.816 9.656 1.00 0.50 C ATOM 1073 C GLU A 93 -4.372 -11.251 9.499 1.00 0.52 C ATOM 1074 O GLU A 93 -3.983 -11.944 8.565 1.00 0.59 O ATOM 1075 CB GLU A 93 -2.374 -9.808 10.084 1.00 0.57 C ATOM 1076 CG GLU A 93 -2.055 -10.542 11.398 1.00 0.65 C ATOM 1077 CD GLU A 93 -0.560 -10.482 11.751 1.00 0.93 C ATOM 1078 OE1 GLU A 93 0.104 -9.444 11.518 1.00 1.80 O ATOM 1079 OE2 GLU A 93 -0.025 -11.474 12.310 1.00 2.05 O ATOM 0 H GLU A 93 -4.167 -8.659 11.380 1.00 0.48 H new ATOM 0 HA GLU A 93 -3.940 -9.369 8.666 1.00 0.50 H new ATOM 0 HB2 GLU A 93 -1.781 -10.256 9.286 1.00 0.57 H new ATOM 0 HB3 GLU A 93 -2.048 -8.772 10.180 1.00 0.57 H new ATOM 0 HG2 GLU A 93 -2.635 -10.101 12.208 1.00 0.65 H new ATOM 0 HG3 GLU A 93 -2.365 -11.584 11.314 1.00 0.65 H new ATOM 1086 N ASN A 94 -5.283 -11.696 10.367 1.00 0.56 N ATOM 1087 CA ASN A 94 -5.954 -12.989 10.275 1.00 0.59 C ATOM 1088 C ASN A 94 -7.296 -12.893 9.506 1.00 0.53 C ATOM 1089 O ASN A 94 -8.044 -13.874 9.449 1.00 0.63 O ATOM 1090 CB ASN A 94 -6.140 -13.542 11.700 1.00 0.68 C ATOM 1091 CG ASN A 94 -4.896 -13.486 12.578 1.00 1.70 C ATOM 1092 OD1 ASN A 94 -4.059 -14.380 12.594 1.00 3.48 O ATOM 1093 ND2 ASN A 94 -4.746 -12.458 13.376 1.00 1.38 N ATOM 0 H ASN A 94 -5.581 -11.149 11.175 1.00 0.56 H new ATOM 0 HA ASN A 94 -5.337 -13.678 9.699 1.00 0.59 H new ATOM 0 HB2 ASN A 94 -6.938 -12.983 12.189 1.00 0.68 H new ATOM 0 HB3 ASN A 94 -6.472 -14.578 11.631 1.00 0.68 H new ATOM 0 HD21 ASN A 94 -3.940 -12.410 14.000 1.00 1.38 H new ATOM 0 HD22 ASN A 94 -5.435 -11.706 13.374 1.00 1.38 H new ATOM 1100 N GLY A 95 -7.644 -11.720 8.955 1.00 0.43 N ATOM 1101 CA GLY A 95 -8.851 -11.452 8.160 1.00 0.39 C ATOM 1102 C GLY A 95 -10.097 -11.072 8.966 1.00 0.40 C ATOM 1103 O GLY A 95 -11.170 -10.920 8.373 1.00 0.48 O ATOM 0 H GLY A 95 -7.060 -10.890 9.058 1.00 0.43 H new ATOM 0 HA2 GLY A 95 -8.633 -10.646 7.459 1.00 0.39 H new ATOM 0 HA3 GLY A 95 -9.079 -12.337 7.567 1.00 0.39 H new ATOM 1107 N GLN A 96 -9.969 -10.904 10.287 1.00 0.41 N ATOM 1108 CA GLN A 96 -11.024 -10.365 11.146 1.00 0.46 C ATOM 1109 C GLN A 96 -11.256 -8.890 10.820 1.00 0.42 C ATOM 1110 O GLN A 96 -10.311 -8.155 10.555 1.00 0.39 O ATOM 1111 CB GLN A 96 -10.654 -10.556 12.626 1.00 0.53 C ATOM 1112 CG GLN A 96 -11.637 -9.849 13.577 1.00 0.64 C ATOM 1113 CD GLN A 96 -11.316 -10.030 15.049 1.00 1.38 C ATOM 1114 OE1 GLN A 96 -10.244 -10.474 15.449 1.00 2.31 O ATOM 1115 NE2 GLN A 96 -12.218 -9.633 15.909 1.00 1.72 N ATOM 0 H GLN A 96 -9.117 -11.143 10.794 1.00 0.41 H new ATOM 0 HA GLN A 96 -11.952 -10.906 10.960 1.00 0.46 H new ATOM 0 HB2 GLN A 96 -10.633 -11.621 12.857 1.00 0.53 H new ATOM 0 HB3 GLN A 96 -9.648 -10.173 12.798 1.00 0.53 H new ATOM 0 HG2 GLN A 96 -11.645 -8.784 13.347 1.00 0.64 H new ATOM 0 HG3 GLN A 96 -12.643 -10.224 13.387 1.00 0.64 H new ATOM 0 HE21 GLN A 96 -13.110 -9.264 15.579 1.00 1.72 H new ATOM 0 HE22 GLN A 96 -12.030 -9.693 16.910 1.00 1.72 H new ATOM 1124 N THR A 97 -12.506 -8.449 10.884 1.00 0.46 N ATOM 1125 CA THR A 97 -12.923 -7.088 10.550 1.00 0.44 C ATOM 1126 C THR A 97 -13.195 -6.266 11.814 1.00 0.48 C ATOM 1127 O THR A 97 -13.783 -6.760 12.776 1.00 0.62 O ATOM 1128 CB THR A 97 -14.093 -7.118 9.561 1.00 0.51 C ATOM 1129 OG1 THR A 97 -15.287 -7.609 10.132 1.00 0.68 O ATOM 1130 CG2 THR A 97 -13.796 -8.025 8.362 1.00 0.49 C ATOM 0 H THR A 97 -13.281 -9.043 11.178 1.00 0.46 H new ATOM 0 HA THR A 97 -12.107 -6.573 10.043 1.00 0.44 H new ATOM 0 HB THR A 97 -14.219 -6.078 9.259 1.00 0.51 H new ATOM 0 HG1 THR A 97 -15.998 -7.604 9.458 1.00 0.68 H new ATOM 0 HG21 THR A 97 -14.648 -8.021 7.683 1.00 0.49 H new ATOM 0 HG22 THR A 97 -12.913 -7.659 7.838 1.00 0.49 H new ATOM 0 HG23 THR A 97 -13.615 -9.042 8.711 1.00 0.49 H new ATOM 1138 N LEU A 98 -12.717 -5.018 11.843 1.00 0.41 N ATOM 1139 CA LEU A 98 -12.670 -4.174 13.052 1.00 0.44 C ATOM 1140 C LEU A 98 -13.985 -3.423 13.345 1.00 0.51 C ATOM 1141 O LEU A 98 -14.117 -2.804 14.405 1.00 0.65 O ATOM 1142 CB LEU A 98 -11.477 -3.200 12.922 1.00 0.47 C ATOM 1143 CG LEU A 98 -10.069 -3.745 13.254 1.00 0.48 C ATOM 1144 CD1 LEU A 98 -9.873 -3.971 14.748 1.00 0.64 C ATOM 1145 CD2 LEU A 98 -9.683 -5.047 12.554 1.00 0.40 C ATOM 0 H LEU A 98 -12.344 -4.553 11.015 1.00 0.41 H new ATOM 0 HA LEU A 98 -12.534 -4.830 13.912 1.00 0.44 H new ATOM 0 HB2 LEU A 98 -11.459 -2.825 11.899 1.00 0.47 H new ATOM 0 HB3 LEU A 98 -11.668 -2.346 13.571 1.00 0.47 H new ATOM 0 HG LEU A 98 -9.422 -2.953 12.878 1.00 0.48 H new ATOM 0 HD11 LEU A 98 -8.869 -4.354 14.929 1.00 0.64 H new ATOM 0 HD12 LEU A 98 -10.003 -3.028 15.279 1.00 0.64 H new ATOM 0 HD13 LEU A 98 -10.607 -4.693 15.106 1.00 0.64 H new ATOM 0 HD21 LEU A 98 -8.678 -5.339 12.858 1.00 0.40 H new ATOM 0 HD22 LEU A 98 -10.388 -5.831 12.830 1.00 0.40 H new ATOM 0 HD23 LEU A 98 -9.708 -4.901 11.474 1.00 0.40 H new ATOM 1157 N GLY A 99 -14.950 -3.448 12.420 1.00 0.49 N ATOM 1158 CA GLY A 99 -16.204 -2.693 12.512 1.00 0.55 C ATOM 1159 C GLY A 99 -16.098 -1.261 11.971 1.00 0.58 C ATOM 1160 O GLY A 99 -16.922 -0.411 12.318 1.00 0.72 O ATOM 0 H GLY A 99 -14.880 -4.005 11.569 1.00 0.49 H new ATOM 0 HA2 GLY A 99 -16.980 -3.224 11.961 1.00 0.55 H new ATOM 0 HA3 GLY A 99 -16.521 -2.657 13.554 1.00 0.55 H new ATOM 1164 N VAL A 100 -15.091 -0.967 11.139 1.00 0.51 N ATOM 1165 CA VAL A 100 -14.798 0.378 10.613 1.00 0.50 C ATOM 1166 C VAL A 100 -14.568 0.316 9.100 1.00 0.45 C ATOM 1167 O VAL A 100 -14.051 -0.683 8.593 1.00 0.42 O ATOM 1168 CB VAL A 100 -13.591 1.014 11.342 1.00 0.53 C ATOM 1169 CG1 VAL A 100 -13.393 2.484 10.943 1.00 1.04 C ATOM 1170 CG2 VAL A 100 -13.729 0.981 12.872 1.00 1.13 C ATOM 0 H VAL A 100 -14.438 -1.675 10.802 1.00 0.51 H new ATOM 0 HA VAL A 100 -15.661 1.017 10.801 1.00 0.50 H new ATOM 0 HB VAL A 100 -12.737 0.410 11.037 1.00 0.53 H new ATOM 0 HG11 VAL A 100 -12.536 2.894 11.477 1.00 1.04 H new ATOM 0 HG12 VAL A 100 -13.217 2.549 9.869 1.00 1.04 H new ATOM 0 HG13 VAL A 100 -14.286 3.054 11.199 1.00 1.04 H new ATOM 0 HG21 VAL A 100 -12.852 1.441 13.326 1.00 1.13 H new ATOM 0 HG22 VAL A 100 -14.622 1.531 13.169 1.00 1.13 H new ATOM 0 HG23 VAL A 100 -13.811 -0.053 13.208 1.00 1.13 H new ATOM 1180 N ASN A 101 -14.941 1.379 8.383 1.00 0.48 N ATOM 1181 CA ASN A 101 -14.789 1.588 6.955 1.00 0.46 C ATOM 1182 C ASN A 101 -14.083 2.927 6.670 1.00 0.47 C ATOM 1183 O ASN A 101 -14.058 3.812 7.527 1.00 0.51 O ATOM 1184 CB ASN A 101 -16.209 1.517 6.364 1.00 0.57 C ATOM 1185 CG ASN A 101 -16.433 2.365 5.139 1.00 1.00 C ATOM 1186 OD1 ASN A 101 -16.739 3.548 5.231 1.00 1.57 O ATOM 1187 ND2 ASN A 101 -16.237 1.832 3.967 1.00 1.08 N ATOM 0 H ASN A 101 -15.393 2.176 8.830 1.00 0.48 H new ATOM 0 HA ASN A 101 -14.155 0.831 6.492 1.00 0.46 H new ATOM 0 HB2 ASN A 101 -16.431 0.479 6.114 1.00 0.57 H new ATOM 0 HB3 ASN A 101 -16.921 1.819 7.132 1.00 0.57 H new ATOM 0 HD21 ASN A 101 -16.338 2.399 3.125 1.00 1.08 H new ATOM 0 HD22 ASN A 101 -15.982 0.847 3.891 1.00 1.08 H new ATOM 1194 N ILE A 102 -13.529 3.066 5.463 1.00 0.49 N ATOM 1195 CA ILE A 102 -12.727 4.222 5.019 1.00 0.54 C ATOM 1196 C ILE A 102 -13.160 4.700 3.617 1.00 0.63 C ATOM 1197 O ILE A 102 -13.312 3.881 2.711 1.00 0.69 O ATOM 1198 CB ILE A 102 -11.215 3.873 5.062 1.00 0.51 C ATOM 1199 CG1 ILE A 102 -10.785 3.396 6.471 1.00 0.47 C ATOM 1200 CG2 ILE A 102 -10.386 5.104 4.662 1.00 0.58 C ATOM 1201 CD1 ILE A 102 -9.330 2.925 6.608 1.00 0.52 C ATOM 0 H ILE A 102 -13.627 2.355 4.738 1.00 0.49 H new ATOM 0 HA ILE A 102 -12.904 5.050 5.706 1.00 0.54 H new ATOM 0 HB ILE A 102 -11.037 3.060 4.358 1.00 0.51 H new ATOM 0 HG12 ILE A 102 -10.950 4.212 7.175 1.00 0.47 H new ATOM 0 HG13 ILE A 102 -11.440 2.579 6.772 1.00 0.47 H new ATOM 0 HG21 ILE A 102 -9.325 4.854 4.694 1.00 0.58 H new ATOM 0 HG22 ILE A 102 -10.656 5.412 3.652 1.00 0.58 H new ATOM 0 HG23 ILE A 102 -10.588 5.920 5.356 1.00 0.58 H new ATOM 0 HD11 ILE A 102 -9.143 2.615 7.636 1.00 0.52 H new ATOM 0 HD12 ILE A 102 -9.155 2.083 5.938 1.00 0.52 H new ATOM 0 HD13 ILE A 102 -8.657 3.742 6.347 1.00 0.52 H new ATOM 1213 N ASP A 103 -13.320 6.017 3.406 1.00 0.71 N ATOM 1214 CA ASP A 103 -13.609 6.578 2.079 1.00 0.81 C ATOM 1215 C ASP A 103 -12.389 6.464 1.145 1.00 0.78 C ATOM 1216 O ASP A 103 -11.291 6.794 1.594 1.00 0.78 O ATOM 1217 CB ASP A 103 -13.919 8.073 2.201 1.00 0.98 C ATOM 1218 CG ASP A 103 -14.843 8.513 1.082 1.00 1.19 C ATOM 1219 OD1 ASP A 103 -14.345 8.815 -0.022 1.00 2.40 O ATOM 1220 OD2 ASP A 103 -16.074 8.541 1.298 1.00 1.86 O ATOM 0 H ASP A 103 -13.253 6.717 4.145 1.00 0.71 H new ATOM 0 HA ASP A 103 -14.453 6.019 1.675 1.00 0.81 H new ATOM 0 HB2 ASP A 103 -14.383 8.277 3.166 1.00 0.98 H new ATOM 0 HB3 ASP A 103 -12.993 8.647 2.164 1.00 0.98 H new ATOM 1225 N PRO A 104 -12.510 6.119 -0.152 1.00 0.81 N ATOM 1226 CA PRO A 104 -11.352 6.131 -1.053 1.00 0.83 C ATOM 1227 C PRO A 104 -10.877 7.552 -1.395 1.00 0.95 C ATOM 1228 O PRO A 104 -9.688 7.786 -1.637 1.00 1.11 O ATOM 1229 CB PRO A 104 -11.801 5.332 -2.275 1.00 0.85 C ATOM 1230 CG PRO A 104 -13.313 5.532 -2.316 1.00 1.02 C ATOM 1231 CD PRO A 104 -13.730 5.776 -0.871 1.00 0.88 C ATOM 0 HA PRO A 104 -10.473 5.684 -0.589 1.00 0.83 H new ATOM 0 HB2 PRO A 104 -11.326 5.696 -3.186 1.00 0.85 H new ATOM 0 HB3 PRO A 104 -11.541 4.278 -2.180 1.00 0.85 H new ATOM 0 HG2 PRO A 104 -13.580 6.378 -2.950 1.00 1.02 H new ATOM 0 HG3 PRO A 104 -13.814 4.655 -2.726 1.00 1.02 H new ATOM 0 HD2 PRO A 104 -14.460 6.583 -0.807 1.00 0.88 H new ATOM 0 HD3 PRO A 104 -14.197 4.888 -0.445 1.00 0.88 H new ATOM 1239 N GLN A 105 -11.795 8.517 -1.357 1.00 0.94 N ATOM 1240 CA GLN A 105 -11.557 9.899 -1.745 1.00 1.02 C ATOM 1241 C GLN A 105 -11.015 10.727 -0.583 1.00 1.07 C ATOM 1242 O GLN A 105 -10.003 11.413 -0.738 1.00 1.14 O ATOM 1243 CB GLN A 105 -12.852 10.512 -2.297 1.00 1.14 C ATOM 1244 CG GLN A 105 -13.531 9.625 -3.339 1.00 1.12 C ATOM 1245 CD GLN A 105 -12.628 9.329 -4.522 1.00 1.08 C ATOM 1246 OE1 GLN A 105 -11.887 10.178 -4.993 1.00 1.72 O ATOM 1247 NE2 GLN A 105 -12.587 8.108 -4.990 1.00 0.80 N ATOM 0 H GLN A 105 -12.752 8.350 -1.046 1.00 0.94 H new ATOM 0 HA GLN A 105 -10.796 9.908 -2.525 1.00 1.02 H new ATOM 0 HB2 GLN A 105 -13.543 10.691 -1.474 1.00 1.14 H new ATOM 0 HB3 GLN A 105 -12.628 11.481 -2.742 1.00 1.14 H new ATOM 0 HG2 GLN A 105 -13.834 8.687 -2.873 1.00 1.12 H new ATOM 0 HG3 GLN A 105 -14.439 10.113 -3.692 1.00 1.12 H new ATOM 0 HE21 GLN A 105 -13.202 7.392 -4.603 1.00 0.80 H new ATOM 0 HE22 GLN A 105 -11.940 7.872 -5.742 1.00 0.80 H new ATOM 1256 N THR A 106 -11.669 10.623 0.575 1.00 1.08 N ATOM 1257 CA THR A 106 -11.379 11.434 1.772 1.00 1.12 C ATOM 1258 C THR A 106 -10.359 10.788 2.709 1.00 1.04 C ATOM 1259 O THR A 106 -9.701 11.489 3.484 1.00 1.10 O ATOM 1260 CB THR A 106 -12.664 11.736 2.573 1.00 1.16 C ATOM 1261 OG1 THR A 106 -13.059 10.666 3.380 1.00 1.03 O ATOM 1262 CG2 THR A 106 -13.874 12.004 1.697 1.00 1.22 C ATOM 0 H THR A 106 -12.432 9.961 0.716 1.00 1.08 H new ATOM 0 HA THR A 106 -10.948 12.360 1.391 1.00 1.12 H new ATOM 0 HB THR A 106 -12.386 12.616 3.154 1.00 1.16 H new ATOM 0 HG1 THR A 106 -14.034 10.675 3.481 1.00 1.03 H new ATOM 0 HG21 THR A 106 -14.740 12.208 2.326 1.00 1.22 H new ATOM 0 HG22 THR A 106 -13.677 12.865 1.059 1.00 1.22 H new ATOM 0 HG23 THR A 106 -14.074 11.131 1.076 1.00 1.22 H new ATOM 1270 N PHE A 107 -10.238 9.455 2.649 1.00 0.92 N ATOM 1271 CA PHE A 107 -9.519 8.626 3.625 1.00 0.85 C ATOM 1272 C PHE A 107 -10.003 8.882 5.083 1.00 0.81 C ATOM 1273 O PHE A 107 -9.233 8.737 6.037 1.00 0.90 O ATOM 1274 CB PHE A 107 -7.988 8.717 3.433 1.00 0.98 C ATOM 1275 CG PHE A 107 -7.302 8.097 2.217 1.00 0.84 C ATOM 1276 CD1 PHE A 107 -7.953 7.324 1.226 1.00 1.56 C ATOM 1277 CD2 PHE A 107 -5.905 8.255 2.131 1.00 2.54 C ATOM 1278 CE1 PHE A 107 -7.201 6.643 0.260 1.00 1.51 C ATOM 1279 CE2 PHE A 107 -5.167 7.635 1.111 1.00 2.56 C ATOM 1280 CZ PHE A 107 -5.809 6.794 0.192 1.00 0.85 C ATOM 0 H PHE A 107 -10.652 8.906 1.895 1.00 0.92 H new ATOM 0 HA PHE A 107 -9.771 7.584 3.430 1.00 0.85 H new ATOM 0 HB2 PHE A 107 -7.730 9.776 3.438 1.00 0.98 H new ATOM 0 HB3 PHE A 107 -7.530 8.273 4.317 1.00 0.98 H new ATOM 0 HD1 PHE A 107 -9.031 7.259 1.215 1.00 1.56 H new ATOM 0 HD2 PHE A 107 -5.393 8.863 2.862 1.00 2.54 H new ATOM 0 HE1 PHE A 107 -7.701 5.992 -0.442 1.00 1.51 H new ATOM 0 HE2 PHE A 107 -4.103 7.806 1.034 1.00 2.56 H new ATOM 0 HZ PHE A 107 -5.238 6.269 -0.559 1.00 0.85 H new ATOM 1290 N LYS A 108 -11.280 9.270 5.273 1.00 0.72 N ATOM 1291 CA LYS A 108 -11.937 9.439 6.586 1.00 0.68 C ATOM 1292 C LYS A 108 -12.706 8.176 6.998 1.00 0.56 C ATOM 1293 O LYS A 108 -13.160 7.397 6.153 1.00 0.52 O ATOM 1294 CB LYS A 108 -12.779 10.738 6.630 1.00 0.80 C ATOM 1295 CG LYS A 108 -14.259 10.591 6.215 1.00 0.83 C ATOM 1296 CD LYS A 108 -15.219 10.406 7.404 1.00 1.09 C ATOM 1297 CE LYS A 108 -16.417 9.537 7.004 1.00 1.56 C ATOM 1298 NZ LYS A 108 -17.378 9.369 8.117 1.00 2.36 N ATOM 0 H LYS A 108 -11.902 9.481 4.493 1.00 0.72 H new ATOM 0 HA LYS A 108 -11.166 9.565 7.346 1.00 0.68 H new ATOM 0 HB2 LYS A 108 -12.743 11.138 7.643 1.00 0.80 H new ATOM 0 HB3 LYS A 108 -12.310 11.476 5.979 1.00 0.80 H new ATOM 0 HG2 LYS A 108 -14.559 11.475 5.651 1.00 0.83 H new ATOM 0 HG3 LYS A 108 -14.356 9.737 5.545 1.00 0.83 H new ATOM 0 HD2 LYS A 108 -14.689 9.943 8.237 1.00 1.09 H new ATOM 0 HD3 LYS A 108 -15.569 11.379 7.750 1.00 1.09 H new ATOM 0 HE2 LYS A 108 -16.925 9.990 6.152 1.00 1.56 H new ATOM 0 HE3 LYS A 108 -16.063 8.558 6.680 1.00 1.56 H new ATOM 0 HZ1 LYS A 108 -18.234 8.892 7.768 1.00 2.36 H new ATOM 0 HZ2 LYS A 108 -16.943 8.795 8.867 1.00 2.36 H new ATOM 0 HZ3 LYS A 108 -17.633 10.302 8.499 1.00 2.36 H new ATOM 1312 N LEU A 109 -12.852 7.986 8.304 1.00 0.66 N ATOM 1313 CA LEU A 109 -13.343 6.761 8.942 1.00 0.65 C ATOM 1314 C LEU A 109 -14.853 6.788 9.229 1.00 0.71 C ATOM 1315 O LEU A 109 -15.428 7.837 9.516 1.00 0.83 O ATOM 1316 CB LEU A 109 -12.538 6.570 10.242 1.00 0.71 C ATOM 1317 CG LEU A 109 -11.047 6.278 9.990 1.00 0.68 C ATOM 1318 CD1 LEU A 109 -10.149 6.812 11.101 1.00 0.76 C ATOM 1319 CD2 LEU A 109 -10.806 4.778 9.914 1.00 0.61 C ATOM 0 H LEU A 109 -12.622 8.713 8.982 1.00 0.66 H new ATOM 0 HA LEU A 109 -13.200 5.924 8.259 1.00 0.65 H new ATOM 0 HB2 LEU A 109 -12.628 7.468 10.854 1.00 0.71 H new ATOM 0 HB3 LEU A 109 -12.971 5.750 10.814 1.00 0.71 H new ATOM 0 HG LEU A 109 -10.801 6.775 9.052 1.00 0.68 H new ATOM 0 HD11 LEU A 109 -9.109 6.579 10.872 1.00 0.76 H new ATOM 0 HD12 LEU A 109 -10.270 7.893 11.179 1.00 0.76 H new ATOM 0 HD13 LEU A 109 -10.425 6.347 12.047 1.00 0.76 H new ATOM 0 HD21 LEU A 109 -9.748 4.588 9.736 1.00 0.61 H new ATOM 0 HD22 LEU A 109 -11.105 4.313 10.854 1.00 0.61 H new ATOM 0 HD23 LEU A 109 -11.393 4.356 9.098 1.00 0.61 H new ATOM 1331 N SER A 110 -15.496 5.617 9.251 1.00 0.68 N ATOM 1332 CA SER A 110 -16.882 5.462 9.741 1.00 0.75 C ATOM 1333 C SER A 110 -17.008 5.559 11.276 1.00 0.84 C ATOM 1334 O SER A 110 -18.115 5.501 11.820 1.00 1.05 O ATOM 1335 CB SER A 110 -17.487 4.148 9.225 1.00 0.77 C ATOM 1336 OG SER A 110 -16.956 2.998 9.860 1.00 1.27 O ATOM 0 H SER A 110 -15.076 4.745 8.931 1.00 0.68 H new ATOM 0 HA SER A 110 -17.447 6.304 9.341 1.00 0.75 H new ATOM 0 HB2 SER A 110 -18.567 4.170 9.374 1.00 0.77 H new ATOM 0 HB3 SER A 110 -17.314 4.074 8.151 1.00 0.77 H new ATOM 0 HG SER A 110 -17.380 2.195 9.491 1.00 1.27 H new ATOM 1342 N GLY A 111 -15.875 5.709 11.969 1.00 0.78 N ATOM 1343 CA GLY A 111 -15.714 5.612 13.423 1.00 0.82 C ATOM 1344 C GLY A 111 -14.306 6.014 13.887 1.00 0.79 C ATOM 1345 O GLY A 111 -13.673 6.887 13.286 1.00 0.90 O ATOM 0 H GLY A 111 -14.992 5.914 11.501 1.00 0.78 H new ATOM 0 HA2 GLY A 111 -16.450 6.252 13.910 1.00 0.82 H new ATOM 0 HA3 GLY A 111 -15.920 4.590 13.741 1.00 0.82 H new ATOM 1349 N ALA A 112 -13.825 5.392 14.963 1.00 0.84 N ATOM 1350 CA ALA A 112 -12.539 5.673 15.605 1.00 0.81 C ATOM 1351 C ALA A 112 -11.371 4.821 15.055 1.00 0.74 C ATOM 1352 O ALA A 112 -11.550 3.932 14.219 1.00 0.93 O ATOM 1353 CB ALA A 112 -12.738 5.493 17.118 1.00 0.95 C ATOM 0 H ALA A 112 -14.341 4.647 15.431 1.00 0.84 H new ATOM 0 HA ALA A 112 -12.239 6.696 15.378 1.00 0.81 H new ATOM 0 HB1 ALA A 112 -11.800 5.694 17.635 1.00 0.95 H new ATOM 0 HB2 ALA A 112 -13.502 6.187 17.470 1.00 0.95 H new ATOM 0 HB3 ALA A 112 -13.054 4.470 17.324 1.00 0.95 H new ATOM 1359 N MET A 113 -10.156 5.095 15.540 1.00 0.74 N ATOM 1360 CA MET A 113 -8.949 4.307 15.256 1.00 0.72 C ATOM 1361 C MET A 113 -9.043 2.868 15.816 1.00 0.67 C ATOM 1362 O MET A 113 -9.490 2.683 16.956 1.00 0.85 O ATOM 1363 CB MET A 113 -7.727 5.027 15.845 1.00 0.95 C ATOM 1364 CG MET A 113 -7.131 6.065 14.892 1.00 1.37 C ATOM 1365 SD MET A 113 -6.023 5.352 13.642 1.00 1.34 S ATOM 1366 CE MET A 113 -6.956 5.654 12.127 1.00 1.33 C ATOM 0 H MET A 113 -9.979 5.889 16.155 1.00 0.74 H new ATOM 0 HA MET A 113 -8.849 4.221 14.174 1.00 0.72 H new ATOM 0 HB2 MET A 113 -8.014 5.518 16.775 1.00 0.95 H new ATOM 0 HB3 MET A 113 -6.964 4.291 16.096 1.00 0.95 H new ATOM 0 HG2 MET A 113 -7.942 6.592 14.389 1.00 1.37 H new ATOM 0 HG3 MET A 113 -6.581 6.806 15.473 1.00 1.37 H new ATOM 0 HE1 MET A 113 -6.368 5.334 11.267 1.00 1.33 H new ATOM 0 HE2 MET A 113 -7.890 5.093 12.157 1.00 1.33 H new ATOM 0 HE3 MET A 113 -7.175 6.718 12.040 1.00 1.33 H new ATOM 1376 N PRO A 114 -8.601 1.841 15.061 1.00 0.56 N ATOM 1377 CA PRO A 114 -8.733 0.432 15.434 1.00 0.51 C ATOM 1378 C PRO A 114 -7.588 -0.078 16.324 1.00 0.59 C ATOM 1379 O PRO A 114 -6.436 0.328 16.166 1.00 0.78 O ATOM 1380 CB PRO A 114 -8.721 -0.314 14.102 1.00 0.46 C ATOM 1381 CG PRO A 114 -7.721 0.514 13.296 1.00 0.56 C ATOM 1382 CD PRO A 114 -8.042 1.937 13.716 1.00 0.65 C ATOM 0 HA PRO A 114 -9.638 0.279 16.023 1.00 0.51 H new ATOM 0 HB2 PRO A 114 -8.399 -1.349 14.215 1.00 0.46 H new ATOM 0 HB3 PRO A 114 -9.706 -0.335 13.635 1.00 0.46 H new ATOM 0 HG2 PRO A 114 -6.691 0.246 13.532 1.00 0.56 H new ATOM 0 HG3 PRO A 114 -7.850 0.371 12.223 1.00 0.56 H new ATOM 0 HD2 PRO A 114 -7.146 2.558 13.709 1.00 0.65 H new ATOM 0 HD3 PRO A 114 -8.753 2.396 13.029 1.00 0.65 H new ATOM 1390 N ALA A 115 -7.872 -1.059 17.178 1.00 0.61 N ATOM 1391 CA ALA A 115 -6.903 -1.637 18.107 1.00 0.73 C ATOM 1392 C ALA A 115 -5.860 -2.563 17.447 1.00 0.71 C ATOM 1393 O ALA A 115 -4.651 -2.374 17.617 1.00 1.14 O ATOM 1394 CB ALA A 115 -7.702 -2.414 19.152 1.00 0.85 C ATOM 0 H ALA A 115 -8.798 -1.482 17.245 1.00 0.61 H new ATOM 0 HA ALA A 115 -6.321 -0.823 18.540 1.00 0.73 H new ATOM 0 HB1 ALA A 115 -7.018 -2.866 19.871 1.00 0.85 H new ATOM 0 HB2 ALA A 115 -8.378 -1.735 19.672 1.00 0.85 H new ATOM 0 HB3 ALA A 115 -8.280 -3.196 18.660 1.00 0.85 H new ATOM 1400 N THR A 116 -6.321 -3.573 16.700 1.00 0.55 N ATOM 1401 CA THR A 116 -5.507 -4.703 16.196 1.00 0.51 C ATOM 1402 C THR A 116 -5.225 -4.673 14.689 1.00 0.48 C ATOM 1403 O THR A 116 -4.522 -5.552 14.187 1.00 0.62 O ATOM 1404 CB THR A 116 -6.187 -6.038 16.557 1.00 0.62 C ATOM 1405 OG1 THR A 116 -7.485 -6.027 16.014 1.00 0.83 O ATOM 1406 CG2 THR A 116 -6.307 -6.237 18.068 1.00 0.75 C ATOM 0 H THR A 116 -7.299 -3.635 16.417 1.00 0.55 H new ATOM 0 HA THR A 116 -4.539 -4.603 16.686 1.00 0.51 H new ATOM 0 HB THR A 116 -5.578 -6.848 16.156 1.00 0.62 H new ATOM 0 HG1 THR A 116 -7.937 -6.869 16.230 1.00 0.83 H new ATOM 0 HG21 THR A 116 -6.792 -7.191 18.272 1.00 0.75 H new ATOM 0 HG22 THR A 116 -5.313 -6.232 18.516 1.00 0.75 H new ATOM 0 HG23 THR A 116 -6.901 -5.429 18.495 1.00 0.75 H new ATOM 1414 N ALA A 117 -5.748 -3.678 13.964 1.00 0.40 N ATOM 1415 CA ALA A 117 -5.687 -3.576 12.497 1.00 0.35 C ATOM 1416 C ALA A 117 -4.276 -3.762 11.885 1.00 0.33 C ATOM 1417 O ALA A 117 -3.263 -3.392 12.479 1.00 0.39 O ATOM 1418 CB ALA A 117 -6.273 -2.223 12.075 1.00 0.35 C ATOM 0 H ALA A 117 -6.242 -2.895 14.393 1.00 0.40 H new ATOM 0 HA ALA A 117 -6.272 -4.408 12.105 1.00 0.35 H new ATOM 0 HB1 ALA A 117 -6.235 -2.133 10.989 1.00 0.35 H new ATOM 0 HB2 ALA A 117 -7.309 -2.155 12.408 1.00 0.35 H new ATOM 0 HB3 ALA A 117 -5.693 -1.418 12.527 1.00 0.35 H new ATOM 1424 N MET A 118 -4.221 -4.295 10.664 1.00 0.29 N ATOM 1425 CA MET A 118 -3.016 -4.570 9.871 1.00 0.28 C ATOM 1426 C MET A 118 -2.438 -3.274 9.268 1.00 0.29 C ATOM 1427 O MET A 118 -2.938 -2.777 8.262 1.00 0.30 O ATOM 1428 CB MET A 118 -3.439 -5.581 8.790 1.00 0.26 C ATOM 1429 CG MET A 118 -2.339 -6.011 7.820 1.00 0.29 C ATOM 1430 SD MET A 118 -0.894 -6.817 8.557 1.00 1.66 S ATOM 1431 CE MET A 118 -0.595 -8.082 7.291 1.00 0.72 C ATOM 0 H MET A 118 -5.070 -4.565 10.168 1.00 0.29 H new ATOM 0 HA MET A 118 -2.216 -4.982 10.486 1.00 0.28 H new ATOM 0 HB2 MET A 118 -3.831 -6.470 9.283 1.00 0.26 H new ATOM 0 HB3 MET A 118 -4.257 -5.149 8.214 1.00 0.26 H new ATOM 0 HG2 MET A 118 -2.774 -6.691 7.088 1.00 0.29 H new ATOM 0 HG3 MET A 118 -1.999 -5.130 7.275 1.00 0.29 H new ATOM 0 HE1 MET A 118 0.464 -8.339 7.276 1.00 0.72 H new ATOM 0 HE2 MET A 118 -1.181 -8.972 7.520 1.00 0.72 H new ATOM 0 HE3 MET A 118 -0.888 -7.696 6.315 1.00 0.72 H new ATOM 1441 N LYS A 119 -1.404 -2.697 9.885 1.00 0.39 N ATOM 1442 CA LYS A 119 -0.813 -1.382 9.520 1.00 0.41 C ATOM 1443 C LYS A 119 0.668 -1.269 9.918 1.00 0.46 C ATOM 1444 O LYS A 119 1.089 -1.842 10.927 1.00 0.58 O ATOM 1445 CB LYS A 119 -1.638 -0.267 10.182 1.00 0.44 C ATOM 1446 CG LYS A 119 -1.700 -0.337 11.720 1.00 0.50 C ATOM 1447 CD LYS A 119 -3.085 0.091 12.219 1.00 0.59 C ATOM 1448 CE LYS A 119 -3.255 -0.226 13.711 1.00 0.78 C ATOM 1449 NZ LYS A 119 -2.593 0.757 14.594 1.00 0.93 N ATOM 0 H LYS A 119 -0.932 -3.134 10.677 1.00 0.39 H new ATOM 0 HA LYS A 119 -0.847 -1.283 8.435 1.00 0.41 H new ATOM 0 HB2 LYS A 119 -1.219 0.697 9.893 1.00 0.44 H new ATOM 0 HB3 LYS A 119 -2.654 -0.304 9.789 1.00 0.44 H new ATOM 0 HG2 LYS A 119 -1.484 -1.352 12.053 1.00 0.50 H new ATOM 0 HG3 LYS A 119 -0.935 0.309 12.151 1.00 0.50 H new ATOM 0 HD2 LYS A 119 -3.221 1.160 12.053 1.00 0.59 H new ATOM 0 HD3 LYS A 119 -3.857 -0.421 11.645 1.00 0.59 H new ATOM 0 HE2 LYS A 119 -4.318 -0.261 13.950 1.00 0.78 H new ATOM 0 HE3 LYS A 119 -2.850 -1.217 13.914 1.00 0.78 H new ATOM 0 HZ1 LYS A 119 -2.744 0.488 15.587 1.00 0.93 H new ATOM 0 HZ2 LYS A 119 -1.573 0.774 14.391 1.00 0.93 H new ATOM 0 HZ3 LYS A 119 -2.996 1.701 14.426 1.00 0.93 H new ATOM 1463 N LYS A 120 1.457 -0.534 9.126 1.00 0.41 N ATOM 1464 CA LYS A 120 2.908 -0.314 9.319 1.00 0.44 C ATOM 1465 C LYS A 120 3.395 0.861 8.462 1.00 0.41 C ATOM 1466 O LYS A 120 2.764 1.194 7.462 1.00 0.47 O ATOM 1467 CB LYS A 120 3.657 -1.616 8.964 1.00 0.55 C ATOM 1468 CG LYS A 120 5.111 -1.673 9.453 1.00 0.59 C ATOM 1469 CD LYS A 120 5.695 -3.064 9.180 1.00 0.81 C ATOM 1470 CE LYS A 120 7.218 -3.118 9.328 1.00 0.97 C ATOM 1471 NZ LYS A 120 7.678 -3.049 10.732 1.00 1.69 N ATOM 0 H LYS A 120 1.096 -0.055 8.301 1.00 0.41 H new ATOM 0 HA LYS A 120 3.109 -0.058 10.359 1.00 0.44 H new ATOM 0 HB2 LYS A 120 3.112 -2.460 9.388 1.00 0.55 H new ATOM 0 HB3 LYS A 120 3.647 -1.741 7.881 1.00 0.55 H new ATOM 0 HG2 LYS A 120 5.705 -0.913 8.946 1.00 0.59 H new ATOM 0 HG3 LYS A 120 5.155 -1.453 10.520 1.00 0.59 H new ATOM 0 HD2 LYS A 120 5.244 -3.781 9.866 1.00 0.81 H new ATOM 0 HD3 LYS A 120 5.423 -3.373 8.171 1.00 0.81 H new ATOM 0 HE2 LYS A 120 7.586 -4.040 8.878 1.00 0.97 H new ATOM 0 HE3 LYS A 120 7.659 -2.293 8.769 1.00 0.97 H new ATOM 0 HZ1 LYS A 120 8.717 -3.090 10.759 1.00 1.69 H new ATOM 0 HZ2 LYS A 120 7.356 -2.157 11.159 1.00 1.69 H new ATOM 0 HZ3 LYS A 120 7.285 -3.851 11.266 1.00 1.69 H new ATOM 1485 N LEU A 121 4.524 1.462 8.839 1.00 0.44 N ATOM 1486 CA LEU A 121 5.192 2.530 8.080 1.00 0.44 C ATOM 1487 C LEU A 121 6.356 2.006 7.228 1.00 0.44 C ATOM 1488 O LEU A 121 7.032 1.061 7.641 1.00 0.46 O ATOM 1489 CB LEU A 121 5.677 3.651 9.018 1.00 0.46 C ATOM 1490 CG LEU A 121 4.520 4.427 9.669 1.00 0.47 C ATOM 1491 CD1 LEU A 121 4.190 3.969 11.085 1.00 0.49 C ATOM 1492 CD2 LEU A 121 4.824 5.923 9.705 1.00 0.56 C ATOM 0 H LEU A 121 5.014 1.217 9.700 1.00 0.44 H new ATOM 0 HA LEU A 121 4.448 2.938 7.395 1.00 0.44 H new ATOM 0 HB2 LEU A 121 6.303 3.219 9.799 1.00 0.46 H new ATOM 0 HB3 LEU A 121 6.302 4.344 8.455 1.00 0.46 H new ATOM 0 HG LEU A 121 3.651 4.221 9.044 1.00 0.47 H new ATOM 0 HD11 LEU A 121 3.364 4.563 11.476 1.00 0.49 H new ATOM 0 HD12 LEU A 121 3.905 2.917 11.070 1.00 0.49 H new ATOM 0 HD13 LEU A 121 5.065 4.099 11.722 1.00 0.49 H new ATOM 0 HD21 LEU A 121 3.992 6.452 10.170 1.00 0.56 H new ATOM 0 HD22 LEU A 121 5.732 6.096 10.283 1.00 0.56 H new ATOM 0 HD23 LEU A 121 4.965 6.290 8.688 1.00 0.56 H new ATOM 1504 N THR A 122 6.658 2.640 6.086 1.00 0.45 N ATOM 1505 CA THR A 122 7.891 2.324 5.330 1.00 0.46 C ATOM 1506 C THR A 122 9.125 2.720 6.155 1.00 0.47 C ATOM 1507 O THR A 122 9.218 3.840 6.662 1.00 0.51 O ATOM 1508 CB THR A 122 7.948 2.947 3.912 1.00 0.48 C ATOM 1509 OG1 THR A 122 7.391 4.244 3.897 1.00 0.48 O ATOM 1510 CG2 THR A 122 7.237 2.147 2.811 1.00 0.59 C ATOM 0 H THR A 122 6.078 3.366 5.665 1.00 0.45 H new ATOM 0 HA THR A 122 7.882 1.246 5.166 1.00 0.46 H new ATOM 0 HB THR A 122 9.015 2.952 3.689 1.00 0.48 H new ATOM 0 HG1 THR A 122 7.683 4.716 3.090 1.00 0.48 H new ATOM 0 HG21 THR A 122 7.337 2.669 1.860 1.00 0.59 H new ATOM 0 HG22 THR A 122 7.688 1.158 2.731 1.00 0.59 H new ATOM 0 HG23 THR A 122 6.181 2.045 3.060 1.00 0.59 H new ATOM 1518 N GLU A 123 10.080 1.801 6.326 1.00 0.48 N ATOM 1519 CA GLU A 123 11.253 2.008 7.209 1.00 0.54 C ATOM 1520 C GLU A 123 12.410 2.763 6.543 1.00 0.59 C ATOM 1521 O GLU A 123 12.882 3.777 7.061 1.00 0.72 O ATOM 1522 CB GLU A 123 11.790 0.686 7.788 1.00 0.61 C ATOM 1523 CG GLU A 123 11.589 -0.544 6.916 1.00 0.67 C ATOM 1524 CD GLU A 123 12.454 -1.700 7.419 1.00 1.06 C ATOM 1525 OE1 GLU A 123 12.043 -2.424 8.360 1.00 2.00 O ATOM 1526 OE2 GLU A 123 13.572 -1.887 6.893 1.00 2.06 O ATOM 0 H GLU A 123 10.071 0.893 5.862 1.00 0.48 H new ATOM 0 HA GLU A 123 10.868 2.632 8.016 1.00 0.54 H new ATOM 0 HB2 GLU A 123 12.856 0.802 7.981 1.00 0.61 H new ATOM 0 HB3 GLU A 123 11.309 0.510 8.750 1.00 0.61 H new ATOM 0 HG2 GLU A 123 10.539 -0.836 6.925 1.00 0.67 H new ATOM 0 HG3 GLU A 123 11.847 -0.311 5.883 1.00 0.67 H new ATOM 1533 N ALA A 124 12.876 2.253 5.406 1.00 0.58 N ATOM 1534 CA ALA A 124 13.968 2.818 4.615 1.00 0.71 C ATOM 1535 C ALA A 124 13.768 2.512 3.123 1.00 0.72 C ATOM 1536 O ALA A 124 13.895 3.407 2.283 1.00 1.03 O ATOM 1537 CB ALA A 124 15.295 2.243 5.133 1.00 0.90 C ATOM 0 H ALA A 124 12.490 1.403 4.994 1.00 0.58 H new ATOM 0 HA ALA A 124 13.983 3.903 4.720 1.00 0.71 H new ATOM 0 HB1 ALA A 124 16.121 2.655 4.553 1.00 0.90 H new ATOM 0 HB2 ALA A 124 15.421 2.508 6.183 1.00 0.90 H new ATOM 0 HB3 ALA A 124 15.286 1.158 5.031 1.00 0.90 H new ATOM 1543 N GLU A 125 13.384 1.273 2.795 1.00 0.75 N ATOM 1544 CA GLU A 125 13.087 0.845 1.421 1.00 1.16 C ATOM 1545 C GLU A 125 11.617 0.483 1.199 1.00 1.20 C ATOM 1546 O GLU A 125 11.128 0.543 0.069 1.00 2.12 O ATOM 1547 CB GLU A 125 13.929 -0.386 1.085 1.00 1.48 C ATOM 1548 CG GLU A 125 15.434 -0.142 0.969 1.00 1.68 C ATOM 1549 CD GLU A 125 16.114 -1.446 0.544 1.00 2.72 C ATOM 1550 OE1 GLU A 125 16.165 -2.408 1.351 1.00 3.33 O ATOM 1551 OE2 GLU A 125 16.520 -1.583 -0.635 1.00 3.81 O ATOM 0 H GLU A 125 13.269 0.530 3.484 1.00 0.75 H new ATOM 0 HA GLU A 125 13.322 1.693 0.777 1.00 1.16 H new ATOM 0 HB2 GLU A 125 13.759 -1.141 1.852 1.00 1.48 H new ATOM 0 HB3 GLU A 125 13.572 -0.803 0.143 1.00 1.48 H new ATOM 0 HG2 GLU A 125 15.634 0.643 0.240 1.00 1.68 H new ATOM 0 HG3 GLU A 125 15.836 0.200 1.923 1.00 1.68 H new ATOM 1558 N GLY A 126 10.917 0.086 2.259 1.00 0.48 N ATOM 1559 CA GLY A 126 9.581 -0.492 2.190 1.00 0.46 C ATOM 1560 C GLY A 126 9.068 -0.910 3.572 1.00 0.46 C ATOM 1561 O GLY A 126 9.637 -0.507 4.582 1.00 0.58 O ATOM 0 H GLY A 126 11.273 0.160 3.212 1.00 0.48 H new ATOM 0 HA2 GLY A 126 8.894 0.232 1.751 1.00 0.46 H new ATOM 0 HA3 GLY A 126 9.594 -1.359 1.530 1.00 0.46 H new ATOM 1565 N ALA A 127 7.990 -1.687 3.619 1.00 0.44 N ATOM 1566 CA ALA A 127 7.470 -2.368 4.814 1.00 0.47 C ATOM 1567 C ALA A 127 6.947 -3.783 4.495 1.00 0.45 C ATOM 1568 O ALA A 127 6.307 -3.979 3.459 1.00 0.52 O ATOM 1569 CB ALA A 127 6.373 -1.496 5.434 1.00 0.48 C ATOM 0 H ALA A 127 7.425 -1.871 2.790 1.00 0.44 H new ATOM 0 HA ALA A 127 8.283 -2.501 5.527 1.00 0.47 H new ATOM 0 HB1 ALA A 127 5.976 -1.987 6.322 1.00 0.48 H new ATOM 0 HB2 ALA A 127 6.791 -0.528 5.711 1.00 0.48 H new ATOM 0 HB3 ALA A 127 5.571 -1.352 4.710 1.00 0.48 H new ATOM 1575 N LYS A 128 7.170 -4.753 5.397 1.00 0.42 N ATOM 1576 CA LYS A 128 6.691 -6.148 5.283 1.00 0.42 C ATOM 1577 C LYS A 128 5.335 -6.380 5.968 1.00 0.39 C ATOM 1578 O LYS A 128 5.111 -5.936 7.095 1.00 0.43 O ATOM 1579 CB LYS A 128 7.770 -7.111 5.822 1.00 0.49 C ATOM 1580 CG LYS A 128 7.266 -8.563 5.939 1.00 0.93 C ATOM 1581 CD LYS A 128 8.361 -9.531 6.386 1.00 0.91 C ATOM 1582 CE LYS A 128 7.715 -10.821 6.906 1.00 0.97 C ATOM 1583 NZ LYS A 128 8.729 -11.785 7.384 1.00 1.33 N ATOM 0 H LYS A 128 7.703 -4.588 6.251 1.00 0.42 H new ATOM 0 HA LYS A 128 6.521 -6.352 4.226 1.00 0.42 H new ATOM 0 HB2 LYS A 128 8.638 -7.084 5.163 1.00 0.49 H new ATOM 0 HB3 LYS A 128 8.103 -6.766 6.801 1.00 0.49 H new ATOM 0 HG2 LYS A 128 6.440 -8.601 6.650 1.00 0.93 H new ATOM 0 HG3 LYS A 128 6.872 -8.886 4.975 1.00 0.93 H new ATOM 0 HD2 LYS A 128 9.027 -9.754 5.553 1.00 0.91 H new ATOM 0 HD3 LYS A 128 8.969 -9.075 7.167 1.00 0.91 H new ATOM 0 HE2 LYS A 128 7.028 -10.583 7.718 1.00 0.97 H new ATOM 0 HE3 LYS A 128 7.124 -11.278 6.112 1.00 0.97 H new ATOM 0 HZ1 LYS A 128 8.256 -12.645 7.728 1.00 1.33 H new ATOM 0 HZ2 LYS A 128 9.369 -12.031 6.602 1.00 1.33 H new ATOM 0 HZ3 LYS A 128 9.276 -11.358 8.158 1.00 1.33 H new ATOM 1597 N PHE A 129 4.467 -7.141 5.296 1.00 0.39 N ATOM 1598 CA PHE A 129 3.164 -7.613 5.778 1.00 0.38 C ATOM 1599 C PHE A 129 3.072 -9.137 5.572 1.00 0.40 C ATOM 1600 O PHE A 129 3.289 -9.615 4.457 1.00 0.41 O ATOM 1601 CB PHE A 129 2.049 -6.860 5.024 1.00 0.36 C ATOM 1602 CG PHE A 129 1.912 -5.381 5.360 1.00 0.33 C ATOM 1603 CD1 PHE A 129 2.941 -4.470 5.053 1.00 1.91 C ATOM 1604 CD2 PHE A 129 0.755 -4.902 6.004 1.00 1.87 C ATOM 1605 CE1 PHE A 129 2.855 -3.142 5.485 1.00 1.96 C ATOM 1606 CE2 PHE A 129 0.648 -3.556 6.396 1.00 1.83 C ATOM 1607 CZ PHE A 129 1.710 -2.673 6.149 1.00 0.39 C ATOM 0 H PHE A 129 4.665 -7.463 4.348 1.00 0.39 H new ATOM 0 HA PHE A 129 3.046 -7.412 6.843 1.00 0.38 H new ATOM 0 HB2 PHE A 129 2.230 -6.956 3.953 1.00 0.36 H new ATOM 0 HB3 PHE A 129 1.098 -7.351 5.232 1.00 0.36 H new ATOM 0 HD1 PHE A 129 3.798 -4.797 4.483 1.00 1.91 H new ATOM 0 HD2 PHE A 129 -0.063 -5.579 6.200 1.00 1.87 H new ATOM 0 HE1 PHE A 129 3.680 -2.469 5.305 1.00 1.96 H new ATOM 0 HE2 PHE A 129 -0.248 -3.203 6.885 1.00 1.83 H new ATOM 0 HZ PHE A 129 1.647 -1.643 6.466 1.00 0.39 H new ATOM 1617 N ASN A 130 2.770 -9.915 6.618 1.00 0.48 N ATOM 1618 CA ASN A 130 2.707 -11.383 6.547 1.00 0.49 C ATOM 1619 C ASN A 130 1.298 -11.858 6.136 1.00 0.55 C ATOM 1620 O ASN A 130 0.358 -11.800 6.926 1.00 0.85 O ATOM 1621 CB ASN A 130 3.150 -11.944 7.910 1.00 0.60 C ATOM 1622 CG ASN A 130 3.205 -13.459 7.964 1.00 0.84 C ATOM 1623 OD1 ASN A 130 2.086 -14.116 8.159 1.00 1.63 O flip ATOM 1624 ND2 ASN A 130 4.263 -14.066 7.850 1.00 1.09 N flip ATOM 0 H ASN A 130 2.561 -9.543 7.544 1.00 0.48 H new ATOM 0 HA ASN A 130 3.380 -11.759 5.776 1.00 0.49 H new ATOM 0 HB2 ASN A 130 4.135 -11.546 8.153 1.00 0.60 H new ATOM 0 HB3 ASN A 130 2.464 -11.588 8.679 1.00 0.60 H new ATOM 0 HD21 ASN A 130 5.132 -13.553 7.698 1.00 1.09 H new ATOM 0 HD22 ASN A 130 4.275 -15.084 7.907 1.00 1.09 H new ATOM 1631 N THR A 131 1.149 -12.366 4.913 1.00 0.45 N ATOM 1632 CA THR A 131 -0.141 -12.758 4.307 1.00 0.47 C ATOM 1633 C THR A 131 -0.485 -14.242 4.491 1.00 0.49 C ATOM 1634 O THR A 131 -1.563 -14.679 4.080 1.00 0.56 O ATOM 1635 CB THR A 131 -0.166 -12.370 2.820 1.00 0.49 C ATOM 1636 OG1 THR A 131 1.032 -12.752 2.185 1.00 0.50 O ATOM 1637 CG2 THR A 131 -0.295 -10.860 2.649 1.00 0.58 C ATOM 0 H THR A 131 1.942 -12.524 4.291 1.00 0.45 H new ATOM 0 HA THR A 131 -0.915 -12.208 4.843 1.00 0.47 H new ATOM 0 HB THR A 131 -1.022 -12.880 2.377 1.00 0.49 H new ATOM 0 HG1 THR A 131 0.996 -12.498 1.239 1.00 0.50 H new ATOM 0 HG21 THR A 131 -0.310 -10.614 1.587 1.00 0.58 H new ATOM 0 HG22 THR A 131 -1.220 -10.519 3.114 1.00 0.58 H new ATOM 0 HG23 THR A 131 0.553 -10.366 3.124 1.00 0.58 H new ATOM 1645 N ALA A 132 0.375 -15.012 5.168 1.00 0.49 N ATOM 1646 CA ALA A 132 0.212 -16.451 5.424 1.00 0.50 C ATOM 1647 C ALA A 132 -1.045 -16.834 6.242 1.00 0.56 C ATOM 1648 O ALA A 132 -1.331 -18.020 6.410 1.00 0.77 O ATOM 1649 CB ALA A 132 1.461 -16.936 6.166 1.00 0.57 C ATOM 0 H ALA A 132 1.236 -14.638 5.568 1.00 0.49 H new ATOM 0 HA ALA A 132 0.080 -16.930 4.454 1.00 0.50 H new ATOM 0 HB1 ALA A 132 1.371 -18.003 6.371 1.00 0.57 H new ATOM 0 HB2 ALA A 132 2.342 -16.758 5.550 1.00 0.57 H new ATOM 0 HB3 ALA A 132 1.560 -16.393 7.106 1.00 0.57 H new ATOM 1655 N ASN A 133 -1.759 -15.846 6.791 1.00 0.63 N ATOM 1656 CA ASN A 133 -2.965 -16.027 7.600 1.00 0.75 C ATOM 1657 C ASN A 133 -4.268 -15.733 6.822 1.00 0.79 C ATOM 1658 O ASN A 133 -5.333 -16.212 7.218 1.00 0.97 O ATOM 1659 CB ASN A 133 -2.842 -15.122 8.838 1.00 0.89 C ATOM 1660 CG ASN A 133 -1.559 -15.319 9.619 1.00 0.90 C ATOM 1661 OD1 ASN A 133 -0.648 -14.500 9.607 1.00 1.67 O ATOM 1662 ND2 ASN A 133 -1.426 -16.411 10.325 1.00 1.85 N ATOM 0 H ASN A 133 -1.503 -14.865 6.679 1.00 0.63 H new ATOM 0 HA ASN A 133 -3.036 -17.075 7.892 1.00 0.75 H new ATOM 0 HB2 ASN A 133 -2.907 -14.081 8.522 1.00 0.89 H new ATOM 0 HB3 ASN A 133 -3.689 -15.309 9.498 1.00 0.89 H new ATOM 0 HD21 ASN A 133 -0.571 -16.573 10.857 1.00 1.85 H new ATOM 0 HD22 ASN A 133 -2.177 -17.101 10.344 1.00 1.85 H new ATOM 1669 N LEU A 134 -4.209 -14.956 5.728 1.00 0.68 N ATOM 1670 CA LEU A 134 -5.397 -14.556 4.973 1.00 0.65 C ATOM 1671 C LEU A 134 -5.921 -15.660 4.033 1.00 0.68 C ATOM 1672 O LEU A 134 -5.127 -16.392 3.434 1.00 0.72 O ATOM 1673 CB LEU A 134 -5.108 -13.304 4.116 1.00 0.59 C ATOM 1674 CG LEU A 134 -5.048 -11.926 4.791 1.00 0.58 C ATOM 1675 CD1 LEU A 134 -6.029 -11.768 5.951 1.00 0.64 C ATOM 1676 CD2 LEU A 134 -3.641 -11.568 5.226 1.00 0.58 C ATOM 0 H LEU A 134 -3.336 -14.591 5.347 1.00 0.68 H new ATOM 0 HA LEU A 134 -6.160 -14.349 5.724 1.00 0.65 H new ATOM 0 HB2 LEU A 134 -4.154 -13.464 3.614 1.00 0.59 H new ATOM 0 HB3 LEU A 134 -5.872 -13.255 3.340 1.00 0.59 H new ATOM 0 HG LEU A 134 -5.361 -11.220 4.022 1.00 0.58 H new ATOM 0 HD11 LEU A 134 -5.929 -10.770 6.378 1.00 0.64 H new ATOM 0 HD12 LEU A 134 -7.047 -11.907 5.588 1.00 0.64 H new ATOM 0 HD13 LEU A 134 -5.811 -12.514 6.716 1.00 0.64 H new ATOM 0 HD21 LEU A 134 -3.645 -10.586 5.698 1.00 0.58 H new ATOM 0 HD22 LEU A 134 -3.280 -12.311 5.937 1.00 0.58 H new ATOM 0 HD23 LEU A 134 -2.985 -11.549 4.356 1.00 0.58 H new ATOM 1688 N PRO A 135 -7.248 -15.727 3.812 1.00 0.70 N ATOM 1689 CA PRO A 135 -7.837 -16.549 2.761 1.00 0.75 C ATOM 1690 C PRO A 135 -7.735 -15.868 1.385 1.00 0.71 C ATOM 1691 O PRO A 135 -7.468 -14.668 1.260 1.00 0.65 O ATOM 1692 CB PRO A 135 -9.291 -16.760 3.171 1.00 0.80 C ATOM 1693 CG PRO A 135 -9.625 -15.464 3.920 1.00 0.76 C ATOM 1694 CD PRO A 135 -8.294 -15.036 4.555 1.00 0.71 C ATOM 0 HA PRO A 135 -7.309 -17.497 2.657 1.00 0.75 H new ATOM 0 HB2 PRO A 135 -9.938 -16.905 2.306 1.00 0.80 H new ATOM 0 HB3 PRO A 135 -9.408 -17.637 3.808 1.00 0.80 H new ATOM 0 HG2 PRO A 135 -10.006 -14.700 3.242 1.00 0.76 H new ATOM 0 HG3 PRO A 135 -10.392 -15.629 4.677 1.00 0.76 H new ATOM 0 HD2 PRO A 135 -8.164 -13.955 4.496 1.00 0.71 H new ATOM 0 HD3 PRO A 135 -8.263 -15.304 5.611 1.00 0.71 H new ATOM 1702 N ALA A 136 -7.997 -16.651 0.343 1.00 0.79 N ATOM 1703 CA ALA A 136 -7.824 -16.314 -1.060 1.00 0.78 C ATOM 1704 C ALA A 136 -8.947 -15.396 -1.571 1.00 0.82 C ATOM 1705 O ALA A 136 -9.963 -15.862 -2.103 1.00 1.01 O ATOM 1706 CB ALA A 136 -7.787 -17.652 -1.793 1.00 0.87 C ATOM 0 H ALA A 136 -8.358 -17.597 0.467 1.00 0.79 H new ATOM 0 HA ALA A 136 -6.909 -15.746 -1.229 1.00 0.78 H new ATOM 0 HB1 ALA A 136 -7.658 -17.478 -2.861 1.00 0.87 H new ATOM 0 HB2 ALA A 136 -6.955 -18.249 -1.419 1.00 0.87 H new ATOM 0 HB3 ALA A 136 -8.722 -18.186 -1.622 1.00 0.87 H new ATOM 1712 N ALA A 137 -8.772 -14.087 -1.383 1.00 0.69 N ATOM 1713 CA ALA A 137 -9.749 -13.075 -1.764 1.00 0.70 C ATOM 1714 C ALA A 137 -9.066 -11.757 -2.201 1.00 0.59 C ATOM 1715 O ALA A 137 -7.832 -11.673 -2.246 1.00 0.56 O ATOM 1716 CB ALA A 137 -10.689 -12.881 -0.566 1.00 0.78 C ATOM 0 H ALA A 137 -7.932 -13.698 -0.954 1.00 0.69 H new ATOM 0 HA ALA A 137 -10.321 -13.400 -2.633 1.00 0.70 H new ATOM 0 HB1 ALA A 137 -11.439 -12.128 -0.810 1.00 0.78 H new ATOM 0 HB2 ALA A 137 -11.184 -13.824 -0.335 1.00 0.78 H new ATOM 0 HB3 ALA A 137 -10.113 -12.552 0.299 1.00 0.78 H new ATOM 1722 N LYS A 138 -9.858 -10.714 -2.489 1.00 0.57 N ATOM 1723 CA LYS A 138 -9.384 -9.342 -2.728 1.00 0.52 C ATOM 1724 C LYS A 138 -9.387 -8.460 -1.479 1.00 0.46 C ATOM 1725 O LYS A 138 -10.307 -8.483 -0.658 1.00 0.55 O ATOM 1726 CB LYS A 138 -10.193 -8.693 -3.854 1.00 0.61 C ATOM 1727 CG LYS A 138 -9.745 -9.264 -5.202 1.00 0.70 C ATOM 1728 CD LYS A 138 -10.632 -8.778 -6.341 1.00 0.92 C ATOM 1729 CE LYS A 138 -12.025 -9.414 -6.289 1.00 2.15 C ATOM 1730 NZ LYS A 138 -12.751 -9.201 -7.559 1.00 2.46 N ATOM 0 H LYS A 138 -10.871 -10.803 -2.564 1.00 0.57 H new ATOM 0 HA LYS A 138 -8.339 -9.426 -3.027 1.00 0.52 H new ATOM 0 HB2 LYS A 138 -11.257 -8.878 -3.705 1.00 0.61 H new ATOM 0 HB3 LYS A 138 -10.052 -7.612 -3.840 1.00 0.61 H new ATOM 0 HG2 LYS A 138 -8.712 -8.974 -5.395 1.00 0.70 H new ATOM 0 HG3 LYS A 138 -9.768 -10.353 -5.162 1.00 0.70 H new ATOM 0 HD2 LYS A 138 -10.726 -7.693 -6.291 1.00 0.92 H new ATOM 0 HD3 LYS A 138 -10.160 -9.014 -7.295 1.00 0.92 H new ATOM 0 HE2 LYS A 138 -11.934 -10.482 -6.092 1.00 2.15 H new ATOM 0 HE3 LYS A 138 -12.594 -8.985 -5.464 1.00 2.15 H new ATOM 0 HZ1 LYS A 138 -13.692 -9.641 -7.499 1.00 2.46 H new ATOM 0 HZ2 LYS A 138 -12.856 -8.181 -7.732 1.00 2.46 H new ATOM 0 HZ3 LYS A 138 -12.217 -9.631 -8.341 1.00 2.46 H new ATOM 1744 N TYR A 139 -8.363 -7.625 -1.407 1.00 0.40 N ATOM 1745 CA TYR A 139 -8.046 -6.702 -0.318 1.00 0.36 C ATOM 1746 C TYR A 139 -7.650 -5.335 -0.887 1.00 0.35 C ATOM 1747 O TYR A 139 -7.436 -5.186 -2.090 1.00 0.41 O ATOM 1748 CB TYR A 139 -6.913 -7.292 0.541 1.00 0.40 C ATOM 1749 CG TYR A 139 -7.214 -8.662 1.111 1.00 0.41 C ATOM 1750 CD1 TYR A 139 -6.940 -9.815 0.347 1.00 0.43 C ATOM 1751 CD2 TYR A 139 -7.806 -8.784 2.383 1.00 0.46 C ATOM 1752 CE1 TYR A 139 -7.287 -11.083 0.842 1.00 0.50 C ATOM 1753 CE2 TYR A 139 -8.140 -10.060 2.876 1.00 0.51 C ATOM 1754 CZ TYR A 139 -7.886 -11.205 2.105 1.00 0.52 C ATOM 1755 OH TYR A 139 -8.242 -12.418 2.589 1.00 0.59 O ATOM 0 H TYR A 139 -7.679 -7.567 -2.161 1.00 0.40 H new ATOM 0 HA TYR A 139 -8.924 -6.564 0.312 1.00 0.36 H new ATOM 0 HB2 TYR A 139 -6.008 -7.353 -0.064 1.00 0.40 H new ATOM 0 HB3 TYR A 139 -6.701 -6.608 1.363 1.00 0.40 H new ATOM 0 HD1 TYR A 139 -6.464 -9.723 -0.618 1.00 0.43 H new ATOM 0 HD2 TYR A 139 -8.003 -7.904 2.977 1.00 0.46 H new ATOM 0 HE1 TYR A 139 -7.093 -11.965 0.250 1.00 0.50 H new ATOM 0 HE2 TYR A 139 -8.593 -10.158 3.851 1.00 0.51 H new ATOM 0 HH TYR A 139 -7.822 -13.121 2.051 1.00 0.59 H new ATOM 1765 N LYS A 140 -7.547 -4.322 -0.028 1.00 0.32 N ATOM 1766 CA LYS A 140 -7.141 -2.957 -0.421 1.00 0.31 C ATOM 1767 C LYS A 140 -6.169 -2.320 0.570 1.00 0.28 C ATOM 1768 O LYS A 140 -6.214 -2.628 1.758 1.00 0.36 O ATOM 1769 CB LYS A 140 -8.376 -2.059 -0.638 1.00 0.35 C ATOM 1770 CG LYS A 140 -9.174 -2.402 -1.894 1.00 0.43 C ATOM 1771 CD LYS A 140 -10.382 -1.477 -2.067 1.00 0.51 C ATOM 1772 CE LYS A 140 -11.196 -2.071 -3.222 1.00 0.62 C ATOM 1773 NZ LYS A 140 -12.483 -1.387 -3.466 1.00 1.70 N ATOM 0 H LYS A 140 -7.742 -4.417 0.969 1.00 0.32 H new ATOM 0 HA LYS A 140 -6.605 -3.049 -1.366 1.00 0.31 H new ATOM 0 HB2 LYS A 140 -9.030 -2.140 0.230 1.00 0.35 H new ATOM 0 HB3 LYS A 140 -8.052 -1.020 -0.697 1.00 0.35 H new ATOM 0 HG2 LYS A 140 -8.528 -2.324 -2.768 1.00 0.43 H new ATOM 0 HG3 LYS A 140 -9.513 -3.437 -1.839 1.00 0.43 H new ATOM 0 HD2 LYS A 140 -10.974 -1.431 -1.153 1.00 0.51 H new ATOM 0 HD3 LYS A 140 -10.066 -0.459 -2.293 1.00 0.51 H new ATOM 0 HE2 LYS A 140 -10.598 -2.032 -4.132 1.00 0.62 H new ATOM 0 HE3 LYS A 140 -11.390 -3.123 -3.013 1.00 0.62 H new ATOM 0 HZ1 LYS A 140 -12.795 -1.571 -4.441 1.00 1.70 H new ATOM 0 HZ2 LYS A 140 -13.198 -1.745 -2.801 1.00 1.70 H new ATOM 0 HZ3 LYS A 140 -12.364 -0.363 -3.328 1.00 1.70 H new ATOM 1787 N ILE A 141 -5.328 -1.395 0.106 1.00 0.26 N ATOM 1788 CA ILE A 141 -4.434 -0.588 0.956 1.00 0.26 C ATOM 1789 C ILE A 141 -4.878 0.880 0.940 1.00 0.27 C ATOM 1790 O ILE A 141 -5.234 1.418 -0.110 1.00 0.30 O ATOM 1791 CB ILE A 141 -2.942 -0.761 0.577 1.00 0.27 C ATOM 1792 CG1 ILE A 141 -2.460 -2.226 0.701 1.00 0.29 C ATOM 1793 CG2 ILE A 141 -2.025 0.098 1.467 1.00 0.29 C ATOM 1794 CD1 ILE A 141 -2.567 -2.987 -0.620 1.00 0.31 C ATOM 0 H ILE A 141 -5.243 -1.177 -0.887 1.00 0.26 H new ATOM 0 HA ILE A 141 -4.517 -0.955 1.979 1.00 0.26 H new ATOM 0 HB ILE A 141 -2.877 -0.442 -0.463 1.00 0.27 H new ATOM 0 HG12 ILE A 141 -1.425 -2.238 1.041 1.00 0.29 H new ATOM 0 HG13 ILE A 141 -3.051 -2.737 1.461 1.00 0.29 H new ATOM 0 HG21 ILE A 141 -0.987 -0.051 1.170 1.00 0.29 H new ATOM 0 HG22 ILE A 141 -2.288 1.150 1.353 1.00 0.29 H new ATOM 0 HG23 ILE A 141 -2.150 -0.196 2.509 1.00 0.29 H new ATOM 0 HD11 ILE A 141 -2.217 -4.010 -0.480 1.00 0.31 H new ATOM 0 HD12 ILE A 141 -3.606 -3.001 -0.949 1.00 0.31 H new ATOM 0 HD13 ILE A 141 -1.954 -2.494 -1.375 1.00 0.31 H new ATOM 1806 N TYR A 142 -4.837 1.518 2.112 1.00 0.29 N ATOM 1807 CA TYR A 142 -5.179 2.926 2.334 1.00 0.32 C ATOM 1808 C TYR A 142 -4.044 3.636 3.092 1.00 0.34 C ATOM 1809 O TYR A 142 -3.561 3.136 4.105 1.00 0.34 O ATOM 1810 CB TYR A 142 -6.509 3.011 3.096 1.00 0.32 C ATOM 1811 CG TYR A 142 -7.755 2.798 2.254 1.00 0.32 C ATOM 1812 CD1 TYR A 142 -8.096 1.522 1.754 1.00 1.75 C ATOM 1813 CD2 TYR A 142 -8.610 3.888 2.008 1.00 1.79 C ATOM 1814 CE1 TYR A 142 -9.265 1.340 0.995 1.00 1.75 C ATOM 1815 CE2 TYR A 142 -9.793 3.698 1.275 1.00 1.80 C ATOM 1816 CZ TYR A 142 -10.114 2.433 0.746 1.00 0.37 C ATOM 1817 OH TYR A 142 -11.242 2.271 0.009 1.00 0.45 O ATOM 0 H TYR A 142 -4.552 1.047 2.971 1.00 0.29 H new ATOM 0 HA TYR A 142 -5.299 3.433 1.377 1.00 0.32 H new ATOM 0 HB2 TYR A 142 -6.499 2.269 3.895 1.00 0.32 H new ATOM 0 HB3 TYR A 142 -6.575 3.990 3.571 1.00 0.32 H new ATOM 0 HD1 TYR A 142 -7.453 0.678 1.957 1.00 1.75 H new ATOM 0 HD2 TYR A 142 -8.357 4.869 2.382 1.00 1.79 H new ATOM 0 HE1 TYR A 142 -9.510 0.364 0.604 1.00 1.75 H new ATOM 0 HE2 TYR A 142 -10.463 4.530 1.116 1.00 1.80 H new ATOM 0 HH TYR A 142 -11.711 3.128 -0.064 1.00 0.45 H new ATOM 1827 N GLU A 143 -3.601 4.801 2.613 1.00 0.45 N ATOM 1828 CA GLU A 143 -2.414 5.507 3.128 1.00 0.56 C ATOM 1829 C GLU A 143 -2.800 6.567 4.176 1.00 0.68 C ATOM 1830 O GLU A 143 -2.898 7.759 3.876 1.00 1.24 O ATOM 1831 CB GLU A 143 -1.619 6.069 1.936 1.00 0.66 C ATOM 1832 CG GLU A 143 -0.245 6.621 2.330 1.00 0.82 C ATOM 1833 CD GLU A 143 0.349 7.439 1.180 1.00 0.86 C ATOM 1834 OE1 GLU A 143 0.751 6.831 0.164 1.00 1.92 O ATOM 1835 OE2 GLU A 143 0.371 8.694 1.287 1.00 1.54 O ATOM 0 H GLU A 143 -4.060 5.292 1.845 1.00 0.45 H new ATOM 0 HA GLU A 143 -1.764 4.814 3.662 1.00 0.56 H new ATOM 0 HB2 GLU A 143 -1.487 5.283 1.193 1.00 0.66 H new ATOM 0 HB3 GLU A 143 -2.199 6.861 1.463 1.00 0.66 H new ATOM 0 HG2 GLU A 143 -0.338 7.245 3.219 1.00 0.82 H new ATOM 0 HG3 GLU A 143 0.425 5.800 2.585 1.00 0.82 H new ATOM 1842 N ILE A 144 -3.064 6.122 5.410 1.00 0.64 N ATOM 1843 CA ILE A 144 -3.563 6.981 6.493 1.00 0.60 C ATOM 1844 C ILE A 144 -2.396 7.717 7.165 1.00 0.70 C ATOM 1845 O ILE A 144 -1.718 7.175 8.037 1.00 0.77 O ATOM 1846 CB ILE A 144 -4.373 6.151 7.521 1.00 0.55 C ATOM 1847 CG1 ILE A 144 -5.414 5.204 6.883 1.00 0.52 C ATOM 1848 CG2 ILE A 144 -5.048 7.086 8.540 1.00 0.56 C ATOM 1849 CD1 ILE A 144 -6.438 5.872 5.963 1.00 0.54 C ATOM 0 H ILE A 144 -2.937 5.149 5.688 1.00 0.64 H new ATOM 0 HA ILE A 144 -4.235 7.727 6.069 1.00 0.60 H new ATOM 0 HB ILE A 144 -3.655 5.505 8.025 1.00 0.55 H new ATOM 0 HG12 ILE A 144 -4.884 4.441 6.313 1.00 0.52 H new ATOM 0 HG13 ILE A 144 -5.950 4.691 7.682 1.00 0.52 H new ATOM 0 HG21 ILE A 144 -5.615 6.493 9.258 1.00 0.56 H new ATOM 0 HG22 ILE A 144 -4.286 7.662 9.066 1.00 0.56 H new ATOM 0 HG23 ILE A 144 -5.722 7.766 8.019 1.00 0.56 H new ATOM 0 HD11 ILE A 144 -7.120 5.118 5.569 1.00 0.54 H new ATOM 0 HD12 ILE A 144 -7.004 6.614 6.526 1.00 0.54 H new ATOM 0 HD13 ILE A 144 -5.921 6.360 5.137 1.00 0.54 H new ATOM 1861 N HIS A 145 -2.209 8.994 6.828 1.00 0.83 N ATOM 1862 CA HIS A 145 -1.082 9.800 7.319 1.00 0.96 C ATOM 1863 C HIS A 145 -1.276 10.369 8.739 1.00 0.93 C ATOM 1864 O HIS A 145 -0.382 11.023 9.265 1.00 1.17 O ATOM 1865 CB HIS A 145 -0.734 10.885 6.284 1.00 1.24 C ATOM 1866 CG HIS A 145 -1.851 11.857 5.990 1.00 1.85 C ATOM 1867 ND1 HIS A 145 -2.264 12.898 6.790 1.00 3.06 N ATOM 1868 CD2 HIS A 145 -2.623 11.891 4.861 1.00 3.17 C ATOM 1869 CE1 HIS A 145 -3.269 13.536 6.171 1.00 4.64 C ATOM 1870 NE2 HIS A 145 -3.528 12.954 4.983 1.00 4.78 N ATOM 0 H HIS A 145 -2.835 9.503 6.205 1.00 0.83 H new ATOM 0 HA HIS A 145 -0.230 9.128 7.428 1.00 0.96 H new ATOM 0 HB2 HIS A 145 0.131 11.444 6.640 1.00 1.24 H new ATOM 0 HB3 HIS A 145 -0.439 10.399 5.354 1.00 1.24 H new ATOM 0 HD2 HIS A 145 -2.548 11.216 4.021 1.00 3.17 H new ATOM 0 HE1 HIS A 145 -3.795 14.392 6.567 1.00 4.64 H new ATOM 0 HE2 HIS A 145 -4.240 13.232 4.308 1.00 4.78 H new ATOM 1878 N SER A 146 -2.415 10.133 9.397 1.00 0.80 N ATOM 1879 CA SER A 146 -2.697 10.708 10.721 1.00 0.86 C ATOM 1880 C SER A 146 -1.959 10.039 11.892 1.00 0.92 C ATOM 1881 O SER A 146 -1.861 10.640 12.966 1.00 1.13 O ATOM 1882 CB SER A 146 -4.204 10.749 10.971 1.00 1.03 C ATOM 1883 OG SER A 146 -4.797 9.475 10.833 1.00 1.71 O ATOM 0 H SER A 146 -3.164 9.543 9.033 1.00 0.80 H new ATOM 0 HA SER A 146 -2.298 11.722 10.689 1.00 0.86 H new ATOM 0 HB2 SER A 146 -4.395 11.131 11.974 1.00 1.03 H new ATOM 0 HB3 SER A 146 -4.669 11.443 10.271 1.00 1.03 H new ATOM 0 HG SER A 146 -5.760 9.542 11.002 1.00 1.71 H new ATOM 2086 N LYS A 162 -2.037 13.915 -2.988 1.00 1.24 N ATOM 2087 CA LYS A 162 -3.041 12.898 -2.639 1.00 1.24 C ATOM 2088 C LYS A 162 -2.658 11.493 -3.104 1.00 0.99 C ATOM 2089 O LYS A 162 -2.639 11.224 -4.309 1.00 1.14 O ATOM 2090 CB LYS A 162 -4.381 13.363 -3.253 1.00 1.78 C ATOM 2091 CG LYS A 162 -5.516 12.337 -3.376 1.00 1.86 C ATOM 2092 CD LYS A 162 -5.954 11.690 -2.065 1.00 1.76 C ATOM 2093 CE LYS A 162 -6.989 10.621 -2.425 1.00 2.04 C ATOM 2094 NZ LYS A 162 -7.335 9.774 -1.256 1.00 3.52 N ATOM 0 HA LYS A 162 -3.117 12.814 -1.555 1.00 1.24 H new ATOM 0 HB2 LYS A 162 -4.749 14.197 -2.656 1.00 1.78 H new ATOM 0 HB3 LYS A 162 -4.174 13.752 -4.250 1.00 1.78 H new ATOM 0 HG2 LYS A 162 -6.379 12.827 -3.827 1.00 1.86 H new ATOM 0 HG3 LYS A 162 -5.201 11.551 -4.063 1.00 1.86 H new ATOM 0 HD2 LYS A 162 -5.103 11.246 -1.549 1.00 1.76 H new ATOM 0 HD3 LYS A 162 -6.383 12.432 -1.392 1.00 1.76 H new ATOM 0 HE2 LYS A 162 -7.890 11.101 -2.806 1.00 2.04 H new ATOM 0 HE3 LYS A 162 -6.600 9.993 -3.226 1.00 2.04 H new ATOM 0 HZ1 LYS A 162 -8.144 9.165 -1.495 1.00 3.52 H new ATOM 0 HZ2 LYS A 162 -6.519 9.181 -1.003 1.00 3.52 H new ATOM 0 HZ3 LYS A 162 -7.585 10.381 -0.449 1.00 3.52 H new ATOM 2108 N ALA A 163 -2.447 10.573 -2.161 1.00 0.83 N ATOM 2109 CA ALA A 163 -2.341 9.146 -2.473 1.00 0.70 C ATOM 2110 C ALA A 163 -3.741 8.551 -2.650 1.00 0.64 C ATOM 2111 O ALA A 163 -4.634 8.761 -1.827 1.00 0.84 O ATOM 2112 CB ALA A 163 -1.545 8.392 -1.406 1.00 0.84 C ATOM 0 H ALA A 163 -2.346 10.792 -1.170 1.00 0.83 H new ATOM 0 HA ALA A 163 -1.792 9.037 -3.408 1.00 0.70 H new ATOM 0 HB1 ALA A 163 -1.488 7.337 -1.673 1.00 0.84 H new ATOM 0 HB2 ALA A 163 -0.538 8.805 -1.343 1.00 0.84 H new ATOM 0 HB3 ALA A 163 -2.041 8.496 -0.441 1.00 0.84 H new ATOM 2118 N VAL A 164 -3.940 7.788 -3.720 1.00 0.53 N ATOM 2119 CA VAL A 164 -5.197 7.071 -3.989 1.00 0.49 C ATOM 2120 C VAL A 164 -5.068 5.589 -3.616 1.00 0.48 C ATOM 2121 O VAL A 164 -3.965 5.039 -3.689 1.00 0.51 O ATOM 2122 CB VAL A 164 -5.682 7.248 -5.438 1.00 0.47 C ATOM 2123 CG1 VAL A 164 -6.500 8.535 -5.534 1.00 0.54 C ATOM 2124 CG2 VAL A 164 -4.532 7.305 -6.442 1.00 0.52 C ATOM 0 H VAL A 164 -3.229 7.644 -4.437 1.00 0.53 H new ATOM 0 HA VAL A 164 -5.962 7.518 -3.355 1.00 0.49 H new ATOM 0 HB VAL A 164 -6.288 6.378 -5.691 1.00 0.47 H new ATOM 0 HG11 VAL A 164 -6.848 8.669 -6.558 1.00 0.54 H new ATOM 0 HG12 VAL A 164 -7.358 8.472 -4.864 1.00 0.54 H new ATOM 0 HG13 VAL A 164 -5.878 9.383 -5.248 1.00 0.54 H new ATOM 0 HG21 VAL A 164 -4.933 7.431 -7.448 1.00 0.52 H new ATOM 0 HG22 VAL A 164 -3.882 8.146 -6.203 1.00 0.52 H new ATOM 0 HG23 VAL A 164 -3.960 6.379 -6.393 1.00 0.52 H new ATOM 2134 N PRO A 165 -6.162 4.935 -3.189 1.00 0.47 N ATOM 2135 CA PRO A 165 -6.117 3.571 -2.670 1.00 0.45 C ATOM 2136 C PRO A 165 -5.888 2.534 -3.782 1.00 0.41 C ATOM 2137 O PRO A 165 -6.119 2.790 -4.970 1.00 0.58 O ATOM 2138 CB PRO A 165 -7.426 3.387 -1.900 1.00 0.53 C ATOM 2139 CG PRO A 165 -8.394 4.302 -2.644 1.00 0.58 C ATOM 2140 CD PRO A 165 -7.519 5.458 -3.127 1.00 0.55 C ATOM 0 HA PRO A 165 -5.267 3.410 -2.007 1.00 0.45 H new ATOM 0 HB2 PRO A 165 -7.760 2.350 -1.914 1.00 0.53 H new ATOM 0 HB3 PRO A 165 -7.322 3.674 -0.854 1.00 0.53 H new ATOM 0 HG2 PRO A 165 -8.869 3.786 -3.479 1.00 0.58 H new ATOM 0 HG3 PRO A 165 -9.193 4.653 -1.990 1.00 0.58 H new ATOM 0 HD2 PRO A 165 -7.846 5.813 -4.105 1.00 0.55 H new ATOM 0 HD3 PRO A 165 -7.580 6.305 -2.444 1.00 0.55 H new ATOM 2148 N ILE A 166 -5.415 1.358 -3.372 1.00 0.41 N ATOM 2149 CA ILE A 166 -4.894 0.287 -4.235 1.00 0.44 C ATOM 2150 C ILE A 166 -5.670 -1.003 -3.959 1.00 0.41 C ATOM 2151 O ILE A 166 -5.832 -1.347 -2.788 1.00 0.47 O ATOM 2152 CB ILE A 166 -3.378 0.060 -3.965 1.00 0.49 C ATOM 2153 CG1 ILE A 166 -2.541 1.354 -3.780 1.00 0.63 C ATOM 2154 CG2 ILE A 166 -2.771 -0.778 -5.102 1.00 0.54 C ATOM 2155 CD1 ILE A 166 -2.496 1.829 -2.319 1.00 1.31 C ATOM 0 H ILE A 166 -5.381 1.110 -2.383 1.00 0.41 H new ATOM 0 HA ILE A 166 -5.019 0.576 -5.279 1.00 0.44 H new ATOM 0 HB ILE A 166 -3.330 -0.463 -3.010 1.00 0.49 H new ATOM 0 HG12 ILE A 166 -1.524 1.177 -4.132 1.00 0.63 H new ATOM 0 HG13 ILE A 166 -2.960 2.145 -4.402 1.00 0.63 H new ATOM 0 HG21 ILE A 166 -1.710 -0.936 -4.911 1.00 0.54 H new ATOM 0 HG22 ILE A 166 -3.277 -1.742 -5.154 1.00 0.54 H new ATOM 0 HG23 ILE A 166 -2.895 -0.251 -6.048 1.00 0.54 H new ATOM 0 HD11 ILE A 166 -1.897 2.737 -2.250 1.00 1.31 H new ATOM 0 HD12 ILE A 166 -3.509 2.035 -1.972 1.00 1.31 H new ATOM 0 HD13 ILE A 166 -2.050 1.052 -1.697 1.00 1.31 H new ATOM 2167 N GLU A 167 -6.104 -1.740 -4.988 1.00 0.48 N ATOM 2168 CA GLU A 167 -6.674 -3.091 -4.819 1.00 0.51 C ATOM 2169 C GLU A 167 -5.634 -4.179 -5.126 1.00 0.49 C ATOM 2170 O GLU A 167 -4.927 -4.124 -6.137 1.00 0.60 O ATOM 2171 CB GLU A 167 -7.982 -3.280 -5.618 1.00 0.76 C ATOM 2172 CG GLU A 167 -8.707 -4.574 -5.197 1.00 2.35 C ATOM 2173 CD GLU A 167 -10.060 -4.767 -5.886 1.00 2.99 C ATOM 2174 OE1 GLU A 167 -10.080 -5.152 -7.081 1.00 3.06 O ATOM 2175 OE2 GLU A 167 -11.108 -4.561 -5.226 1.00 4.22 O ATOM 0 H GLU A 167 -6.073 -1.424 -5.957 1.00 0.48 H new ATOM 0 HA GLU A 167 -6.947 -3.198 -3.769 1.00 0.51 H new ATOM 0 HB2 GLU A 167 -8.637 -2.424 -5.457 1.00 0.76 H new ATOM 0 HB3 GLU A 167 -7.759 -3.315 -6.684 1.00 0.76 H new ATOM 0 HG2 GLU A 167 -8.069 -5.428 -5.422 1.00 2.35 H new ATOM 0 HG3 GLU A 167 -8.856 -4.563 -4.117 1.00 2.35 H new ATOM 2182 N ILE A 168 -5.565 -5.187 -4.257 1.00 0.46 N ATOM 2183 CA ILE A 168 -4.645 -6.322 -4.330 1.00 0.43 C ATOM 2184 C ILE A 168 -5.411 -7.640 -4.153 1.00 0.43 C ATOM 2185 O ILE A 168 -6.313 -7.756 -3.326 1.00 0.50 O ATOM 2186 CB ILE A 168 -3.489 -6.136 -3.313 1.00 0.41 C ATOM 2187 CG1 ILE A 168 -2.390 -7.196 -3.532 1.00 0.50 C ATOM 2188 CG2 ILE A 168 -3.978 -6.152 -1.852 1.00 0.37 C ATOM 2189 CD1 ILE A 168 -1.095 -6.928 -2.755 1.00 0.55 C ATOM 0 H ILE A 168 -6.179 -5.237 -3.444 1.00 0.46 H new ATOM 0 HA ILE A 168 -4.185 -6.366 -5.317 1.00 0.43 H new ATOM 0 HB ILE A 168 -3.066 -5.148 -3.495 1.00 0.41 H new ATOM 0 HG12 ILE A 168 -2.779 -8.172 -3.242 1.00 0.50 H new ATOM 0 HG13 ILE A 168 -2.158 -7.248 -4.596 1.00 0.50 H new ATOM 0 HG21 ILE A 168 -3.128 -6.018 -1.182 1.00 0.37 H new ATOM 0 HG22 ILE A 168 -4.692 -5.343 -1.698 1.00 0.37 H new ATOM 0 HG23 ILE A 168 -4.460 -7.106 -1.640 1.00 0.37 H new ATOM 0 HD11 ILE A 168 -0.375 -7.719 -2.964 1.00 0.55 H new ATOM 0 HD12 ILE A 168 -0.679 -5.968 -3.061 1.00 0.55 H new ATOM 0 HD13 ILE A 168 -1.310 -6.906 -1.687 1.00 0.55 H new ATOM 2201 N GLU A 169 -5.033 -8.657 -4.915 1.00 0.55 N ATOM 2202 CA GLU A 169 -5.503 -10.036 -4.752 1.00 0.62 C ATOM 2203 C GLU A 169 -4.360 -10.887 -4.180 1.00 0.67 C ATOM 2204 O GLU A 169 -3.190 -10.571 -4.424 1.00 0.69 O ATOM 2205 CB GLU A 169 -6.016 -10.531 -6.112 1.00 0.61 C ATOM 2206 CG GLU A 169 -6.844 -11.810 -6.004 1.00 0.79 C ATOM 2207 CD GLU A 169 -7.467 -12.146 -7.367 1.00 0.99 C ATOM 2208 OE1 GLU A 169 -8.573 -11.632 -7.674 1.00 2.11 O ATOM 2209 OE2 GLU A 169 -6.868 -12.920 -8.154 1.00 1.77 O ATOM 0 H GLU A 169 -4.374 -8.548 -5.686 1.00 0.55 H new ATOM 0 HA GLU A 169 -6.330 -10.109 -4.046 1.00 0.62 H new ATOM 0 HB2 GLU A 169 -6.621 -9.750 -6.573 1.00 0.61 H new ATOM 0 HB3 GLU A 169 -5.167 -10.708 -6.773 1.00 0.61 H new ATOM 0 HG2 GLU A 169 -6.214 -12.634 -5.669 1.00 0.79 H new ATOM 0 HG3 GLU A 169 -7.628 -11.684 -5.257 1.00 0.79 H new ATOM 2216 N LEU A 170 -4.647 -11.946 -3.412 1.00 0.74 N ATOM 2217 CA LEU A 170 -3.562 -12.752 -2.838 1.00 0.78 C ATOM 2218 C LEU A 170 -2.705 -13.423 -3.929 1.00 0.77 C ATOM 2219 O LEU A 170 -3.256 -13.856 -4.946 1.00 0.84 O ATOM 2220 CB LEU A 170 -4.071 -13.813 -1.854 1.00 0.80 C ATOM 2221 CG LEU A 170 -4.608 -13.329 -0.499 1.00 0.88 C ATOM 2222 CD1 LEU A 170 -4.383 -14.426 0.538 1.00 1.05 C ATOM 2223 CD2 LEU A 170 -3.963 -12.055 0.058 1.00 0.94 C ATOM 0 H LEU A 170 -5.590 -12.258 -3.179 1.00 0.74 H new ATOM 0 HA LEU A 170 -2.938 -12.051 -2.284 1.00 0.78 H new ATOM 0 HB2 LEU A 170 -4.863 -14.376 -2.347 1.00 0.80 H new ATOM 0 HB3 LEU A 170 -3.256 -14.511 -1.662 1.00 0.80 H new ATOM 0 HG LEU A 170 -5.657 -13.097 -0.683 1.00 0.88 H new ATOM 0 HD11 LEU A 170 -4.760 -14.095 1.506 1.00 1.05 H new ATOM 0 HD12 LEU A 170 -4.911 -15.329 0.233 1.00 1.05 H new ATOM 0 HD13 LEU A 170 -3.317 -14.638 0.618 1.00 1.05 H new ATOM 0 HD21 LEU A 170 -4.418 -11.806 1.017 1.00 0.94 H new ATOM 0 HD22 LEU A 170 -2.894 -12.218 0.195 1.00 0.94 H new ATOM 0 HD23 LEU A 170 -4.117 -11.233 -0.641 1.00 0.94 H new ATOM 2235 N PRO A 171 -1.376 -13.534 -3.722 1.00 0.77 N ATOM 2236 CA PRO A 171 -0.437 -13.947 -4.757 1.00 0.80 C ATOM 2237 C PRO A 171 -0.667 -15.398 -5.187 1.00 0.83 C ATOM 2238 O PRO A 171 -0.321 -16.338 -4.473 1.00 0.95 O ATOM 2239 CB PRO A 171 0.965 -13.707 -4.181 1.00 0.81 C ATOM 2240 CG PRO A 171 0.754 -13.729 -2.669 1.00 0.85 C ATOM 2241 CD PRO A 171 -0.652 -13.168 -2.512 1.00 0.85 C ATOM 0 HA PRO A 171 -0.572 -13.370 -5.672 1.00 0.80 H new ATOM 0 HB2 PRO A 171 1.664 -14.481 -4.497 1.00 0.81 H new ATOM 0 HB3 PRO A 171 1.374 -12.753 -4.513 1.00 0.81 H new ATOM 0 HG2 PRO A 171 0.833 -14.738 -2.265 1.00 0.85 H new ATOM 0 HG3 PRO A 171 1.493 -13.119 -2.149 1.00 0.85 H new ATOM 0 HD2 PRO A 171 -1.139 -13.580 -1.628 1.00 0.85 H new ATOM 0 HD3 PRO A 171 -0.627 -12.086 -2.386 1.00 0.85 H new ATOM 2249 N LEU A 172 -1.219 -15.556 -6.390 1.00 0.81 N ATOM 2250 CA LEU A 172 -1.447 -16.832 -7.080 1.00 0.93 C ATOM 2251 C LEU A 172 -0.675 -16.857 -8.426 1.00 0.88 C ATOM 2252 O LEU A 172 -1.043 -17.541 -9.382 1.00 1.29 O ATOM 2253 CB LEU A 172 -2.973 -17.037 -7.185 1.00 1.15 C ATOM 2254 CG LEU A 172 -3.478 -18.475 -6.963 1.00 1.61 C ATOM 2255 CD1 LEU A 172 -4.985 -18.507 -7.208 1.00 3.08 C ATOM 2256 CD2 LEU A 172 -2.833 -19.526 -7.863 1.00 1.97 C ATOM 0 H LEU A 172 -1.537 -14.758 -6.940 1.00 0.81 H new ATOM 0 HA LEU A 172 -1.049 -17.684 -6.529 1.00 0.93 H new ATOM 0 HB2 LEU A 172 -3.458 -16.386 -6.457 1.00 1.15 H new ATOM 0 HB3 LEU A 172 -3.297 -16.708 -8.172 1.00 1.15 H new ATOM 0 HG LEU A 172 -3.207 -18.732 -5.939 1.00 1.61 H new ATOM 0 HD11 LEU A 172 -5.357 -19.520 -7.054 1.00 3.08 H new ATOM 0 HD12 LEU A 172 -5.481 -17.829 -6.514 1.00 3.08 H new ATOM 0 HD13 LEU A 172 -5.194 -18.195 -8.231 1.00 3.08 H new ATOM 0 HD21 LEU A 172 -3.251 -20.506 -7.635 1.00 1.97 H new ATOM 0 HD22 LEU A 172 -3.030 -19.282 -8.907 1.00 1.97 H new ATOM 0 HD23 LEU A 172 -1.757 -19.541 -7.691 1.00 1.97 H new ATOM 2268 N ASN A 173 0.397 -16.064 -8.491 1.00 0.94 N ATOM 2269 CA ASN A 173 1.228 -15.742 -9.655 1.00 0.97 C ATOM 2270 C ASN A 173 2.649 -16.289 -9.428 1.00 1.07 C ATOM 2271 O ASN A 173 3.131 -16.271 -8.294 1.00 1.89 O ATOM 2272 CB ASN A 173 1.177 -14.207 -9.797 1.00 1.16 C ATOM 2273 CG ASN A 173 1.801 -13.597 -11.038 1.00 1.61 C ATOM 2274 OD1 ASN A 173 2.531 -14.206 -11.810 1.00 2.97 O ATOM 2275 ND2 ASN A 173 1.520 -12.335 -11.243 1.00 1.55 N ATOM 0 H ASN A 173 0.737 -15.588 -7.655 1.00 0.94 H new ATOM 0 HA ASN A 173 0.876 -16.199 -10.580 1.00 0.97 H new ATOM 0 HB2 ASN A 173 0.132 -13.900 -9.761 1.00 1.16 H new ATOM 0 HB3 ASN A 173 1.667 -13.772 -8.926 1.00 1.16 H new ATOM 0 HD21 ASN A 173 1.910 -11.850 -12.051 1.00 1.55 H new ATOM 0 HD22 ASN A 173 0.911 -11.836 -10.594 1.00 1.55 H new ATOM 2282 N ASP A 174 3.326 -16.766 -10.475 1.00 1.15 N ATOM 2283 CA ASP A 174 4.619 -17.480 -10.415 1.00 1.33 C ATOM 2284 C ASP A 174 5.844 -16.589 -10.095 1.00 1.20 C ATOM 2285 O ASP A 174 6.913 -16.727 -10.696 1.00 1.47 O ATOM 2286 CB ASP A 174 4.809 -18.313 -11.697 1.00 1.94 C ATOM 2287 CG ASP A 174 3.876 -19.518 -11.742 1.00 3.51 C ATOM 2288 OD1 ASP A 174 3.997 -20.392 -10.849 1.00 4.51 O ATOM 2289 OD2 ASP A 174 3.048 -19.615 -12.679 1.00 4.55 O ATOM 0 H ASP A 174 2.981 -16.665 -11.430 1.00 1.15 H new ATOM 0 HA ASP A 174 4.568 -18.148 -9.555 1.00 1.33 H new ATOM 0 HB2 ASP A 174 4.629 -17.683 -12.568 1.00 1.94 H new ATOM 0 HB3 ASP A 174 5.843 -18.653 -11.758 1.00 1.94 H new ATOM 2294 N VAL A 175 5.714 -15.668 -9.142 1.00 0.98 N ATOM 2295 CA VAL A 175 6.749 -14.707 -8.726 1.00 1.03 C ATOM 2296 C VAL A 175 7.630 -15.226 -7.589 1.00 1.11 C ATOM 2297 O VAL A 175 7.247 -16.114 -6.818 1.00 1.15 O ATOM 2298 CB VAL A 175 6.158 -13.315 -8.424 1.00 0.97 C ATOM 2299 CG1 VAL A 175 5.288 -12.810 -9.582 1.00 1.16 C ATOM 2300 CG2 VAL A 175 5.320 -13.295 -7.149 1.00 0.76 C ATOM 0 H VAL A 175 4.849 -15.562 -8.612 1.00 0.98 H new ATOM 0 HA VAL A 175 7.414 -14.590 -9.582 1.00 1.03 H new ATOM 0 HB VAL A 175 7.017 -12.658 -8.289 1.00 0.97 H new ATOM 0 HG11 VAL A 175 4.888 -11.827 -9.335 1.00 1.16 H new ATOM 0 HG12 VAL A 175 5.892 -12.739 -10.487 1.00 1.16 H new ATOM 0 HG13 VAL A 175 4.465 -13.505 -9.749 1.00 1.16 H new ATOM 0 HG21 VAL A 175 4.929 -12.291 -6.986 1.00 0.76 H new ATOM 0 HG22 VAL A 175 4.491 -13.995 -7.248 1.00 0.76 H new ATOM 0 HG23 VAL A 175 5.941 -13.585 -6.301 1.00 0.76 H new ATOM 2310 N VAL A 176 8.823 -14.642 -7.486 1.00 1.33 N ATOM 2311 CA VAL A 176 9.793 -14.855 -6.402 1.00 1.59 C ATOM 2312 C VAL A 176 9.332 -14.190 -5.103 1.00 1.35 C ATOM 2313 O VAL A 176 9.519 -14.751 -4.020 1.00 1.52 O ATOM 2314 CB VAL A 176 11.166 -14.303 -6.830 1.00 2.04 C ATOM 2315 CG1 VAL A 176 12.176 -14.335 -5.679 1.00 2.46 C ATOM 2316 CG2 VAL A 176 11.715 -15.105 -8.015 1.00 2.43 C ATOM 0 H VAL A 176 9.159 -13.978 -8.184 1.00 1.33 H new ATOM 0 HA VAL A 176 9.873 -15.925 -6.212 1.00 1.59 H new ATOM 0 HB VAL A 176 11.021 -13.264 -7.125 1.00 2.04 H new ATOM 0 HG11 VAL A 176 13.131 -13.937 -6.022 1.00 2.46 H new ATOM 0 HG12 VAL A 176 11.806 -13.728 -4.853 1.00 2.46 H new ATOM 0 HG13 VAL A 176 12.311 -15.363 -5.342 1.00 2.46 H new ATOM 0 HG21 VAL A 176 12.686 -14.704 -8.307 1.00 2.43 H new ATOM 0 HG22 VAL A 176 11.826 -16.150 -7.727 1.00 2.43 H new ATOM 0 HG23 VAL A 176 11.024 -15.032 -8.855 1.00 2.43 H new ATOM 2326 N ASP A 177 8.722 -13.007 -5.191 1.00 1.10 N ATOM 2327 CA ASP A 177 8.031 -12.363 -4.069 1.00 1.03 C ATOM 2328 C ASP A 177 7.020 -11.304 -4.559 1.00 0.88 C ATOM 2329 O ASP A 177 7.171 -10.804 -5.678 1.00 0.89 O ATOM 2330 CB ASP A 177 9.030 -11.752 -3.066 1.00 1.03 C ATOM 2331 CG ASP A 177 8.703 -12.212 -1.645 1.00 2.02 C ATOM 2332 OD1 ASP A 177 7.504 -12.201 -1.275 1.00 3.54 O ATOM 2333 OD2 ASP A 177 9.632 -12.634 -0.912 1.00 2.46 O ATOM 0 H ASP A 177 8.693 -12.462 -6.052 1.00 1.10 H new ATOM 0 HA ASP A 177 7.471 -13.139 -3.548 1.00 1.03 H new ATOM 0 HB2 ASP A 177 10.046 -12.049 -3.327 1.00 1.03 H new ATOM 0 HB3 ASP A 177 8.992 -10.664 -3.121 1.00 1.03 H new ATOM 2338 N ALA A 178 6.016 -10.950 -3.744 1.00 0.78 N ATOM 2339 CA ALA A 178 4.961 -9.990 -4.106 1.00 0.68 C ATOM 2340 C ALA A 178 5.270 -8.573 -3.604 1.00 0.61 C ATOM 2341 O ALA A 178 5.712 -8.421 -2.459 1.00 0.65 O ATOM 2342 CB ALA A 178 3.619 -10.458 -3.528 1.00 0.63 C ATOM 0 H ALA A 178 5.912 -11.327 -2.802 1.00 0.78 H new ATOM 0 HA ALA A 178 4.911 -9.951 -5.194 1.00 0.68 H new ATOM 0 HB1 ALA A 178 2.839 -9.746 -3.797 1.00 0.63 H new ATOM 0 HB2 ALA A 178 3.370 -11.439 -3.933 1.00 0.63 H new ATOM 0 HB3 ALA A 178 3.693 -10.522 -2.442 1.00 0.63 H new ATOM 2348 N HIS A 179 4.981 -7.542 -4.411 1.00 0.54 N ATOM 2349 CA HIS A 179 5.216 -6.144 -4.022 1.00 0.48 C ATOM 2350 C HIS A 179 4.075 -5.168 -4.372 1.00 0.42 C ATOM 2351 O HIS A 179 3.186 -5.469 -5.175 1.00 0.49 O ATOM 2352 CB HIS A 179 6.552 -5.632 -4.596 1.00 0.50 C ATOM 2353 CG HIS A 179 7.756 -6.474 -4.271 1.00 0.61 C ATOM 2354 ND1 HIS A 179 8.752 -6.158 -3.376 1.00 0.69 N ATOM 2355 CD2 HIS A 179 8.080 -7.682 -4.827 1.00 0.70 C ATOM 2356 CE1 HIS A 179 9.646 -7.161 -3.379 1.00 0.81 C ATOM 2357 NE2 HIS A 179 9.284 -8.114 -4.257 1.00 0.82 N ATOM 0 H HIS A 179 4.582 -7.652 -5.343 1.00 0.54 H new ATOM 0 HA HIS A 179 5.258 -6.162 -2.933 1.00 0.48 H new ATOM 0 HB2 HIS A 179 6.460 -5.562 -5.680 1.00 0.50 H new ATOM 0 HB3 HIS A 179 6.725 -4.622 -4.225 1.00 0.50 H new ATOM 0 HD1 HIS A 179 8.803 -5.311 -2.810 1.00 0.69 H new ATOM 0 HD2 HIS A 179 7.507 -8.210 -5.575 1.00 0.70 H new ATOM 0 HE1 HIS A 179 10.532 -7.197 -2.762 1.00 0.81 H new ATOM 2365 N VAL A 180 4.128 -3.978 -3.763 1.00 0.35 N ATOM 2366 CA VAL A 180 3.169 -2.868 -3.931 1.00 0.30 C ATOM 2367 C VAL A 180 3.896 -1.542 -4.166 1.00 0.33 C ATOM 2368 O VAL A 180 4.895 -1.277 -3.497 1.00 0.42 O ATOM 2369 CB VAL A 180 2.273 -2.667 -2.690 1.00 0.33 C ATOM 2370 CG1 VAL A 180 0.902 -2.148 -3.099 1.00 0.47 C ATOM 2371 CG2 VAL A 180 2.095 -3.884 -1.784 1.00 0.35 C ATOM 0 H VAL A 180 4.874 -3.747 -3.107 1.00 0.35 H new ATOM 0 HA VAL A 180 2.557 -3.143 -4.790 1.00 0.30 H new ATOM 0 HB VAL A 180 2.818 -1.936 -2.092 1.00 0.33 H new ATOM 0 HG11 VAL A 180 0.285 -2.012 -2.211 1.00 0.47 H new ATOM 0 HG12 VAL A 180 1.013 -1.193 -3.613 1.00 0.47 H new ATOM 0 HG13 VAL A 180 0.425 -2.866 -3.766 1.00 0.47 H new ATOM 0 HG21 VAL A 180 1.447 -3.623 -0.947 1.00 0.35 H new ATOM 0 HG22 VAL A 180 1.644 -4.698 -2.352 1.00 0.35 H new ATOM 0 HG23 VAL A 180 3.067 -4.201 -1.405 1.00 0.35 H new ATOM 2381 N TYR A 181 3.343 -0.680 -5.025 1.00 0.36 N ATOM 2382 CA TYR A 181 3.918 0.612 -5.425 1.00 0.40 C ATOM 2383 C TYR A 181 2.879 1.757 -5.462 1.00 0.45 C ATOM 2384 O TYR A 181 2.514 2.213 -6.550 1.00 0.59 O ATOM 2385 CB TYR A 181 4.615 0.433 -6.780 1.00 0.46 C ATOM 2386 CG TYR A 181 5.767 -0.547 -6.719 1.00 0.64 C ATOM 2387 CD1 TYR A 181 7.004 -0.118 -6.208 1.00 1.59 C ATOM 2388 CD2 TYR A 181 5.581 -1.889 -7.102 1.00 2.38 C ATOM 2389 CE1 TYR A 181 8.060 -1.034 -6.063 1.00 1.53 C ATOM 2390 CE2 TYR A 181 6.613 -2.821 -6.903 1.00 2.62 C ATOM 2391 CZ TYR A 181 7.848 -2.394 -6.378 1.00 1.16 C ATOM 2392 OH TYR A 181 8.847 -3.296 -6.240 1.00 1.47 O ATOM 0 H TYR A 181 2.449 -0.868 -5.479 1.00 0.36 H new ATOM 0 HA TYR A 181 4.642 0.916 -4.669 1.00 0.40 H new ATOM 0 HB2 TYR A 181 3.888 0.088 -7.515 1.00 0.46 H new ATOM 0 HB3 TYR A 181 4.983 1.399 -7.125 1.00 0.46 H new ATOM 0 HD1 TYR A 181 7.143 0.915 -5.927 1.00 1.59 H new ATOM 0 HD2 TYR A 181 4.648 -2.201 -7.547 1.00 2.38 H new ATOM 0 HE1 TYR A 181 9.026 -0.700 -5.713 1.00 1.53 H new ATOM 0 HE2 TYR A 181 6.460 -3.861 -7.152 1.00 2.62 H new ATOM 0 HH TYR A 181 8.523 -4.067 -5.729 1.00 1.47 H new ATOM 2402 N PRO A 182 2.373 2.230 -4.303 1.00 0.43 N ATOM 2403 CA PRO A 182 1.352 3.277 -4.240 1.00 0.45 C ATOM 2404 C PRO A 182 1.859 4.661 -4.672 1.00 0.49 C ATOM 2405 O PRO A 182 2.677 5.285 -3.984 1.00 0.92 O ATOM 2406 CB PRO A 182 0.831 3.289 -2.800 1.00 0.50 C ATOM 2407 CG PRO A 182 1.880 2.538 -1.979 1.00 0.55 C ATOM 2408 CD PRO A 182 2.604 1.651 -2.990 1.00 0.45 C ATOM 0 HA PRO A 182 0.558 3.053 -4.952 1.00 0.45 H new ATOM 0 HB2 PRO A 182 0.705 4.309 -2.437 1.00 0.50 H new ATOM 0 HB3 PRO A 182 -0.143 2.804 -2.731 1.00 0.50 H new ATOM 0 HG2 PRO A 182 2.570 3.228 -1.492 1.00 0.55 H new ATOM 0 HG3 PRO A 182 1.416 1.944 -1.192 1.00 0.55 H new ATOM 0 HD2 PRO A 182 3.671 1.606 -2.770 1.00 0.45 H new ATOM 0 HD3 PRO A 182 2.227 0.629 -2.947 1.00 0.45 H new ATOM 2416 N LYS A 183 1.298 5.148 -5.784 1.00 0.75 N ATOM 2417 CA LYS A 183 1.458 6.484 -6.375 1.00 0.67 C ATOM 2418 C LYS A 183 0.416 7.478 -5.838 1.00 0.70 C ATOM 2419 O LYS A 183 -0.530 7.105 -5.135 1.00 1.01 O ATOM 2420 CB LYS A 183 1.283 6.379 -7.901 1.00 0.64 C ATOM 2421 CG LYS A 183 2.225 5.399 -8.618 1.00 0.69 C ATOM 2422 CD LYS A 183 1.929 5.308 -10.127 1.00 1.45 C ATOM 2423 CE LYS A 183 0.806 4.322 -10.498 1.00 1.19 C ATOM 2424 NZ LYS A 183 -0.537 4.766 -10.050 1.00 2.00 N ATOM 0 H LYS A 183 0.668 4.571 -6.341 1.00 0.75 H new ATOM 0 HA LYS A 183 2.451 6.848 -6.111 1.00 0.67 H new ATOM 0 HB2 LYS A 183 0.255 6.083 -8.110 1.00 0.64 H new ATOM 0 HB3 LYS A 183 1.424 7.370 -8.333 1.00 0.64 H new ATOM 0 HG2 LYS A 183 3.257 5.716 -8.470 1.00 0.69 H new ATOM 0 HG3 LYS A 183 2.128 4.410 -8.170 1.00 0.69 H new ATOM 0 HD2 LYS A 183 1.661 6.299 -10.492 1.00 1.45 H new ATOM 0 HD3 LYS A 183 2.841 5.013 -10.646 1.00 1.45 H new ATOM 0 HE2 LYS A 183 0.794 4.186 -11.579 1.00 1.19 H new ATOM 0 HE3 LYS A 183 1.025 3.350 -10.057 1.00 1.19 H new ATOM 0 HZ1 LYS A 183 -1.262 4.374 -10.685 1.00 2.00 H new ATOM 0 HZ2 LYS A 183 -0.708 4.431 -9.081 1.00 2.00 H new ATOM 0 HZ3 LYS A 183 -0.584 5.805 -10.070 1.00 2.00 H new ATOM 2438 N ASN A 184 0.563 8.736 -6.249 0.49 0.57 N ATOM 2439 CA ASN A 184 -0.401 9.817 -6.035 0.49 0.59 C ATOM 2440 C ASN A 184 -1.110 10.204 -7.346 0.49 0.67 C ATOM 2441 O ASN A 184 -0.699 9.775 -8.427 0.49 0.76 O ATOM 2442 CB ASN A 184 0.324 10.992 -5.344 0.49 0.67 C ATOM 2443 CG ASN A 184 0.730 10.683 -3.917 0.49 1.81 C ATOM 2444 OD1 ASN A 184 0.816 9.544 -3.480 0.49 2.94 O ATOM 2445 ND2 ASN A 184 1.009 11.690 -3.137 0.49 2.21 N ATOM 0 H ASN A 184 1.390 9.044 -6.761 0.49 0.57 H new ATOM 0 HA ASN A 184 -1.203 9.488 -5.374 0.49 0.59 H new ATOM 0 HB2 ASN A 184 1.212 11.252 -5.920 0.49 0.67 H new ATOM 0 HB3 ASN A 184 -0.327 11.866 -5.349 0.49 0.67 H new ATOM 0 HD21 ASN A 184 1.296 11.524 -2.172 0.49 2.21 H new ATOM 0 HD22 ASN A 184 0.940 12.644 -3.492 0.49 2.21 H new ATOM 2452 N THR A 185 -2.191 10.988 -7.245 0.49 0.77 N ATOM 2453 CA THR A 185 -2.977 11.461 -8.405 0.49 0.99 C ATOM 2454 C THR A 185 -2.905 12.976 -8.596 0.49 1.40 C ATOM 2455 O THR A 185 -2.472 13.412 -9.660 0.49 2.74 O ATOM 2456 CB THR A 185 -4.424 10.930 -8.381 0.49 0.87 C ATOM 2457 OG1 THR A 185 -5.133 11.354 -9.525 0.49 1.22 O ATOM 2458 CG2 THR A 185 -5.240 11.381 -7.170 0.49 0.87 C ATOM 0 H THR A 185 -2.553 11.318 -6.350 0.49 0.77 H new ATOM 0 HA THR A 185 -2.505 11.033 -9.289 0.49 0.99 H new ATOM 0 HB THR A 185 -4.311 9.847 -8.342 0.49 0.87 H new ATOM 0 HG1 THR A 185 -6.048 11.005 -9.491 0.49 1.22 H new ATOM 0 HG21 THR A 185 -6.245 10.963 -7.232 0.49 0.87 H new ATOM 0 HG22 THR A 185 -4.758 11.033 -6.256 0.49 0.87 H new ATOM 0 HG23 THR A 185 -5.300 12.469 -7.157 0.49 0.87 H new