USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 912 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 20 LYS NZ :NH3+ 142:sc= 0.569 (180deg=0) USER MOD Set 1.2: A 84 SER OG : rot -38:sc= 1.48 USER MOD Set 1.3: A 91 CYS SG : rot 160:sc= 0 USER MOD Set 2.1: A 50 SER OG : rot -170:sc= 0 USER MOD Set 2.2: A 114 SER OG : rot -160:sc= -0.271 USER MOD Single : A 9 LYS NZ :NH3+ 168:sc= 1.24 (180deg=1.1) USER MOD Single : A 13 THR OG1 : rot 180:sc=-0.00992 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.526 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 35 LYS NZ :NH3+ -161:sc= 1.09 (180deg=-0.619!) USER MOD Single : A 36 LYS NZ :NH3+ -161:sc= 1.27 (180deg=0.925) USER MOD Single : A 38 ASN : amide:sc= -0.247 X(o=-0.25,f=-0.57) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HE2:sc= -0.14 K(o=-0.14,f=-2!) USER MOD Single : A 44 TYR OH : rot -6:sc= 0.201 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot -34:sc= 0.808 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 77:sc= 0.355 USER MOD Single : A 62 ASN :FLIP amide:sc= -0.96 F(o=-5.3!,f=-0.96) USER MOD Single : A 66 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0891) USER MOD Single : A 68 HIS : no HD1:sc= -0.441 X(o=-0.44,f=-0.00086) USER MOD Single : A 71 GLN : amide:sc= -2.02 K(o=-2,f=-6.9!) USER MOD Single : A 76 LYS NZ :NH3+ 163:sc= -0.139 (180deg=-0.416) USER MOD Single : A 81 CYS SG : rot 85:sc= -3.45! USER MOD Single : A 83 SER OG : rot 96:sc= -1.36! USER MOD Single : A 85 MET CE :methyl -100:sc= -9.36! (180deg=-10.7!) USER MOD Single : A 87 LYS NZ :NH3+ -164:sc= -0.0672 (180deg=-0.343) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 158:sc= 2.36 (180deg=1.85) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl 162:sc= -0.105 (180deg=-0.53) USER MOD Single : A 99 TYR OH : rot 165:sc= 0 USER MOD Single : A 101 TYR OH : rot -145:sc= 0.273 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 SER OG : rot 180:sc= -0.0295 USER MOD ----------------------------------------------------------------- ATOM 95 N PHE A 7 15.844 -1.613 0.708 1.00 0.87 N ATOM 96 CA PHE A 7 16.374 -1.767 2.054 1.00 0.77 C ATOM 97 C PHE A 7 17.685 -1.016 2.228 1.00 0.72 C ATOM 98 O PHE A 7 18.336 -0.627 1.252 1.00 0.87 O ATOM 99 CB PHE A 7 16.573 -3.242 2.405 1.00 0.77 C ATOM 100 CG PHE A 7 15.436 -3.828 3.200 1.00 1.61 C ATOM 101 CD1 PHE A 7 15.266 -3.489 4.533 1.00 2.72 C ATOM 102 CD2 PHE A 7 14.544 -4.714 2.619 1.00 1.82 C ATOM 103 CE1 PHE A 7 14.225 -4.020 5.270 1.00 3.60 C ATOM 104 CE2 PHE A 7 13.502 -5.249 3.351 1.00 2.63 C ATOM 105 CZ PHE A 7 13.342 -4.902 4.679 1.00 3.44 C ATOM 0 HA PHE A 7 15.638 -1.339 2.735 1.00 0.77 H new ATOM 0 HB2 PHE A 7 16.695 -3.813 1.485 1.00 0.77 H new ATOM 0 HB3 PHE A 7 17.497 -3.351 2.973 1.00 0.77 H new ATOM 0 HD1 PHE A 7 15.955 -2.802 5.001 1.00 2.72 H new ATOM 0 HD2 PHE A 7 14.665 -4.990 1.582 1.00 1.82 H new ATOM 0 HE1 PHE A 7 14.102 -3.746 6.307 1.00 3.60 H new ATOM 0 HE2 PHE A 7 12.813 -5.938 2.886 1.00 2.63 H new ATOM 0 HZ PHE A 7 12.528 -5.320 5.253 1.00 3.44 H new ATOM 115 N GLU A 8 18.071 -0.849 3.480 1.00 0.72 N ATOM 116 CA GLU A 8 19.242 -0.073 3.837 1.00 0.76 C ATOM 117 C GLU A 8 20.455 -0.989 3.974 1.00 0.62 C ATOM 118 O GLU A 8 20.310 -2.183 4.243 1.00 0.61 O ATOM 119 CB GLU A 8 18.953 0.663 5.143 1.00 1.01 C ATOM 120 CG GLU A 8 19.782 1.908 5.369 1.00 1.20 C ATOM 121 CD GLU A 8 19.060 2.876 6.280 1.00 1.97 C ATOM 122 OE1 GLU A 8 18.971 2.602 7.492 1.00 2.71 O ATOM 123 OE2 GLU A 8 18.541 3.896 5.775 1.00 2.22 O ATOM 0 H GLU A 8 17.579 -1.249 4.279 1.00 0.72 H new ATOM 0 HA GLU A 8 19.468 0.655 3.058 1.00 0.76 H new ATOM 0 HB2 GLU A 8 17.898 0.938 5.163 1.00 1.01 H new ATOM 0 HB3 GLU A 8 19.119 -0.023 5.974 1.00 1.01 H new ATOM 0 HG2 GLU A 8 20.742 1.636 5.807 1.00 1.20 H new ATOM 0 HG3 GLU A 8 19.992 2.389 4.414 1.00 1.20 H new ATOM 130 N LYS A 9 21.645 -0.438 3.768 1.00 0.60 N ATOM 131 CA LYS A 9 22.863 -1.237 3.772 1.00 0.53 C ATOM 132 C LYS A 9 23.762 -0.842 4.936 1.00 0.50 C ATOM 133 O LYS A 9 23.787 0.316 5.346 1.00 0.56 O ATOM 134 CB LYS A 9 23.642 -1.073 2.453 1.00 0.63 C ATOM 135 CG LYS A 9 22.921 -1.587 1.206 1.00 0.72 C ATOM 136 CD LYS A 9 21.797 -0.659 0.770 1.00 0.95 C ATOM 137 CE LYS A 9 21.105 -1.160 -0.489 1.00 1.49 C ATOM 138 NZ LYS A 9 19.991 -0.265 -0.894 1.00 1.88 N ATOM 0 H LYS A 9 21.792 0.557 3.596 1.00 0.60 H new ATOM 0 HA LYS A 9 22.567 -2.280 3.880 1.00 0.53 H new ATOM 0 HB2 LYS A 9 23.870 -0.016 2.313 1.00 0.63 H new ATOM 0 HB3 LYS A 9 24.595 -1.595 2.544 1.00 0.63 H new ATOM 0 HG2 LYS A 9 23.638 -1.694 0.392 1.00 0.72 H new ATOM 0 HG3 LYS A 9 22.515 -2.579 1.406 1.00 0.72 H new ATOM 0 HD2 LYS A 9 21.067 -0.570 1.575 1.00 0.95 H new ATOM 0 HD3 LYS A 9 22.198 0.339 0.591 1.00 0.95 H new ATOM 0 HE2 LYS A 9 21.830 -1.229 -1.300 1.00 1.49 H new ATOM 0 HE3 LYS A 9 20.721 -2.166 -0.318 1.00 1.49 H new ATOM 0 HZ1 LYS A 9 19.675 -0.516 -1.853 1.00 1.88 H new ATOM 0 HZ2 LYS A 9 19.199 -0.374 -0.229 1.00 1.88 H new ATOM 0 HZ3 LYS A 9 20.318 0.722 -0.884 1.00 1.88 H new ATOM 152 N VAL A 10 24.492 -1.809 5.465 1.00 0.46 N ATOM 153 CA VAL A 10 25.465 -1.544 6.512 1.00 0.46 C ATOM 154 C VAL A 10 26.869 -1.551 5.917 1.00 0.48 C ATOM 155 O VAL A 10 27.387 -2.603 5.535 1.00 0.54 O ATOM 156 CB VAL A 10 25.381 -2.586 7.648 1.00 0.51 C ATOM 157 CG1 VAL A 10 26.355 -2.251 8.765 1.00 0.54 C ATOM 158 CG2 VAL A 10 23.965 -2.675 8.193 1.00 0.59 C ATOM 0 H VAL A 10 24.429 -2.788 5.186 1.00 0.46 H new ATOM 0 HA VAL A 10 25.241 -0.566 6.937 1.00 0.46 H new ATOM 0 HB VAL A 10 25.655 -3.556 7.233 1.00 0.51 H new ATOM 0 HG11 VAL A 10 26.276 -3.000 9.553 1.00 0.54 H new ATOM 0 HG12 VAL A 10 27.371 -2.244 8.371 1.00 0.54 H new ATOM 0 HG13 VAL A 10 26.117 -1.269 9.173 1.00 0.54 H new ATOM 0 HG21 VAL A 10 23.929 -3.415 8.992 1.00 0.59 H new ATOM 0 HG22 VAL A 10 23.664 -1.703 8.584 1.00 0.59 H new ATOM 0 HG23 VAL A 10 23.285 -2.971 7.394 1.00 0.59 H new ATOM 168 N GLU A 11 27.469 -0.374 5.819 1.00 0.53 N ATOM 169 CA GLU A 11 28.779 -0.247 5.208 1.00 0.63 C ATOM 170 C GLU A 11 29.896 -0.418 6.240 1.00 0.55 C ATOM 171 O GLU A 11 29.919 0.253 7.275 1.00 0.59 O ATOM 172 CB GLU A 11 28.911 1.099 4.477 1.00 0.88 C ATOM 173 CG GLU A 11 28.802 2.320 5.380 1.00 1.37 C ATOM 174 CD GLU A 11 28.962 3.625 4.629 1.00 1.72 C ATOM 175 OE1 GLU A 11 30.032 3.842 4.019 1.00 2.02 O ATOM 176 OE2 GLU A 11 28.021 4.448 4.654 1.00 2.16 O ATOM 0 H GLU A 11 27.069 0.503 6.154 1.00 0.53 H new ATOM 0 HA GLU A 11 28.882 -1.047 4.475 1.00 0.63 H new ATOM 0 HB2 GLU A 11 29.872 1.127 3.964 1.00 0.88 H new ATOM 0 HB3 GLU A 11 28.138 1.159 3.710 1.00 0.88 H new ATOM 0 HG2 GLU A 11 27.833 2.311 5.880 1.00 1.37 H new ATOM 0 HG3 GLU A 11 29.563 2.259 6.158 1.00 1.37 H new ATOM 183 N LEU A 12 30.792 -1.357 5.947 1.00 0.52 N ATOM 184 CA LEU A 12 31.998 -1.588 6.736 1.00 0.51 C ATOM 185 C LEU A 12 31.655 -1.826 8.203 1.00 0.52 C ATOM 186 O LEU A 12 32.010 -1.031 9.073 1.00 0.61 O ATOM 187 CB LEU A 12 32.953 -0.400 6.596 1.00 0.57 C ATOM 188 CG LEU A 12 34.433 -0.724 6.812 1.00 0.88 C ATOM 189 CD1 LEU A 12 34.948 -1.622 5.699 1.00 1.35 C ATOM 190 CD2 LEU A 12 35.256 0.550 6.890 1.00 1.45 C ATOM 0 H LEU A 12 30.700 -1.984 5.148 1.00 0.52 H new ATOM 0 HA LEU A 12 32.490 -2.484 6.356 1.00 0.51 H new ATOM 0 HB2 LEU A 12 32.833 0.027 5.600 1.00 0.57 H new ATOM 0 HB3 LEU A 12 32.658 0.369 7.310 1.00 0.57 H new ATOM 0 HG LEU A 12 34.533 -1.254 7.759 1.00 0.88 H new ATOM 0 HD11 LEU A 12 36.002 -1.843 5.868 1.00 1.35 H new ATOM 0 HD12 LEU A 12 34.379 -2.552 5.689 1.00 1.35 H new ATOM 0 HD13 LEU A 12 34.832 -1.116 4.740 1.00 1.35 H new ATOM 0 HD21 LEU A 12 36.305 0.297 7.044 1.00 1.45 H new ATOM 0 HD22 LEU A 12 35.150 1.109 5.960 1.00 1.45 H new ATOM 0 HD23 LEU A 12 34.904 1.160 7.722 1.00 1.45 H new ATOM 202 N THR A 13 30.944 -2.919 8.457 1.00 0.50 N ATOM 203 CA THR A 13 30.514 -3.266 9.805 1.00 0.56 C ATOM 204 C THR A 13 31.709 -3.434 10.754 1.00 0.53 C ATOM 205 O THR A 13 32.827 -3.739 10.325 1.00 0.50 O ATOM 206 CB THR A 13 29.657 -4.553 9.798 1.00 0.68 C ATOM 207 OG1 THR A 13 29.178 -4.841 11.118 1.00 0.78 O ATOM 208 CG2 THR A 13 30.454 -5.738 9.282 1.00 0.69 C ATOM 0 H THR A 13 30.652 -3.584 7.741 1.00 0.50 H new ATOM 0 HA THR A 13 29.904 -2.440 10.171 1.00 0.56 H new ATOM 0 HB THR A 13 28.810 -4.384 9.133 1.00 0.68 H new ATOM 0 HG1 THR A 13 28.636 -5.657 11.098 1.00 0.78 H new ATOM 0 HG21 THR A 13 29.826 -6.629 9.288 1.00 0.69 H new ATOM 0 HG22 THR A 13 30.788 -5.536 8.264 1.00 0.69 H new ATOM 0 HG23 THR A 13 31.321 -5.900 9.923 1.00 0.69 H new ATOM 216 N ALA A 14 31.450 -3.258 12.044 1.00 0.61 N ATOM 217 CA ALA A 14 32.498 -3.233 13.059 1.00 0.66 C ATOM 218 C ALA A 14 33.163 -4.596 13.250 1.00 0.69 C ATOM 219 O ALA A 14 34.277 -4.674 13.768 1.00 0.79 O ATOM 220 CB ALA A 14 31.923 -2.741 14.380 1.00 0.81 C ATOM 0 H ALA A 14 30.509 -3.129 12.416 1.00 0.61 H new ATOM 0 HA ALA A 14 33.271 -2.548 12.711 1.00 0.66 H new ATOM 0 HB1 ALA A 14 32.709 -2.724 15.135 1.00 0.81 H new ATOM 0 HB2 ALA A 14 31.522 -1.736 14.250 1.00 0.81 H new ATOM 0 HB3 ALA A 14 31.125 -3.411 14.702 1.00 0.81 H new ATOM 226 N ASP A 15 32.494 -5.668 12.828 1.00 0.71 N ATOM 227 CA ASP A 15 33.020 -7.024 13.022 1.00 0.85 C ATOM 228 C ASP A 15 34.030 -7.414 11.945 1.00 0.74 C ATOM 229 O ASP A 15 34.322 -8.595 11.750 1.00 0.86 O ATOM 230 CB ASP A 15 31.881 -8.048 13.080 1.00 1.08 C ATOM 231 CG ASP A 15 31.489 -8.388 14.505 1.00 1.69 C ATOM 232 OD1 ASP A 15 30.895 -7.528 15.186 1.00 1.87 O ATOM 233 OD2 ASP A 15 31.773 -9.517 14.952 1.00 2.40 O ATOM 0 H ASP A 15 31.593 -5.628 12.352 1.00 0.71 H new ATOM 0 HA ASP A 15 33.546 -7.025 13.977 1.00 0.85 H new ATOM 0 HB2 ASP A 15 31.013 -7.654 12.550 1.00 1.08 H new ATOM 0 HB3 ASP A 15 32.185 -8.957 12.562 1.00 1.08 H new ATOM 238 N GLY A 16 34.594 -6.422 11.270 1.00 0.64 N ATOM 239 CA GLY A 16 35.664 -6.696 10.330 1.00 0.68 C ATOM 240 C GLY A 16 35.383 -6.245 8.913 1.00 0.57 C ATOM 241 O GLY A 16 35.862 -6.866 7.966 1.00 0.63 O ATOM 0 H GLY A 16 34.333 -5.440 11.355 1.00 0.64 H new ATOM 0 HA2 GLY A 16 36.573 -6.207 10.680 1.00 0.68 H new ATOM 0 HA3 GLY A 16 35.861 -7.768 10.325 1.00 0.68 H new ATOM 245 N GLY A 17 34.605 -5.179 8.773 1.00 0.54 N ATOM 246 CA GLY A 17 34.451 -4.513 7.487 1.00 0.52 C ATOM 247 C GLY A 17 33.869 -5.383 6.390 1.00 0.46 C ATOM 248 O GLY A 17 34.600 -5.945 5.581 1.00 0.61 O ATOM 0 H GLY A 17 34.072 -4.758 9.534 1.00 0.54 H new ATOM 0 HA2 GLY A 17 33.811 -3.641 7.619 1.00 0.52 H new ATOM 0 HA3 GLY A 17 35.425 -4.147 7.164 1.00 0.52 H new ATOM 252 N VAL A 18 32.548 -5.484 6.352 1.00 0.36 N ATOM 253 CA VAL A 18 31.858 -6.195 5.283 1.00 0.34 C ATOM 254 C VAL A 18 30.589 -5.439 4.910 1.00 0.32 C ATOM 255 O VAL A 18 29.911 -4.895 5.785 1.00 0.36 O ATOM 256 CB VAL A 18 31.509 -7.654 5.682 1.00 0.40 C ATOM 257 CG1 VAL A 18 30.594 -8.305 4.652 1.00 0.47 C ATOM 258 CG2 VAL A 18 32.778 -8.477 5.852 1.00 0.49 C ATOM 0 H VAL A 18 31.928 -5.080 7.054 1.00 0.36 H new ATOM 0 HA VAL A 18 32.530 -6.246 4.426 1.00 0.34 H new ATOM 0 HB VAL A 18 30.978 -7.621 6.634 1.00 0.40 H new ATOM 0 HG11 VAL A 18 30.368 -9.326 4.960 1.00 0.47 H new ATOM 0 HG12 VAL A 18 29.668 -7.735 4.576 1.00 0.47 H new ATOM 0 HG13 VAL A 18 31.091 -8.320 3.682 1.00 0.47 H new ATOM 0 HG21 VAL A 18 32.515 -9.497 6.132 1.00 0.49 H new ATOM 0 HG22 VAL A 18 33.332 -8.489 4.913 1.00 0.49 H new ATOM 0 HG23 VAL A 18 33.397 -8.035 6.633 1.00 0.49 H new ATOM 268 N ILE A 19 30.295 -5.375 3.617 1.00 0.31 N ATOM 269 CA ILE A 19 29.096 -4.702 3.131 1.00 0.31 C ATOM 270 C ILE A 19 27.950 -5.706 2.989 1.00 0.30 C ATOM 271 O ILE A 19 28.014 -6.606 2.148 1.00 0.30 O ATOM 272 CB ILE A 19 29.326 -4.041 1.748 1.00 0.34 C ATOM 273 CG1 ILE A 19 30.703 -3.369 1.659 1.00 0.41 C ATOM 274 CG2 ILE A 19 28.226 -3.031 1.456 1.00 0.36 C ATOM 275 CD1 ILE A 19 30.930 -2.274 2.675 1.00 0.47 C ATOM 0 H ILE A 19 30.874 -5.783 2.883 1.00 0.31 H new ATOM 0 HA ILE A 19 28.848 -3.930 3.859 1.00 0.31 H new ATOM 0 HB ILE A 19 29.296 -4.830 0.997 1.00 0.34 H new ATOM 0 HG12 ILE A 19 31.474 -4.130 1.784 1.00 0.41 H new ATOM 0 HG13 ILE A 19 30.826 -2.952 0.660 1.00 0.41 H new ATOM 0 HG21 ILE A 19 28.400 -2.575 0.482 1.00 0.36 H new ATOM 0 HG22 ILE A 19 27.260 -3.536 1.453 1.00 0.36 H new ATOM 0 HG23 ILE A 19 28.229 -2.258 2.224 1.00 0.36 H new ATOM 0 HD11 ILE A 19 31.927 -1.854 2.541 1.00 0.47 H new ATOM 0 HD12 ILE A 19 30.185 -1.490 2.538 1.00 0.47 H new ATOM 0 HD13 ILE A 19 30.842 -2.686 3.680 1.00 0.47 H new ATOM 287 N LYS A 20 26.909 -5.562 3.799 1.00 0.33 N ATOM 288 CA LYS A 20 25.779 -6.480 3.715 1.00 0.37 C ATOM 289 C LYS A 20 24.452 -5.756 3.908 1.00 0.33 C ATOM 290 O LYS A 20 24.364 -4.760 4.629 1.00 0.37 O ATOM 291 CB LYS A 20 25.924 -7.636 4.713 1.00 0.53 C ATOM 292 CG LYS A 20 25.753 -7.259 6.176 1.00 0.59 C ATOM 293 CD LYS A 20 26.126 -8.429 7.074 1.00 0.76 C ATOM 294 CE LYS A 20 25.823 -8.152 8.537 1.00 0.83 C ATOM 295 NZ LYS A 20 24.375 -8.301 8.856 1.00 1.34 N ATOM 0 H LYS A 20 26.822 -4.834 4.508 1.00 0.33 H new ATOM 0 HA LYS A 20 25.781 -6.903 2.710 1.00 0.37 H new ATOM 0 HB2 LYS A 20 25.190 -8.402 4.465 1.00 0.53 H new ATOM 0 HB3 LYS A 20 26.909 -8.084 4.583 1.00 0.53 H new ATOM 0 HG2 LYS A 20 26.379 -6.398 6.411 1.00 0.59 H new ATOM 0 HG3 LYS A 20 24.721 -6.964 6.363 1.00 0.59 H new ATOM 0 HD2 LYS A 20 25.582 -9.318 6.754 1.00 0.76 H new ATOM 0 HD3 LYS A 20 27.188 -8.648 6.960 1.00 0.76 H new ATOM 0 HE2 LYS A 20 26.401 -8.834 9.160 1.00 0.83 H new ATOM 0 HE3 LYS A 20 26.145 -7.141 8.787 1.00 0.83 H new ATOM 0 HZ1 LYS A 20 24.269 -8.734 9.795 1.00 1.34 H new ATOM 0 HZ2 LYS A 20 23.921 -7.365 8.853 1.00 1.34 H new ATOM 0 HZ3 LYS A 20 23.923 -8.907 8.142 1.00 1.34 H new ATOM 309 N THR A 21 23.435 -6.254 3.221 1.00 0.34 N ATOM 310 CA THR A 21 22.099 -5.688 3.268 1.00 0.36 C ATOM 311 C THR A 21 21.154 -6.631 4.016 1.00 0.36 C ATOM 312 O THR A 21 21.224 -7.845 3.833 1.00 0.40 O ATOM 313 CB THR A 21 21.571 -5.468 1.837 1.00 0.44 C ATOM 314 OG1 THR A 21 22.601 -4.874 1.034 1.00 0.49 O ATOM 315 CG2 THR A 21 20.341 -4.573 1.838 1.00 0.50 C ATOM 0 H THR A 21 23.516 -7.068 2.612 1.00 0.34 H new ATOM 0 HA THR A 21 22.143 -4.732 3.791 1.00 0.36 H new ATOM 0 HB THR A 21 21.288 -6.435 1.421 1.00 0.44 H new ATOM 0 HG1 THR A 21 22.267 -4.735 0.123 1.00 0.49 H new ATOM 0 HG21 THR A 21 19.990 -4.435 0.815 1.00 0.50 H new ATOM 0 HG22 THR A 21 19.554 -5.037 2.432 1.00 0.50 H new ATOM 0 HG23 THR A 21 20.596 -3.604 2.268 1.00 0.50 H new ATOM 323 N ILE A 22 20.284 -6.082 4.857 1.00 0.40 N ATOM 324 CA ILE A 22 19.320 -6.894 5.590 1.00 0.43 C ATOM 325 C ILE A 22 18.004 -6.980 4.816 1.00 0.44 C ATOM 326 O ILE A 22 17.501 -5.974 4.320 1.00 0.55 O ATOM 327 CB ILE A 22 19.075 -6.331 7.017 1.00 0.56 C ATOM 328 CG1 ILE A 22 18.095 -7.214 7.796 1.00 0.63 C ATOM 329 CG2 ILE A 22 18.572 -4.897 6.960 1.00 0.67 C ATOM 330 CD1 ILE A 22 18.626 -8.602 8.083 1.00 0.66 C ATOM 0 H ILE A 22 20.227 -5.082 5.047 1.00 0.40 H new ATOM 0 HA ILE A 22 19.735 -7.896 5.695 1.00 0.43 H new ATOM 0 HB ILE A 22 20.030 -6.336 7.543 1.00 0.56 H new ATOM 0 HG12 ILE A 22 17.850 -6.726 8.739 1.00 0.63 H new ATOM 0 HG13 ILE A 22 17.167 -7.299 7.230 1.00 0.63 H new ATOM 0 HG21 ILE A 22 18.409 -4.528 7.973 1.00 0.67 H new ATOM 0 HG22 ILE A 22 19.312 -4.271 6.461 1.00 0.67 H new ATOM 0 HG23 ILE A 22 17.634 -4.862 6.406 1.00 0.67 H new ATOM 0 HD11 ILE A 22 17.879 -9.170 8.637 1.00 0.66 H new ATOM 0 HD12 ILE A 22 18.844 -9.109 7.143 1.00 0.66 H new ATOM 0 HD13 ILE A 22 19.538 -8.527 8.676 1.00 0.66 H new ATOM 342 N LEU A 23 17.475 -8.192 4.680 1.00 0.41 N ATOM 343 CA LEU A 23 16.229 -8.399 3.948 1.00 0.47 C ATOM 344 C LEU A 23 15.137 -8.910 4.880 1.00 0.50 C ATOM 345 O LEU A 23 14.041 -8.361 4.923 1.00 0.67 O ATOM 346 CB LEU A 23 16.416 -9.383 2.779 1.00 0.54 C ATOM 347 CG LEU A 23 17.218 -8.867 1.572 1.00 0.53 C ATOM 348 CD1 LEU A 23 16.665 -7.539 1.077 1.00 0.83 C ATOM 349 CD2 LEU A 23 18.697 -8.737 1.896 1.00 0.64 C ATOM 0 H LEU A 23 17.887 -9.042 5.065 1.00 0.41 H new ATOM 0 HA LEU A 23 15.930 -7.434 3.538 1.00 0.47 H new ATOM 0 HB2 LEU A 23 16.910 -10.277 3.160 1.00 0.54 H new ATOM 0 HB3 LEU A 23 15.430 -9.689 2.429 1.00 0.54 H new ATOM 0 HG LEU A 23 17.113 -9.604 0.776 1.00 0.53 H new ATOM 0 HD11 LEU A 23 17.250 -7.197 0.223 1.00 0.83 H new ATOM 0 HD12 LEU A 23 15.625 -7.667 0.776 1.00 0.83 H new ATOM 0 HD13 LEU A 23 16.723 -6.800 1.876 1.00 0.83 H new ATOM 0 HD21 LEU A 23 19.231 -8.370 1.019 1.00 0.64 H new ATOM 0 HD22 LEU A 23 18.829 -8.036 2.721 1.00 0.64 H new ATOM 0 HD23 LEU A 23 19.094 -9.711 2.181 1.00 0.64 H new ATOM 361 N LYS A 24 15.440 -9.965 5.623 1.00 0.49 N ATOM 362 CA LYS A 24 14.480 -10.522 6.561 1.00 0.60 C ATOM 363 C LYS A 24 15.076 -10.535 7.957 1.00 0.60 C ATOM 364 O LYS A 24 16.228 -10.929 8.134 1.00 0.76 O ATOM 365 CB LYS A 24 14.080 -11.947 6.172 1.00 0.78 C ATOM 366 CG LYS A 24 12.827 -12.429 6.894 1.00 1.05 C ATOM 367 CD LYS A 24 12.722 -13.951 6.925 1.00 1.11 C ATOM 368 CE LYS A 24 12.707 -14.566 5.535 1.00 1.12 C ATOM 369 NZ LYS A 24 12.353 -16.011 5.582 1.00 1.56 N ATOM 0 H LYS A 24 16.337 -10.449 5.594 1.00 0.49 H new ATOM 0 HA LYS A 24 13.588 -9.895 6.539 1.00 0.60 H new ATOM 0 HB2 LYS A 24 13.913 -11.991 5.096 1.00 0.78 H new ATOM 0 HB3 LYS A 24 14.905 -12.624 6.395 1.00 0.78 H new ATOM 0 HG2 LYS A 24 12.830 -12.047 7.915 1.00 1.05 H new ATOM 0 HG3 LYS A 24 11.946 -12.017 6.402 1.00 1.05 H new ATOM 0 HD2 LYS A 24 13.562 -14.358 7.489 1.00 1.11 H new ATOM 0 HD3 LYS A 24 11.814 -14.238 7.455 1.00 1.11 H new ATOM 0 HE2 LYS A 24 11.990 -14.035 4.909 1.00 1.12 H new ATOM 0 HE3 LYS A 24 13.686 -14.445 5.072 1.00 1.12 H new ATOM 0 HZ1 LYS A 24 12.352 -16.400 4.617 1.00 1.56 H new ATOM 0 HZ2 LYS A 24 13.051 -16.521 6.160 1.00 1.56 H new ATOM 0 HZ3 LYS A 24 11.408 -16.123 6.002 1.00 1.56 H new ATOM 383 N LYS A 25 14.290 -10.113 8.936 1.00 0.61 N ATOM 384 CA LYS A 25 14.736 -10.074 10.324 1.00 0.64 C ATOM 385 C LYS A 25 14.218 -11.287 11.094 1.00 0.72 C ATOM 386 O LYS A 25 13.129 -11.792 10.817 1.00 0.90 O ATOM 387 CB LYS A 25 14.256 -8.777 10.994 1.00 0.76 C ATOM 388 CG LYS A 25 14.552 -8.701 12.488 1.00 1.52 C ATOM 389 CD LYS A 25 14.115 -7.373 13.084 1.00 1.72 C ATOM 390 CE LYS A 25 15.024 -6.242 12.640 1.00 2.60 C ATOM 391 NZ LYS A 25 14.563 -4.922 13.139 1.00 2.95 N ATOM 0 H LYS A 25 13.333 -9.790 8.795 1.00 0.61 H new ATOM 0 HA LYS A 25 15.826 -10.100 10.337 1.00 0.64 H new ATOM 0 HB2 LYS A 25 14.727 -7.929 10.498 1.00 0.76 H new ATOM 0 HB3 LYS A 25 13.181 -8.679 10.842 1.00 0.76 H new ATOM 0 HG2 LYS A 25 14.041 -9.515 13.002 1.00 1.52 H new ATOM 0 HG3 LYS A 25 15.620 -8.840 12.654 1.00 1.52 H new ATOM 0 HD2 LYS A 25 13.090 -7.157 12.784 1.00 1.72 H new ATOM 0 HD3 LYS A 25 14.121 -7.441 14.172 1.00 1.72 H new ATOM 0 HE2 LYS A 25 16.036 -6.430 12.998 1.00 2.60 H new ATOM 0 HE3 LYS A 25 15.069 -6.221 11.551 1.00 2.60 H new ATOM 0 HZ1 LYS A 25 15.214 -4.180 12.811 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 13.607 -4.729 12.777 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 14.544 -4.931 14.179 1.00 2.95 H new ATOM 405 N GLY A 26 15.011 -11.750 12.055 1.00 0.69 N ATOM 406 CA GLY A 26 14.601 -12.849 12.906 1.00 0.85 C ATOM 407 C GLY A 26 13.556 -12.422 13.919 1.00 0.88 C ATOM 408 O GLY A 26 13.266 -11.232 14.058 1.00 1.32 O ATOM 0 H GLY A 26 15.939 -11.379 12.260 1.00 0.69 H new ATOM 0 HA2 GLY A 26 14.202 -13.655 12.290 1.00 0.85 H new ATOM 0 HA3 GLY A 26 15.471 -13.248 13.428 1.00 0.85 H new ATOM 412 N ASP A 27 12.984 -13.384 14.629 1.00 0.84 N ATOM 413 CA ASP A 27 11.970 -13.088 15.634 1.00 1.01 C ATOM 414 C ASP A 27 12.605 -12.915 17.007 1.00 0.93 C ATOM 415 O ASP A 27 12.606 -11.820 17.569 1.00 1.24 O ATOM 416 CB ASP A 27 10.914 -14.196 15.687 1.00 1.33 C ATOM 417 CG ASP A 27 10.149 -14.338 14.388 1.00 2.08 C ATOM 418 OD1 ASP A 27 9.337 -13.446 14.075 1.00 2.38 O ATOM 419 OD2 ASP A 27 10.352 -15.345 13.678 1.00 2.77 O ATOM 0 H ASP A 27 13.204 -14.375 14.529 1.00 0.84 H new ATOM 0 HA ASP A 27 11.484 -12.154 15.350 1.00 1.01 H new ATOM 0 HB2 ASP A 27 11.399 -15.143 15.924 1.00 1.33 H new ATOM 0 HB3 ASP A 27 10.213 -13.986 16.495 1.00 1.33 H new ATOM 424 N GLU A 28 13.165 -13.993 17.534 1.00 0.91 N ATOM 425 CA GLU A 28 13.746 -13.981 18.868 1.00 0.91 C ATOM 426 C GLU A 28 14.870 -15.009 18.959 1.00 0.96 C ATOM 427 O GLU A 28 14.883 -15.987 18.213 1.00 1.22 O ATOM 428 CB GLU A 28 12.658 -14.285 19.906 1.00 1.11 C ATOM 429 CG GLU A 28 13.153 -14.305 21.342 1.00 1.59 C ATOM 430 CD GLU A 28 12.047 -14.601 22.325 1.00 2.09 C ATOM 431 OE1 GLU A 28 11.775 -15.790 22.580 1.00 2.56 O ATOM 432 OE2 GLU A 28 11.436 -13.647 22.842 1.00 2.64 O ATOM 0 H GLU A 28 13.230 -14.892 17.056 1.00 0.91 H new ATOM 0 HA GLU A 28 14.163 -12.994 19.070 1.00 0.91 H new ATOM 0 HB2 GLU A 28 11.868 -13.539 19.817 1.00 1.11 H new ATOM 0 HB3 GLU A 28 12.211 -15.252 19.674 1.00 1.11 H new ATOM 0 HG2 GLU A 28 13.937 -15.056 21.443 1.00 1.59 H new ATOM 0 HG3 GLU A 28 13.602 -13.341 21.583 1.00 1.59 H new ATOM 439 N GLY A 29 15.828 -14.770 19.845 1.00 0.88 N ATOM 440 CA GLY A 29 16.869 -15.747 20.071 1.00 1.04 C ATOM 441 C GLY A 29 18.233 -15.123 20.261 1.00 0.79 C ATOM 442 O GLY A 29 18.879 -14.729 19.295 1.00 0.90 O ATOM 0 H GLY A 29 15.901 -13.922 20.407 1.00 0.88 H new ATOM 0 HA2 GLY A 29 16.620 -16.338 20.952 1.00 1.04 H new ATOM 0 HA3 GLY A 29 16.904 -16.434 19.226 1.00 1.04 H new ATOM 446 N GLU A 30 18.663 -15.019 21.516 1.00 0.73 N ATOM 447 CA GLU A 30 20.018 -14.577 21.823 1.00 0.80 C ATOM 448 C GLU A 30 21.008 -15.697 21.519 1.00 0.78 C ATOM 449 O GLU A 30 22.072 -15.471 20.946 1.00 0.96 O ATOM 450 CB GLU A 30 20.139 -14.190 23.299 1.00 1.08 C ATOM 451 CG GLU A 30 21.510 -13.646 23.670 1.00 1.35 C ATOM 452 CD GLU A 30 21.749 -13.633 25.164 1.00 1.68 C ATOM 453 OE1 GLU A 30 20.920 -13.053 25.899 1.00 1.89 O ATOM 454 OE2 GLU A 30 22.756 -14.213 25.613 1.00 2.29 O ATOM 0 H GLU A 30 18.093 -15.235 22.334 1.00 0.73 H new ATOM 0 HA GLU A 30 20.242 -13.706 21.207 1.00 0.80 H new ATOM 0 HB2 GLU A 30 19.383 -13.440 23.534 1.00 1.08 H new ATOM 0 HB3 GLU A 30 19.924 -15.063 23.915 1.00 1.08 H new ATOM 0 HG2 GLU A 30 22.279 -14.251 23.189 1.00 1.35 H new ATOM 0 HG3 GLU A 30 21.612 -12.633 23.281 1.00 1.35 H new ATOM 461 N GLU A 31 20.628 -16.910 21.898 1.00 0.76 N ATOM 462 CA GLU A 31 21.478 -18.076 21.714 1.00 0.86 C ATOM 463 C GLU A 31 21.369 -18.602 20.285 1.00 0.78 C ATOM 464 O GLU A 31 22.285 -19.259 19.784 1.00 1.11 O ATOM 465 CB GLU A 31 21.097 -19.155 22.731 1.00 1.09 C ATOM 466 CG GLU A 31 21.999 -20.375 22.705 1.00 1.56 C ATOM 467 CD GLU A 31 21.740 -21.303 23.870 1.00 2.17 C ATOM 468 OE1 GLU A 31 20.756 -22.073 23.814 1.00 2.64 O ATOM 469 OE2 GLU A 31 22.504 -21.249 24.860 1.00 2.54 O ATOM 0 H GLU A 31 19.730 -17.111 22.338 1.00 0.76 H new ATOM 0 HA GLU A 31 22.517 -17.791 21.881 1.00 0.86 H new ATOM 0 HB2 GLU A 31 21.119 -18.721 23.731 1.00 1.09 H new ATOM 0 HB3 GLU A 31 20.071 -19.471 22.543 1.00 1.09 H new ATOM 0 HG2 GLU A 31 21.848 -20.916 21.771 1.00 1.56 H new ATOM 0 HG3 GLU A 31 23.041 -20.055 22.723 1.00 1.56 H new ATOM 476 N ASN A 32 20.260 -18.294 19.618 1.00 0.51 N ATOM 477 CA ASN A 32 20.096 -18.682 18.221 1.00 0.55 C ATOM 478 C ASN A 32 20.872 -17.726 17.332 1.00 0.49 C ATOM 479 O ASN A 32 20.302 -16.857 16.673 1.00 0.57 O ATOM 480 CB ASN A 32 18.622 -18.705 17.805 1.00 0.71 C ATOM 481 CG ASN A 32 17.838 -19.828 18.457 1.00 0.95 C ATOM 482 OD1 ASN A 32 17.819 -20.955 17.961 1.00 1.45 O ATOM 483 ND2 ASN A 32 17.165 -19.521 19.558 1.00 1.19 N ATOM 0 H ASN A 32 19.471 -17.784 20.016 1.00 0.51 H new ATOM 0 HA ASN A 32 20.485 -19.694 18.106 1.00 0.55 H new ATOM 0 HB2 ASN A 32 18.163 -17.751 18.064 1.00 0.71 H new ATOM 0 HB3 ASN A 32 18.558 -18.806 16.722 1.00 0.71 H new ATOM 0 HD21 ASN A 32 16.604 -20.232 20.028 1.00 1.19 H new ATOM 0 HD22 ASN A 32 17.209 -18.574 19.935 1.00 1.19 H new ATOM 490 N ILE A 33 22.180 -17.914 17.327 1.00 0.47 N ATOM 491 CA ILE A 33 23.099 -17.079 16.568 1.00 0.51 C ATOM 492 C ILE A 33 24.268 -17.932 16.082 1.00 0.44 C ATOM 493 O ILE A 33 24.996 -18.515 16.889 1.00 0.47 O ATOM 494 CB ILE A 33 23.660 -15.903 17.419 1.00 0.66 C ATOM 495 CG1 ILE A 33 22.551 -14.918 17.818 1.00 0.74 C ATOM 496 CG2 ILE A 33 24.770 -15.172 16.667 1.00 0.76 C ATOM 497 CD1 ILE A 33 22.013 -14.104 16.664 1.00 0.81 C ATOM 0 H ILE A 33 22.640 -18.657 17.854 1.00 0.47 H new ATOM 0 HA ILE A 33 22.546 -16.657 15.729 1.00 0.51 H new ATOM 0 HB ILE A 33 24.076 -16.330 18.332 1.00 0.66 H new ATOM 0 HG12 ILE A 33 21.731 -15.474 18.272 1.00 0.74 H new ATOM 0 HG13 ILE A 33 22.937 -14.240 18.580 1.00 0.74 H new ATOM 0 HG21 ILE A 33 25.147 -14.354 17.281 1.00 0.76 H new ATOM 0 HG22 ILE A 33 25.581 -15.867 16.450 1.00 0.76 H new ATOM 0 HG23 ILE A 33 24.375 -14.773 15.733 1.00 0.76 H new ATOM 0 HD11 ILE A 33 21.234 -13.432 17.025 1.00 0.81 H new ATOM 0 HD12 ILE A 33 22.821 -13.520 16.223 1.00 0.81 H new ATOM 0 HD13 ILE A 33 21.596 -14.772 15.911 1.00 0.81 H new ATOM 509 N PRO A 34 24.444 -18.034 14.764 1.00 0.46 N ATOM 510 CA PRO A 34 25.546 -18.792 14.167 1.00 0.44 C ATOM 511 C PRO A 34 26.909 -18.235 14.586 1.00 0.52 C ATOM 512 O PRO A 34 27.182 -17.046 14.422 1.00 0.75 O ATOM 513 CB PRO A 34 25.334 -18.614 12.658 1.00 0.51 C ATOM 514 CG PRO A 34 24.455 -17.419 12.531 1.00 0.54 C ATOM 515 CD PRO A 34 23.583 -17.424 13.745 1.00 0.62 C ATOM 0 HA PRO A 34 25.546 -19.835 14.483 1.00 0.44 H new ATOM 0 HB2 PRO A 34 26.282 -18.463 12.141 1.00 0.51 H new ATOM 0 HB3 PRO A 34 24.868 -19.496 12.218 1.00 0.51 H new ATOM 0 HG2 PRO A 34 25.045 -16.504 12.477 1.00 0.54 H new ATOM 0 HG3 PRO A 34 23.858 -17.468 11.620 1.00 0.54 H new ATOM 0 HD2 PRO A 34 23.276 -16.417 14.026 1.00 0.62 H new ATOM 0 HD3 PRO A 34 22.673 -18.002 13.586 1.00 0.62 H new ATOM 523 N LYS A 35 27.755 -19.085 15.149 1.00 0.49 N ATOM 524 CA LYS A 35 29.091 -18.665 15.554 1.00 0.60 C ATOM 525 C LYS A 35 30.129 -19.423 14.748 1.00 0.56 C ATOM 526 O LYS A 35 29.896 -20.567 14.356 1.00 0.58 O ATOM 527 CB LYS A 35 29.337 -18.935 17.040 1.00 0.83 C ATOM 528 CG LYS A 35 28.224 -18.478 17.962 1.00 1.17 C ATOM 529 CD LYS A 35 28.027 -16.977 17.964 1.00 1.46 C ATOM 530 CE LYS A 35 27.146 -16.554 19.129 1.00 1.98 C ATOM 531 NZ LYS A 35 25.951 -17.435 19.286 1.00 2.66 N ATOM 0 H LYS A 35 27.543 -20.065 15.336 1.00 0.49 H new ATOM 0 HA LYS A 35 29.170 -17.593 15.374 1.00 0.60 H new ATOM 0 HB2 LYS A 35 29.489 -20.005 17.180 1.00 0.83 H new ATOM 0 HB3 LYS A 35 30.262 -18.440 17.337 1.00 0.83 H new ATOM 0 HG2 LYS A 35 27.293 -18.959 17.663 1.00 1.17 H new ATOM 0 HG3 LYS A 35 28.443 -18.810 18.977 1.00 1.17 H new ATOM 0 HD2 LYS A 35 28.994 -16.478 18.032 1.00 1.46 H new ATOM 0 HD3 LYS A 35 27.572 -16.663 17.024 1.00 1.46 H new ATOM 0 HE2 LYS A 35 27.731 -16.572 20.049 1.00 1.98 H new ATOM 0 HE3 LYS A 35 26.819 -15.525 18.979 1.00 1.98 H new ATOM 0 HZ1 LYS A 35 25.231 -16.946 19.855 1.00 2.66 H new ATOM 0 HZ2 LYS A 35 25.559 -17.658 18.349 1.00 2.66 H new ATOM 0 HZ3 LYS A 35 26.230 -18.316 19.763 1.00 2.66 H new ATOM 545 N LYS A 36 31.269 -18.801 14.507 1.00 0.67 N ATOM 546 CA LYS A 36 32.324 -19.463 13.762 1.00 0.82 C ATOM 547 C LYS A 36 33.057 -20.466 14.645 1.00 0.84 C ATOM 548 O LYS A 36 33.213 -20.253 15.848 1.00 0.91 O ATOM 549 CB LYS A 36 33.281 -18.439 13.127 1.00 1.09 C ATOM 550 CG LYS A 36 34.053 -17.544 14.094 1.00 1.26 C ATOM 551 CD LYS A 36 35.296 -18.234 14.646 1.00 1.36 C ATOM 552 CE LYS A 36 36.404 -17.240 14.959 1.00 2.14 C ATOM 553 NZ LYS A 36 36.978 -16.640 13.726 1.00 2.51 N ATOM 0 H LYS A 36 31.486 -17.852 14.811 1.00 0.67 H new ATOM 0 HA LYS A 36 31.871 -20.021 12.943 1.00 0.82 H new ATOM 0 HB2 LYS A 36 34.001 -18.979 12.512 1.00 1.09 H new ATOM 0 HB3 LYS A 36 32.704 -17.801 12.457 1.00 1.09 H new ATOM 0 HG2 LYS A 36 34.345 -16.626 13.583 1.00 1.26 H new ATOM 0 HG3 LYS A 36 33.402 -17.256 14.919 1.00 1.26 H new ATOM 0 HD2 LYS A 36 35.035 -18.783 15.550 1.00 1.36 H new ATOM 0 HD3 LYS A 36 35.657 -18.965 13.922 1.00 1.36 H new ATOM 0 HE2 LYS A 36 36.012 -16.449 15.598 1.00 2.14 H new ATOM 0 HE3 LYS A 36 37.193 -17.741 15.520 1.00 2.14 H new ATOM 0 HZ1 LYS A 36 37.911 -16.233 13.940 1.00 2.51 H new ATOM 0 HZ2 LYS A 36 37.080 -17.375 12.997 1.00 2.51 H new ATOM 0 HZ3 LYS A 36 36.346 -15.892 13.377 1.00 2.51 H new ATOM 567 N GLY A 37 33.469 -21.572 14.048 1.00 0.92 N ATOM 568 CA GLY A 37 34.086 -22.639 14.807 1.00 1.04 C ATOM 569 C GLY A 37 33.093 -23.741 15.107 1.00 0.96 C ATOM 570 O GLY A 37 33.474 -24.884 15.354 1.00 1.12 O ATOM 0 H GLY A 37 33.387 -21.751 13.047 1.00 0.92 H new ATOM 0 HA2 GLY A 37 34.928 -23.047 14.248 1.00 1.04 H new ATOM 0 HA3 GLY A 37 34.485 -22.242 15.740 1.00 1.04 H new ATOM 574 N ASN A 38 31.815 -23.391 15.071 1.00 0.79 N ATOM 575 CA ASN A 38 30.753 -24.363 15.263 1.00 0.75 C ATOM 576 C ASN A 38 30.187 -24.788 13.921 1.00 0.72 C ATOM 577 O ASN A 38 30.488 -24.183 12.889 1.00 0.79 O ATOM 578 CB ASN A 38 29.634 -23.808 16.149 1.00 0.75 C ATOM 579 CG ASN A 38 30.016 -23.773 17.617 1.00 0.87 C ATOM 580 OD1 ASN A 38 29.843 -24.753 18.338 1.00 1.38 O ATOM 581 ND2 ASN A 38 30.511 -22.636 18.078 1.00 0.98 N ATOM 0 H ASN A 38 31.490 -22.438 14.910 1.00 0.79 H new ATOM 0 HA ASN A 38 31.182 -25.229 15.768 1.00 0.75 H new ATOM 0 HB2 ASN A 38 29.380 -22.801 15.819 1.00 0.75 H new ATOM 0 HB3 ASN A 38 28.740 -24.419 16.024 1.00 0.75 H new ATOM 0 HD21 ASN A 38 30.763 -22.552 19.063 1.00 0.98 H new ATOM 0 HD22 ASN A 38 30.640 -21.844 17.449 1.00 0.98 H new ATOM 588 N GLU A 39 29.358 -25.816 13.932 1.00 0.71 N ATOM 589 CA GLU A 39 28.820 -26.360 12.703 1.00 0.73 C ATOM 590 C GLU A 39 27.551 -25.630 12.283 1.00 0.63 C ATOM 591 O GLU A 39 26.598 -25.507 13.055 1.00 0.69 O ATOM 592 CB GLU A 39 28.549 -27.859 12.854 1.00 0.86 C ATOM 593 CG GLU A 39 27.979 -28.503 11.600 1.00 1.37 C ATOM 594 CD GLU A 39 27.960 -30.011 11.686 1.00 1.73 C ATOM 595 OE1 GLU A 39 28.984 -30.636 11.332 1.00 2.20 O ATOM 596 OE2 GLU A 39 26.929 -30.574 12.111 1.00 2.17 O ATOM 0 H GLU A 39 29.044 -26.289 14.779 1.00 0.71 H new ATOM 0 HA GLU A 39 29.564 -26.215 11.920 1.00 0.73 H new ATOM 0 HB2 GLU A 39 29.478 -28.363 13.121 1.00 0.86 H new ATOM 0 HB3 GLU A 39 27.854 -28.013 13.680 1.00 0.86 H new ATOM 0 HG2 GLU A 39 26.965 -28.138 11.436 1.00 1.37 H new ATOM 0 HG3 GLU A 39 28.571 -28.198 10.737 1.00 1.37 H new ATOM 603 N VAL A 40 27.555 -25.137 11.056 1.00 0.60 N ATOM 604 CA VAL A 40 26.384 -24.499 10.477 1.00 0.54 C ATOM 605 C VAL A 40 26.188 -25.006 9.057 1.00 0.54 C ATOM 606 O VAL A 40 27.119 -25.547 8.452 1.00 0.67 O ATOM 607 CB VAL A 40 26.491 -22.953 10.457 1.00 0.57 C ATOM 608 CG1 VAL A 40 26.749 -22.398 11.853 1.00 0.61 C ATOM 609 CG2 VAL A 40 27.559 -22.490 9.472 1.00 0.67 C ATOM 0 H VAL A 40 28.364 -25.167 10.436 1.00 0.60 H new ATOM 0 HA VAL A 40 25.531 -24.757 11.105 1.00 0.54 H new ATOM 0 HB VAL A 40 25.533 -22.558 10.119 1.00 0.57 H new ATOM 0 HG11 VAL A 40 26.819 -21.311 11.805 1.00 0.61 H new ATOM 0 HG12 VAL A 40 25.929 -22.680 12.514 1.00 0.61 H new ATOM 0 HG13 VAL A 40 27.683 -22.805 12.239 1.00 0.61 H new ATOM 0 HG21 VAL A 40 27.613 -21.401 9.479 1.00 0.67 H new ATOM 0 HG22 VAL A 40 28.525 -22.903 9.762 1.00 0.67 H new ATOM 0 HG23 VAL A 40 27.304 -22.835 8.470 1.00 0.67 H new ATOM 619 N THR A 41 24.984 -24.854 8.538 1.00 0.46 N ATOM 620 CA THR A 41 24.684 -25.220 7.168 1.00 0.48 C ATOM 621 C THR A 41 23.965 -24.068 6.483 1.00 0.42 C ATOM 622 O THR A 41 22.835 -23.726 6.846 1.00 0.44 O ATOM 623 CB THR A 41 23.817 -26.493 7.105 1.00 0.56 C ATOM 624 OG1 THR A 41 24.436 -27.528 7.874 1.00 0.65 O ATOM 625 CG2 THR A 41 23.637 -26.966 5.670 1.00 0.63 C ATOM 0 H THR A 41 24.189 -24.475 9.053 1.00 0.46 H new ATOM 0 HA THR A 41 25.622 -25.429 6.654 1.00 0.48 H new ATOM 0 HB THR A 41 22.834 -26.259 7.514 1.00 0.56 H new ATOM 0 HG1 THR A 41 23.885 -28.338 7.836 1.00 0.65 H new ATOM 0 HG21 THR A 41 23.021 -27.865 5.658 1.00 0.63 H new ATOM 0 HG22 THR A 41 23.149 -26.184 5.088 1.00 0.63 H new ATOM 0 HG23 THR A 41 24.612 -27.188 5.235 1.00 0.63 H new ATOM 633 N VAL A 42 24.635 -23.446 5.522 1.00 0.40 N ATOM 634 CA VAL A 42 24.083 -22.281 4.851 1.00 0.42 C ATOM 635 C VAL A 42 24.002 -22.483 3.348 1.00 0.43 C ATOM 636 O VAL A 42 24.767 -23.253 2.771 1.00 0.49 O ATOM 637 CB VAL A 42 24.904 -21.004 5.139 1.00 0.46 C ATOM 638 CG1 VAL A 42 24.816 -20.621 6.605 1.00 0.80 C ATOM 639 CG2 VAL A 42 26.358 -21.190 4.728 1.00 0.87 C ATOM 0 H VAL A 42 25.558 -23.729 5.192 1.00 0.40 H new ATOM 0 HA VAL A 42 23.077 -22.154 5.252 1.00 0.42 H new ATOM 0 HB VAL A 42 24.479 -20.194 4.546 1.00 0.46 H new ATOM 0 HG11 VAL A 42 25.402 -19.719 6.781 1.00 0.80 H new ATOM 0 HG12 VAL A 42 23.775 -20.435 6.871 1.00 0.80 H new ATOM 0 HG13 VAL A 42 25.207 -21.433 7.217 1.00 0.80 H new ATOM 0 HG21 VAL A 42 26.916 -20.278 4.940 1.00 0.87 H new ATOM 0 HG22 VAL A 42 26.791 -22.019 5.288 1.00 0.87 H new ATOM 0 HG23 VAL A 42 26.410 -21.407 3.661 1.00 0.87 H new ATOM 649 N HIS A 43 23.065 -21.784 2.728 1.00 0.44 N ATOM 650 CA HIS A 43 22.906 -21.816 1.286 1.00 0.49 C ATOM 651 C HIS A 43 23.180 -20.431 0.727 1.00 0.47 C ATOM 652 O HIS A 43 22.645 -19.444 1.226 1.00 0.53 O ATOM 653 CB HIS A 43 21.486 -22.265 0.915 1.00 0.64 C ATOM 654 CG HIS A 43 21.239 -22.382 -0.563 1.00 1.16 C ATOM 655 ND1 HIS A 43 20.435 -21.510 -1.266 1.00 2.00 N ATOM 656 CD2 HIS A 43 21.682 -23.286 -1.467 1.00 2.04 C ATOM 657 CE1 HIS A 43 20.395 -21.871 -2.532 1.00 2.74 C ATOM 658 NE2 HIS A 43 21.143 -22.946 -2.686 1.00 2.75 N ATOM 0 H HIS A 43 22.397 -21.182 3.209 1.00 0.44 H new ATOM 0 HA HIS A 43 23.612 -22.529 0.859 1.00 0.49 H new ATOM 0 HB2 HIS A 43 21.290 -23.230 1.382 1.00 0.64 H new ATOM 0 HB3 HIS A 43 20.772 -21.557 1.336 1.00 0.64 H new ATOM 0 HD1 HIS A 43 19.946 -20.709 -0.867 1.00 2.00 H new ATOM 0 HD2 HIS A 43 22.338 -24.121 -1.268 1.00 2.04 H new ATOM 0 HE1 HIS A 43 19.842 -21.370 -3.313 1.00 2.74 H new ATOM 667 N TYR A 44 24.025 -20.359 -0.290 1.00 0.44 N ATOM 668 CA TYR A 44 24.367 -19.087 -0.900 1.00 0.42 C ATOM 669 C TYR A 44 24.146 -19.151 -2.405 1.00 0.41 C ATOM 670 O TYR A 44 24.341 -20.198 -3.028 1.00 0.47 O ATOM 671 CB TYR A 44 25.820 -18.703 -0.581 1.00 0.46 C ATOM 672 CG TYR A 44 26.860 -19.600 -1.226 1.00 0.50 C ATOM 673 CD1 TYR A 44 27.101 -20.877 -0.742 1.00 0.52 C ATOM 674 CD2 TYR A 44 27.598 -19.165 -2.324 1.00 0.60 C ATOM 675 CE1 TYR A 44 28.044 -21.698 -1.331 1.00 0.60 C ATOM 676 CE2 TYR A 44 28.542 -19.979 -2.915 1.00 0.68 C ATOM 677 CZ TYR A 44 28.762 -21.245 -2.414 1.00 0.66 C ATOM 678 OH TYR A 44 29.698 -22.059 -3.005 1.00 0.76 O ATOM 0 H TYR A 44 24.485 -21.167 -0.709 1.00 0.44 H new ATOM 0 HA TYR A 44 23.716 -18.317 -0.485 1.00 0.42 H new ATOM 0 HB2 TYR A 44 25.992 -17.677 -0.905 1.00 0.46 H new ATOM 0 HB3 TYR A 44 25.960 -18.724 0.500 1.00 0.46 H new ATOM 0 HD1 TYR A 44 26.542 -21.236 0.110 1.00 0.52 H new ATOM 0 HD2 TYR A 44 27.429 -18.174 -2.719 1.00 0.60 H new ATOM 0 HE1 TYR A 44 28.217 -22.691 -0.943 1.00 0.60 H new ATOM 0 HE2 TYR A 44 29.106 -19.627 -3.766 1.00 0.68 H new ATOM 0 HH TYR A 44 29.797 -22.880 -2.479 1.00 0.76 H new ATOM 688 N VAL A 45 23.702 -18.038 -2.968 1.00 0.35 N ATOM 689 CA VAL A 45 23.459 -17.925 -4.401 1.00 0.36 C ATOM 690 C VAL A 45 23.252 -16.453 -4.753 1.00 0.30 C ATOM 691 O VAL A 45 22.945 -15.652 -3.876 1.00 0.30 O ATOM 692 CB VAL A 45 22.225 -18.759 -4.830 1.00 0.44 C ATOM 693 CG1 VAL A 45 20.944 -18.195 -4.232 1.00 0.47 C ATOM 694 CG2 VAL A 45 22.122 -18.854 -6.344 1.00 0.49 C ATOM 0 H VAL A 45 23.499 -17.186 -2.445 1.00 0.35 H new ATOM 0 HA VAL A 45 24.322 -18.318 -4.938 1.00 0.36 H new ATOM 0 HB VAL A 45 22.360 -19.768 -4.441 1.00 0.44 H new ATOM 0 HG11 VAL A 45 20.096 -18.801 -4.551 1.00 0.47 H new ATOM 0 HG12 VAL A 45 21.013 -18.211 -3.144 1.00 0.47 H new ATOM 0 HG13 VAL A 45 20.805 -17.169 -4.572 1.00 0.47 H new ATOM 0 HG21 VAL A 45 21.247 -19.445 -6.613 1.00 0.49 H new ATOM 0 HG22 VAL A 45 22.028 -17.853 -6.766 1.00 0.49 H new ATOM 0 HG23 VAL A 45 23.018 -19.332 -6.740 1.00 0.49 H new ATOM 704 N GLY A 46 23.439 -16.081 -6.011 1.00 0.31 N ATOM 705 CA GLY A 46 23.244 -14.700 -6.389 1.00 0.30 C ATOM 706 C GLY A 46 23.710 -14.400 -7.794 1.00 0.30 C ATOM 707 O GLY A 46 23.358 -15.107 -8.738 1.00 0.36 O ATOM 0 H GLY A 46 23.719 -16.704 -6.768 1.00 0.31 H new ATOM 0 HA2 GLY A 46 22.186 -14.451 -6.302 1.00 0.30 H new ATOM 0 HA3 GLY A 46 23.780 -14.059 -5.690 1.00 0.30 H new ATOM 711 N LYS A 47 24.500 -13.346 -7.930 1.00 0.27 N ATOM 712 CA LYS A 47 24.988 -12.908 -9.230 1.00 0.29 C ATOM 713 C LYS A 47 26.259 -12.080 -9.077 1.00 0.25 C ATOM 714 O LYS A 47 26.679 -11.765 -7.961 1.00 0.26 O ATOM 715 CB LYS A 47 23.919 -12.097 -9.971 1.00 0.36 C ATOM 716 CG LYS A 47 23.483 -10.838 -9.243 1.00 0.42 C ATOM 717 CD LYS A 47 22.643 -9.932 -10.129 1.00 0.66 C ATOM 718 CE LYS A 47 22.211 -8.682 -9.379 1.00 0.83 C ATOM 719 NZ LYS A 47 21.469 -7.732 -10.250 1.00 1.43 N ATOM 0 H LYS A 47 24.819 -12.773 -7.149 1.00 0.27 H new ATOM 0 HA LYS A 47 25.217 -13.797 -9.818 1.00 0.29 H new ATOM 0 HB2 LYS A 47 24.303 -11.822 -10.953 1.00 0.36 H new ATOM 0 HB3 LYS A 47 23.047 -12.730 -10.135 1.00 0.36 H new ATOM 0 HG2 LYS A 47 22.910 -11.111 -8.357 1.00 0.42 H new ATOM 0 HG3 LYS A 47 24.363 -10.295 -8.899 1.00 0.42 H new ATOM 0 HD2 LYS A 47 23.215 -9.650 -11.013 1.00 0.66 H new ATOM 0 HD3 LYS A 47 21.763 -10.473 -10.478 1.00 0.66 H new ATOM 0 HE2 LYS A 47 21.582 -8.966 -8.535 1.00 0.83 H new ATOM 0 HE3 LYS A 47 23.090 -8.185 -8.968 1.00 0.83 H new ATOM 0 HZ1 LYS A 47 21.195 -6.895 -9.696 1.00 1.43 H new ATOM 0 HZ2 LYS A 47 22.077 -7.439 -11.041 1.00 1.43 H new ATOM 0 HZ3 LYS A 47 20.616 -8.196 -10.622 1.00 1.43 H new ATOM 733 N LEU A 48 26.877 -11.744 -10.200 1.00 0.27 N ATOM 734 CA LEU A 48 28.072 -10.915 -10.205 1.00 0.26 C ATOM 735 C LEU A 48 27.698 -9.447 -10.417 1.00 0.25 C ATOM 736 O LEU A 48 27.289 -9.056 -11.512 1.00 0.27 O ATOM 737 CB LEU A 48 29.018 -11.389 -11.316 1.00 0.29 C ATOM 738 CG LEU A 48 30.300 -10.575 -11.500 1.00 0.32 C ATOM 739 CD1 LEU A 48 31.179 -10.656 -10.266 1.00 0.36 C ATOM 740 CD2 LEU A 48 31.062 -11.057 -12.723 1.00 0.38 C ATOM 0 H LEU A 48 26.567 -12.036 -11.127 1.00 0.27 H new ATOM 0 HA LEU A 48 28.576 -11.005 -9.243 1.00 0.26 H new ATOM 0 HB2 LEU A 48 29.295 -12.424 -11.113 1.00 0.29 H new ATOM 0 HB3 LEU A 48 28.470 -11.384 -12.258 1.00 0.29 H new ATOM 0 HG LEU A 48 30.020 -9.532 -11.649 1.00 0.32 H new ATOM 0 HD11 LEU A 48 32.083 -10.068 -10.424 1.00 0.36 H new ATOM 0 HD12 LEU A 48 30.636 -10.263 -9.406 1.00 0.36 H new ATOM 0 HD13 LEU A 48 31.450 -11.695 -10.080 1.00 0.36 H new ATOM 0 HD21 LEU A 48 31.972 -10.468 -12.840 1.00 0.38 H new ATOM 0 HD22 LEU A 48 31.324 -12.108 -12.598 1.00 0.38 H new ATOM 0 HD23 LEU A 48 30.438 -10.942 -13.609 1.00 0.38 H new ATOM 752 N GLU A 49 27.843 -8.635 -9.366 1.00 0.29 N ATOM 753 CA GLU A 49 27.468 -7.219 -9.427 1.00 0.36 C ATOM 754 C GLU A 49 28.410 -6.469 -10.354 1.00 0.34 C ATOM 755 O GLU A 49 28.084 -5.395 -10.863 1.00 0.41 O ATOM 756 CB GLU A 49 27.504 -6.577 -8.032 1.00 0.50 C ATOM 757 CG GLU A 49 26.715 -5.277 -7.942 1.00 0.63 C ATOM 758 CD GLU A 49 26.851 -4.582 -6.598 1.00 1.20 C ATOM 759 OE1 GLU A 49 26.056 -4.879 -5.681 1.00 1.75 O ATOM 760 OE2 GLU A 49 27.741 -3.718 -6.465 1.00 1.96 O ATOM 0 H GLU A 49 28.216 -8.933 -8.465 1.00 0.29 H new ATOM 0 HA GLU A 49 26.450 -7.157 -9.812 1.00 0.36 H new ATOM 0 HB2 GLU A 49 27.107 -7.285 -7.304 1.00 0.50 H new ATOM 0 HB3 GLU A 49 28.541 -6.384 -7.756 1.00 0.50 H new ATOM 0 HG2 GLU A 49 27.051 -4.601 -8.728 1.00 0.63 H new ATOM 0 HG3 GLU A 49 25.662 -5.486 -8.130 1.00 0.63 H new ATOM 767 N SER A 50 29.575 -7.060 -10.571 1.00 0.33 N ATOM 768 CA SER A 50 30.607 -6.464 -11.401 1.00 0.40 C ATOM 769 C SER A 50 30.074 -6.127 -12.796 1.00 0.45 C ATOM 770 O SER A 50 30.345 -5.049 -13.330 1.00 0.55 O ATOM 771 CB SER A 50 31.797 -7.419 -11.515 1.00 0.46 C ATOM 772 OG SER A 50 32.842 -6.860 -12.289 1.00 0.67 O ATOM 0 H SER A 50 29.830 -7.965 -10.176 1.00 0.33 H new ATOM 0 HA SER A 50 30.927 -5.535 -10.929 1.00 0.40 H new ATOM 0 HB2 SER A 50 32.169 -7.658 -10.519 1.00 0.46 H new ATOM 0 HB3 SER A 50 31.470 -8.356 -11.966 1.00 0.46 H new ATOM 0 HG SER A 50 33.515 -7.547 -12.475 1.00 0.67 H new ATOM 778 N THR A 51 29.305 -7.042 -13.380 1.00 0.44 N ATOM 779 CA THR A 51 28.782 -6.836 -14.723 1.00 0.53 C ATOM 780 C THR A 51 27.256 -6.956 -14.753 1.00 0.54 C ATOM 781 O THR A 51 26.638 -6.870 -15.816 1.00 0.73 O ATOM 782 CB THR A 51 29.416 -7.834 -15.720 1.00 0.59 C ATOM 783 OG1 THR A 51 28.940 -7.586 -17.049 1.00 0.72 O ATOM 784 CG2 THR A 51 29.116 -9.273 -15.325 1.00 0.53 C ATOM 0 H THR A 51 29.033 -7.925 -12.947 1.00 0.44 H new ATOM 0 HA THR A 51 29.048 -5.823 -15.025 1.00 0.53 H new ATOM 0 HB THR A 51 30.496 -7.688 -15.693 1.00 0.59 H new ATOM 0 HG1 THR A 51 28.008 -7.286 -17.012 1.00 0.72 H new ATOM 0 HG21 THR A 51 29.575 -9.951 -16.045 1.00 0.53 H new ATOM 0 HG22 THR A 51 29.521 -9.470 -14.332 1.00 0.53 H new ATOM 0 HG23 THR A 51 28.037 -9.430 -15.315 1.00 0.53 H new ATOM 792 N GLY A 52 26.660 -7.152 -13.581 1.00 0.48 N ATOM 793 CA GLY A 52 25.211 -7.225 -13.483 1.00 0.51 C ATOM 794 C GLY A 52 24.643 -8.516 -14.039 1.00 0.54 C ATOM 795 O GLY A 52 23.443 -8.619 -14.279 1.00 0.78 O ATOM 0 H GLY A 52 27.154 -7.262 -12.696 1.00 0.48 H new ATOM 0 HA2 GLY A 52 24.918 -7.126 -12.438 1.00 0.51 H new ATOM 0 HA3 GLY A 52 24.773 -6.382 -14.018 1.00 0.51 H new ATOM 799 N LYS A 53 25.504 -9.508 -14.236 1.00 0.44 N ATOM 800 CA LYS A 53 25.082 -10.787 -14.787 1.00 0.49 C ATOM 801 C LYS A 53 24.713 -11.760 -13.679 1.00 0.41 C ATOM 802 O LYS A 53 25.448 -11.910 -12.699 1.00 0.38 O ATOM 803 CB LYS A 53 26.171 -11.389 -15.682 1.00 0.60 C ATOM 804 CG LYS A 53 26.241 -10.742 -17.054 1.00 0.84 C ATOM 805 CD LYS A 53 24.935 -10.926 -17.812 1.00 1.47 C ATOM 806 CE LYS A 53 24.957 -10.231 -19.160 1.00 2.09 C ATOM 807 NZ LYS A 53 23.647 -10.344 -19.847 1.00 2.89 N ATOM 0 H LYS A 53 26.499 -9.449 -14.021 1.00 0.44 H new ATOM 0 HA LYS A 53 24.198 -10.607 -15.398 1.00 0.49 H new ATOM 0 HB2 LYS A 53 27.137 -11.285 -15.188 1.00 0.60 H new ATOM 0 HB3 LYS A 53 25.987 -12.457 -15.800 1.00 0.60 H new ATOM 0 HG2 LYS A 53 26.457 -9.679 -16.948 1.00 0.84 H new ATOM 0 HG3 LYS A 53 27.061 -11.179 -17.624 1.00 0.84 H new ATOM 0 HD2 LYS A 53 24.746 -11.990 -17.956 1.00 1.47 H new ATOM 0 HD3 LYS A 53 24.111 -10.534 -17.215 1.00 1.47 H new ATOM 0 HE2 LYS A 53 25.210 -9.179 -19.025 1.00 2.09 H new ATOM 0 HE3 LYS A 53 25.736 -10.668 -19.784 1.00 2.09 H new ATOM 0 HZ1 LYS A 53 23.694 -9.859 -20.766 1.00 2.89 H new ATOM 0 HZ2 LYS A 53 23.419 -11.348 -19.996 1.00 2.89 H new ATOM 0 HZ3 LYS A 53 22.909 -9.905 -19.261 1.00 2.89 H new ATOM 821 N VAL A 54 23.570 -12.407 -13.847 1.00 0.44 N ATOM 822 CA VAL A 54 23.067 -13.360 -12.874 1.00 0.44 C ATOM 823 C VAL A 54 23.847 -14.674 -12.978 1.00 0.46 C ATOM 824 O VAL A 54 24.590 -14.880 -13.939 1.00 0.51 O ATOM 825 CB VAL A 54 21.550 -13.602 -13.084 1.00 0.52 C ATOM 826 CG1 VAL A 54 21.288 -14.428 -14.338 1.00 0.59 C ATOM 827 CG2 VAL A 54 20.916 -14.244 -11.858 1.00 0.57 C ATOM 0 H VAL A 54 22.967 -12.285 -14.661 1.00 0.44 H new ATOM 0 HA VAL A 54 23.208 -12.950 -11.874 1.00 0.44 H new ATOM 0 HB VAL A 54 21.080 -12.629 -13.226 1.00 0.52 H new ATOM 0 HG11 VAL A 54 20.215 -14.580 -14.456 1.00 0.59 H new ATOM 0 HG12 VAL A 54 21.678 -13.901 -15.209 1.00 0.59 H new ATOM 0 HG13 VAL A 54 21.783 -15.395 -14.247 1.00 0.59 H new ATOM 0 HG21 VAL A 54 19.852 -14.400 -12.038 1.00 0.57 H new ATOM 0 HG22 VAL A 54 21.395 -15.203 -11.661 1.00 0.57 H new ATOM 0 HG23 VAL A 54 21.046 -13.589 -10.996 1.00 0.57 H new ATOM 837 N PHE A 55 23.694 -15.546 -11.988 1.00 0.48 N ATOM 838 CA PHE A 55 24.373 -16.832 -12.002 1.00 0.54 C ATOM 839 C PHE A 55 23.738 -17.760 -13.023 1.00 0.61 C ATOM 840 O PHE A 55 22.553 -18.089 -12.943 1.00 0.78 O ATOM 841 CB PHE A 55 24.346 -17.475 -10.614 1.00 0.59 C ATOM 842 CG PHE A 55 25.637 -17.331 -9.853 1.00 0.47 C ATOM 843 CD1 PHE A 55 26.387 -16.168 -9.930 1.00 0.52 C ATOM 844 CD2 PHE A 55 26.099 -18.368 -9.058 1.00 0.58 C ATOM 845 CE1 PHE A 55 27.575 -16.043 -9.230 1.00 0.46 C ATOM 846 CE2 PHE A 55 27.284 -18.250 -8.355 1.00 0.70 C ATOM 847 CZ PHE A 55 28.022 -17.087 -8.442 1.00 0.56 C ATOM 0 H PHE A 55 23.108 -15.385 -11.169 1.00 0.48 H new ATOM 0 HA PHE A 55 25.412 -16.663 -12.284 1.00 0.54 H new ATOM 0 HB2 PHE A 55 23.540 -17.028 -10.032 1.00 0.59 H new ATOM 0 HB3 PHE A 55 24.113 -18.535 -10.719 1.00 0.59 H new ATOM 0 HD1 PHE A 55 26.041 -15.349 -10.543 1.00 0.52 H new ATOM 0 HD2 PHE A 55 25.526 -19.281 -8.987 1.00 0.58 H new ATOM 0 HE1 PHE A 55 28.151 -15.132 -9.299 1.00 0.46 H new ATOM 0 HE2 PHE A 55 27.631 -19.066 -7.739 1.00 0.70 H new ATOM 0 HZ PHE A 55 28.948 -16.993 -7.895 1.00 0.56 H new ATOM 857 N ASP A 56 24.535 -18.145 -14.002 1.00 0.61 N ATOM 858 CA ASP A 56 24.096 -19.047 -15.052 1.00 0.71 C ATOM 859 C ASP A 56 25.189 -20.064 -15.334 1.00 0.70 C ATOM 860 O ASP A 56 26.145 -19.772 -16.056 1.00 0.87 O ATOM 861 CB ASP A 56 23.769 -18.261 -16.326 1.00 0.91 C ATOM 862 CG ASP A 56 23.152 -19.128 -17.406 1.00 1.59 C ATOM 863 OD1 ASP A 56 23.903 -19.776 -18.166 1.00 2.14 O ATOM 864 OD2 ASP A 56 21.907 -19.161 -17.505 1.00 2.18 O ATOM 0 H ASP A 56 25.505 -17.842 -14.092 1.00 0.61 H new ATOM 0 HA ASP A 56 23.195 -19.565 -14.724 1.00 0.71 H new ATOM 0 HB2 ASP A 56 23.084 -17.449 -16.082 1.00 0.91 H new ATOM 0 HB3 ASP A 56 24.681 -17.803 -16.710 1.00 0.91 H new ATOM 869 N SER A 57 25.096 -21.226 -14.705 1.00 0.61 N ATOM 870 CA SER A 57 26.068 -22.279 -14.907 1.00 0.67 C ATOM 871 C SER A 57 25.370 -23.627 -15.031 1.00 0.68 C ATOM 872 O SER A 57 24.167 -23.740 -14.799 1.00 0.75 O ATOM 873 CB SER A 57 27.069 -22.299 -13.747 1.00 0.75 C ATOM 874 OG SER A 57 27.704 -21.041 -13.606 1.00 1.24 O ATOM 0 H SER A 57 24.352 -21.460 -14.048 1.00 0.61 H new ATOM 0 HA SER A 57 26.609 -22.085 -15.833 1.00 0.67 H new ATOM 0 HB2 SER A 57 26.554 -22.557 -12.821 1.00 0.75 H new ATOM 0 HB3 SER A 57 27.818 -23.072 -13.921 1.00 0.75 H new ATOM 0 HG SER A 57 28.337 -21.076 -12.859 1.00 1.24 H new ATOM 880 N SER A 58 26.129 -24.644 -15.397 1.00 0.75 N ATOM 881 CA SER A 58 25.599 -25.993 -15.506 1.00 0.82 C ATOM 882 C SER A 58 25.284 -26.569 -14.124 1.00 0.70 C ATOM 883 O SER A 58 24.327 -27.330 -13.958 1.00 0.70 O ATOM 884 CB SER A 58 26.609 -26.875 -16.239 1.00 1.03 C ATOM 885 OG SER A 58 27.923 -26.649 -15.749 1.00 1.49 O ATOM 0 H SER A 58 27.120 -24.561 -15.625 1.00 0.75 H new ATOM 0 HA SER A 58 24.668 -25.964 -16.072 1.00 0.82 H new ATOM 0 HB2 SER A 58 26.343 -27.924 -16.111 1.00 1.03 H new ATOM 0 HB3 SER A 58 26.573 -26.666 -17.308 1.00 1.03 H new ATOM 0 HG SER A 58 28.031 -27.096 -14.883 1.00 1.49 H new ATOM 891 N PHE A 59 26.086 -26.191 -13.135 1.00 0.69 N ATOM 892 CA PHE A 59 25.945 -26.734 -11.788 1.00 0.70 C ATOM 893 C PHE A 59 25.040 -25.879 -10.904 1.00 0.64 C ATOM 894 O PHE A 59 24.284 -26.418 -10.107 1.00 0.67 O ATOM 895 CB PHE A 59 27.317 -26.894 -11.123 1.00 0.85 C ATOM 896 CG PHE A 59 28.122 -28.053 -11.648 1.00 1.08 C ATOM 897 CD1 PHE A 59 28.952 -27.893 -12.748 1.00 1.39 C ATOM 898 CD2 PHE A 59 28.043 -29.299 -11.050 1.00 1.28 C ATOM 899 CE1 PHE A 59 29.689 -28.953 -13.238 1.00 1.77 C ATOM 900 CE2 PHE A 59 28.777 -30.365 -11.536 1.00 1.58 C ATOM 901 CZ PHE A 59 29.614 -30.195 -12.605 1.00 1.80 C ATOM 0 H PHE A 59 26.840 -25.512 -13.240 1.00 0.69 H new ATOM 0 HA PHE A 59 25.474 -27.711 -11.894 1.00 0.70 H new ATOM 0 HB2 PHE A 59 27.887 -25.976 -11.264 1.00 0.85 H new ATOM 0 HB3 PHE A 59 27.176 -27.020 -10.049 1.00 0.85 H new ATOM 0 HD1 PHE A 59 29.023 -26.928 -13.227 1.00 1.39 H new ATOM 0 HD2 PHE A 59 27.400 -29.440 -10.194 1.00 1.28 H new ATOM 0 HE1 PHE A 59 30.319 -28.822 -14.105 1.00 1.77 H new ATOM 0 HE2 PHE A 59 28.689 -31.335 -11.070 1.00 1.58 H new ATOM 0 HZ PHE A 59 30.215 -31.020 -12.958 1.00 1.80 H new ATOM 911 N ASP A 60 25.089 -24.559 -11.067 1.00 0.66 N ATOM 912 CA ASP A 60 24.397 -23.642 -10.149 1.00 0.72 C ATOM 913 C ASP A 60 22.884 -23.866 -10.166 1.00 0.71 C ATOM 914 O ASP A 60 22.213 -23.715 -9.146 1.00 0.86 O ATOM 915 CB ASP A 60 24.706 -22.176 -10.493 1.00 0.83 C ATOM 916 CG ASP A 60 23.688 -21.557 -11.435 1.00 1.54 C ATOM 917 OD1 ASP A 60 23.689 -21.913 -12.631 1.00 1.89 O ATOM 918 OD2 ASP A 60 22.877 -20.728 -10.976 1.00 2.19 O ATOM 0 H ASP A 60 25.597 -24.097 -11.821 1.00 0.66 H new ATOM 0 HA ASP A 60 24.768 -23.856 -9.147 1.00 0.72 H new ATOM 0 HB2 ASP A 60 24.742 -21.593 -9.573 1.00 0.83 H new ATOM 0 HB3 ASP A 60 25.695 -22.116 -10.947 1.00 0.83 H new ATOM 923 N ARG A 61 22.355 -24.229 -11.325 1.00 0.68 N ATOM 924 CA ARG A 61 20.920 -24.441 -11.472 1.00 0.80 C ATOM 925 C ARG A 61 20.536 -25.858 -11.073 1.00 0.75 C ATOM 926 O ARG A 61 19.355 -26.176 -10.913 1.00 0.92 O ATOM 927 CB ARG A 61 20.499 -24.192 -12.919 1.00 0.97 C ATOM 928 CG ARG A 61 21.017 -25.243 -13.889 1.00 1.23 C ATOM 929 CD ARG A 61 20.635 -24.912 -15.315 1.00 1.65 C ATOM 930 NE ARG A 61 21.312 -23.706 -15.782 1.00 1.75 N ATOM 931 CZ ARG A 61 21.413 -23.350 -17.060 1.00 2.15 C ATOM 932 NH1 ARG A 61 20.836 -24.089 -18.005 1.00 2.58 N ATOM 933 NH2 ARG A 61 22.080 -22.250 -17.384 1.00 2.78 N ATOM 0 H ARG A 61 22.895 -24.383 -12.176 1.00 0.68 H new ATOM 0 HA ARG A 61 20.406 -23.740 -10.814 1.00 0.80 H new ATOM 0 HB2 ARG A 61 19.411 -24.164 -12.973 1.00 0.97 H new ATOM 0 HB3 ARG A 61 20.859 -23.212 -13.231 1.00 0.97 H new ATOM 0 HG2 ARG A 61 22.102 -25.312 -13.808 1.00 1.23 H new ATOM 0 HG3 ARG A 61 20.614 -26.219 -13.620 1.00 1.23 H new ATOM 0 HD2 ARG A 61 20.890 -25.749 -15.965 1.00 1.65 H new ATOM 0 HD3 ARG A 61 19.556 -24.774 -15.381 1.00 1.65 H new ATOM 0 HE ARG A 61 21.735 -23.096 -15.083 1.00 1.75 H new ATOM 0 HH11 ARG A 61 20.316 -24.929 -17.749 1.00 2.58 H new ATOM 0 HH12 ARG A 61 20.914 -23.816 -18.985 1.00 2.58 H new ATOM 0 HH21 ARG A 61 22.512 -21.682 -16.655 1.00 2.78 H new ATOM 0 HH22 ARG A 61 22.161 -21.972 -18.362 1.00 2.78 H new ATOM 947 N ASN A 62 21.535 -26.709 -10.914 1.00 0.64 N ATOM 948 CA ASN A 62 21.284 -28.129 -10.691 1.00 0.68 C ATOM 949 C ASN A 62 21.687 -28.563 -9.280 1.00 0.73 C ATOM 950 O ASN A 62 20.848 -29.010 -8.499 1.00 0.89 O ATOM 951 CB ASN A 62 22.028 -28.961 -11.739 1.00 0.71 C ATOM 952 CG ASN A 62 21.518 -30.386 -11.818 1.00 0.83 C ATOM 953 OD1 ASN A 62 22.168 -31.295 -11.114 1.00 0.93 O flip ATOM 954 ND2 ASN A 62 20.551 -30.669 -12.528 1.00 1.10 N flip ATOM 0 H ASN A 62 22.521 -26.448 -10.934 1.00 0.64 H new ATOM 0 HA ASN A 62 20.212 -28.299 -10.790 1.00 0.68 H new ATOM 0 HB2 ASN A 62 21.924 -28.487 -12.715 1.00 0.71 H new ATOM 0 HB3 ASN A 62 23.092 -28.972 -11.501 1.00 0.71 H new ATOM 0 HD21 ASN A 62 20.075 -29.938 -13.057 1.00 1.10 H new ATOM 0 HD22 ASN A 62 20.227 -31.634 -12.587 1.00 1.10 H new ATOM 961 N VAL A 63 22.965 -28.417 -8.956 1.00 0.68 N ATOM 962 CA VAL A 63 23.488 -28.837 -7.658 1.00 0.83 C ATOM 963 C VAL A 63 24.069 -27.639 -6.908 1.00 0.62 C ATOM 964 O VAL A 63 25.150 -27.155 -7.240 1.00 0.64 O ATOM 965 CB VAL A 63 24.576 -29.930 -7.799 1.00 1.16 C ATOM 966 CG1 VAL A 63 25.164 -30.293 -6.439 1.00 1.76 C ATOM 967 CG2 VAL A 63 24.004 -31.166 -8.479 1.00 2.03 C ATOM 0 H VAL A 63 23.664 -28.009 -9.577 1.00 0.68 H new ATOM 0 HA VAL A 63 22.654 -29.258 -7.096 1.00 0.83 H new ATOM 0 HB VAL A 63 25.379 -29.531 -8.420 1.00 1.16 H new ATOM 0 HG11 VAL A 63 25.926 -31.063 -6.566 1.00 1.76 H new ATOM 0 HG12 VAL A 63 25.614 -29.408 -5.989 1.00 1.76 H new ATOM 0 HG13 VAL A 63 24.373 -30.668 -5.789 1.00 1.76 H new ATOM 0 HG21 VAL A 63 24.782 -31.924 -8.570 1.00 2.03 H new ATOM 0 HG22 VAL A 63 23.181 -31.561 -7.884 1.00 2.03 H new ATOM 0 HG23 VAL A 63 23.639 -30.900 -9.471 1.00 2.03 H new ATOM 977 N PRO A 64 23.340 -27.131 -5.904 1.00 0.91 N ATOM 978 CA PRO A 64 23.782 -25.996 -5.089 1.00 1.03 C ATOM 979 C PRO A 64 24.909 -26.380 -4.137 1.00 0.81 C ATOM 980 O PRO A 64 24.974 -27.517 -3.660 1.00 0.86 O ATOM 981 CB PRO A 64 22.526 -25.600 -4.294 1.00 1.53 C ATOM 982 CG PRO A 64 21.402 -26.371 -4.906 1.00 1.76 C ATOM 983 CD PRO A 64 22.019 -27.610 -5.485 1.00 1.40 C ATOM 0 HA PRO A 64 24.180 -25.188 -5.704 1.00 1.03 H new ATOM 0 HB2 PRO A 64 22.638 -25.843 -3.237 1.00 1.53 H new ATOM 0 HB3 PRO A 64 22.345 -24.527 -4.357 1.00 1.53 H new ATOM 0 HG2 PRO A 64 20.649 -26.622 -4.159 1.00 1.76 H new ATOM 0 HG3 PRO A 64 20.902 -25.786 -5.678 1.00 1.76 H new ATOM 0 HD2 PRO A 64 22.091 -28.411 -4.749 1.00 1.40 H new ATOM 0 HD3 PRO A 64 21.442 -27.999 -6.324 1.00 1.40 H new ATOM 991 N PHE A 65 25.794 -25.434 -3.864 1.00 0.68 N ATOM 992 CA PHE A 65 26.915 -25.682 -2.976 1.00 0.53 C ATOM 993 C PHE A 65 26.633 -25.079 -1.600 1.00 0.47 C ATOM 994 O PHE A 65 25.888 -24.102 -1.481 1.00 0.54 O ATOM 995 CB PHE A 65 28.200 -25.091 -3.567 1.00 0.62 C ATOM 996 CG PHE A 65 29.454 -25.694 -3.003 1.00 0.72 C ATOM 997 CD1 PHE A 65 30.003 -26.829 -3.577 1.00 1.06 C ATOM 998 CD2 PHE A 65 30.084 -25.132 -1.904 1.00 0.71 C ATOM 999 CE1 PHE A 65 31.155 -27.392 -3.065 1.00 1.31 C ATOM 1000 CE2 PHE A 65 31.235 -25.691 -1.387 1.00 0.95 C ATOM 1001 CZ PHE A 65 31.771 -26.822 -1.968 1.00 1.24 C ATOM 0 H PHE A 65 25.756 -24.489 -4.245 1.00 0.68 H new ATOM 0 HA PHE A 65 27.049 -26.758 -2.866 1.00 0.53 H new ATOM 0 HB2 PHE A 65 28.192 -25.234 -4.648 1.00 0.62 H new ATOM 0 HB3 PHE A 65 28.211 -24.016 -3.388 1.00 0.62 H new ATOM 0 HD1 PHE A 65 29.525 -27.278 -4.435 1.00 1.06 H new ATOM 0 HD2 PHE A 65 29.669 -24.246 -1.447 1.00 0.71 H new ATOM 0 HE1 PHE A 65 31.574 -28.277 -3.522 1.00 1.31 H new ATOM 0 HE2 PHE A 65 31.715 -25.244 -0.529 1.00 0.95 H new ATOM 0 HZ PHE A 65 32.672 -27.261 -1.565 1.00 1.24 H new ATOM 1011 N LYS A 66 27.195 -25.687 -0.568 1.00 0.41 N ATOM 1012 CA LYS A 66 27.049 -25.198 0.793 1.00 0.39 C ATOM 1013 C LYS A 66 28.336 -25.451 1.574 1.00 0.38 C ATOM 1014 O LYS A 66 29.025 -26.446 1.337 1.00 0.48 O ATOM 1015 CB LYS A 66 25.841 -25.871 1.460 1.00 0.45 C ATOM 1016 CG LYS A 66 25.878 -27.390 1.410 1.00 0.60 C ATOM 1017 CD LYS A 66 26.483 -27.986 2.671 1.00 0.67 C ATOM 1018 CE LYS A 66 26.901 -29.435 2.458 1.00 0.93 C ATOM 1019 NZ LYS A 66 25.785 -30.271 1.939 1.00 1.36 N ATOM 0 H LYS A 66 27.763 -26.530 -0.650 1.00 0.41 H new ATOM 0 HA LYS A 66 26.870 -24.123 0.782 1.00 0.39 H new ATOM 0 HB2 LYS A 66 25.789 -25.553 2.501 1.00 0.45 H new ATOM 0 HB3 LYS A 66 24.929 -25.523 0.974 1.00 0.45 H new ATOM 0 HG2 LYS A 66 24.866 -27.773 1.277 1.00 0.60 H new ATOM 0 HG3 LYS A 66 26.457 -27.710 0.544 1.00 0.60 H new ATOM 0 HD2 LYS A 66 27.349 -27.397 2.974 1.00 0.67 H new ATOM 0 HD3 LYS A 66 25.759 -27.931 3.484 1.00 0.67 H new ATOM 0 HE2 LYS A 66 27.736 -29.471 1.758 1.00 0.93 H new ATOM 0 HE3 LYS A 66 27.257 -29.851 3.401 1.00 0.93 H new ATOM 0 HZ1 LYS A 66 26.046 -31.276 2.001 1.00 1.36 H new ATOM 0 HZ2 LYS A 66 24.930 -30.100 2.506 1.00 1.36 H new ATOM 0 HZ3 LYS A 66 25.597 -30.022 0.947 1.00 1.36 H new ATOM 1033 N PHE A 67 28.664 -24.554 2.492 1.00 0.39 N ATOM 1034 CA PHE A 67 29.920 -24.650 3.225 1.00 0.42 C ATOM 1035 C PHE A 67 29.688 -24.588 4.731 1.00 0.42 C ATOM 1036 O PHE A 67 28.551 -24.523 5.192 1.00 0.46 O ATOM 1037 CB PHE A 67 30.876 -23.528 2.788 1.00 0.46 C ATOM 1038 CG PHE A 67 30.311 -22.141 2.959 1.00 0.45 C ATOM 1039 CD1 PHE A 67 30.412 -21.480 4.173 1.00 0.43 C ATOM 1040 CD2 PHE A 67 29.674 -21.502 1.906 1.00 0.55 C ATOM 1041 CE1 PHE A 67 29.893 -20.209 4.332 1.00 0.46 C ATOM 1042 CE2 PHE A 67 29.155 -20.232 2.060 1.00 0.57 C ATOM 1043 CZ PHE A 67 29.261 -19.585 3.274 1.00 0.51 C ATOM 0 H PHE A 67 28.083 -23.756 2.747 1.00 0.39 H new ATOM 0 HA PHE A 67 30.372 -25.614 2.994 1.00 0.42 H new ATOM 0 HB2 PHE A 67 31.799 -23.607 3.362 1.00 0.46 H new ATOM 0 HB3 PHE A 67 31.139 -23.676 1.741 1.00 0.46 H new ATOM 0 HD1 PHE A 67 30.902 -21.964 5.005 1.00 0.43 H new ATOM 0 HD2 PHE A 67 29.583 -22.004 0.954 1.00 0.55 H new ATOM 0 HE1 PHE A 67 29.981 -19.704 5.283 1.00 0.46 H new ATOM 0 HE2 PHE A 67 28.666 -19.745 1.230 1.00 0.57 H new ATOM 0 HZ PHE A 67 28.851 -18.593 3.397 1.00 0.51 H new ATOM 1053 N HIS A 68 30.781 -24.612 5.490 1.00 0.42 N ATOM 1054 CA HIS A 68 30.717 -24.528 6.946 1.00 0.44 C ATOM 1055 C HIS A 68 31.455 -23.279 7.413 1.00 0.42 C ATOM 1056 O HIS A 68 32.385 -22.820 6.752 1.00 0.44 O ATOM 1057 CB HIS A 68 31.303 -25.787 7.608 1.00 0.53 C ATOM 1058 CG HIS A 68 30.446 -27.016 7.460 1.00 0.89 C ATOM 1059 ND1 HIS A 68 30.283 -27.951 8.459 1.00 1.68 N ATOM 1060 CD2 HIS A 68 29.709 -27.464 6.415 1.00 1.56 C ATOM 1061 CE1 HIS A 68 29.486 -28.914 8.033 1.00 1.98 C ATOM 1062 NE2 HIS A 68 29.124 -28.646 6.793 1.00 1.87 N ATOM 0 H HIS A 68 31.727 -24.689 5.117 1.00 0.42 H new ATOM 0 HA HIS A 68 29.671 -24.463 7.246 1.00 0.44 H new ATOM 0 HB2 HIS A 68 32.284 -25.987 7.177 1.00 0.53 H new ATOM 0 HB3 HIS A 68 31.455 -25.589 8.669 1.00 0.53 H new ATOM 0 HD2 HIS A 68 29.601 -26.978 5.457 1.00 1.56 H new ATOM 0 HE1 HIS A 68 29.181 -29.778 8.605 1.00 1.98 H new ATOM 0 HE2 HIS A 68 28.512 -29.221 6.213 1.00 1.87 H new ATOM 1071 N LEU A 69 31.022 -22.711 8.520 1.00 0.44 N ATOM 1072 CA LEU A 69 31.577 -21.448 8.986 1.00 0.47 C ATOM 1073 C LEU A 69 32.958 -21.627 9.619 1.00 0.49 C ATOM 1074 O LEU A 69 33.106 -22.319 10.628 1.00 0.58 O ATOM 1075 CB LEU A 69 30.611 -20.784 9.973 1.00 0.59 C ATOM 1076 CG LEU A 69 31.063 -19.442 10.550 1.00 0.71 C ATOM 1077 CD1 LEU A 69 31.567 -18.513 9.456 1.00 0.74 C ATOM 1078 CD2 LEU A 69 29.910 -18.800 11.303 1.00 0.95 C ATOM 0 H LEU A 69 30.290 -23.099 9.115 1.00 0.44 H new ATOM 0 HA LEU A 69 31.705 -20.800 8.119 1.00 0.47 H new ATOM 0 HB2 LEU A 69 29.654 -20.638 9.472 1.00 0.59 H new ATOM 0 HB3 LEU A 69 30.437 -21.473 10.800 1.00 0.59 H new ATOM 0 HG LEU A 69 31.890 -19.620 11.237 1.00 0.71 H new ATOM 0 HD11 LEU A 69 31.881 -17.567 9.898 1.00 0.74 H new ATOM 0 HD12 LEU A 69 32.413 -18.975 8.948 1.00 0.74 H new ATOM 0 HD13 LEU A 69 30.768 -18.330 8.737 1.00 0.74 H new ATOM 0 HD21 LEU A 69 30.232 -17.843 11.714 1.00 0.95 H new ATOM 0 HD22 LEU A 69 29.075 -18.639 10.621 1.00 0.95 H new ATOM 0 HD23 LEU A 69 29.595 -19.456 12.114 1.00 0.95 H new ATOM 1090 N GLU A 70 33.957 -21.000 8.991 1.00 0.59 N ATOM 1091 CA GLU A 70 35.331 -20.964 9.497 1.00 0.69 C ATOM 1092 C GLU A 70 36.004 -22.332 9.449 1.00 0.69 C ATOM 1093 O GLU A 70 36.616 -22.775 10.421 1.00 0.96 O ATOM 1094 CB GLU A 70 35.370 -20.380 10.910 1.00 0.95 C ATOM 1095 CG GLU A 70 35.932 -18.965 10.960 1.00 1.12 C ATOM 1096 CD GLU A 70 37.443 -18.941 11.018 1.00 1.47 C ATOM 1097 OE1 GLU A 70 38.095 -19.342 10.034 1.00 1.79 O ATOM 1098 OE2 GLU A 70 37.989 -18.534 12.070 1.00 2.08 O ATOM 0 H GLU A 70 33.833 -20.500 8.111 1.00 0.59 H new ATOM 0 HA GLU A 70 35.901 -20.312 8.836 1.00 0.69 H new ATOM 0 HB2 GLU A 70 34.361 -20.378 11.323 1.00 0.95 H new ATOM 0 HB3 GLU A 70 35.974 -21.026 11.547 1.00 0.95 H new ATOM 0 HG2 GLU A 70 35.597 -18.414 10.081 1.00 1.12 H new ATOM 0 HG3 GLU A 70 35.530 -18.449 11.832 1.00 1.12 H new ATOM 1105 N GLN A 71 35.907 -22.990 8.300 1.00 0.68 N ATOM 1106 CA GLN A 71 36.671 -24.206 8.063 1.00 0.86 C ATOM 1107 C GLN A 71 37.994 -23.842 7.386 1.00 0.83 C ATOM 1108 O GLN A 71 38.814 -24.711 7.076 1.00 0.96 O ATOM 1109 CB GLN A 71 35.895 -25.204 7.191 1.00 1.05 C ATOM 1110 CG GLN A 71 35.905 -24.861 5.709 1.00 0.96 C ATOM 1111 CD GLN A 71 34.967 -23.733 5.348 1.00 1.14 C ATOM 1112 OE1 GLN A 71 35.296 -22.555 5.505 1.00 1.98 O ATOM 1113 NE2 GLN A 71 33.818 -24.085 4.800 1.00 0.97 N ATOM 0 H GLN A 71 35.311 -22.704 7.523 1.00 0.68 H new ATOM 0 HA GLN A 71 36.859 -24.686 9.023 1.00 0.86 H new ATOM 0 HB2 GLN A 71 36.320 -26.198 7.327 1.00 1.05 H new ATOM 0 HB3 GLN A 71 34.862 -25.249 7.537 1.00 1.05 H new ATOM 0 HG2 GLN A 71 36.918 -24.590 5.413 1.00 0.96 H new ATOM 0 HG3 GLN A 71 35.632 -25.748 5.137 1.00 0.96 H new ATOM 0 HE21 GLN A 71 33.587 -25.072 4.690 1.00 0.97 H new ATOM 0 HE22 GLN A 71 33.162 -23.370 4.487 1.00 0.97 H new ATOM 1122 N GLY A 72 38.186 -22.543 7.169 1.00 0.72 N ATOM 1123 CA GLY A 72 39.381 -22.056 6.509 1.00 0.72 C ATOM 1124 C GLY A 72 39.138 -21.639 5.067 1.00 0.67 C ATOM 1125 O GLY A 72 40.068 -21.223 4.376 1.00 0.70 O ATOM 0 H GLY A 72 37.527 -21.814 7.443 1.00 0.72 H new ATOM 0 HA2 GLY A 72 39.775 -21.206 7.065 1.00 0.72 H new ATOM 0 HA3 GLY A 72 40.144 -22.834 6.532 1.00 0.72 H new ATOM 1129 N GLU A 73 37.893 -21.738 4.601 1.00 0.63 N ATOM 1130 CA GLU A 73 37.574 -21.346 3.227 1.00 0.62 C ATOM 1131 C GLU A 73 36.972 -19.943 3.177 1.00 0.57 C ATOM 1132 O GLU A 73 37.038 -19.266 2.155 1.00 0.66 O ATOM 1133 CB GLU A 73 36.607 -22.341 2.581 1.00 0.67 C ATOM 1134 CG GLU A 73 37.083 -23.785 2.621 1.00 0.73 C ATOM 1135 CD GLU A 73 38.406 -23.999 1.919 1.00 0.81 C ATOM 1136 OE1 GLU A 73 39.463 -23.823 2.558 1.00 0.92 O ATOM 1137 OE2 GLU A 73 38.399 -24.301 0.710 1.00 0.97 O ATOM 0 H GLU A 73 37.100 -22.080 5.144 1.00 0.63 H new ATOM 0 HA GLU A 73 38.509 -21.347 2.667 1.00 0.62 H new ATOM 0 HB2 GLU A 73 35.643 -22.273 3.085 1.00 0.67 H new ATOM 0 HB3 GLU A 73 36.445 -22.052 1.543 1.00 0.67 H new ATOM 0 HG2 GLU A 73 37.176 -24.101 3.660 1.00 0.73 H new ATOM 0 HG3 GLU A 73 36.328 -24.422 2.160 1.00 0.73 H new ATOM 1144 N VAL A 74 36.378 -19.505 4.276 1.00 0.50 N ATOM 1145 CA VAL A 74 35.750 -18.190 4.313 1.00 0.45 C ATOM 1146 C VAL A 74 36.621 -17.190 5.075 1.00 0.41 C ATOM 1147 O VAL A 74 36.999 -17.423 6.224 1.00 0.46 O ATOM 1148 CB VAL A 74 34.334 -18.253 4.934 1.00 0.50 C ATOM 1149 CG1 VAL A 74 33.405 -19.074 4.053 1.00 0.58 C ATOM 1150 CG2 VAL A 74 34.376 -18.830 6.341 1.00 0.55 C ATOM 0 H VAL A 74 36.317 -20.033 5.147 1.00 0.50 H new ATOM 0 HA VAL A 74 35.650 -17.849 3.282 1.00 0.45 H new ATOM 0 HB VAL A 74 33.949 -17.235 4.999 1.00 0.50 H new ATOM 0 HG11 VAL A 74 32.413 -19.109 4.503 1.00 0.58 H new ATOM 0 HG12 VAL A 74 33.340 -18.615 3.066 1.00 0.58 H new ATOM 0 HG13 VAL A 74 33.796 -20.087 3.957 1.00 0.58 H new ATOM 0 HG21 VAL A 74 33.367 -18.862 6.751 1.00 0.55 H new ATOM 0 HG22 VAL A 74 34.786 -19.839 6.308 1.00 0.55 H new ATOM 0 HG23 VAL A 74 35.005 -18.203 6.973 1.00 0.55 H new ATOM 1160 N ILE A 75 36.968 -16.090 4.417 1.00 0.38 N ATOM 1161 CA ILE A 75 37.834 -15.080 5.022 1.00 0.40 C ATOM 1162 C ILE A 75 37.039 -13.920 5.626 1.00 0.39 C ATOM 1163 O ILE A 75 37.083 -13.698 6.832 1.00 0.47 O ATOM 1164 CB ILE A 75 38.908 -14.525 4.044 1.00 0.45 C ATOM 1165 CG1 ILE A 75 38.361 -14.339 2.614 1.00 0.46 C ATOM 1166 CG2 ILE A 75 40.137 -15.429 4.036 1.00 0.53 C ATOM 1167 CD1 ILE A 75 38.375 -15.596 1.765 1.00 0.62 C ATOM 0 H ILE A 75 36.665 -15.873 3.467 1.00 0.38 H new ATOM 0 HA ILE A 75 38.355 -15.604 5.823 1.00 0.40 H new ATOM 0 HB ILE A 75 39.194 -13.537 4.406 1.00 0.45 H new ATOM 0 HG12 ILE A 75 37.338 -13.969 2.676 1.00 0.46 H new ATOM 0 HG13 ILE A 75 38.948 -13.570 2.112 1.00 0.46 H new ATOM 0 HG21 ILE A 75 40.880 -15.027 3.347 1.00 0.53 H new ATOM 0 HG22 ILE A 75 40.561 -15.476 5.039 1.00 0.53 H new ATOM 0 HG23 ILE A 75 39.850 -16.431 3.716 1.00 0.53 H new ATOM 0 HD11 ILE A 75 37.973 -15.372 0.777 1.00 0.62 H new ATOM 0 HD12 ILE A 75 39.399 -15.958 1.667 1.00 0.62 H new ATOM 0 HD13 ILE A 75 37.763 -16.363 2.240 1.00 0.62 H new ATOM 1179 N LYS A 76 36.307 -13.184 4.796 1.00 0.33 N ATOM 1180 CA LYS A 76 35.642 -11.971 5.262 1.00 0.35 C ATOM 1181 C LYS A 76 34.164 -11.938 4.893 1.00 0.29 C ATOM 1182 O LYS A 76 33.310 -11.916 5.776 1.00 0.31 O ATOM 1183 CB LYS A 76 36.337 -10.725 4.697 1.00 0.48 C ATOM 1184 CG LYS A 76 37.731 -10.459 5.256 1.00 0.62 C ATOM 1185 CD LYS A 76 37.692 -9.635 6.541 1.00 0.98 C ATOM 1186 CE LYS A 76 37.258 -10.456 7.748 1.00 1.18 C ATOM 1187 NZ LYS A 76 37.173 -9.628 8.978 1.00 2.04 N ATOM 0 H LYS A 76 36.160 -13.401 3.810 1.00 0.33 H new ATOM 0 HA LYS A 76 35.714 -11.974 6.350 1.00 0.35 H new ATOM 0 HB2 LYS A 76 36.409 -10.826 3.614 1.00 0.48 H new ATOM 0 HB3 LYS A 76 35.710 -9.856 4.895 1.00 0.48 H new ATOM 0 HG2 LYS A 76 38.229 -11.409 5.451 1.00 0.62 H new ATOM 0 HG3 LYS A 76 38.326 -9.934 4.508 1.00 0.62 H new ATOM 0 HD2 LYS A 76 38.680 -9.214 6.729 1.00 0.98 H new ATOM 0 HD3 LYS A 76 37.007 -8.797 6.411 1.00 0.98 H new ATOM 0 HE2 LYS A 76 36.288 -10.910 7.548 1.00 1.18 H new ATOM 0 HE3 LYS A 76 37.965 -11.270 7.906 1.00 1.18 H new ATOM 0 HZ1 LYS A 76 36.612 -10.130 9.696 1.00 2.04 H new ATOM 0 HZ2 LYS A 76 38.130 -9.453 9.346 1.00 2.04 H new ATOM 0 HZ3 LYS A 76 36.717 -8.720 8.755 1.00 2.04 H new ATOM 1201 N GLY A 77 33.874 -11.948 3.594 1.00 0.29 N ATOM 1202 CA GLY A 77 32.515 -11.709 3.125 1.00 0.30 C ATOM 1203 C GLY A 77 31.483 -12.607 3.781 1.00 0.27 C ATOM 1204 O GLY A 77 30.497 -12.125 4.339 1.00 0.32 O ATOM 0 H GLY A 77 34.556 -12.118 2.855 1.00 0.29 H new ATOM 0 HA2 GLY A 77 32.252 -10.668 3.313 1.00 0.30 H new ATOM 0 HA3 GLY A 77 32.480 -11.857 2.046 1.00 0.30 H new ATOM 1208 N TRP A 78 31.715 -13.906 3.733 1.00 0.24 N ATOM 1209 CA TRP A 78 30.789 -14.860 4.324 1.00 0.26 C ATOM 1210 C TRP A 78 30.915 -14.861 5.841 1.00 0.29 C ATOM 1211 O TRP A 78 29.917 -14.973 6.549 1.00 0.30 O ATOM 1212 CB TRP A 78 31.047 -16.270 3.790 1.00 0.28 C ATOM 1213 CG TRP A 78 31.102 -16.342 2.293 1.00 0.29 C ATOM 1214 CD1 TRP A 78 30.050 -16.529 1.442 1.00 0.32 C ATOM 1215 CD2 TRP A 78 32.272 -16.231 1.471 1.00 0.34 C ATOM 1216 NE1 TRP A 78 30.495 -16.536 0.142 1.00 0.36 N ATOM 1217 CE2 TRP A 78 31.856 -16.360 0.134 1.00 0.37 C ATOM 1218 CE3 TRP A 78 33.634 -16.038 1.735 1.00 0.40 C ATOM 1219 CZ2 TRP A 78 32.746 -16.297 -0.935 1.00 0.43 C ATOM 1220 CZ3 TRP A 78 34.518 -15.978 0.673 1.00 0.48 C ATOM 1221 CH2 TRP A 78 34.070 -16.107 -0.647 1.00 0.49 C ATOM 0 H TRP A 78 32.534 -14.326 3.293 1.00 0.24 H new ATOM 0 HA TRP A 78 29.779 -14.556 4.049 1.00 0.26 H new ATOM 0 HB2 TRP A 78 31.988 -16.638 4.198 1.00 0.28 H new ATOM 0 HB3 TRP A 78 30.262 -16.935 4.149 1.00 0.28 H new ATOM 0 HD1 TRP A 78 29.021 -16.653 1.746 1.00 0.32 H new ATOM 0 HE1 TRP A 78 29.908 -16.653 -0.684 1.00 0.36 H new ATOM 0 HE3 TRP A 78 33.988 -15.938 2.750 1.00 0.40 H new ATOM 0 HZ2 TRP A 78 32.404 -16.395 -1.955 1.00 0.43 H new ATOM 0 HZ3 TRP A 78 35.570 -15.829 0.865 1.00 0.48 H new ATOM 0 HH2 TRP A 78 34.785 -16.055 -1.455 1.00 0.49 H new ATOM 1232 N ASP A 79 32.149 -14.708 6.318 1.00 0.35 N ATOM 1233 CA ASP A 79 32.473 -14.802 7.748 1.00 0.42 C ATOM 1234 C ASP A 79 31.591 -13.884 8.587 1.00 0.43 C ATOM 1235 O ASP A 79 30.963 -14.323 9.549 1.00 0.47 O ATOM 1236 CB ASP A 79 33.953 -14.454 7.965 1.00 0.52 C ATOM 1237 CG ASP A 79 34.365 -14.467 9.430 1.00 0.76 C ATOM 1238 OD1 ASP A 79 34.739 -15.543 9.942 1.00 1.14 O ATOM 1239 OD2 ASP A 79 34.301 -13.404 10.079 1.00 0.90 O ATOM 0 H ASP A 79 32.957 -14.515 5.726 1.00 0.35 H new ATOM 0 HA ASP A 79 32.284 -15.826 8.071 1.00 0.42 H new ATOM 0 HB2 ASP A 79 34.571 -15.164 7.415 1.00 0.52 H new ATOM 0 HB3 ASP A 79 34.152 -13.467 7.547 1.00 0.52 H new ATOM 1244 N ILE A 80 31.537 -12.619 8.210 1.00 0.45 N ATOM 1245 CA ILE A 80 30.739 -11.645 8.937 1.00 0.52 C ATOM 1246 C ILE A 80 29.250 -11.839 8.657 1.00 0.47 C ATOM 1247 O ILE A 80 28.420 -11.768 9.567 1.00 0.56 O ATOM 1248 CB ILE A 80 31.143 -10.191 8.582 1.00 0.63 C ATOM 1249 CG1 ILE A 80 32.484 -9.811 9.227 1.00 0.75 C ATOM 1250 CG2 ILE A 80 30.062 -9.212 9.009 1.00 0.78 C ATOM 1251 CD1 ILE A 80 33.690 -10.464 8.591 1.00 0.70 C ATOM 0 H ILE A 80 32.036 -12.241 7.405 1.00 0.45 H new ATOM 0 HA ILE A 80 30.931 -11.809 9.997 1.00 0.52 H new ATOM 0 HB ILE A 80 31.258 -10.137 7.499 1.00 0.63 H new ATOM 0 HG12 ILE A 80 32.604 -8.729 9.177 1.00 0.75 H new ATOM 0 HG13 ILE A 80 32.455 -10.080 10.283 1.00 0.75 H new ATOM 0 HG21 ILE A 80 30.367 -8.198 8.750 1.00 0.78 H new ATOM 0 HG22 ILE A 80 29.130 -9.453 8.497 1.00 0.78 H new ATOM 0 HG23 ILE A 80 29.913 -9.282 10.086 1.00 0.78 H new ATOM 0 HD11 ILE A 80 34.594 -10.141 9.108 1.00 0.70 H new ATOM 0 HD12 ILE A 80 33.598 -11.548 8.664 1.00 0.70 H new ATOM 0 HD13 ILE A 80 33.749 -10.175 7.542 1.00 0.70 H new ATOM 1263 N CYS A 81 28.917 -12.092 7.397 1.00 0.38 N ATOM 1264 CA CYS A 81 27.525 -12.177 6.983 1.00 0.40 C ATOM 1265 C CYS A 81 26.786 -13.286 7.724 1.00 0.35 C ATOM 1266 O CYS A 81 25.728 -13.041 8.305 1.00 0.42 O ATOM 1267 CB CYS A 81 27.413 -12.399 5.476 1.00 0.44 C ATOM 1268 SG CYS A 81 25.715 -12.315 4.859 1.00 0.55 S ATOM 0 H CYS A 81 29.592 -12.241 6.647 1.00 0.38 H new ATOM 0 HA CYS A 81 27.059 -11.225 7.236 1.00 0.40 H new ATOM 0 HB2 CYS A 81 28.016 -11.651 4.961 1.00 0.44 H new ATOM 0 HB3 CYS A 81 27.834 -13.374 5.228 1.00 0.44 H new ATOM 0 HG CYS A 81 25.399 -11.076 4.626 1.00 0.55 H new ATOM 1274 N VAL A 82 27.349 -14.493 7.729 1.00 0.30 N ATOM 1275 CA VAL A 82 26.659 -15.646 8.298 1.00 0.34 C ATOM 1276 C VAL A 82 26.506 -15.530 9.813 1.00 0.39 C ATOM 1277 O VAL A 82 25.436 -15.801 10.343 1.00 0.48 O ATOM 1278 CB VAL A 82 27.349 -16.985 7.947 1.00 0.36 C ATOM 1279 CG1 VAL A 82 27.322 -17.222 6.450 1.00 0.84 C ATOM 1280 CG2 VAL A 82 28.774 -17.020 8.458 1.00 0.73 C ATOM 0 H VAL A 82 28.273 -14.696 7.349 1.00 0.30 H new ATOM 0 HA VAL A 82 25.668 -15.646 7.844 1.00 0.34 H new ATOM 0 HB VAL A 82 26.794 -17.783 8.439 1.00 0.36 H new ATOM 0 HG11 VAL A 82 27.812 -18.169 6.223 1.00 0.84 H new ATOM 0 HG12 VAL A 82 26.288 -17.257 6.106 1.00 0.84 H new ATOM 0 HG13 VAL A 82 27.846 -16.411 5.944 1.00 0.84 H new ATOM 0 HG21 VAL A 82 29.231 -17.974 8.195 1.00 0.73 H new ATOM 0 HG22 VAL A 82 29.343 -16.208 8.005 1.00 0.73 H new ATOM 0 HG23 VAL A 82 28.775 -16.903 9.542 1.00 0.73 H new ATOM 1290 N SER A 83 27.560 -15.096 10.500 1.00 0.39 N ATOM 1291 CA SER A 83 27.545 -15.002 11.960 1.00 0.49 C ATOM 1292 C SER A 83 26.625 -13.878 12.439 1.00 0.48 C ATOM 1293 O SER A 83 26.266 -13.810 13.612 1.00 0.60 O ATOM 1294 CB SER A 83 28.963 -14.768 12.480 1.00 0.63 C ATOM 1295 OG SER A 83 29.848 -15.769 12.005 1.00 1.43 O ATOM 0 H SER A 83 28.437 -14.803 10.069 1.00 0.39 H new ATOM 0 HA SER A 83 27.161 -15.943 12.353 1.00 0.49 H new ATOM 0 HB2 SER A 83 29.314 -13.786 12.162 1.00 0.63 H new ATOM 0 HB3 SER A 83 28.959 -14.768 13.570 1.00 0.63 H new ATOM 0 HG SER A 83 30.309 -15.445 11.203 1.00 1.43 H new ATOM 1301 N SER A 84 26.246 -12.996 11.523 1.00 0.50 N ATOM 1302 CA SER A 84 25.381 -11.874 11.851 1.00 0.53 C ATOM 1303 C SER A 84 23.937 -12.177 11.458 1.00 0.51 C ATOM 1304 O SER A 84 23.140 -11.265 11.226 1.00 0.64 O ATOM 1305 CB SER A 84 25.883 -10.613 11.137 1.00 0.69 C ATOM 1306 OG SER A 84 25.085 -9.476 11.444 1.00 1.23 O ATOM 0 H SER A 84 26.526 -13.038 10.543 1.00 0.50 H new ATOM 0 HA SER A 84 25.408 -11.706 12.928 1.00 0.53 H new ATOM 0 HB2 SER A 84 26.916 -10.420 11.425 1.00 0.69 H new ATOM 0 HB3 SER A 84 25.878 -10.780 10.060 1.00 0.69 H new ATOM 0 HG SER A 84 24.143 -9.742 11.497 1.00 1.23 H new ATOM 1312 N MET A 85 23.601 -13.457 11.397 1.00 0.46 N ATOM 1313 CA MET A 85 22.254 -13.871 11.035 1.00 0.49 C ATOM 1314 C MET A 85 21.597 -14.653 12.162 1.00 0.49 C ATOM 1315 O MET A 85 22.146 -14.779 13.254 1.00 0.74 O ATOM 1316 CB MET A 85 22.263 -14.736 9.781 1.00 0.54 C ATOM 1317 CG MET A 85 22.786 -14.030 8.547 1.00 0.63 C ATOM 1318 SD MET A 85 22.646 -15.060 7.079 1.00 1.05 S ATOM 1319 CE MET A 85 23.319 -16.601 7.705 1.00 2.27 C ATOM 0 H MET A 85 24.242 -14.226 11.593 1.00 0.46 H new ATOM 0 HA MET A 85 21.684 -12.962 10.845 1.00 0.49 H new ATOM 0 HB2 MET A 85 22.873 -15.620 9.967 1.00 0.54 H new ATOM 0 HB3 MET A 85 21.249 -15.084 9.585 1.00 0.54 H new ATOM 0 HG2 MET A 85 22.231 -13.104 8.396 1.00 0.63 H new ATOM 0 HG3 MET A 85 23.830 -13.755 8.700 1.00 0.63 H new ATOM 0 HE1 MET A 85 24.355 -16.703 7.383 1.00 2.27 H new ATOM 0 HE2 MET A 85 23.275 -16.601 8.794 1.00 2.27 H new ATOM 0 HE3 MET A 85 22.735 -17.437 7.318 1.00 2.27 H new ATOM 1329 N ARG A 86 20.420 -15.182 11.868 1.00 0.45 N ATOM 1330 CA ARG A 86 19.679 -16.025 12.788 1.00 0.46 C ATOM 1331 C ARG A 86 18.998 -17.139 12.010 1.00 0.49 C ATOM 1332 O ARG A 86 19.040 -17.153 10.780 1.00 0.57 O ATOM 1333 CB ARG A 86 18.647 -15.208 13.570 1.00 0.49 C ATOM 1334 CG ARG A 86 19.255 -14.400 14.704 1.00 0.96 C ATOM 1335 CD ARG A 86 18.222 -13.571 15.440 1.00 1.24 C ATOM 1336 NE ARG A 86 17.912 -12.332 14.738 1.00 2.20 N ATOM 1337 CZ ARG A 86 17.314 -11.291 15.309 1.00 3.10 C ATOM 1338 NH1 ARG A 86 16.994 -11.336 16.597 1.00 3.34 N ATOM 1339 NH2 ARG A 86 17.059 -10.200 14.604 1.00 4.19 N ATOM 0 H ARG A 86 19.949 -15.036 10.975 1.00 0.45 H new ATOM 0 HA ARG A 86 20.373 -16.458 13.509 1.00 0.46 H new ATOM 0 HB2 ARG A 86 18.135 -14.532 12.885 1.00 0.49 H new ATOM 0 HB3 ARG A 86 17.893 -15.882 13.977 1.00 0.49 H new ATOM 0 HG2 ARG A 86 19.743 -15.075 15.407 1.00 0.96 H new ATOM 0 HG3 ARG A 86 20.027 -13.743 14.305 1.00 0.96 H new ATOM 0 HD2 ARG A 86 17.310 -14.155 15.563 1.00 1.24 H new ATOM 0 HD3 ARG A 86 18.589 -13.339 16.440 1.00 1.24 H new ATOM 0 HE ARG A 86 18.168 -12.260 13.753 1.00 2.20 H new ATOM 0 HH11 ARG A 86 17.207 -12.168 17.147 1.00 3.34 H new ATOM 0 HH12 ARG A 86 16.535 -10.538 17.037 1.00 3.34 H new ATOM 0 HH21 ARG A 86 17.321 -10.156 13.619 1.00 4.19 H new ATOM 0 HH22 ARG A 86 16.600 -9.403 15.045 1.00 4.19 H new ATOM 1353 N LYS A 87 18.354 -18.052 12.724 1.00 0.51 N ATOM 1354 CA LYS A 87 17.783 -19.258 12.119 1.00 0.59 C ATOM 1355 C LYS A 87 16.688 -18.939 11.088 1.00 0.59 C ATOM 1356 O LYS A 87 16.324 -19.786 10.272 1.00 0.74 O ATOM 1357 CB LYS A 87 17.231 -20.163 13.222 1.00 0.68 C ATOM 1358 CG LYS A 87 16.768 -21.526 12.731 1.00 0.84 C ATOM 1359 CD LYS A 87 16.214 -22.368 13.866 1.00 1.03 C ATOM 1360 CE LYS A 87 15.718 -23.715 13.365 1.00 1.26 C ATOM 1361 NZ LYS A 87 14.630 -23.566 12.361 1.00 1.94 N ATOM 0 H LYS A 87 18.211 -17.983 13.732 1.00 0.51 H new ATOM 0 HA LYS A 87 18.580 -19.770 11.579 1.00 0.59 H new ATOM 0 HB2 LYS A 87 18.001 -20.304 13.981 1.00 0.68 H new ATOM 0 HB3 LYS A 87 16.394 -19.659 13.706 1.00 0.68 H new ATOM 0 HG2 LYS A 87 16.003 -21.397 11.965 1.00 0.84 H new ATOM 0 HG3 LYS A 87 17.603 -22.048 12.263 1.00 0.84 H new ATOM 0 HD2 LYS A 87 16.987 -22.520 14.619 1.00 1.03 H new ATOM 0 HD3 LYS A 87 15.397 -21.835 14.351 1.00 1.03 H new ATOM 0 HE2 LYS A 87 16.548 -24.266 12.922 1.00 1.26 H new ATOM 0 HE3 LYS A 87 15.357 -24.305 14.207 1.00 1.26 H new ATOM 0 HZ1 LYS A 87 14.138 -24.475 12.245 1.00 1.94 H new ATOM 0 HZ2 LYS A 87 13.954 -22.845 12.686 1.00 1.94 H new ATOM 0 HZ3 LYS A 87 15.037 -23.274 11.449 1.00 1.94 H new ATOM 1375 N ASN A 88 16.169 -17.719 11.128 1.00 0.55 N ATOM 1376 CA ASN A 88 15.126 -17.296 10.192 1.00 0.66 C ATOM 1377 C ASN A 88 15.424 -15.905 9.644 1.00 0.60 C ATOM 1378 O ASN A 88 14.514 -15.161 9.279 1.00 0.71 O ATOM 1379 CB ASN A 88 13.749 -17.311 10.872 1.00 0.79 C ATOM 1380 CG ASN A 88 13.129 -18.702 10.924 1.00 0.96 C ATOM 1381 OD1 ASN A 88 12.401 -19.107 10.014 1.00 1.23 O ATOM 1382 ND2 ASN A 88 13.398 -19.440 11.994 1.00 1.20 N ATOM 0 H ASN A 88 16.451 -17.002 11.797 1.00 0.55 H new ATOM 0 HA ASN A 88 15.113 -18.002 9.361 1.00 0.66 H new ATOM 0 HB2 ASN A 88 13.846 -16.924 11.886 1.00 0.79 H new ATOM 0 HB3 ASN A 88 13.078 -16.639 10.337 1.00 0.79 H new ATOM 0 HD21 ASN A 88 12.998 -20.374 12.083 1.00 1.20 H new ATOM 0 HD22 ASN A 88 14.004 -19.073 12.727 1.00 1.20 H new ATOM 1389 N GLU A 89 16.704 -15.574 9.561 1.00 0.50 N ATOM 1390 CA GLU A 89 17.130 -14.255 9.114 1.00 0.46 C ATOM 1391 C GLU A 89 17.869 -14.381 7.781 1.00 0.47 C ATOM 1392 O GLU A 89 18.431 -15.437 7.481 1.00 0.65 O ATOM 1393 CB GLU A 89 18.020 -13.627 10.188 1.00 0.50 C ATOM 1394 CG GLU A 89 18.037 -12.112 10.192 1.00 0.48 C ATOM 1395 CD GLU A 89 18.222 -11.556 11.591 1.00 1.01 C ATOM 1396 OE1 GLU A 89 19.120 -12.034 12.317 1.00 1.60 O ATOM 1397 OE2 GLU A 89 17.510 -10.603 11.951 1.00 1.38 O ATOM 0 H GLU A 89 17.470 -16.204 9.799 1.00 0.50 H new ATOM 0 HA GLU A 89 16.266 -13.609 8.960 1.00 0.46 H new ATOM 0 HB2 GLU A 89 17.687 -13.975 11.166 1.00 0.50 H new ATOM 0 HB3 GLU A 89 19.040 -13.988 10.052 1.00 0.50 H new ATOM 0 HG2 GLU A 89 18.842 -11.756 9.549 1.00 0.48 H new ATOM 0 HG3 GLU A 89 17.104 -11.737 9.772 1.00 0.48 H new ATOM 1404 N LYS A 90 17.862 -13.324 6.981 1.00 0.39 N ATOM 1405 CA LYS A 90 18.417 -13.398 5.636 1.00 0.40 C ATOM 1406 C LYS A 90 19.112 -12.093 5.260 1.00 0.39 C ATOM 1407 O LYS A 90 18.519 -11.014 5.358 1.00 0.47 O ATOM 1408 CB LYS A 90 17.291 -13.723 4.642 1.00 0.50 C ATOM 1409 CG LYS A 90 17.766 -14.151 3.258 1.00 0.56 C ATOM 1410 CD LYS A 90 18.053 -12.964 2.353 1.00 0.93 C ATOM 1411 CE LYS A 90 18.514 -13.410 0.972 1.00 0.85 C ATOM 1412 NZ LYS A 90 17.489 -14.233 0.270 1.00 1.17 N ATOM 0 H LYS A 90 17.482 -12.413 7.236 1.00 0.39 H new ATOM 0 HA LYS A 90 19.166 -14.189 5.602 1.00 0.40 H new ATOM 0 HB2 LYS A 90 16.673 -14.517 5.061 1.00 0.50 H new ATOM 0 HB3 LYS A 90 16.653 -12.845 4.537 1.00 0.50 H new ATOM 0 HG2 LYS A 90 18.667 -14.756 3.357 1.00 0.56 H new ATOM 0 HG3 LYS A 90 17.008 -14.783 2.795 1.00 0.56 H new ATOM 0 HD2 LYS A 90 17.155 -12.353 2.258 1.00 0.93 H new ATOM 0 HD3 LYS A 90 18.819 -12.336 2.808 1.00 0.93 H new ATOM 0 HE2 LYS A 90 18.747 -12.533 0.369 1.00 0.85 H new ATOM 0 HE3 LYS A 90 19.435 -13.985 1.067 1.00 0.85 H new ATOM 0 HZ1 LYS A 90 17.661 -14.202 -0.755 1.00 1.17 H new ATOM 0 HZ2 LYS A 90 17.548 -15.217 0.601 1.00 1.17 H new ATOM 0 HZ3 LYS A 90 16.542 -13.855 0.474 1.00 1.17 H new ATOM 1426 N CYS A 91 20.364 -12.199 4.819 1.00 0.35 N ATOM 1427 CA CYS A 91 21.148 -11.032 4.428 1.00 0.38 C ATOM 1428 C CYS A 91 21.740 -11.200 3.025 1.00 0.32 C ATOM 1429 O CYS A 91 21.988 -12.320 2.571 1.00 0.37 O ATOM 1430 CB CYS A 91 22.279 -10.794 5.435 1.00 0.48 C ATOM 1431 SG CYS A 91 21.720 -10.429 7.118 1.00 1.20 S ATOM 0 H CYS A 91 20.858 -13.086 4.724 1.00 0.35 H new ATOM 0 HA CYS A 91 20.479 -10.172 4.418 1.00 0.38 H new ATOM 0 HB2 CYS A 91 22.917 -11.677 5.461 1.00 0.48 H new ATOM 0 HB3 CYS A 91 22.894 -9.966 5.082 1.00 0.48 H new ATOM 0 HG CYS A 91 22.686 -10.662 7.956 1.00 1.20 H new ATOM 1437 N LEU A 92 21.943 -10.076 2.344 1.00 0.31 N ATOM 1438 CA LEU A 92 22.636 -10.057 1.059 1.00 0.32 C ATOM 1439 C LEU A 92 24.015 -9.452 1.246 1.00 0.28 C ATOM 1440 O LEU A 92 24.148 -8.294 1.642 1.00 0.39 O ATOM 1441 CB LEU A 92 21.861 -9.234 0.029 1.00 0.40 C ATOM 1442 CG LEU A 92 21.381 -9.990 -1.211 1.00 0.79 C ATOM 1443 CD1 LEU A 92 20.545 -9.076 -2.093 1.00 1.39 C ATOM 1444 CD2 LEU A 92 22.563 -10.537 -1.993 1.00 1.73 C ATOM 0 H LEU A 92 21.634 -9.158 2.664 1.00 0.31 H new ATOM 0 HA LEU A 92 22.716 -11.081 0.694 1.00 0.32 H new ATOM 0 HB2 LEU A 92 20.993 -8.797 0.522 1.00 0.40 H new ATOM 0 HB3 LEU A 92 22.493 -8.408 -0.296 1.00 0.40 H new ATOM 0 HG LEU A 92 20.763 -10.828 -0.887 1.00 0.79 H new ATOM 0 HD11 LEU A 92 20.209 -9.626 -2.972 1.00 1.39 H new ATOM 0 HD12 LEU A 92 19.679 -8.723 -1.533 1.00 1.39 H new ATOM 0 HD13 LEU A 92 21.147 -8.223 -2.407 1.00 1.39 H new ATOM 0 HD21 LEU A 92 22.202 -11.072 -2.872 1.00 1.73 H new ATOM 0 HD22 LEU A 92 23.204 -9.713 -2.307 1.00 1.73 H new ATOM 0 HD23 LEU A 92 23.133 -11.219 -1.362 1.00 1.73 H new ATOM 1456 N VAL A 93 25.036 -10.223 0.957 1.00 0.25 N ATOM 1457 CA VAL A 93 26.399 -9.799 1.228 1.00 0.25 C ATOM 1458 C VAL A 93 27.156 -9.500 -0.061 1.00 0.23 C ATOM 1459 O VAL A 93 26.976 -10.173 -1.080 1.00 0.26 O ATOM 1460 CB VAL A 93 27.157 -10.859 2.062 1.00 0.34 C ATOM 1461 CG1 VAL A 93 27.177 -12.203 1.351 1.00 0.74 C ATOM 1462 CG2 VAL A 93 28.570 -10.391 2.391 1.00 0.60 C ATOM 0 H VAL A 93 24.954 -11.148 0.534 1.00 0.25 H new ATOM 0 HA VAL A 93 26.342 -8.879 1.809 1.00 0.25 H new ATOM 0 HB VAL A 93 26.622 -10.988 3.003 1.00 0.34 H new ATOM 0 HG11 VAL A 93 27.716 -12.929 1.960 1.00 0.74 H new ATOM 0 HG12 VAL A 93 26.155 -12.548 1.196 1.00 0.74 H new ATOM 0 HG13 VAL A 93 27.675 -12.097 0.387 1.00 0.74 H new ATOM 0 HG21 VAL A 93 29.079 -11.156 2.978 1.00 0.60 H new ATOM 0 HG22 VAL A 93 29.120 -10.217 1.466 1.00 0.60 H new ATOM 0 HG23 VAL A 93 28.522 -9.465 2.965 1.00 0.60 H new ATOM 1472 N ARG A 94 27.981 -8.463 -0.015 1.00 0.25 N ATOM 1473 CA ARG A 94 28.824 -8.105 -1.144 1.00 0.30 C ATOM 1474 C ARG A 94 30.230 -8.635 -0.927 1.00 0.33 C ATOM 1475 O ARG A 94 30.905 -8.246 0.024 1.00 0.38 O ATOM 1476 CB ARG A 94 28.891 -6.588 -1.331 1.00 0.40 C ATOM 1477 CG ARG A 94 27.552 -5.920 -1.579 1.00 0.92 C ATOM 1478 CD ARG A 94 26.806 -6.562 -2.736 1.00 0.65 C ATOM 1479 NE ARG A 94 25.671 -5.750 -3.169 1.00 0.89 N ATOM 1480 CZ ARG A 94 24.513 -5.644 -2.507 1.00 1.05 C ATOM 1481 NH1 ARG A 94 24.316 -6.313 -1.370 1.00 1.71 N ATOM 1482 NH2 ARG A 94 23.553 -4.859 -2.978 1.00 1.58 N ATOM 0 H ARG A 94 28.084 -7.853 0.796 1.00 0.25 H new ATOM 0 HA ARG A 94 28.387 -8.549 -2.038 1.00 0.30 H new ATOM 0 HB2 ARG A 94 29.343 -6.146 -0.443 1.00 0.40 H new ATOM 0 HB3 ARG A 94 29.552 -6.368 -2.169 1.00 0.40 H new ATOM 0 HG2 ARG A 94 26.944 -5.980 -0.677 1.00 0.92 H new ATOM 0 HG3 ARG A 94 27.707 -4.862 -1.789 1.00 0.92 H new ATOM 0 HD2 ARG A 94 27.489 -6.707 -3.573 1.00 0.65 H new ATOM 0 HD3 ARG A 94 26.453 -7.549 -2.438 1.00 0.65 H new ATOM 0 HE ARG A 94 25.768 -5.226 -4.039 1.00 0.89 H new ATOM 0 HH11 ARG A 94 25.052 -6.913 -0.997 1.00 1.71 H new ATOM 0 HH12 ARG A 94 23.429 -6.225 -0.873 1.00 1.71 H new ATOM 0 HH21 ARG A 94 23.699 -4.338 -3.843 1.00 1.58 H new ATOM 0 HH22 ARG A 94 22.669 -4.776 -2.475 1.00 1.58 H new ATOM 1496 N ILE A 95 30.669 -9.524 -1.799 1.00 0.35 N ATOM 1497 CA ILE A 95 32.019 -10.055 -1.712 1.00 0.38 C ATOM 1498 C ILE A 95 32.933 -9.291 -2.655 1.00 0.41 C ATOM 1499 O ILE A 95 32.857 -9.444 -3.873 1.00 0.45 O ATOM 1500 CB ILE A 95 32.085 -11.580 -2.020 1.00 0.43 C ATOM 1501 CG1 ILE A 95 31.522 -12.403 -0.851 1.00 0.47 C ATOM 1502 CG2 ILE A 95 33.516 -12.023 -2.317 1.00 0.52 C ATOM 1503 CD1 ILE A 95 30.039 -12.225 -0.607 1.00 0.51 C ATOM 0 H ILE A 95 30.115 -9.893 -2.572 1.00 0.35 H new ATOM 0 HA ILE A 95 32.353 -9.925 -0.683 1.00 0.38 H new ATOM 0 HB ILE A 95 31.473 -11.758 -2.905 1.00 0.43 H new ATOM 0 HG12 ILE A 95 31.721 -13.458 -1.039 1.00 0.47 H new ATOM 0 HG13 ILE A 95 32.061 -12.133 0.058 1.00 0.47 H new ATOM 0 HG21 ILE A 95 33.529 -13.092 -2.528 1.00 0.52 H new ATOM 0 HG22 ILE A 95 33.894 -11.478 -3.182 1.00 0.52 H new ATOM 0 HG23 ILE A 95 34.148 -11.816 -1.453 1.00 0.52 H new ATOM 0 HD11 ILE A 95 29.732 -12.844 0.236 1.00 0.51 H new ATOM 0 HD12 ILE A 95 29.830 -11.179 -0.384 1.00 0.51 H new ATOM 0 HD13 ILE A 95 29.485 -12.524 -1.497 1.00 0.51 H new ATOM 1515 N GLU A 96 33.754 -8.427 -2.079 1.00 0.43 N ATOM 1516 CA GLU A 96 34.750 -7.688 -2.835 1.00 0.49 C ATOM 1517 C GLU A 96 35.991 -8.562 -2.999 1.00 0.45 C ATOM 1518 O GLU A 96 36.083 -9.628 -2.386 1.00 0.45 O ATOM 1519 CB GLU A 96 35.090 -6.380 -2.103 1.00 0.55 C ATOM 1520 CG GLU A 96 35.852 -5.366 -2.949 1.00 0.77 C ATOM 1521 CD GLU A 96 36.217 -4.116 -2.178 1.00 0.88 C ATOM 1522 OE1 GLU A 96 35.329 -3.264 -1.982 1.00 1.19 O ATOM 1523 OE2 GLU A 96 37.385 -3.992 -1.761 1.00 1.37 O ATOM 0 H GLU A 96 33.748 -8.220 -1.080 1.00 0.43 H new ATOM 0 HA GLU A 96 34.364 -7.433 -3.822 1.00 0.49 H new ATOM 0 HB2 GLU A 96 34.165 -5.922 -1.754 1.00 0.55 H new ATOM 0 HB3 GLU A 96 35.682 -6.616 -1.219 1.00 0.55 H new ATOM 0 HG2 GLU A 96 36.761 -5.829 -3.332 1.00 0.77 H new ATOM 0 HG3 GLU A 96 35.246 -5.091 -3.812 1.00 0.77 H new ATOM 1530 N SER A 97 36.931 -8.117 -3.824 1.00 0.49 N ATOM 1531 CA SER A 97 38.175 -8.842 -4.060 1.00 0.54 C ATOM 1532 C SER A 97 38.854 -9.250 -2.750 1.00 0.52 C ATOM 1533 O SER A 97 39.197 -10.417 -2.562 1.00 0.59 O ATOM 1534 CB SER A 97 39.113 -7.964 -4.888 1.00 0.64 C ATOM 1535 OG SER A 97 39.146 -6.643 -4.370 1.00 1.00 O ATOM 0 H SER A 97 36.853 -7.245 -4.348 1.00 0.49 H new ATOM 0 HA SER A 97 37.942 -9.759 -4.602 1.00 0.54 H new ATOM 0 HB2 SER A 97 40.117 -8.388 -4.882 1.00 0.64 H new ATOM 0 HB3 SER A 97 38.781 -7.945 -5.926 1.00 0.64 H new ATOM 0 HG SER A 97 39.752 -6.095 -4.910 1.00 1.00 H new ATOM 1541 N MET A 98 39.006 -8.290 -1.843 1.00 0.48 N ATOM 1542 CA MET A 98 39.695 -8.527 -0.576 1.00 0.53 C ATOM 1543 C MET A 98 38.811 -9.296 0.413 1.00 0.49 C ATOM 1544 O MET A 98 39.295 -9.811 1.420 1.00 0.58 O ATOM 1545 CB MET A 98 40.149 -7.203 0.050 1.00 0.59 C ATOM 1546 CG MET A 98 39.008 -6.263 0.394 1.00 0.57 C ATOM 1547 SD MET A 98 39.574 -4.737 1.170 1.00 0.79 S ATOM 1548 CE MET A 98 40.549 -4.019 -0.148 1.00 1.79 C ATOM 0 H MET A 98 38.661 -7.338 -1.961 1.00 0.48 H new ATOM 0 HA MET A 98 40.571 -9.138 -0.793 1.00 0.53 H new ATOM 0 HB2 MET A 98 40.717 -7.416 0.956 1.00 0.59 H new ATOM 0 HB3 MET A 98 40.826 -6.700 -0.640 1.00 0.59 H new ATOM 0 HG2 MET A 98 38.456 -6.021 -0.514 1.00 0.57 H new ATOM 0 HG3 MET A 98 38.314 -6.771 1.064 1.00 0.57 H new ATOM 0 HE1 MET A 98 40.697 -2.957 0.046 1.00 1.79 H new ATOM 0 HE2 MET A 98 41.517 -4.517 -0.197 1.00 1.79 H new ATOM 0 HE3 MET A 98 40.027 -4.145 -1.097 1.00 1.79 H new ATOM 1558 N TYR A 99 37.516 -9.385 0.116 1.00 0.41 N ATOM 1559 CA TYR A 99 36.583 -10.094 0.989 1.00 0.43 C ATOM 1560 C TYR A 99 36.597 -11.585 0.672 1.00 0.49 C ATOM 1561 O TYR A 99 35.962 -12.387 1.366 1.00 0.48 O ATOM 1562 CB TYR A 99 35.158 -9.545 0.849 1.00 0.43 C ATOM 1563 CG TYR A 99 34.962 -8.130 1.362 1.00 0.46 C ATOM 1564 CD1 TYR A 99 35.977 -7.445 2.023 1.00 0.51 C ATOM 1565 CD2 TYR A 99 33.751 -7.478 1.173 1.00 0.53 C ATOM 1566 CE1 TYR A 99 35.782 -6.158 2.485 1.00 0.59 C ATOM 1567 CE2 TYR A 99 33.550 -6.193 1.632 1.00 0.62 C ATOM 1568 CZ TYR A 99 34.569 -5.536 2.283 1.00 0.63 C ATOM 1569 OH TYR A 99 34.371 -4.255 2.739 1.00 0.75 O ATOM 0 H TYR A 99 37.091 -8.978 -0.717 1.00 0.41 H new ATOM 0 HA TYR A 99 36.906 -9.939 2.018 1.00 0.43 H new ATOM 0 HB2 TYR A 99 34.874 -9.576 -0.203 1.00 0.43 H new ATOM 0 HB3 TYR A 99 34.476 -10.207 1.383 1.00 0.43 H new ATOM 0 HD1 TYR A 99 36.931 -7.927 2.177 1.00 0.51 H new ATOM 0 HD2 TYR A 99 32.951 -7.987 0.656 1.00 0.53 H new ATOM 0 HE1 TYR A 99 36.577 -5.641 3.002 1.00 0.59 H new ATOM 0 HE2 TYR A 99 32.598 -5.705 1.481 1.00 0.62 H new ATOM 0 HH TYR A 99 33.568 -3.879 2.321 1.00 0.75 H new ATOM 1579 N GLY A 100 37.327 -11.940 -0.377 1.00 0.60 N ATOM 1580 CA GLY A 100 37.446 -13.321 -0.785 1.00 0.71 C ATOM 1581 C GLY A 100 38.866 -13.662 -1.183 1.00 0.67 C ATOM 1582 O GLY A 100 39.799 -12.943 -0.831 1.00 0.67 O ATOM 0 H GLY A 100 37.846 -11.282 -0.959 1.00 0.60 H new ATOM 0 HA2 GLY A 100 37.130 -13.971 0.031 1.00 0.71 H new ATOM 0 HA3 GLY A 100 36.776 -13.513 -1.623 1.00 0.71 H new ATOM 1586 N TYR A 101 39.034 -14.750 -1.925 1.00 0.76 N ATOM 1587 CA TYR A 101 40.359 -15.173 -2.376 1.00 0.86 C ATOM 1588 C TYR A 101 40.672 -14.607 -3.756 1.00 0.93 C ATOM 1589 O TYR A 101 41.425 -15.204 -4.527 1.00 1.52 O ATOM 1590 CB TYR A 101 40.468 -16.701 -2.398 1.00 1.01 C ATOM 1591 CG TYR A 101 40.550 -17.320 -1.021 1.00 0.86 C ATOM 1592 CD1 TYR A 101 41.667 -17.120 -0.222 1.00 1.09 C ATOM 1593 CD2 TYR A 101 39.514 -18.093 -0.516 1.00 0.75 C ATOM 1594 CE1 TYR A 101 41.751 -17.670 1.040 1.00 1.14 C ATOM 1595 CE2 TYR A 101 39.588 -18.645 0.748 1.00 0.74 C ATOM 1596 CZ TYR A 101 40.712 -18.432 1.522 1.00 0.92 C ATOM 1597 OH TYR A 101 40.790 -18.974 2.786 1.00 1.09 O ATOM 0 H TYR A 101 38.272 -15.356 -2.228 1.00 0.76 H new ATOM 0 HA TYR A 101 41.089 -14.783 -1.667 1.00 0.86 H new ATOM 0 HB2 TYR A 101 39.604 -17.111 -2.921 1.00 1.01 H new ATOM 0 HB3 TYR A 101 41.352 -16.986 -2.969 1.00 1.01 H new ATOM 0 HD1 TYR A 101 42.486 -16.523 -0.595 1.00 1.09 H new ATOM 0 HD2 TYR A 101 38.636 -18.266 -1.121 1.00 0.75 H new ATOM 0 HE1 TYR A 101 42.629 -17.503 1.647 1.00 1.14 H new ATOM 0 HE2 TYR A 101 38.771 -19.240 1.129 1.00 0.74 H new ATOM 0 HH TYR A 101 40.351 -19.850 2.794 1.00 1.09 H new ATOM 1681 N SER A 109 33.006 -19.842 -8.709 1.00 0.97 N ATOM 1682 CA SER A 109 32.364 -19.556 -9.983 1.00 0.88 C ATOM 1683 C SER A 109 33.185 -18.524 -10.752 1.00 0.77 C ATOM 1684 O SER A 109 33.890 -18.861 -11.705 1.00 0.85 O ATOM 1685 CB SER A 109 30.924 -19.056 -9.758 1.00 0.92 C ATOM 1686 OG SER A 109 30.203 -18.960 -10.978 1.00 1.52 O ATOM 0 HA SER A 109 32.313 -20.471 -10.573 1.00 0.88 H new ATOM 0 HB2 SER A 109 30.405 -19.735 -9.081 1.00 0.92 H new ATOM 0 HB3 SER A 109 30.950 -18.080 -9.273 1.00 0.92 H new ATOM 0 HG SER A 109 29.294 -18.642 -10.797 1.00 1.52 H new ATOM 1692 N ILE A 110 33.123 -17.274 -10.308 1.00 0.68 N ATOM 1693 CA ILE A 110 33.917 -16.208 -10.900 1.00 0.65 C ATOM 1694 C ILE A 110 34.391 -15.232 -9.821 1.00 0.63 C ATOM 1695 O ILE A 110 33.585 -14.625 -9.122 1.00 0.75 O ATOM 1696 CB ILE A 110 33.164 -15.413 -12.011 1.00 0.64 C ATOM 1697 CG1 ILE A 110 31.902 -14.696 -11.479 1.00 0.66 C ATOM 1698 CG2 ILE A 110 32.802 -16.324 -13.181 1.00 0.72 C ATOM 1699 CD1 ILE A 110 30.731 -15.605 -11.177 1.00 0.74 C ATOM 0 H ILE A 110 32.527 -16.975 -9.536 1.00 0.68 H new ATOM 0 HA ILE A 110 34.767 -16.699 -11.373 1.00 0.65 H new ATOM 0 HB ILE A 110 33.850 -14.641 -12.359 1.00 0.64 H new ATOM 0 HG12 ILE A 110 32.166 -14.154 -10.571 1.00 0.66 H new ATOM 0 HG13 ILE A 110 31.587 -13.954 -12.213 1.00 0.66 H new ATOM 0 HG21 ILE A 110 32.278 -15.747 -13.943 1.00 0.72 H new ATOM 0 HG22 ILE A 110 33.711 -16.747 -13.608 1.00 0.72 H new ATOM 0 HG23 ILE A 110 32.158 -17.130 -12.829 1.00 0.72 H new ATOM 0 HD11 ILE A 110 29.894 -15.011 -10.810 1.00 0.74 H new ATOM 0 HD12 ILE A 110 30.433 -16.129 -12.085 1.00 0.74 H new ATOM 0 HD13 ILE A 110 31.021 -16.332 -10.418 1.00 0.74 H new ATOM 1711 N PRO A 111 35.707 -15.121 -9.624 1.00 0.70 N ATOM 1712 CA PRO A 111 36.275 -14.086 -8.774 1.00 0.78 C ATOM 1713 C PRO A 111 36.375 -12.748 -9.503 1.00 0.79 C ATOM 1714 O PRO A 111 35.684 -11.785 -9.159 1.00 1.58 O ATOM 1715 CB PRO A 111 37.669 -14.609 -8.411 1.00 1.10 C ATOM 1716 CG PRO A 111 37.921 -15.817 -9.267 1.00 1.22 C ATOM 1717 CD PRO A 111 36.729 -16.016 -10.172 1.00 0.89 C ATOM 0 HA PRO A 111 35.654 -13.899 -7.898 1.00 0.78 H new ATOM 0 HB2 PRO A 111 38.426 -13.845 -8.589 1.00 1.10 H new ATOM 0 HB3 PRO A 111 37.720 -14.868 -7.353 1.00 1.10 H new ATOM 0 HG2 PRO A 111 38.827 -15.681 -9.857 1.00 1.22 H new ATOM 0 HG3 PRO A 111 38.076 -16.698 -8.644 1.00 1.22 H new ATOM 0 HD2 PRO A 111 36.967 -15.763 -11.205 1.00 0.89 H new ATOM 0 HD3 PRO A 111 36.394 -17.053 -10.167 1.00 0.89 H new ATOM 1725 N GLY A 112 37.258 -12.686 -10.500 1.00 0.95 N ATOM 1726 CA GLY A 112 37.392 -11.497 -11.327 1.00 1.02 C ATOM 1727 C GLY A 112 37.956 -10.301 -10.578 1.00 1.09 C ATOM 1728 O GLY A 112 38.104 -9.222 -11.154 1.00 2.05 O ATOM 0 H GLY A 112 37.889 -13.447 -10.751 1.00 0.95 H new ATOM 0 HA2 GLY A 112 38.039 -11.724 -12.174 1.00 1.02 H new ATOM 0 HA3 GLY A 112 36.415 -11.234 -11.733 1.00 1.02 H new ATOM 1732 N ASN A 113 38.273 -10.499 -9.294 1.00 0.74 N ATOM 1733 CA ASN A 113 38.767 -9.426 -8.426 1.00 0.84 C ATOM 1734 C ASN A 113 37.739 -8.312 -8.301 1.00 0.75 C ATOM 1735 O ASN A 113 38.078 -7.158 -8.036 1.00 1.00 O ATOM 1736 CB ASN A 113 40.101 -8.873 -8.944 1.00 1.00 C ATOM 1737 CG ASN A 113 41.242 -9.843 -8.732 1.00 1.49 C ATOM 1738 OD1 ASN A 113 41.485 -10.723 -9.552 1.00 2.03 O ATOM 1739 ND2 ASN A 113 41.963 -9.681 -7.632 1.00 1.79 N ATOM 0 H ASN A 113 38.195 -11.404 -8.829 1.00 0.74 H new ATOM 0 HA ASN A 113 38.935 -9.848 -7.435 1.00 0.84 H new ATOM 0 HB2 ASN A 113 40.011 -8.647 -10.007 1.00 1.00 H new ATOM 0 HB3 ASN A 113 40.325 -7.935 -8.437 1.00 1.00 H new ATOM 0 HD21 ASN A 113 42.752 -10.300 -7.443 1.00 1.79 H new ATOM 0 HD22 ASN A 113 41.729 -8.937 -6.974 1.00 1.79 H new ATOM 1746 N SER A 114 36.475 -8.673 -8.449 1.00 0.57 N ATOM 1747 CA SER A 114 35.399 -7.703 -8.414 1.00 0.58 C ATOM 1748 C SER A 114 34.434 -8.023 -7.275 1.00 0.50 C ATOM 1749 O SER A 114 34.778 -8.782 -6.369 1.00 0.59 O ATOM 1750 CB SER A 114 34.677 -7.680 -9.763 1.00 0.65 C ATOM 1751 OG SER A 114 34.229 -8.971 -10.137 1.00 1.14 O ATOM 0 H SER A 114 36.171 -9.636 -8.595 1.00 0.57 H new ATOM 0 HA SER A 114 35.814 -6.712 -8.231 1.00 0.58 H new ATOM 0 HB2 SER A 114 33.826 -7.000 -9.710 1.00 0.65 H new ATOM 0 HB3 SER A 114 35.348 -7.291 -10.529 1.00 0.65 H new ATOM 0 HG SER A 114 34.067 -8.994 -11.103 1.00 1.14 H new ATOM 1757 N VAL A 115 33.241 -7.440 -7.317 1.00 0.44 N ATOM 1758 CA VAL A 115 32.256 -7.636 -6.259 1.00 0.38 C ATOM 1759 C VAL A 115 31.089 -8.516 -6.724 1.00 0.31 C ATOM 1760 O VAL A 115 30.505 -8.298 -7.795 1.00 0.31 O ATOM 1761 CB VAL A 115 31.732 -6.278 -5.732 1.00 0.44 C ATOM 1762 CG1 VAL A 115 31.135 -5.436 -6.849 1.00 0.48 C ATOM 1763 CG2 VAL A 115 30.709 -6.477 -4.620 1.00 0.42 C ATOM 0 H VAL A 115 32.932 -6.828 -8.072 1.00 0.44 H new ATOM 0 HA VAL A 115 32.759 -8.155 -5.443 1.00 0.38 H new ATOM 0 HB VAL A 115 32.589 -5.742 -5.324 1.00 0.44 H new ATOM 0 HG11 VAL A 115 30.778 -4.490 -6.441 1.00 0.48 H new ATOM 0 HG12 VAL A 115 31.896 -5.241 -7.604 1.00 0.48 H new ATOM 0 HG13 VAL A 115 30.302 -5.972 -7.304 1.00 0.48 H new ATOM 0 HG21 VAL A 115 30.359 -5.506 -4.270 1.00 0.42 H new ATOM 0 HG22 VAL A 115 29.865 -7.051 -5.001 1.00 0.42 H new ATOM 0 HG23 VAL A 115 31.171 -7.016 -3.793 1.00 0.42 H new ATOM 1773 N LEU A 116 30.776 -9.527 -5.923 1.00 0.28 N ATOM 1774 CA LEU A 116 29.646 -10.407 -6.190 1.00 0.25 C ATOM 1775 C LEU A 116 28.573 -10.211 -5.119 1.00 0.28 C ATOM 1776 O LEU A 116 28.856 -9.677 -4.045 1.00 0.37 O ATOM 1777 CB LEU A 116 30.077 -11.887 -6.198 1.00 0.30 C ATOM 1778 CG LEU A 116 31.027 -12.323 -7.321 1.00 0.33 C ATOM 1779 CD1 LEU A 116 32.450 -11.843 -7.061 1.00 0.51 C ATOM 1780 CD2 LEU A 116 30.990 -13.835 -7.469 1.00 0.50 C ATOM 0 H LEU A 116 31.294 -9.759 -5.076 1.00 0.28 H new ATOM 0 HA LEU A 116 29.251 -10.152 -7.173 1.00 0.25 H new ATOM 0 HB2 LEU A 116 30.555 -12.107 -5.244 1.00 0.30 H new ATOM 0 HB3 LEU A 116 29.179 -12.502 -6.254 1.00 0.30 H new ATOM 0 HG LEU A 116 30.692 -11.865 -8.252 1.00 0.33 H new ATOM 0 HD11 LEU A 116 33.098 -12.168 -7.875 1.00 0.51 H new ATOM 0 HD12 LEU A 116 32.462 -10.755 -7.001 1.00 0.51 H new ATOM 0 HD13 LEU A 116 32.809 -12.262 -6.121 1.00 0.51 H new ATOM 0 HD21 LEU A 116 31.666 -14.139 -8.268 1.00 0.50 H new ATOM 0 HD22 LEU A 116 31.301 -14.300 -6.533 1.00 0.50 H new ATOM 0 HD23 LEU A 116 29.976 -14.152 -7.712 1.00 0.50 H new ATOM 1792 N LEU A 117 27.350 -10.646 -5.406 1.00 0.31 N ATOM 1793 CA LEU A 117 26.271 -10.598 -4.424 1.00 0.38 C ATOM 1794 C LEU A 117 25.821 -12.011 -4.096 1.00 0.31 C ATOM 1795 O LEU A 117 25.347 -12.736 -4.974 1.00 0.38 O ATOM 1796 CB LEU A 117 25.048 -9.807 -4.925 1.00 0.61 C ATOM 1797 CG LEU A 117 25.331 -8.590 -5.797 1.00 0.38 C ATOM 1798 CD1 LEU A 117 25.425 -9.003 -7.249 1.00 0.70 C ATOM 1799 CD2 LEU A 117 24.243 -7.548 -5.619 1.00 0.59 C ATOM 0 H LEU A 117 27.081 -11.035 -6.310 1.00 0.31 H new ATOM 0 HA LEU A 117 26.666 -10.092 -3.543 1.00 0.38 H new ATOM 0 HB2 LEU A 117 24.410 -10.488 -5.488 1.00 0.61 H new ATOM 0 HB3 LEU A 117 24.476 -9.478 -4.057 1.00 0.61 H new ATOM 0 HG LEU A 117 26.282 -8.155 -5.491 1.00 0.38 H new ATOM 0 HD11 LEU A 117 25.627 -8.126 -7.864 1.00 0.70 H new ATOM 0 HD12 LEU A 117 26.232 -9.726 -7.370 1.00 0.70 H new ATOM 0 HD13 LEU A 117 24.483 -9.455 -7.560 1.00 0.70 H new ATOM 0 HD21 LEU A 117 24.459 -6.685 -6.248 1.00 0.59 H new ATOM 0 HD22 LEU A 117 23.281 -7.974 -5.905 1.00 0.59 H new ATOM 0 HD23 LEU A 117 24.205 -7.236 -4.575 1.00 0.59 H new ATOM 1811 N PHE A 118 25.991 -12.412 -2.850 1.00 0.30 N ATOM 1812 CA PHE A 118 25.518 -13.712 -2.404 1.00 0.34 C ATOM 1813 C PHE A 118 24.402 -13.566 -1.386 1.00 0.34 C ATOM 1814 O PHE A 118 24.546 -12.870 -0.378 1.00 0.37 O ATOM 1815 CB PHE A 118 26.657 -14.538 -1.808 1.00 0.43 C ATOM 1816 CG PHE A 118 27.681 -14.956 -2.822 1.00 0.37 C ATOM 1817 CD1 PHE A 118 27.292 -15.581 -3.995 1.00 0.39 C ATOM 1818 CD2 PHE A 118 29.028 -14.729 -2.603 1.00 0.38 C ATOM 1819 CE1 PHE A 118 28.230 -15.967 -4.932 1.00 0.38 C ATOM 1820 CE2 PHE A 118 29.971 -15.112 -3.536 1.00 0.40 C ATOM 1821 CZ PHE A 118 29.572 -15.736 -4.702 1.00 0.38 C ATOM 0 H PHE A 118 26.452 -11.858 -2.128 1.00 0.30 H new ATOM 0 HA PHE A 118 25.129 -14.234 -3.278 1.00 0.34 H new ATOM 0 HB2 PHE A 118 27.146 -13.958 -1.026 1.00 0.43 H new ATOM 0 HB3 PHE A 118 26.242 -15.427 -1.333 1.00 0.43 H new ATOM 0 HD1 PHE A 118 26.244 -15.768 -4.179 1.00 0.39 H new ATOM 0 HD2 PHE A 118 29.346 -14.246 -1.691 1.00 0.38 H new ATOM 0 HE1 PHE A 118 27.914 -16.450 -5.845 1.00 0.38 H new ATOM 0 HE2 PHE A 118 31.019 -14.924 -3.354 1.00 0.40 H new ATOM 0 HZ PHE A 118 30.307 -16.042 -5.431 1.00 0.38 H new ATOM 1831 N GLU A 119 23.284 -14.198 -1.677 1.00 0.33 N ATOM 1832 CA GLU A 119 22.200 -14.310 -0.726 1.00 0.37 C ATOM 1833 C GLU A 119 22.513 -15.426 0.254 1.00 0.34 C ATOM 1834 O GLU A 119 22.596 -16.592 -0.134 1.00 0.47 O ATOM 1835 CB GLU A 119 20.881 -14.601 -1.443 1.00 0.56 C ATOM 1836 CG GLU A 119 20.413 -13.477 -2.355 1.00 0.82 C ATOM 1837 CD GLU A 119 19.079 -13.781 -2.998 1.00 1.18 C ATOM 1838 OE1 GLU A 119 18.071 -13.847 -2.261 1.00 1.46 O ATOM 1839 OE2 GLU A 119 19.035 -13.950 -4.233 1.00 1.43 O ATOM 0 H GLU A 119 23.102 -14.646 -2.575 1.00 0.33 H new ATOM 0 HA GLU A 119 22.096 -13.366 -0.191 1.00 0.37 H new ATOM 0 HB2 GLU A 119 20.993 -15.511 -2.032 1.00 0.56 H new ATOM 0 HB3 GLU A 119 20.109 -14.796 -0.698 1.00 0.56 H new ATOM 0 HG2 GLU A 119 20.336 -12.554 -1.781 1.00 0.82 H new ATOM 0 HG3 GLU A 119 21.159 -13.307 -3.132 1.00 0.82 H new ATOM 1846 N ILE A 120 22.715 -15.070 1.508 1.00 0.29 N ATOM 1847 CA ILE A 120 23.053 -16.048 2.525 1.00 0.31 C ATOM 1848 C ILE A 120 21.874 -16.267 3.461 1.00 0.31 C ATOM 1849 O ILE A 120 21.342 -15.320 4.046 1.00 0.33 O ATOM 1850 CB ILE A 120 24.303 -15.621 3.330 1.00 0.34 C ATOM 1851 CG1 ILE A 120 25.553 -15.695 2.444 1.00 0.33 C ATOM 1852 CG2 ILE A 120 24.467 -16.488 4.574 1.00 0.48 C ATOM 1853 CD1 ILE A 120 26.842 -15.364 3.168 1.00 0.39 C ATOM 0 H ILE A 120 22.651 -14.110 1.847 1.00 0.29 H new ATOM 0 HA ILE A 120 23.285 -16.985 2.020 1.00 0.31 H new ATOM 0 HB ILE A 120 24.171 -14.589 3.656 1.00 0.34 H new ATOM 0 HG12 ILE A 120 25.631 -16.699 2.026 1.00 0.33 H new ATOM 0 HG13 ILE A 120 25.433 -15.009 1.606 1.00 0.33 H new ATOM 0 HG21 ILE A 120 25.352 -16.170 5.125 1.00 0.48 H new ATOM 0 HG22 ILE A 120 23.587 -16.383 5.209 1.00 0.48 H new ATOM 0 HG23 ILE A 120 24.579 -17.531 4.278 1.00 0.48 H new ATOM 0 HD11 ILE A 120 27.679 -15.439 2.474 1.00 0.39 H new ATOM 0 HD12 ILE A 120 26.787 -14.349 3.563 1.00 0.39 H new ATOM 0 HD13 ILE A 120 26.988 -16.065 3.989 1.00 0.39 H new ATOM 1865 N GLU A 121 21.454 -17.523 3.573 1.00 0.36 N ATOM 1866 CA GLU A 121 20.333 -17.891 4.424 1.00 0.40 C ATOM 1867 C GLU A 121 20.742 -19.026 5.359 1.00 0.35 C ATOM 1868 O GLU A 121 21.316 -20.030 4.922 1.00 0.40 O ATOM 1869 CB GLU A 121 19.132 -18.303 3.563 1.00 0.60 C ATOM 1870 CG GLU A 121 18.934 -17.397 2.354 1.00 1.06 C ATOM 1871 CD GLU A 121 17.618 -17.611 1.633 1.00 1.43 C ATOM 1872 OE1 GLU A 121 17.311 -18.763 1.266 1.00 1.67 O ATOM 1873 OE2 GLU A 121 16.904 -16.610 1.395 1.00 1.88 O ATOM 0 H GLU A 121 21.879 -18.308 3.079 1.00 0.36 H new ATOM 0 HA GLU A 121 20.043 -17.031 5.028 1.00 0.40 H new ATOM 0 HB2 GLU A 121 19.269 -19.330 3.223 1.00 0.60 H new ATOM 0 HB3 GLU A 121 18.230 -18.288 4.175 1.00 0.60 H new ATOM 0 HG2 GLU A 121 18.995 -16.358 2.678 1.00 1.06 H new ATOM 0 HG3 GLU A 121 19.752 -17.561 1.652 1.00 1.06 H new ATOM 1880 N LEU A 122 20.462 -18.853 6.647 1.00 0.33 N ATOM 1881 CA LEU A 122 20.828 -19.841 7.656 1.00 0.33 C ATOM 1882 C LEU A 122 19.689 -20.826 7.869 1.00 0.38 C ATOM 1883 O LEU A 122 18.717 -20.525 8.558 1.00 0.54 O ATOM 1884 CB LEU A 122 21.160 -19.150 8.982 1.00 0.38 C ATOM 1885 CG LEU A 122 21.750 -20.050 10.077 1.00 0.43 C ATOM 1886 CD1 LEU A 122 23.167 -20.468 9.720 1.00 0.80 C ATOM 1887 CD2 LEU A 122 21.724 -19.336 11.414 1.00 1.12 C ATOM 0 H LEU A 122 19.981 -18.034 7.018 1.00 0.33 H new ATOM 0 HA LEU A 122 21.707 -20.381 7.303 1.00 0.33 H new ATOM 0 HB2 LEU A 122 21.865 -18.343 8.783 1.00 0.38 H new ATOM 0 HB3 LEU A 122 20.250 -18.690 9.368 1.00 0.38 H new ATOM 0 HG LEU A 122 21.139 -20.950 10.153 1.00 0.43 H new ATOM 0 HD11 LEU A 122 23.568 -21.105 10.508 1.00 0.80 H new ATOM 0 HD12 LEU A 122 23.158 -21.017 8.779 1.00 0.80 H new ATOM 0 HD13 LEU A 122 23.793 -19.582 9.617 1.00 0.80 H new ATOM 0 HD21 LEU A 122 22.145 -19.985 12.182 1.00 1.12 H new ATOM 0 HD22 LEU A 122 22.313 -18.421 11.349 1.00 1.12 H new ATOM 0 HD23 LEU A 122 20.695 -19.087 11.674 1.00 1.12 H new ATOM 1899 N LEU A 123 19.803 -21.998 7.266 1.00 0.39 N ATOM 1900 CA LEU A 123 18.765 -23.009 7.399 1.00 0.47 C ATOM 1901 C LEU A 123 19.029 -23.911 8.598 1.00 0.47 C ATOM 1902 O LEU A 123 18.091 -24.418 9.216 1.00 0.59 O ATOM 1903 CB LEU A 123 18.621 -23.846 6.120 1.00 0.55 C ATOM 1904 CG LEU A 123 19.900 -24.513 5.600 1.00 0.58 C ATOM 1905 CD1 LEU A 123 19.574 -25.856 4.961 1.00 1.00 C ATOM 1906 CD2 LEU A 123 20.597 -23.613 4.586 1.00 0.77 C ATOM 0 H LEU A 123 20.595 -22.272 6.685 1.00 0.39 H new ATOM 0 HA LEU A 123 17.824 -22.484 7.562 1.00 0.47 H new ATOM 0 HB2 LEU A 123 17.879 -24.623 6.301 1.00 0.55 H new ATOM 0 HB3 LEU A 123 18.225 -23.204 5.333 1.00 0.55 H new ATOM 0 HG LEU A 123 20.569 -24.675 6.445 1.00 0.58 H new ATOM 0 HD11 LEU A 123 20.492 -26.318 4.596 1.00 1.00 H new ATOM 0 HD12 LEU A 123 19.109 -26.508 5.701 1.00 1.00 H new ATOM 0 HD13 LEU A 123 18.888 -25.705 4.128 1.00 1.00 H new ATOM 0 HD21 LEU A 123 21.503 -24.102 4.227 1.00 0.77 H new ATOM 0 HD22 LEU A 123 19.929 -23.426 3.746 1.00 0.77 H new ATOM 0 HD23 LEU A 123 20.859 -22.666 5.059 1.00 0.77 H new ATOM 1918 N SER A 124 20.298 -24.107 8.935 1.00 0.44 N ATOM 1919 CA SER A 124 20.660 -24.959 10.059 1.00 0.47 C ATOM 1920 C SER A 124 21.965 -24.505 10.705 1.00 0.43 C ATOM 1921 O SER A 124 22.857 -23.982 10.032 1.00 0.48 O ATOM 1922 CB SER A 124 20.778 -26.415 9.600 1.00 0.63 C ATOM 1923 OG SER A 124 19.543 -26.880 9.078 1.00 1.19 O ATOM 0 H SER A 124 21.090 -23.689 8.448 1.00 0.44 H new ATOM 0 HA SER A 124 19.871 -24.880 10.807 1.00 0.47 H new ATOM 0 HB2 SER A 124 21.554 -26.500 8.840 1.00 0.63 H new ATOM 0 HB3 SER A 124 21.083 -27.042 10.438 1.00 0.63 H new ATOM 0 HG SER A 124 19.640 -27.811 8.789 1.00 1.19 H new ATOM 1929 N PHE A 125 22.059 -24.708 12.014 1.00 0.39 N ATOM 1930 CA PHE A 125 23.247 -24.362 12.785 1.00 0.43 C ATOM 1931 C PHE A 125 23.183 -25.048 14.149 1.00 0.46 C ATOM 1932 O PHE A 125 22.106 -25.448 14.592 1.00 0.46 O ATOM 1933 CB PHE A 125 23.358 -22.841 12.961 1.00 0.46 C ATOM 1934 CG PHE A 125 22.360 -22.254 13.929 1.00 0.46 C ATOM 1935 CD1 PHE A 125 20.998 -22.397 13.721 1.00 0.44 C ATOM 1936 CD2 PHE A 125 22.792 -21.551 15.046 1.00 0.62 C ATOM 1937 CE1 PHE A 125 20.086 -21.858 14.605 1.00 0.54 C ATOM 1938 CE2 PHE A 125 21.882 -21.010 15.934 1.00 0.72 C ATOM 1939 CZ PHE A 125 20.527 -21.165 15.713 1.00 0.67 C ATOM 0 H PHE A 125 21.311 -25.119 12.572 1.00 0.39 H new ATOM 0 HA PHE A 125 24.130 -24.705 12.246 1.00 0.43 H new ATOM 0 HB2 PHE A 125 24.364 -22.599 13.303 1.00 0.46 H new ATOM 0 HB3 PHE A 125 23.228 -22.364 11.990 1.00 0.46 H new ATOM 0 HD1 PHE A 125 20.645 -22.938 12.855 1.00 0.44 H new ATOM 0 HD2 PHE A 125 23.850 -21.426 15.222 1.00 0.62 H new ATOM 0 HE1 PHE A 125 19.027 -21.979 14.429 1.00 0.54 H new ATOM 0 HE2 PHE A 125 22.230 -20.466 16.800 1.00 0.72 H new ATOM 0 HZ PHE A 125 19.814 -20.744 16.407 1.00 0.67 H new ATOM 1949 N ARG A 126 24.324 -25.192 14.804 1.00 0.60 N ATOM 1950 CA ARG A 126 24.378 -25.859 16.100 1.00 0.71 C ATOM 1951 C ARG A 126 25.628 -25.458 16.880 1.00 0.76 C ATOM 1952 O ARG A 126 26.751 -25.756 16.473 1.00 0.90 O ATOM 1953 CB ARG A 126 24.321 -27.383 15.896 1.00 0.83 C ATOM 1954 CG ARG A 126 25.282 -27.890 14.832 1.00 0.85 C ATOM 1955 CD ARG A 126 25.040 -29.354 14.488 1.00 1.12 C ATOM 1956 NE ARG A 126 25.220 -30.242 15.638 1.00 1.57 N ATOM 1957 CZ ARG A 126 25.912 -31.384 15.594 1.00 2.14 C ATOM 1958 NH1 ARG A 126 26.544 -31.747 14.480 1.00 2.47 N ATOM 1959 NH2 ARG A 126 26.001 -32.150 16.677 1.00 2.98 N ATOM 0 H ARG A 126 25.225 -24.857 14.462 1.00 0.60 H new ATOM 0 HA ARG A 126 23.517 -25.546 16.690 1.00 0.71 H new ATOM 0 HB2 ARG A 126 24.545 -27.877 16.842 1.00 0.83 H new ATOM 0 HB3 ARG A 126 23.305 -27.667 15.621 1.00 0.83 H new ATOM 0 HG2 ARG A 126 25.176 -27.285 13.932 1.00 0.85 H new ATOM 0 HG3 ARG A 126 26.307 -27.765 15.182 1.00 0.85 H new ATOM 0 HD2 ARG A 126 24.028 -29.469 14.100 1.00 1.12 H new ATOM 0 HD3 ARG A 126 25.722 -29.654 13.693 1.00 1.12 H new ATOM 0 HE ARG A 126 24.792 -29.973 16.524 1.00 1.57 H new ATOM 0 HH11 ARG A 126 26.502 -31.152 13.653 1.00 2.47 H new ATOM 0 HH12 ARG A 126 27.070 -32.620 14.454 1.00 2.47 H new ATOM 0 HH21 ARG A 126 25.541 -31.866 17.542 1.00 2.98 H new ATOM 0 HH22 ARG A 126 26.529 -33.022 16.643 1.00 2.98 H new ATOM 1973 N GLU A 127 25.430 -24.757 17.994 1.00 0.82 N ATOM 1974 CA GLU A 127 26.538 -24.395 18.869 1.00 0.88 C ATOM 1975 C GLU A 127 26.828 -25.509 19.859 1.00 1.01 C ATOM 1976 O GLU A 127 25.909 -26.140 20.388 1.00 1.11 O ATOM 1977 CB GLU A 127 26.259 -23.108 19.647 1.00 1.10 C ATOM 1978 CG GLU A 127 26.651 -21.842 18.914 1.00 1.68 C ATOM 1979 CD GLU A 127 27.074 -20.740 19.868 1.00 2.69 C ATOM 1980 OE1 GLU A 127 28.258 -20.714 20.261 1.00 3.18 O ATOM 1981 OE2 GLU A 127 26.235 -19.886 20.218 1.00 3.38 O ATOM 0 H GLU A 127 24.517 -24.430 18.310 1.00 0.82 H new ATOM 0 HA GLU A 127 27.402 -24.233 18.225 1.00 0.88 H new ATOM 0 HB2 GLU A 127 25.196 -23.063 19.884 1.00 1.10 H new ATOM 0 HB3 GLU A 127 26.795 -23.146 20.595 1.00 1.10 H new ATOM 0 HG2 GLU A 127 27.468 -22.060 18.226 1.00 1.68 H new ATOM 0 HG3 GLU A 127 25.811 -21.497 18.311 1.00 1.68 H new