USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1160 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 67 HIS : no HE2:sc= 0.307 K(o=1.7,f=-10!) USER MOD Set 1.2: B 69 ASN : amide:sc= 1.43 K(o=1.7,f=-12!) USER MOD Set 2.1: B 9 HIS : no HD1:sc= 0.28 K(o=2.6,f=-1.4!) USER MOD Set 2.2: B 37 HIS : no HD1:sc= 0.996 K(o=2.6,f=-3) USER MOD Set 2.3: B 40 THR OG1 : rot 81:sc= 1.28 USER MOD Set 3.1: A 69 ASN : amide:sc= 1.41 K(o=2.4,f=-11!) USER MOD Set 3.2: B 67 HIS : no HE2:sc= 0.959 K(o=2.4,f=-11!) USER MOD Set 4.1: A 37 HIS : no HD1:sc= 0.883 K(o=1.6,f=-4.5) USER MOD Set 4.2: A 40 THR OG1 : rot 40:sc= 0.758 USER MOD Single : A 1 VAL N :NH3+ -145:sc= -0.0967 (180deg=-0.489) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= 0.774 K(o=0.77,f=-4!) USER MOD Single : A 12 CYS SG : rot 180:sc= -0.0944 USER MOD Single : A 15 CYS SG : rot 20:sc= -3.49! USER MOD Single : A 17 SER OG : rot 77:sc= 0.177 USER MOD Single : A 20 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 24 ASN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 29 SER OG : rot 93:sc= 1.23 USER MOD Single : A 30 LYS NZ :NH3+ 169:sc= 2.97 (180deg=1.91) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 177:sc= 0.0405 (180deg=0.0383) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= -0.0821 USER MOD Single : A 78 LYS NZ :NH3+ -149:sc= -0.2 (180deg=-1.1!) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : B 1 VAL N :NH3+ -121:sc= -0.287 (180deg=-0.368) USER MOD Single : B 3 SER OG : rot 180:sc= 0 USER MOD Single : B 4 LYS NZ :NH3+ 159:sc= 1.06 (180deg=0.259) USER MOD Single : B 8 TYR OH : rot 180:sc= 0 USER MOD Single : B 12 CYS SG : rot 180:sc= 0.0624 USER MOD Single : B 15 CYS SG : rot 80:sc= -3.53! USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 20 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : B 24 ASN : amide:sc= 1.18 K(o=1.2,f=-0.053) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 30 LYS NZ :NH3+ -159:sc= 1.28 (180deg=0.264) USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 THR OG1 : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 LYS NZ :NH3+ -169:sc= -0.016 (180deg=-0.121) USER MOD Single : B 54 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00581) USER MOD Single : B 55 SER OG : rot 180:sc= -0.184 USER MOD Single : B 78 LYS NZ :NH3+ -165:sc= -0.248 (180deg=-0.517!) USER MOD Single : B 80 SER OG : rot -1:sc= 0.449 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 30.174 16.298 -13.900 1.00 0.00 N ATOM 2 CA VAL A 1 30.456 17.021 -12.641 1.00 0.00 C ATOM 3 C VAL A 1 29.519 16.533 -11.547 1.00 0.00 C ATOM 4 O VAL A 1 28.342 16.902 -11.509 1.00 0.00 O ATOM 5 CB VAL A 1 30.294 18.548 -12.810 1.00 0.00 C ATOM 6 CG1 VAL A 1 30.700 19.280 -11.538 1.00 0.00 C ATOM 7 CG2 VAL A 1 31.103 19.050 -13.997 1.00 0.00 C ATOM 0 H1 VAL A 1 31.062 16.148 -14.420 1.00 0.00 H new ATOM 0 H2 VAL A 1 29.740 15.378 -13.682 1.00 0.00 H new ATOM 0 H3 VAL A 1 29.521 16.859 -14.484 1.00 0.00 H new ATOM 0 HA VAL A 1 31.491 16.818 -12.367 1.00 0.00 H new ATOM 0 HB VAL A 1 29.241 18.755 -13.002 1.00 0.00 H new ATOM 0 HG11 VAL A 1 30.577 20.354 -11.681 1.00 0.00 H new ATOM 0 HG12 VAL A 1 30.071 18.950 -10.712 1.00 0.00 H new ATOM 0 HG13 VAL A 1 31.743 19.061 -11.309 1.00 0.00 H new ATOM 0 HG21 VAL A 1 30.973 20.128 -14.096 1.00 0.00 H new ATOM 0 HG22 VAL A 1 32.158 18.824 -13.840 1.00 0.00 H new ATOM 0 HG23 VAL A 1 30.758 18.558 -14.906 1.00 0.00 H new ATOM 19 N ALA A 2 30.040 15.697 -10.665 1.00 0.00 N ATOM 20 CA ALA A 2 29.231 15.076 -9.632 1.00 0.00 C ATOM 21 C ALA A 2 29.183 15.928 -8.372 1.00 0.00 C ATOM 22 O ALA A 2 30.219 16.301 -7.819 1.00 0.00 O ATOM 23 CB ALA A 2 29.767 13.688 -9.310 1.00 0.00 C ATOM 0 H ALA A 2 31.025 15.432 -10.645 1.00 0.00 H new ATOM 0 HA ALA A 2 28.213 14.988 -10.012 1.00 0.00 H new ATOM 0 HB1 ALA A 2 29.153 13.232 -8.534 1.00 0.00 H new ATOM 0 HB2 ALA A 2 29.737 13.069 -10.207 1.00 0.00 H new ATOM 0 HB3 ALA A 2 30.796 13.768 -8.958 1.00 0.00 H new ATOM 29 N SER A 3 27.977 16.249 -7.933 1.00 0.00 N ATOM 30 CA SER A 3 27.782 16.939 -6.669 1.00 0.00 C ATOM 31 C SER A 3 27.690 15.911 -5.551 1.00 0.00 C ATOM 32 O SER A 3 27.341 14.758 -5.801 1.00 0.00 O ATOM 33 CB SER A 3 26.507 17.780 -6.715 1.00 0.00 C ATOM 34 OG SER A 3 26.505 18.641 -7.841 1.00 0.00 O ATOM 0 H SER A 3 27.115 16.041 -8.436 1.00 0.00 H new ATOM 0 HA SER A 3 28.626 17.604 -6.486 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.637 17.125 -6.752 1.00 0.00 H new ATOM 0 HB3 SER A 3 26.423 18.370 -5.802 1.00 0.00 H new ATOM 0 HG SER A 3 25.678 19.167 -7.849 1.00 0.00 H new ATOM 40 N LYS A 4 28.001 16.307 -4.330 1.00 0.00 N ATOM 41 CA LYS A 4 27.967 15.365 -3.226 1.00 0.00 C ATOM 42 C LYS A 4 26.588 15.334 -2.573 1.00 0.00 C ATOM 43 O LYS A 4 25.935 16.366 -2.403 1.00 0.00 O ATOM 44 CB LYS A 4 29.048 15.679 -2.185 1.00 0.00 C ATOM 45 CG LYS A 4 28.848 16.985 -1.431 1.00 0.00 C ATOM 46 CD LYS A 4 29.879 17.124 -0.323 1.00 0.00 C ATOM 47 CE LYS A 4 29.622 18.339 0.552 1.00 0.00 C ATOM 48 NZ LYS A 4 30.567 18.387 1.700 1.00 0.00 N ATOM 0 H LYS A 4 28.275 17.257 -4.080 1.00 0.00 H new ATOM 0 HA LYS A 4 28.175 14.377 -3.637 1.00 0.00 H new ATOM 0 HB2 LYS A 4 29.087 14.862 -1.464 1.00 0.00 H new ATOM 0 HB3 LYS A 4 30.016 15.709 -2.685 1.00 0.00 H new ATOM 0 HG2 LYS A 4 28.930 17.826 -2.120 1.00 0.00 H new ATOM 0 HG3 LYS A 4 27.844 17.017 -1.008 1.00 0.00 H new ATOM 0 HD2 LYS A 4 29.870 16.226 0.294 1.00 0.00 H new ATOM 0 HD3 LYS A 4 30.874 17.199 -0.762 1.00 0.00 H new ATOM 0 HE2 LYS A 4 29.723 19.247 -0.043 1.00 0.00 H new ATOM 0 HE3 LYS A 4 28.597 18.313 0.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 30.367 19.227 2.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 30.452 17.531 2.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 31.543 18.436 1.344 1.00 0.00 H new ATOM 62 N ALA A 5 26.150 14.133 -2.242 1.00 0.00 N ATOM 63 CA ALA A 5 24.901 13.929 -1.536 1.00 0.00 C ATOM 64 C ALA A 5 25.185 13.273 -0.197 1.00 0.00 C ATOM 65 O ALA A 5 25.632 12.128 -0.141 1.00 0.00 O ATOM 66 CB ALA A 5 23.952 13.073 -2.365 1.00 0.00 C ATOM 0 H ALA A 5 26.652 13.271 -2.456 1.00 0.00 H new ATOM 0 HA ALA A 5 24.420 14.893 -1.368 1.00 0.00 H new ATOM 0 HB1 ALA A 5 23.020 12.930 -1.819 1.00 0.00 H new ATOM 0 HB2 ALA A 5 23.745 13.572 -3.312 1.00 0.00 H new ATOM 0 HB3 ALA A 5 24.411 12.103 -2.558 1.00 0.00 H new ATOM 72 N ILE A 6 24.938 13.999 0.878 1.00 0.00 N ATOM 73 CA ILE A 6 25.278 13.523 2.208 1.00 0.00 C ATOM 74 C ILE A 6 24.078 12.854 2.860 1.00 0.00 C ATOM 75 O ILE A 6 23.024 13.467 3.023 1.00 0.00 O ATOM 76 CB ILE A 6 25.779 14.671 3.110 1.00 0.00 C ATOM 77 CG1 ILE A 6 26.885 15.460 2.404 1.00 0.00 C ATOM 78 CG2 ILE A 6 26.284 14.113 4.434 1.00 0.00 C ATOM 79 CD1 ILE A 6 27.374 16.660 3.188 1.00 0.00 C ATOM 0 H ILE A 6 24.503 14.921 0.857 1.00 0.00 H new ATOM 0 HA ILE A 6 26.082 12.796 2.095 1.00 0.00 H new ATOM 0 HB ILE A 6 24.949 15.348 3.310 1.00 0.00 H new ATOM 0 HG12 ILE A 6 27.727 14.795 2.212 1.00 0.00 H new ATOM 0 HG13 ILE A 6 26.517 15.796 1.435 1.00 0.00 H new ATOM 0 HG21 ILE A 6 26.635 14.931 5.063 1.00 0.00 H new ATOM 0 HG22 ILE A 6 25.474 13.588 4.940 1.00 0.00 H new ATOM 0 HG23 ILE A 6 27.105 13.420 4.248 1.00 0.00 H new ATOM 0 HD11 ILE A 6 28.156 17.168 2.625 1.00 0.00 H new ATOM 0 HD12 ILE A 6 26.544 17.346 3.358 1.00 0.00 H new ATOM 0 HD13 ILE A 6 27.774 16.330 4.147 1.00 0.00 H new ATOM 91 N PHE A 7 24.242 11.596 3.221 1.00 0.00 N ATOM 92 CA PHE A 7 23.171 10.829 3.824 1.00 0.00 C ATOM 93 C PHE A 7 23.405 10.689 5.324 1.00 0.00 C ATOM 94 O PHE A 7 24.246 9.904 5.761 1.00 0.00 O ATOM 95 CB PHE A 7 23.076 9.450 3.160 1.00 0.00 C ATOM 96 CG PHE A 7 21.912 8.621 3.624 1.00 0.00 C ATOM 97 CD1 PHE A 7 20.621 8.935 3.230 1.00 0.00 C ATOM 98 CD2 PHE A 7 22.107 7.526 4.451 1.00 0.00 C ATOM 99 CE1 PHE A 7 19.549 8.173 3.651 1.00 0.00 C ATOM 100 CE2 PHE A 7 21.039 6.759 4.875 1.00 0.00 C ATOM 101 CZ PHE A 7 19.758 7.084 4.474 1.00 0.00 C ATOM 0 H PHE A 7 25.115 11.081 3.106 1.00 0.00 H new ATOM 0 HA PHE A 7 22.228 11.353 3.671 1.00 0.00 H new ATOM 0 HB2 PHE A 7 23.005 9.583 2.081 1.00 0.00 H new ATOM 0 HB3 PHE A 7 23.998 8.902 3.354 1.00 0.00 H new ATOM 0 HD1 PHE A 7 20.451 9.785 2.586 1.00 0.00 H new ATOM 0 HD2 PHE A 7 23.107 7.269 4.768 1.00 0.00 H new ATOM 0 HE1 PHE A 7 18.548 8.429 3.337 1.00 0.00 H new ATOM 0 HE2 PHE A 7 21.205 5.908 5.518 1.00 0.00 H new ATOM 0 HZ PHE A 7 18.921 6.487 4.804 1.00 0.00 H new ATOM 111 N TYR A 8 22.677 11.474 6.102 1.00 0.00 N ATOM 112 CA TYR A 8 22.784 11.426 7.554 1.00 0.00 C ATOM 113 C TYR A 8 21.801 10.417 8.121 1.00 0.00 C ATOM 114 O TYR A 8 20.597 10.516 7.890 1.00 0.00 O ATOM 115 CB TYR A 8 22.513 12.802 8.168 1.00 0.00 C ATOM 116 CG TYR A 8 23.613 13.811 7.935 1.00 0.00 C ATOM 117 CD1 TYR A 8 24.863 13.641 8.516 1.00 0.00 C ATOM 118 CD2 TYR A 8 23.402 14.936 7.149 1.00 0.00 C ATOM 119 CE1 TYR A 8 25.871 14.563 8.321 1.00 0.00 C ATOM 120 CE2 TYR A 8 24.408 15.863 6.947 1.00 0.00 C ATOM 121 CZ TYR A 8 25.640 15.670 7.536 1.00 0.00 C ATOM 122 OH TYR A 8 26.647 16.586 7.340 1.00 0.00 O ATOM 0 H TYR A 8 22.003 12.155 5.752 1.00 0.00 H new ATOM 0 HA TYR A 8 23.800 11.123 7.806 1.00 0.00 H new ATOM 0 HB2 TYR A 8 21.583 13.194 7.757 1.00 0.00 H new ATOM 0 HB3 TYR A 8 22.363 12.686 9.241 1.00 0.00 H new ATOM 0 HD1 TYR A 8 25.049 12.773 9.131 1.00 0.00 H new ATOM 0 HD2 TYR A 8 22.437 15.089 6.688 1.00 0.00 H new ATOM 0 HE1 TYR A 8 26.837 14.417 8.782 1.00 0.00 H new ATOM 0 HE2 TYR A 8 24.230 16.733 6.332 1.00 0.00 H new ATOM 0 HH TYR A 8 26.324 17.308 6.761 1.00 0.00 H new ATOM 132 N HIS A 9 22.310 9.445 8.859 1.00 0.00 N ATOM 133 CA HIS A 9 21.456 8.433 9.462 1.00 0.00 C ATOM 134 C HIS A 9 21.834 8.212 10.923 1.00 0.00 C ATOM 135 O HIS A 9 22.810 8.784 11.411 1.00 0.00 O ATOM 136 CB HIS A 9 21.540 7.119 8.678 1.00 0.00 C ATOM 137 CG HIS A 9 22.865 6.426 8.769 1.00 0.00 C ATOM 138 ND1 HIS A 9 23.034 5.316 9.558 1.00 0.00 N ATOM 139 CD2 HIS A 9 24.034 6.715 8.152 1.00 0.00 C ATOM 140 CE1 HIS A 9 24.296 4.954 9.404 1.00 0.00 C ATOM 141 NE2 HIS A 9 24.939 5.773 8.562 1.00 0.00 N ATOM 0 H HIS A 9 23.305 9.334 9.055 1.00 0.00 H new ATOM 0 HA HIS A 9 20.426 8.788 9.425 1.00 0.00 H new ATOM 0 HB2 HIS A 9 20.765 6.444 9.041 1.00 0.00 H new ATOM 0 HB3 HIS A 9 21.321 7.321 7.630 1.00 0.00 H new ATOM 0 HD2 HIS A 9 24.218 7.531 7.468 1.00 0.00 H new ATOM 0 HE1 HIS A 9 24.750 4.106 9.895 1.00 0.00 H new ATOM 0 HE2 HIS A 9 25.917 5.708 8.280 1.00 0.00 H new ATOM 149 N ALA A 10 21.065 7.381 11.614 1.00 0.00 N ATOM 150 CA ALA A 10 21.293 7.128 13.031 1.00 0.00 C ATOM 151 C ALA A 10 21.530 5.644 13.299 1.00 0.00 C ATOM 152 O ALA A 10 21.397 5.181 14.432 1.00 0.00 O ATOM 153 CB ALA A 10 20.114 7.636 13.848 1.00 0.00 C ATOM 0 H ALA A 10 20.277 6.870 11.216 1.00 0.00 H new ATOM 0 HA ALA A 10 22.192 7.666 13.332 1.00 0.00 H new ATOM 0 HB1 ALA A 10 20.294 7.442 14.905 1.00 0.00 H new ATOM 0 HB2 ALA A 10 19.997 8.708 13.690 1.00 0.00 H new ATOM 0 HB3 ALA A 10 19.206 7.122 13.534 1.00 0.00 H new ATOM 159 N GLY A 11 21.889 4.906 12.255 1.00 0.00 N ATOM 160 CA GLY A 11 22.169 3.489 12.407 1.00 0.00 C ATOM 161 C GLY A 11 20.913 2.652 12.555 1.00 0.00 C ATOM 162 O GLY A 11 20.961 1.527 13.049 1.00 0.00 O ATOM 0 H GLY A 11 21.991 5.263 11.305 1.00 0.00 H new ATOM 0 HA2 GLY A 11 22.732 3.140 11.541 1.00 0.00 H new ATOM 0 HA3 GLY A 11 22.803 3.341 13.281 1.00 0.00 H new ATOM 166 N CYS A 12 19.788 3.204 12.130 1.00 0.00 N ATOM 167 CA CYS A 12 18.518 2.499 12.203 1.00 0.00 C ATOM 168 C CYS A 12 18.359 1.577 10.994 1.00 0.00 C ATOM 169 O CYS A 12 18.907 1.854 9.927 1.00 0.00 O ATOM 170 CB CYS A 12 17.370 3.508 12.256 1.00 0.00 C ATOM 171 SG CYS A 12 17.559 4.764 13.542 1.00 0.00 S ATOM 0 H CYS A 12 19.728 4.140 11.730 1.00 0.00 H new ATOM 0 HA CYS A 12 18.497 1.892 13.108 1.00 0.00 H new ATOM 0 HB2 CYS A 12 17.289 4.002 11.288 1.00 0.00 H new ATOM 0 HB3 CYS A 12 16.435 2.972 12.420 1.00 0.00 H new ATOM 0 HG CYS A 12 16.543 5.574 13.510 1.00 0.00 H new ATOM 177 N PRO A 13 17.610 0.468 11.143 1.00 0.00 N ATOM 178 CA PRO A 13 17.380 -0.489 10.050 1.00 0.00 C ATOM 179 C PRO A 13 16.834 0.187 8.792 1.00 0.00 C ATOM 180 O PRO A 13 17.224 -0.150 7.674 1.00 0.00 O ATOM 181 CB PRO A 13 16.346 -1.455 10.632 1.00 0.00 C ATOM 182 CG PRO A 13 16.541 -1.373 12.106 1.00 0.00 C ATOM 183 CD PRO A 13 16.945 0.045 12.391 1.00 0.00 C ATOM 0 HA PRO A 13 18.303 -0.975 9.733 1.00 0.00 H new ATOM 0 HB2 PRO A 13 15.333 -1.168 10.350 1.00 0.00 H new ATOM 0 HB3 PRO A 13 16.503 -2.470 10.267 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.624 -1.632 12.636 1.00 0.00 H new ATOM 0 HG3 PRO A 13 17.309 -2.072 12.438 1.00 0.00 H new ATOM 0 HD2 PRO A 13 16.082 0.671 12.619 1.00 0.00 H new ATOM 0 HD3 PRO A 13 17.618 0.107 13.246 1.00 0.00 H new ATOM 191 N VAL A 14 15.946 1.158 8.989 1.00 0.00 N ATOM 192 CA VAL A 14 15.351 1.901 7.881 1.00 0.00 C ATOM 193 C VAL A 14 16.426 2.631 7.075 1.00 0.00 C ATOM 194 O VAL A 14 16.343 2.730 5.850 1.00 0.00 O ATOM 195 CB VAL A 14 14.313 2.927 8.392 1.00 0.00 C ATOM 196 CG1 VAL A 14 13.615 3.622 7.232 1.00 0.00 C ATOM 197 CG2 VAL A 14 13.298 2.254 9.304 1.00 0.00 C ATOM 0 H VAL A 14 15.621 1.450 9.911 1.00 0.00 H new ATOM 0 HA VAL A 14 14.849 1.178 7.238 1.00 0.00 H new ATOM 0 HB VAL A 14 14.844 3.685 8.968 1.00 0.00 H new ATOM 0 HG11 VAL A 14 12.890 4.338 7.620 1.00 0.00 H new ATOM 0 HG12 VAL A 14 14.353 4.145 6.624 1.00 0.00 H new ATOM 0 HG13 VAL A 14 13.101 2.881 6.620 1.00 0.00 H new ATOM 0 HG21 VAL A 14 12.576 2.993 9.653 1.00 0.00 H new ATOM 0 HG22 VAL A 14 12.778 1.470 8.753 1.00 0.00 H new ATOM 0 HG23 VAL A 14 13.812 1.816 10.160 1.00 0.00 H new ATOM 207 N CYS A 15 17.447 3.115 7.771 1.00 0.00 N ATOM 208 CA CYS A 15 18.541 3.832 7.134 1.00 0.00 C ATOM 209 C CYS A 15 19.323 2.899 6.213 1.00 0.00 C ATOM 210 O CYS A 15 19.719 3.284 5.113 1.00 0.00 O ATOM 211 CB CYS A 15 19.470 4.419 8.196 1.00 0.00 C ATOM 212 SG CYS A 15 18.618 5.389 9.465 1.00 0.00 S ATOM 0 H CYS A 15 17.539 3.022 8.783 1.00 0.00 H new ATOM 0 HA CYS A 15 18.126 4.644 6.537 1.00 0.00 H new ATOM 0 HB2 CYS A 15 20.013 3.606 8.678 1.00 0.00 H new ATOM 0 HB3 CYS A 15 20.211 5.051 7.707 1.00 0.00 H new ATOM 0 HG CYS A 15 17.358 5.068 9.484 1.00 0.00 H new ATOM 218 N VAL A 16 19.520 1.665 6.667 1.00 0.00 N ATOM 219 CA VAL A 16 20.231 0.662 5.885 1.00 0.00 C ATOM 220 C VAL A 16 19.449 0.317 4.619 1.00 0.00 C ATOM 221 O VAL A 16 20.024 0.159 3.543 1.00 0.00 O ATOM 222 CB VAL A 16 20.471 -0.626 6.706 1.00 0.00 C ATOM 223 CG1 VAL A 16 21.292 -1.632 5.913 1.00 0.00 C ATOM 224 CG2 VAL A 16 21.153 -0.297 8.027 1.00 0.00 C ATOM 0 H VAL A 16 19.195 1.336 7.576 1.00 0.00 H new ATOM 0 HA VAL A 16 21.197 1.086 5.612 1.00 0.00 H new ATOM 0 HB VAL A 16 19.502 -1.077 6.921 1.00 0.00 H new ATOM 0 HG11 VAL A 16 21.447 -2.529 6.513 1.00 0.00 H new ATOM 0 HG12 VAL A 16 20.761 -1.895 4.998 1.00 0.00 H new ATOM 0 HG13 VAL A 16 22.257 -1.194 5.659 1.00 0.00 H new ATOM 0 HG21 VAL A 16 21.314 -1.215 8.592 1.00 0.00 H new ATOM 0 HG22 VAL A 16 22.112 0.182 7.832 1.00 0.00 H new ATOM 0 HG23 VAL A 16 20.521 0.378 8.604 1.00 0.00 H new ATOM 234 N SER A 17 18.132 0.223 4.752 1.00 0.00 N ATOM 235 CA SER A 17 17.269 -0.061 3.616 1.00 0.00 C ATOM 236 C SER A 17 17.345 1.065 2.586 1.00 0.00 C ATOM 237 O SER A 17 17.339 0.821 1.379 1.00 0.00 O ATOM 238 CB SER A 17 15.831 -0.257 4.096 1.00 0.00 C ATOM 239 OG SER A 17 15.776 -1.241 5.116 1.00 0.00 O ATOM 0 H SER A 17 17.639 0.340 5.637 1.00 0.00 H new ATOM 0 HA SER A 17 17.609 -0.979 3.136 1.00 0.00 H new ATOM 0 HB2 SER A 17 15.435 0.687 4.472 1.00 0.00 H new ATOM 0 HB3 SER A 17 15.200 -0.557 3.259 1.00 0.00 H new ATOM 0 HG SER A 17 16.098 -0.857 5.958 1.00 0.00 H new ATOM 245 N ALA A 18 17.440 2.299 3.069 1.00 0.00 N ATOM 246 CA ALA A 18 17.582 3.451 2.191 1.00 0.00 C ATOM 247 C ALA A 18 18.946 3.439 1.506 1.00 0.00 C ATOM 248 O ALA A 18 19.074 3.826 0.345 1.00 0.00 O ATOM 249 CB ALA A 18 17.384 4.741 2.971 1.00 0.00 C ATOM 0 H ALA A 18 17.421 2.525 4.063 1.00 0.00 H new ATOM 0 HA ALA A 18 16.813 3.394 1.420 1.00 0.00 H new ATOM 0 HB1 ALA A 18 17.494 5.593 2.300 1.00 0.00 H new ATOM 0 HB2 ALA A 18 16.386 4.751 3.410 1.00 0.00 H new ATOM 0 HB3 ALA A 18 18.130 4.805 3.763 1.00 0.00 H new ATOM 255 N GLU A 19 19.956 2.976 2.236 1.00 0.00 N ATOM 256 CA GLU A 19 21.311 2.869 1.706 1.00 0.00 C ATOM 257 C GLU A 19 21.372 1.866 0.554 1.00 0.00 C ATOM 258 O GLU A 19 22.004 2.120 -0.471 1.00 0.00 O ATOM 259 CB GLU A 19 22.279 2.442 2.815 1.00 0.00 C ATOM 260 CG GLU A 19 23.705 2.233 2.331 1.00 0.00 C ATOM 261 CD GLU A 19 24.622 1.693 3.410 1.00 0.00 C ATOM 262 OE1 GLU A 19 24.715 0.458 3.546 1.00 0.00 O ATOM 263 OE2 GLU A 19 25.271 2.498 4.112 1.00 0.00 O ATOM 0 H GLU A 19 19.860 2.667 3.203 1.00 0.00 H new ATOM 0 HA GLU A 19 21.604 3.848 1.327 1.00 0.00 H new ATOM 0 HB2 GLU A 19 22.278 3.200 3.599 1.00 0.00 H new ATOM 0 HB3 GLU A 19 21.918 1.517 3.265 1.00 0.00 H new ATOM 0 HG2 GLU A 19 23.699 1.543 1.487 1.00 0.00 H new ATOM 0 HG3 GLU A 19 24.101 3.180 1.965 1.00 0.00 H new ATOM 270 N GLN A 20 20.704 0.735 0.724 1.00 0.00 N ATOM 271 CA GLN A 20 20.754 -0.339 -0.260 1.00 0.00 C ATOM 272 C GLN A 20 19.846 -0.063 -1.457 1.00 0.00 C ATOM 273 O GLN A 20 20.045 -0.618 -2.534 1.00 0.00 O ATOM 274 CB GLN A 20 20.370 -1.666 0.393 1.00 0.00 C ATOM 275 CG GLN A 20 21.323 -2.096 1.495 1.00 0.00 C ATOM 276 CD GLN A 20 20.901 -3.388 2.165 1.00 0.00 C ATOM 277 OE1 GLN A 20 19.711 -3.696 2.258 1.00 0.00 O ATOM 278 NE2 GLN A 20 21.873 -4.154 2.630 1.00 0.00 N ATOM 0 H GLN A 20 20.119 0.536 1.536 1.00 0.00 H new ATOM 0 HA GLN A 20 21.777 -0.396 -0.631 1.00 0.00 H new ATOM 0 HB2 GLN A 20 19.364 -1.582 0.805 1.00 0.00 H new ATOM 0 HB3 GLN A 20 20.337 -2.442 -0.372 1.00 0.00 H new ATOM 0 HG2 GLN A 20 22.322 -2.218 1.078 1.00 0.00 H new ATOM 0 HG3 GLN A 20 21.385 -1.307 2.244 1.00 0.00 H new ATOM 0 HE21 GLN A 20 22.845 -3.861 2.532 1.00 0.00 H new ATOM 0 HE22 GLN A 20 21.651 -5.038 3.087 1.00 0.00 H new ATOM 287 N ALA A 21 18.850 0.792 -1.272 1.00 0.00 N ATOM 288 CA ALA A 21 17.904 1.083 -2.342 1.00 0.00 C ATOM 289 C ALA A 21 18.167 2.445 -2.979 1.00 0.00 C ATOM 290 O ALA A 21 18.581 2.530 -4.136 1.00 0.00 O ATOM 291 CB ALA A 21 16.479 1.009 -1.819 1.00 0.00 C ATOM 0 H ALA A 21 18.676 1.292 -0.400 1.00 0.00 H new ATOM 0 HA ALA A 21 18.040 0.328 -3.117 1.00 0.00 H new ATOM 0 HB1 ALA A 21 15.783 1.228 -2.628 1.00 0.00 H new ATOM 0 HB2 ALA A 21 16.284 0.008 -1.434 1.00 0.00 H new ATOM 0 HB3 ALA A 21 16.347 1.737 -1.019 1.00 0.00 H new ATOM 297 N VAL A 22 17.945 3.505 -2.213 1.00 0.00 N ATOM 298 CA VAL A 22 18.037 4.865 -2.733 1.00 0.00 C ATOM 299 C VAL A 22 19.461 5.197 -3.170 1.00 0.00 C ATOM 300 O VAL A 22 19.676 5.747 -4.251 1.00 0.00 O ATOM 301 CB VAL A 22 17.571 5.901 -1.686 1.00 0.00 C ATOM 302 CG1 VAL A 22 17.580 7.307 -2.273 1.00 0.00 C ATOM 303 CG2 VAL A 22 16.189 5.547 -1.158 1.00 0.00 C ATOM 0 H VAL A 22 17.699 3.450 -1.225 1.00 0.00 H new ATOM 0 HA VAL A 22 17.378 4.916 -3.600 1.00 0.00 H new ATOM 0 HB VAL A 22 18.272 5.878 -0.851 1.00 0.00 H new ATOM 0 HG11 VAL A 22 17.248 8.019 -1.517 1.00 0.00 H new ATOM 0 HG12 VAL A 22 18.591 7.561 -2.592 1.00 0.00 H new ATOM 0 HG13 VAL A 22 16.908 7.348 -3.130 1.00 0.00 H new ATOM 0 HG21 VAL A 22 15.880 6.289 -0.422 1.00 0.00 H new ATOM 0 HG22 VAL A 22 15.476 5.535 -1.983 1.00 0.00 H new ATOM 0 HG23 VAL A 22 16.219 4.563 -0.690 1.00 0.00 H new ATOM 313 N ALA A 23 20.432 4.829 -2.344 1.00 0.00 N ATOM 314 CA ALA A 23 21.830 5.133 -2.629 1.00 0.00 C ATOM 315 C ALA A 23 22.389 4.229 -3.728 1.00 0.00 C ATOM 316 O ALA A 23 23.533 4.385 -4.152 1.00 0.00 O ATOM 317 CB ALA A 23 22.664 5.023 -1.361 1.00 0.00 C ATOM 0 H ALA A 23 20.279 4.321 -1.473 1.00 0.00 H new ATOM 0 HA ALA A 23 21.883 6.159 -2.994 1.00 0.00 H new ATOM 0 HB1 ALA A 23 23.705 5.253 -1.589 1.00 0.00 H new ATOM 0 HB2 ALA A 23 22.291 5.728 -0.618 1.00 0.00 H new ATOM 0 HB3 ALA A 23 22.594 4.009 -0.966 1.00 0.00 H new ATOM 323 N ASN A 24 21.581 3.277 -4.181 1.00 0.00 N ATOM 324 CA ASN A 24 21.958 2.421 -5.303 1.00 0.00 C ATOM 325 C ASN A 24 21.266 2.882 -6.578 1.00 0.00 C ATOM 326 O ASN A 24 21.635 2.482 -7.681 1.00 0.00 O ATOM 327 CB ASN A 24 21.618 0.956 -5.017 1.00 0.00 C ATOM 328 CG ASN A 24 22.685 0.257 -4.195 1.00 0.00 C ATOM 329 OD1 ASN A 24 23.404 0.885 -3.418 1.00 0.00 O ATOM 330 ND2 ASN A 24 22.796 -1.052 -4.363 1.00 0.00 N ATOM 0 H ASN A 24 20.661 3.077 -3.789 1.00 0.00 H new ATOM 0 HA ASN A 24 23.037 2.500 -5.438 1.00 0.00 H new ATOM 0 HB2 ASN A 24 20.666 0.905 -4.488 1.00 0.00 H new ATOM 0 HB3 ASN A 24 21.487 0.427 -5.961 1.00 0.00 H new ATOM 0 HD21 ASN A 24 23.497 -1.576 -3.838 1.00 0.00 H new ATOM 0 HD22 ASN A 24 22.181 -1.536 -5.017 1.00 0.00 H new ATOM 337 N ALA A 25 20.251 3.720 -6.418 1.00 0.00 N ATOM 338 CA ALA A 25 19.556 4.299 -7.558 1.00 0.00 C ATOM 339 C ALA A 25 20.261 5.566 -8.020 1.00 0.00 C ATOM 340 O ALA A 25 20.274 5.886 -9.210 1.00 0.00 O ATOM 341 CB ALA A 25 18.108 4.594 -7.208 1.00 0.00 C ATOM 0 H ALA A 25 19.891 4.014 -5.510 1.00 0.00 H new ATOM 0 HA ALA A 25 19.571 3.576 -8.374 1.00 0.00 H new ATOM 0 HB1 ALA A 25 17.605 5.026 -8.073 1.00 0.00 H new ATOM 0 HB2 ALA A 25 17.607 3.669 -6.922 1.00 0.00 H new ATOM 0 HB3 ALA A 25 18.071 5.299 -6.377 1.00 0.00 H new ATOM 347 N ILE A 26 20.844 6.285 -7.069 1.00 0.00 N ATOM 348 CA ILE A 26 21.622 7.470 -7.383 1.00 0.00 C ATOM 349 C ILE A 26 23.012 7.058 -7.847 1.00 0.00 C ATOM 350 O ILE A 26 23.827 6.583 -7.056 1.00 0.00 O ATOM 351 CB ILE A 26 21.736 8.421 -6.170 1.00 0.00 C ATOM 352 CG1 ILE A 26 20.340 8.822 -5.681 1.00 0.00 C ATOM 353 CG2 ILE A 26 22.548 9.657 -6.539 1.00 0.00 C ATOM 354 CD1 ILE A 26 20.356 9.707 -4.453 1.00 0.00 C ATOM 0 H ILE A 26 20.791 6.066 -6.074 1.00 0.00 H new ATOM 0 HA ILE A 26 21.107 8.009 -8.178 1.00 0.00 H new ATOM 0 HB ILE A 26 22.251 7.900 -5.363 1.00 0.00 H new ATOM 0 HG12 ILE A 26 19.818 9.341 -6.485 1.00 0.00 H new ATOM 0 HG13 ILE A 26 19.769 7.920 -5.461 1.00 0.00 H new ATOM 0 HG21 ILE A 26 22.619 10.317 -5.674 1.00 0.00 H new ATOM 0 HG22 ILE A 26 23.549 9.356 -6.849 1.00 0.00 H new ATOM 0 HG23 ILE A 26 22.058 10.183 -7.358 1.00 0.00 H new ATOM 0 HD11 ILE A 26 19.333 9.950 -4.166 1.00 0.00 H new ATOM 0 HD12 ILE A 26 20.848 9.183 -3.634 1.00 0.00 H new ATOM 0 HD13 ILE A 26 20.898 10.626 -4.674 1.00 0.00 H new ATOM 366 N ASP A 27 23.262 7.219 -9.138 1.00 0.00 N ATOM 367 CA ASP A 27 24.514 6.775 -9.737 1.00 0.00 C ATOM 368 C ASP A 27 25.674 7.652 -9.278 1.00 0.00 C ATOM 369 O ASP A 27 25.599 8.881 -9.355 1.00 0.00 O ATOM 370 CB ASP A 27 24.412 6.808 -11.263 1.00 0.00 C ATOM 371 CG ASP A 27 25.462 5.943 -11.931 1.00 0.00 C ATOM 372 OD1 ASP A 27 26.647 6.327 -11.934 1.00 0.00 O ATOM 373 OD2 ASP A 27 25.098 4.865 -12.454 1.00 0.00 O ATOM 0 H ASP A 27 22.613 7.655 -9.793 1.00 0.00 H new ATOM 0 HA ASP A 27 24.702 5.751 -9.413 1.00 0.00 H new ATOM 0 HB2 ASP A 27 23.421 6.470 -11.566 1.00 0.00 H new ATOM 0 HB3 ASP A 27 24.518 7.836 -11.609 1.00 0.00 H new ATOM 378 N PRO A 28 26.763 7.026 -8.799 1.00 0.00 N ATOM 379 CA PRO A 28 27.960 7.738 -8.325 1.00 0.00 C ATOM 380 C PRO A 28 28.607 8.604 -9.406 1.00 0.00 C ATOM 381 O PRO A 28 29.392 9.504 -9.102 1.00 0.00 O ATOM 382 CB PRO A 28 28.913 6.611 -7.910 1.00 0.00 C ATOM 383 CG PRO A 28 28.036 5.430 -7.680 1.00 0.00 C ATOM 384 CD PRO A 28 26.905 5.567 -8.657 1.00 0.00 C ATOM 0 HA PRO A 28 27.715 8.431 -7.520 1.00 0.00 H new ATOM 0 HB2 PRO A 28 29.649 6.410 -8.688 1.00 0.00 H new ATOM 0 HB3 PRO A 28 29.466 6.874 -7.008 1.00 0.00 H new ATOM 0 HG2 PRO A 28 28.582 4.500 -7.841 1.00 0.00 H new ATOM 0 HG3 PRO A 28 27.667 5.410 -6.654 1.00 0.00 H new ATOM 0 HD2 PRO A 28 27.135 5.090 -9.610 1.00 0.00 H new ATOM 0 HD3 PRO A 28 25.990 5.107 -8.282 1.00 0.00 H new ATOM 392 N SER A 29 28.281 8.330 -10.665 1.00 0.00 N ATOM 393 CA SER A 29 28.809 9.111 -11.777 1.00 0.00 C ATOM 394 C SER A 29 28.082 10.451 -11.878 1.00 0.00 C ATOM 395 O SER A 29 28.564 11.389 -12.513 1.00 0.00 O ATOM 396 CB SER A 29 28.653 8.337 -13.088 1.00 0.00 C ATOM 397 OG SER A 29 29.039 6.981 -12.928 1.00 0.00 O ATOM 0 H SER A 29 27.654 7.574 -10.940 1.00 0.00 H new ATOM 0 HA SER A 29 29.868 9.296 -11.597 1.00 0.00 H new ATOM 0 HB2 SER A 29 27.617 8.387 -13.422 1.00 0.00 H new ATOM 0 HB3 SER A 29 29.261 8.803 -13.864 1.00 0.00 H new ATOM 0 HG SER A 29 28.253 6.442 -12.702 1.00 0.00 H new ATOM 403 N LYS A 30 26.919 10.530 -11.242 1.00 0.00 N ATOM 404 CA LYS A 30 26.107 11.737 -11.271 1.00 0.00 C ATOM 405 C LYS A 30 26.224 12.486 -9.951 1.00 0.00 C ATOM 406 O LYS A 30 26.377 13.708 -9.925 1.00 0.00 O ATOM 407 CB LYS A 30 24.643 11.383 -11.541 1.00 0.00 C ATOM 408 CG LYS A 30 24.438 10.594 -12.823 1.00 0.00 C ATOM 409 CD LYS A 30 22.985 10.195 -13.015 1.00 0.00 C ATOM 410 CE LYS A 30 22.084 11.403 -13.215 1.00 0.00 C ATOM 411 NZ LYS A 30 20.664 11.005 -13.396 1.00 0.00 N ATOM 0 H LYS A 30 26.517 9.767 -10.698 1.00 0.00 H new ATOM 0 HA LYS A 30 26.470 12.379 -12.073 1.00 0.00 H new ATOM 0 HB2 LYS A 30 24.256 10.805 -10.702 1.00 0.00 H new ATOM 0 HB3 LYS A 30 24.058 12.302 -11.591 1.00 0.00 H new ATOM 0 HG2 LYS A 30 24.766 11.191 -13.674 1.00 0.00 H new ATOM 0 HG3 LYS A 30 25.061 9.700 -12.803 1.00 0.00 H new ATOM 0 HD2 LYS A 30 22.902 9.534 -13.878 1.00 0.00 H new ATOM 0 HD3 LYS A 30 22.646 9.630 -12.146 1.00 0.00 H new ATOM 0 HE2 LYS A 30 22.169 12.067 -12.355 1.00 0.00 H new ATOM 0 HE3 LYS A 30 22.418 11.966 -14.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 20.058 11.848 -13.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 20.546 10.552 -14.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 20.393 10.336 -12.647 1.00 0.00 H new ATOM 425 N TYR A 31 26.146 11.744 -8.855 1.00 0.00 N ATOM 426 CA TYR A 31 26.257 12.327 -7.528 1.00 0.00 C ATOM 427 C TYR A 31 27.114 11.449 -6.632 1.00 0.00 C ATOM 428 O TYR A 31 27.048 10.225 -6.700 1.00 0.00 O ATOM 429 CB TYR A 31 24.875 12.524 -6.898 1.00 0.00 C ATOM 430 CG TYR A 31 24.048 13.602 -7.562 1.00 0.00 C ATOM 431 CD1 TYR A 31 24.280 14.944 -7.292 1.00 0.00 C ATOM 432 CD2 TYR A 31 23.037 13.279 -8.459 1.00 0.00 C ATOM 433 CE1 TYR A 31 23.531 15.934 -7.896 1.00 0.00 C ATOM 434 CE2 TYR A 31 22.282 14.265 -9.066 1.00 0.00 C ATOM 435 CZ TYR A 31 22.534 15.590 -8.782 1.00 0.00 C ATOM 436 OH TYR A 31 21.785 16.575 -9.383 1.00 0.00 O ATOM 0 H TYR A 31 26.006 10.734 -8.861 1.00 0.00 H new ATOM 0 HA TYR A 31 26.733 13.303 -7.629 1.00 0.00 H new ATOM 0 HB2 TYR A 31 24.329 11.582 -6.942 1.00 0.00 H new ATOM 0 HB3 TYR A 31 24.999 12.772 -5.844 1.00 0.00 H new ATOM 0 HD1 TYR A 31 25.060 15.218 -6.597 1.00 0.00 H new ATOM 0 HD2 TYR A 31 22.838 12.242 -8.685 1.00 0.00 H new ATOM 0 HE1 TYR A 31 23.726 16.973 -7.675 1.00 0.00 H new ATOM 0 HE2 TYR A 31 21.498 13.998 -9.760 1.00 0.00 H new ATOM 0 HH TYR A 31 21.125 16.165 -9.980 1.00 0.00 H new ATOM 446 N THR A 32 27.920 12.085 -5.803 1.00 0.00 N ATOM 447 CA THR A 32 28.775 11.377 -4.872 1.00 0.00 C ATOM 448 C THR A 32 28.049 11.171 -3.549 1.00 0.00 C ATOM 449 O THR A 32 27.829 12.120 -2.799 1.00 0.00 O ATOM 450 CB THR A 32 30.083 12.153 -4.640 1.00 0.00 C ATOM 451 OG1 THR A 32 30.689 12.440 -5.906 1.00 0.00 O ATOM 452 CG2 THR A 32 31.053 11.360 -3.775 1.00 0.00 C ATOM 0 H THR A 32 28.000 13.101 -5.756 1.00 0.00 H new ATOM 0 HA THR A 32 29.021 10.405 -5.299 1.00 0.00 H new ATOM 0 HB THR A 32 29.847 13.079 -4.116 1.00 0.00 H new ATOM 0 HG1 THR A 32 31.522 12.936 -5.765 1.00 0.00 H new ATOM 0 HG21 THR A 32 31.967 11.937 -3.631 1.00 0.00 H new ATOM 0 HG22 THR A 32 30.595 11.157 -2.807 1.00 0.00 H new ATOM 0 HG23 THR A 32 31.293 10.418 -4.267 1.00 0.00 H new ATOM 460 N VAL A 33 27.664 9.936 -3.280 1.00 0.00 N ATOM 461 CA VAL A 33 26.889 9.620 -2.092 1.00 0.00 C ATOM 462 C VAL A 33 27.805 9.427 -0.889 1.00 0.00 C ATOM 463 O VAL A 33 28.581 8.474 -0.834 1.00 0.00 O ATOM 464 CB VAL A 33 26.037 8.348 -2.295 1.00 0.00 C ATOM 465 CG1 VAL A 33 25.160 8.084 -1.079 1.00 0.00 C ATOM 466 CG2 VAL A 33 25.189 8.464 -3.553 1.00 0.00 C ATOM 0 H VAL A 33 27.876 9.132 -3.871 1.00 0.00 H new ATOM 0 HA VAL A 33 26.220 10.461 -1.909 1.00 0.00 H new ATOM 0 HB VAL A 33 26.714 7.502 -2.415 1.00 0.00 H new ATOM 0 HG11 VAL A 33 24.569 7.183 -1.245 1.00 0.00 H new ATOM 0 HG12 VAL A 33 25.789 7.948 -0.199 1.00 0.00 H new ATOM 0 HG13 VAL A 33 24.493 8.931 -0.921 1.00 0.00 H new ATOM 0 HG21 VAL A 33 24.597 7.558 -3.677 1.00 0.00 H new ATOM 0 HG22 VAL A 33 24.524 9.323 -3.465 1.00 0.00 H new ATOM 0 HG23 VAL A 33 25.838 8.595 -4.419 1.00 0.00 H new ATOM 476 N GLU A 34 27.723 10.343 0.062 1.00 0.00 N ATOM 477 CA GLU A 34 28.500 10.241 1.284 1.00 0.00 C ATOM 478 C GLU A 34 27.584 9.937 2.459 1.00 0.00 C ATOM 479 O GLU A 34 26.832 10.797 2.912 1.00 0.00 O ATOM 480 CB GLU A 34 29.281 11.528 1.548 1.00 0.00 C ATOM 481 CG GLU A 34 30.309 11.849 0.479 1.00 0.00 C ATOM 482 CD GLU A 34 31.259 12.943 0.911 1.00 0.00 C ATOM 483 OE1 GLU A 34 32.230 12.633 1.633 1.00 0.00 O ATOM 484 OE2 GLU A 34 31.036 14.115 0.548 1.00 0.00 O ATOM 0 H GLU A 34 27.124 11.167 0.010 1.00 0.00 H new ATOM 0 HA GLU A 34 29.216 9.427 1.166 1.00 0.00 H new ATOM 0 HB2 GLU A 34 28.579 12.359 1.626 1.00 0.00 H new ATOM 0 HB3 GLU A 34 29.785 11.445 2.511 1.00 0.00 H new ATOM 0 HG2 GLU A 34 30.877 10.949 0.242 1.00 0.00 H new ATOM 0 HG3 GLU A 34 29.798 12.153 -0.434 1.00 0.00 H new ATOM 491 N ILE A 35 27.635 8.707 2.931 1.00 0.00 N ATOM 492 CA ILE A 35 26.793 8.282 4.034 1.00 0.00 C ATOM 493 C ILE A 35 27.503 8.530 5.360 1.00 0.00 C ATOM 494 O ILE A 35 28.624 8.063 5.571 1.00 0.00 O ATOM 495 CB ILE A 35 26.424 6.793 3.890 1.00 0.00 C ATOM 496 CG1 ILE A 35 25.777 6.561 2.523 1.00 0.00 C ATOM 497 CG2 ILE A 35 25.488 6.359 5.009 1.00 0.00 C ATOM 498 CD1 ILE A 35 25.577 5.104 2.178 1.00 0.00 C ATOM 0 H ILE A 35 28.253 7.981 2.567 1.00 0.00 H new ATOM 0 HA ILE A 35 25.872 8.865 4.015 1.00 0.00 H new ATOM 0 HB ILE A 35 27.330 6.192 3.964 1.00 0.00 H new ATOM 0 HG12 ILE A 35 24.811 7.065 2.499 1.00 0.00 H new ATOM 0 HG13 ILE A 35 26.397 7.024 1.755 1.00 0.00 H new ATOM 0 HG21 ILE A 35 25.240 5.304 4.888 1.00 0.00 H new ATOM 0 HG22 ILE A 35 25.978 6.508 5.971 1.00 0.00 H new ATOM 0 HG23 ILE A 35 24.575 6.953 4.970 1.00 0.00 H new ATOM 0 HD11 ILE A 35 25.114 5.023 1.195 1.00 0.00 H new ATOM 0 HD12 ILE A 35 26.542 4.597 2.167 1.00 0.00 H new ATOM 0 HD13 ILE A 35 24.931 4.639 2.923 1.00 0.00 H new ATOM 510 N VAL A 36 26.856 9.283 6.239 1.00 0.00 N ATOM 511 CA VAL A 36 27.458 9.682 7.503 1.00 0.00 C ATOM 512 C VAL A 36 26.546 9.336 8.674 1.00 0.00 C ATOM 513 O VAL A 36 25.364 9.691 8.681 1.00 0.00 O ATOM 514 CB VAL A 36 27.755 11.200 7.532 1.00 0.00 C ATOM 515 CG1 VAL A 36 28.426 11.598 8.837 1.00 0.00 C ATOM 516 CG2 VAL A 36 28.613 11.608 6.342 1.00 0.00 C ATOM 0 H VAL A 36 25.908 9.632 6.098 1.00 0.00 H new ATOM 0 HA VAL A 36 28.395 9.133 7.596 1.00 0.00 H new ATOM 0 HB VAL A 36 26.804 11.728 7.464 1.00 0.00 H new ATOM 0 HG11 VAL A 36 28.624 12.670 8.832 1.00 0.00 H new ATOM 0 HG12 VAL A 36 27.770 11.354 9.673 1.00 0.00 H new ATOM 0 HG13 VAL A 36 29.366 11.056 8.943 1.00 0.00 H new ATOM 0 HG21 VAL A 36 28.808 12.680 6.385 1.00 0.00 H new ATOM 0 HG22 VAL A 36 29.558 11.065 6.372 1.00 0.00 H new ATOM 0 HG23 VAL A 36 28.088 11.371 5.417 1.00 0.00 H new ATOM 526 N HIS A 37 27.094 8.637 9.656 1.00 0.00 N ATOM 527 CA HIS A 37 26.356 8.325 10.868 1.00 0.00 C ATOM 528 C HIS A 37 26.307 9.565 11.756 1.00 0.00 C ATOM 529 O HIS A 37 27.311 9.948 12.365 1.00 0.00 O ATOM 530 CB HIS A 37 27.016 7.161 11.612 1.00 0.00 C ATOM 531 CG HIS A 37 26.148 6.536 12.664 1.00 0.00 C ATOM 532 ND1 HIS A 37 25.870 7.177 13.848 1.00 0.00 N ATOM 533 CD2 HIS A 37 25.538 5.327 12.665 1.00 0.00 C ATOM 534 CE1 HIS A 37 25.103 6.348 14.537 1.00 0.00 C ATOM 535 NE2 HIS A 37 24.876 5.215 13.861 1.00 0.00 N ATOM 0 H HIS A 37 28.048 8.275 9.636 1.00 0.00 H new ATOM 0 HA HIS A 37 25.341 8.026 10.606 1.00 0.00 H new ATOM 0 HB2 HIS A 37 27.300 6.396 10.889 1.00 0.00 H new ATOM 0 HB3 HIS A 37 27.935 7.516 12.078 1.00 0.00 H new ATOM 0 HD2 HIS A 37 25.567 4.591 11.875 1.00 0.00 H new ATOM 0 HE1 HIS A 37 24.710 6.559 15.521 1.00 0.00 H new ATOM 0 HE2 HIS A 37 24.318 4.421 14.175 1.00 0.00 H new ATOM 543 N LEU A 38 25.143 10.192 11.818 1.00 0.00 N ATOM 544 CA LEU A 38 24.986 11.459 12.519 1.00 0.00 C ATOM 545 C LEU A 38 24.940 11.246 14.029 1.00 0.00 C ATOM 546 O LEU A 38 25.051 12.191 14.806 1.00 0.00 O ATOM 547 CB LEU A 38 23.715 12.167 12.039 1.00 0.00 C ATOM 548 CG LEU A 38 23.527 13.600 12.546 1.00 0.00 C ATOM 549 CD1 LEU A 38 24.676 14.484 12.088 1.00 0.00 C ATOM 550 CD2 LEU A 38 22.198 14.163 12.068 1.00 0.00 C ATOM 0 H LEU A 38 24.287 9.842 11.388 1.00 0.00 H new ATOM 0 HA LEU A 38 25.848 12.087 12.295 1.00 0.00 H new ATOM 0 HB2 LEU A 38 23.719 12.183 10.949 1.00 0.00 H new ATOM 0 HB3 LEU A 38 22.853 11.575 12.346 1.00 0.00 H new ATOM 0 HG LEU A 38 23.522 13.581 13.636 1.00 0.00 H new ATOM 0 HD11 LEU A 38 24.525 15.498 12.458 1.00 0.00 H new ATOM 0 HD12 LEU A 38 25.615 14.092 12.479 1.00 0.00 H new ATOM 0 HD13 LEU A 38 24.713 14.497 10.999 1.00 0.00 H new ATOM 0 HD21 LEU A 38 22.081 15.182 12.437 1.00 0.00 H new ATOM 0 HD22 LEU A 38 22.175 14.167 10.978 1.00 0.00 H new ATOM 0 HD23 LEU A 38 21.384 13.544 12.445 1.00 0.00 H new ATOM 562 N GLY A 39 24.797 9.995 14.438 1.00 0.00 N ATOM 563 CA GLY A 39 24.742 9.681 15.851 1.00 0.00 C ATOM 564 C GLY A 39 26.120 9.470 16.446 1.00 0.00 C ATOM 565 O GLY A 39 26.266 9.333 17.660 1.00 0.00 O ATOM 0 H GLY A 39 24.718 9.190 13.816 1.00 0.00 H new ATOM 0 HA2 GLY A 39 24.239 10.490 16.382 1.00 0.00 H new ATOM 0 HA3 GLY A 39 24.143 8.782 15.998 1.00 0.00 H new ATOM 569 N THR A 40 27.134 9.433 15.593 1.00 0.00 N ATOM 570 CA THR A 40 28.501 9.243 16.050 1.00 0.00 C ATOM 571 C THR A 40 29.136 10.575 16.446 1.00 0.00 C ATOM 572 O THR A 40 29.838 10.666 17.456 1.00 0.00 O ATOM 573 CB THR A 40 29.367 8.572 14.966 1.00 0.00 C ATOM 574 OG1 THR A 40 28.734 7.373 14.504 1.00 0.00 O ATOM 575 CG2 THR A 40 30.751 8.238 15.506 1.00 0.00 C ATOM 0 H THR A 40 27.035 9.532 14.583 1.00 0.00 H new ATOM 0 HA THR A 40 28.458 8.591 16.922 1.00 0.00 H new ATOM 0 HB THR A 40 29.474 9.272 14.137 1.00 0.00 H new ATOM 0 HG1 THR A 40 27.768 7.521 14.429 1.00 0.00 H new ATOM 0 HG21 THR A 40 31.343 7.765 14.722 1.00 0.00 H new ATOM 0 HG22 THR A 40 31.245 9.153 15.832 1.00 0.00 H new ATOM 0 HG23 THR A 40 30.657 7.556 16.351 1.00 0.00 H new ATOM 583 N ASP A 41 28.877 11.610 15.660 1.00 0.00 N ATOM 584 CA ASP A 41 29.489 12.910 15.898 1.00 0.00 C ATOM 585 C ASP A 41 28.431 13.947 16.243 1.00 0.00 C ATOM 586 O ASP A 41 27.517 14.199 15.458 1.00 0.00 O ATOM 587 CB ASP A 41 30.288 13.357 14.674 1.00 0.00 C ATOM 588 CG ASP A 41 31.069 14.625 14.940 1.00 0.00 C ATOM 589 OD1 ASP A 41 32.217 14.531 15.423 1.00 0.00 O ATOM 590 OD2 ASP A 41 30.541 15.717 14.680 1.00 0.00 O ATOM 0 H ASP A 41 28.251 11.576 14.856 1.00 0.00 H new ATOM 0 HA ASP A 41 30.170 12.816 16.744 1.00 0.00 H new ATOM 0 HB2 ASP A 41 30.975 12.563 14.379 1.00 0.00 H new ATOM 0 HB3 ASP A 41 29.609 13.518 13.837 1.00 0.00 H new ATOM 595 N LYS A 42 28.567 14.553 17.414 1.00 0.00 N ATOM 596 CA LYS A 42 27.563 15.483 17.917 1.00 0.00 C ATOM 597 C LYS A 42 27.742 16.876 17.321 1.00 0.00 C ATOM 598 O LYS A 42 26.786 17.645 17.222 1.00 0.00 O ATOM 599 CB LYS A 42 27.619 15.547 19.445 1.00 0.00 C ATOM 600 CG LYS A 42 27.475 14.187 20.108 1.00 0.00 C ATOM 601 CD LYS A 42 27.491 14.291 21.624 1.00 0.00 C ATOM 602 CE LYS A 42 27.466 12.915 22.271 1.00 0.00 C ATOM 603 NZ LYS A 42 27.404 12.993 23.754 1.00 0.00 N ATOM 0 H LYS A 42 29.364 14.418 18.036 1.00 0.00 H new ATOM 0 HA LYS A 42 26.584 15.115 17.612 1.00 0.00 H new ATOM 0 HB2 LYS A 42 28.566 15.993 19.749 1.00 0.00 H new ATOM 0 HB3 LYS A 42 26.827 16.204 19.804 1.00 0.00 H new ATOM 0 HG2 LYS A 42 26.543 13.723 19.786 1.00 0.00 H new ATOM 0 HG3 LYS A 42 28.285 13.536 19.780 1.00 0.00 H new ATOM 0 HD2 LYS A 42 28.382 14.830 21.945 1.00 0.00 H new ATOM 0 HD3 LYS A 42 26.631 14.869 21.960 1.00 0.00 H new ATOM 0 HE2 LYS A 42 26.605 12.357 21.902 1.00 0.00 H new ATOM 0 HE3 LYS A 42 28.356 12.360 21.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 27.389 12.032 24.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 28.238 13.502 24.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 26.542 13.499 24.039 1.00 0.00 H new ATOM 617 N ALA A 43 28.963 17.197 16.911 1.00 0.00 N ATOM 618 CA ALA A 43 29.242 18.493 16.306 1.00 0.00 C ATOM 619 C ALA A 43 28.629 18.574 14.912 1.00 0.00 C ATOM 620 O ALA A 43 28.168 19.635 14.481 1.00 0.00 O ATOM 621 CB ALA A 43 30.740 18.746 16.247 1.00 0.00 C ATOM 0 H ALA A 43 29.772 16.581 16.986 1.00 0.00 H new ATOM 0 HA ALA A 43 28.790 19.266 16.927 1.00 0.00 H new ATOM 0 HB1 ALA A 43 30.927 19.719 15.792 1.00 0.00 H new ATOM 0 HB2 ALA A 43 31.151 18.732 17.256 1.00 0.00 H new ATOM 0 HB3 ALA A 43 31.217 17.969 15.650 1.00 0.00 H new ATOM 627 N ARG A 44 28.616 17.441 14.219 1.00 0.00 N ATOM 628 CA ARG A 44 28.038 17.354 12.886 1.00 0.00 C ATOM 629 C ARG A 44 26.526 17.543 12.946 1.00 0.00 C ATOM 630 O ARG A 44 25.905 17.949 11.966 1.00 0.00 O ATOM 631 CB ARG A 44 28.382 16.008 12.241 1.00 0.00 C ATOM 632 CG ARG A 44 28.057 15.941 10.757 1.00 0.00 C ATOM 633 CD ARG A 44 29.291 15.607 9.932 1.00 0.00 C ATOM 634 NE ARG A 44 30.366 16.573 10.147 1.00 0.00 N ATOM 635 CZ ARG A 44 31.615 16.419 9.714 1.00 0.00 C ATOM 636 NH1 ARG A 44 31.955 15.359 8.991 1.00 0.00 N ATOM 637 NH2 ARG A 44 32.523 17.340 9.999 1.00 0.00 N ATOM 0 H ARG A 44 29.004 16.563 14.564 1.00 0.00 H new ATOM 0 HA ARG A 44 28.462 18.150 12.274 1.00 0.00 H new ATOM 0 HB2 ARG A 44 29.445 15.809 12.381 1.00 0.00 H new ATOM 0 HB3 ARG A 44 27.839 15.217 12.759 1.00 0.00 H new ATOM 0 HG2 ARG A 44 27.288 15.188 10.585 1.00 0.00 H new ATOM 0 HG3 ARG A 44 27.646 16.896 10.430 1.00 0.00 H new ATOM 0 HD2 ARG A 44 29.642 14.608 10.192 1.00 0.00 H new ATOM 0 HD3 ARG A 44 29.027 15.587 8.875 1.00 0.00 H new ATOM 0 HE ARG A 44 30.144 17.424 10.664 1.00 0.00 H new ATOM 0 HH11 ARG A 44 31.256 14.652 8.762 1.00 0.00 H new ATOM 0 HH12 ARG A 44 32.915 15.251 8.664 1.00 0.00 H new ATOM 0 HH21 ARG A 44 32.263 18.160 10.547 1.00 0.00 H new ATOM 0 HH22 ARG A 44 33.482 17.229 9.671 1.00 0.00 H new ATOM 651 N ILE A 45 25.938 17.258 14.103 1.00 0.00 N ATOM 652 CA ILE A 45 24.514 17.488 14.309 1.00 0.00 C ATOM 653 C ILE A 45 24.209 18.976 14.170 1.00 0.00 C ATOM 654 O ILE A 45 23.243 19.371 13.516 1.00 0.00 O ATOM 655 CB ILE A 45 24.049 16.988 15.697 1.00 0.00 C ATOM 656 CG1 ILE A 45 24.321 15.486 15.836 1.00 0.00 C ATOM 657 CG2 ILE A 45 22.569 17.284 15.908 1.00 0.00 C ATOM 658 CD1 ILE A 45 23.945 14.919 17.189 1.00 0.00 C ATOM 0 H ILE A 45 26.425 16.868 14.910 1.00 0.00 H new ATOM 0 HA ILE A 45 23.970 16.924 13.551 1.00 0.00 H new ATOM 0 HB ILE A 45 24.614 17.518 16.463 1.00 0.00 H new ATOM 0 HG12 ILE A 45 23.768 14.953 15.063 1.00 0.00 H new ATOM 0 HG13 ILE A 45 25.380 15.300 15.656 1.00 0.00 H new ATOM 0 HG21 ILE A 45 22.262 16.924 16.890 1.00 0.00 H new ATOM 0 HG22 ILE A 45 22.401 18.359 15.847 1.00 0.00 H new ATOM 0 HG23 ILE A 45 21.984 16.781 15.138 1.00 0.00 H new ATOM 0 HD11 ILE A 45 24.167 13.852 17.211 1.00 0.00 H new ATOM 0 HD12 ILE A 45 24.517 15.424 17.967 1.00 0.00 H new ATOM 0 HD13 ILE A 45 22.880 15.072 17.364 1.00 0.00 H new ATOM 670 N ALA A 46 25.069 19.801 14.759 1.00 0.00 N ATOM 671 CA ALA A 46 24.922 21.246 14.671 1.00 0.00 C ATOM 672 C ALA A 46 25.224 21.734 13.256 1.00 0.00 C ATOM 673 O ALA A 46 24.714 22.770 12.822 1.00 0.00 O ATOM 674 CB ALA A 46 25.825 21.933 15.684 1.00 0.00 C ATOM 0 H ALA A 46 25.875 19.491 15.302 1.00 0.00 H new ATOM 0 HA ALA A 46 23.888 21.503 14.903 1.00 0.00 H new ATOM 0 HB1 ALA A 46 25.704 23.013 15.606 1.00 0.00 H new ATOM 0 HB2 ALA A 46 25.556 21.609 16.690 1.00 0.00 H new ATOM 0 HB3 ALA A 46 26.863 21.669 15.484 1.00 0.00 H new ATOM 680 N GLU A 47 26.058 20.986 12.540 1.00 0.00 N ATOM 681 CA GLU A 47 26.339 21.280 11.139 1.00 0.00 C ATOM 682 C GLU A 47 25.113 20.972 10.289 1.00 0.00 C ATOM 683 O GLU A 47 24.747 21.740 9.398 1.00 0.00 O ATOM 684 CB GLU A 47 27.532 20.460 10.639 1.00 0.00 C ATOM 685 CG GLU A 47 28.837 20.762 11.357 1.00 0.00 C ATOM 686 CD GLU A 47 29.999 19.971 10.796 1.00 0.00 C ATOM 687 OE1 GLU A 47 30.519 20.351 9.725 1.00 0.00 O ATOM 688 OE2 GLU A 47 30.399 18.966 11.419 1.00 0.00 O ATOM 0 H GLU A 47 26.551 20.172 12.907 1.00 0.00 H new ATOM 0 HA GLU A 47 26.585 22.338 11.053 1.00 0.00 H new ATOM 0 HB2 GLU A 47 27.304 19.400 10.753 1.00 0.00 H new ATOM 0 HB3 GLU A 47 27.665 20.645 9.573 1.00 0.00 H new ATOM 0 HG2 GLU A 47 29.054 21.827 11.278 1.00 0.00 H new ATOM 0 HG3 GLU A 47 28.726 20.537 12.418 1.00 0.00 H new ATOM 695 N ALA A 48 24.472 19.850 10.592 1.00 0.00 N ATOM 696 CA ALA A 48 23.279 19.419 9.880 1.00 0.00 C ATOM 697 C ALA A 48 22.157 20.444 10.014 1.00 0.00 C ATOM 698 O ALA A 48 21.386 20.662 9.074 1.00 0.00 O ATOM 699 CB ALA A 48 22.828 18.060 10.393 1.00 0.00 C ATOM 0 H ALA A 48 24.764 19.216 11.336 1.00 0.00 H new ATOM 0 HA ALA A 48 23.524 19.333 8.821 1.00 0.00 H new ATOM 0 HB1 ALA A 48 21.934 17.746 9.854 1.00 0.00 H new ATOM 0 HB2 ALA A 48 23.622 17.330 10.236 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.604 18.129 11.458 1.00 0.00 H new ATOM 705 N GLU A 49 22.080 21.083 11.177 1.00 0.00 N ATOM 706 CA GLU A 49 21.083 22.123 11.416 1.00 0.00 C ATOM 707 C GLU A 49 21.348 23.352 10.547 1.00 0.00 C ATOM 708 O GLU A 49 20.433 24.115 10.243 1.00 0.00 O ATOM 709 CB GLU A 49 21.059 22.525 12.894 1.00 0.00 C ATOM 710 CG GLU A 49 20.641 21.400 13.824 1.00 0.00 C ATOM 711 CD GLU A 49 20.460 21.858 15.257 1.00 0.00 C ATOM 712 OE1 GLU A 49 21.441 21.836 16.029 1.00 0.00 O ATOM 713 OE2 GLU A 49 19.331 22.236 15.628 1.00 0.00 O ATOM 0 H GLU A 49 22.696 20.900 11.969 1.00 0.00 H new ATOM 0 HA GLU A 49 20.110 21.713 11.147 1.00 0.00 H new ATOM 0 HB2 GLU A 49 22.050 22.874 13.183 1.00 0.00 H new ATOM 0 HB3 GLU A 49 20.375 23.364 13.022 1.00 0.00 H new ATOM 0 HG2 GLU A 49 19.707 20.967 13.465 1.00 0.00 H new ATOM 0 HG3 GLU A 49 21.392 20.611 13.792 1.00 0.00 H new ATOM 720 N LYS A 50 22.601 23.538 10.144 1.00 0.00 N ATOM 721 CA LYS A 50 22.964 24.663 9.289 1.00 0.00 C ATOM 722 C LYS A 50 22.658 24.340 7.828 1.00 0.00 C ATOM 723 O LYS A 50 22.419 25.237 7.015 1.00 0.00 O ATOM 724 CB LYS A 50 24.447 25.013 9.444 1.00 0.00 C ATOM 725 CG LYS A 50 24.842 25.416 10.856 1.00 0.00 C ATOM 726 CD LYS A 50 26.293 25.871 10.916 1.00 0.00 C ATOM 727 CE LYS A 50 26.707 26.265 12.326 1.00 0.00 C ATOM 728 NZ LYS A 50 26.746 25.096 13.245 1.00 0.00 N ATOM 0 H LYS A 50 23.379 22.927 10.394 1.00 0.00 H new ATOM 0 HA LYS A 50 22.371 25.524 9.597 1.00 0.00 H new ATOM 0 HB2 LYS A 50 25.046 24.154 9.141 1.00 0.00 H new ATOM 0 HB3 LYS A 50 24.691 25.828 8.763 1.00 0.00 H new ATOM 0 HG2 LYS A 50 24.192 26.220 11.202 1.00 0.00 H new ATOM 0 HG3 LYS A 50 24.695 24.573 11.532 1.00 0.00 H new ATOM 0 HD2 LYS A 50 26.940 25.070 10.559 1.00 0.00 H new ATOM 0 HD3 LYS A 50 26.436 26.719 10.246 1.00 0.00 H new ATOM 0 HE2 LYS A 50 27.690 26.735 12.297 1.00 0.00 H new ATOM 0 HE3 LYS A 50 26.010 27.007 12.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 27.081 25.401 14.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 25.792 24.692 13.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 27.392 24.376 12.864 1.00 0.00 H new ATOM 742 N ALA A 51 22.672 23.054 7.505 1.00 0.00 N ATOM 743 CA ALA A 51 22.375 22.598 6.154 1.00 0.00 C ATOM 744 C ALA A 51 20.869 22.542 5.920 1.00 0.00 C ATOM 745 O ALA A 51 20.371 23.005 4.894 1.00 0.00 O ATOM 746 CB ALA A 51 23.004 21.235 5.907 1.00 0.00 C ATOM 0 H ALA A 51 22.887 22.305 8.163 1.00 0.00 H new ATOM 0 HA ALA A 51 22.801 23.312 5.449 1.00 0.00 H new ATOM 0 HB1 ALA A 51 22.774 20.906 4.893 1.00 0.00 H new ATOM 0 HB2 ALA A 51 24.085 21.306 6.029 1.00 0.00 H new ATOM 0 HB3 ALA A 51 22.604 20.515 6.621 1.00 0.00 H new ATOM 752 N GLY A 52 20.148 21.982 6.882 1.00 0.00 N ATOM 753 CA GLY A 52 18.705 21.893 6.764 1.00 0.00 C ATOM 754 C GLY A 52 18.164 20.529 7.143 1.00 0.00 C ATOM 755 O GLY A 52 17.091 20.130 6.684 1.00 0.00 O ATOM 0 H GLY A 52 20.535 21.589 7.740 1.00 0.00 H new ATOM 0 HA2 GLY A 52 18.246 22.650 7.401 1.00 0.00 H new ATOM 0 HA3 GLY A 52 18.415 22.121 5.738 1.00 0.00 H new ATOM 759 N VAL A 53 18.904 19.807 7.973 1.00 0.00 N ATOM 760 CA VAL A 53 18.463 18.509 8.455 1.00 0.00 C ATOM 761 C VAL A 53 17.596 18.688 9.692 1.00 0.00 C ATOM 762 O VAL A 53 18.003 19.339 10.655 1.00 0.00 O ATOM 763 CB VAL A 53 19.659 17.591 8.787 1.00 0.00 C ATOM 764 CG1 VAL A 53 19.185 16.246 9.320 1.00 0.00 C ATOM 765 CG2 VAL A 53 20.538 17.399 7.560 1.00 0.00 C ATOM 0 H VAL A 53 19.815 20.101 8.326 1.00 0.00 H new ATOM 0 HA VAL A 53 17.884 18.035 7.662 1.00 0.00 H new ATOM 0 HB VAL A 53 20.249 18.073 9.566 1.00 0.00 H new ATOM 0 HG11 VAL A 53 20.048 15.619 9.546 1.00 0.00 H new ATOM 0 HG12 VAL A 53 18.601 16.400 10.227 1.00 0.00 H new ATOM 0 HG13 VAL A 53 18.566 15.755 8.569 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.376 16.749 7.811 1.00 0.00 H new ATOM 0 HG22 VAL A 53 19.953 16.944 6.761 1.00 0.00 H new ATOM 0 HG23 VAL A 53 20.915 18.366 7.228 1.00 0.00 H new ATOM 775 N LYS A 54 16.393 18.140 9.651 1.00 0.00 N ATOM 776 CA LYS A 54 15.447 18.300 10.747 1.00 0.00 C ATOM 777 C LYS A 54 14.991 16.944 11.276 1.00 0.00 C ATOM 778 O LYS A 54 14.342 16.857 12.322 1.00 0.00 O ATOM 779 CB LYS A 54 14.246 19.126 10.276 1.00 0.00 C ATOM 780 CG LYS A 54 14.646 20.465 9.677 1.00 0.00 C ATOM 781 CD LYS A 54 13.446 21.244 9.168 1.00 0.00 C ATOM 782 CE LYS A 54 13.883 22.528 8.478 1.00 0.00 C ATOM 783 NZ LYS A 54 12.724 23.340 8.028 1.00 0.00 N ATOM 0 H LYS A 54 16.047 17.580 8.872 1.00 0.00 H new ATOM 0 HA LYS A 54 15.943 18.826 11.563 1.00 0.00 H new ATOM 0 HB2 LYS A 54 13.687 18.555 9.535 1.00 0.00 H new ATOM 0 HB3 LYS A 54 13.576 19.296 11.119 1.00 0.00 H new ATOM 0 HG2 LYS A 54 15.169 21.056 10.429 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.345 20.301 8.857 1.00 0.00 H new ATOM 0 HD2 LYS A 54 12.877 20.628 8.472 1.00 0.00 H new ATOM 0 HD3 LYS A 54 12.782 21.481 10.000 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.495 23.117 9.162 1.00 0.00 H new ATOM 0 HE3 LYS A 54 14.509 22.283 7.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.066 24.205 7.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 12.154 22.788 7.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 12.140 23.596 8.849 1.00 0.00 H new ATOM 797 N SER A 55 15.333 15.889 10.555 1.00 0.00 N ATOM 798 CA SER A 55 14.976 14.534 10.949 1.00 0.00 C ATOM 799 C SER A 55 15.998 13.544 10.399 1.00 0.00 C ATOM 800 O SER A 55 16.883 13.925 9.632 1.00 0.00 O ATOM 801 CB SER A 55 13.574 14.187 10.437 1.00 0.00 C ATOM 802 OG SER A 55 12.618 15.131 10.892 1.00 0.00 O ATOM 0 H SER A 55 15.863 15.945 9.685 1.00 0.00 H new ATOM 0 HA SER A 55 14.976 14.471 12.037 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.577 14.163 9.347 1.00 0.00 H new ATOM 0 HB3 SER A 55 13.296 13.189 10.777 1.00 0.00 H new ATOM 0 HG SER A 55 11.732 14.889 10.551 1.00 0.00 H new ATOM 808 N VAL A 56 15.887 12.288 10.800 1.00 0.00 N ATOM 809 CA VAL A 56 16.767 11.242 10.301 1.00 0.00 C ATOM 810 C VAL A 56 15.957 10.021 9.869 1.00 0.00 C ATOM 811 O VAL A 56 14.938 9.691 10.487 1.00 0.00 O ATOM 812 CB VAL A 56 17.823 10.815 11.350 1.00 0.00 C ATOM 813 CG1 VAL A 56 18.829 11.931 11.588 1.00 0.00 C ATOM 814 CG2 VAL A 56 17.161 10.407 12.659 1.00 0.00 C ATOM 0 H VAL A 56 15.192 11.966 11.474 1.00 0.00 H new ATOM 0 HA VAL A 56 17.295 11.657 9.442 1.00 0.00 H new ATOM 0 HB VAL A 56 18.355 9.950 10.955 1.00 0.00 H new ATOM 0 HG11 VAL A 56 19.561 11.609 12.328 1.00 0.00 H new ATOM 0 HG12 VAL A 56 19.338 12.168 10.654 1.00 0.00 H new ATOM 0 HG13 VAL A 56 18.310 12.817 11.953 1.00 0.00 H new ATOM 0 HG21 VAL A 56 17.926 10.112 13.377 1.00 0.00 H new ATOM 0 HG22 VAL A 56 16.594 11.248 13.058 1.00 0.00 H new ATOM 0 HG23 VAL A 56 16.488 9.568 12.481 1.00 0.00 H new ATOM 824 N PRO A 57 16.392 9.338 8.797 1.00 0.00 N ATOM 825 CA PRO A 57 17.586 9.717 8.037 1.00 0.00 C ATOM 826 C PRO A 57 17.310 10.821 7.015 1.00 0.00 C ATOM 827 O PRO A 57 16.173 11.019 6.587 1.00 0.00 O ATOM 828 CB PRO A 57 17.967 8.416 7.336 1.00 0.00 C ATOM 829 CG PRO A 57 16.675 7.699 7.131 1.00 0.00 C ATOM 830 CD PRO A 57 15.747 8.136 8.239 1.00 0.00 C ATOM 0 HA PRO A 57 18.369 10.126 8.676 1.00 0.00 H new ATOM 0 HB2 PRO A 57 18.466 8.610 6.387 1.00 0.00 H new ATOM 0 HB3 PRO A 57 18.654 7.827 7.943 1.00 0.00 H new ATOM 0 HG2 PRO A 57 16.251 7.939 6.156 1.00 0.00 H new ATOM 0 HG3 PRO A 57 16.825 6.620 7.157 1.00 0.00 H new ATOM 0 HD2 PRO A 57 14.750 8.359 7.859 1.00 0.00 H new ATOM 0 HD3 PRO A 57 15.634 7.358 8.994 1.00 0.00 H new ATOM 838 N ALA A 58 18.357 11.534 6.624 1.00 0.00 N ATOM 839 CA ALA A 58 18.218 12.649 5.699 1.00 0.00 C ATOM 840 C ALA A 58 19.207 12.543 4.547 1.00 0.00 C ATOM 841 O ALA A 58 20.410 12.387 4.757 1.00 0.00 O ATOM 842 CB ALA A 58 18.407 13.967 6.431 1.00 0.00 C ATOM 0 H ALA A 58 19.313 11.360 6.934 1.00 0.00 H new ATOM 0 HA ALA A 58 17.212 12.612 5.282 1.00 0.00 H new ATOM 0 HB1 ALA A 58 18.300 14.793 5.727 1.00 0.00 H new ATOM 0 HB2 ALA A 58 17.655 14.059 7.215 1.00 0.00 H new ATOM 0 HB3 ALA A 58 19.401 13.996 6.877 1.00 0.00 H new ATOM 848 N LEU A 59 18.684 12.619 3.335 1.00 0.00 N ATOM 849 CA LEU A 59 19.496 12.606 2.128 1.00 0.00 C ATOM 850 C LEU A 59 19.693 14.033 1.622 1.00 0.00 C ATOM 851 O LEU A 59 18.797 14.611 1.009 1.00 0.00 O ATOM 852 CB LEU A 59 18.816 11.750 1.055 1.00 0.00 C ATOM 853 CG LEU A 59 19.501 11.721 -0.315 1.00 0.00 C ATOM 854 CD1 LEU A 59 20.859 11.043 -0.231 1.00 0.00 C ATOM 855 CD2 LEU A 59 18.615 11.016 -1.328 1.00 0.00 C ATOM 0 H LEU A 59 17.682 12.692 3.159 1.00 0.00 H new ATOM 0 HA LEU A 59 20.472 12.176 2.354 1.00 0.00 H new ATOM 0 HB2 LEU A 59 18.745 10.727 1.425 1.00 0.00 H new ATOM 0 HB3 LEU A 59 17.797 12.112 0.922 1.00 0.00 H new ATOM 0 HG LEU A 59 19.659 12.749 -0.641 1.00 0.00 H new ATOM 0 HD11 LEU A 59 21.324 11.036 -1.217 1.00 0.00 H new ATOM 0 HD12 LEU A 59 21.495 11.588 0.466 1.00 0.00 H new ATOM 0 HD13 LEU A 59 20.733 10.018 0.118 1.00 0.00 H new ATOM 0 HD21 LEU A 59 19.112 11.001 -2.298 1.00 0.00 H new ATOM 0 HD22 LEU A 59 18.430 9.993 -1.000 1.00 0.00 H new ATOM 0 HD23 LEU A 59 17.667 11.547 -1.414 1.00 0.00 H new ATOM 867 N VAL A 60 20.852 14.604 1.905 1.00 0.00 N ATOM 868 CA VAL A 60 21.144 15.973 1.512 1.00 0.00 C ATOM 869 C VAL A 60 21.793 16.007 0.132 1.00 0.00 C ATOM 870 O VAL A 60 23.001 15.814 -0.003 1.00 0.00 O ATOM 871 CB VAL A 60 22.072 16.672 2.529 1.00 0.00 C ATOM 872 CG1 VAL A 60 22.261 18.141 2.173 1.00 0.00 C ATOM 873 CG2 VAL A 60 21.527 16.529 3.942 1.00 0.00 C ATOM 0 H VAL A 60 21.608 14.139 2.407 1.00 0.00 H new ATOM 0 HA VAL A 60 20.195 16.509 1.484 1.00 0.00 H new ATOM 0 HB VAL A 60 23.046 16.185 2.486 1.00 0.00 H new ATOM 0 HG11 VAL A 60 22.919 18.611 2.904 1.00 0.00 H new ATOM 0 HG12 VAL A 60 22.706 18.221 1.181 1.00 0.00 H new ATOM 0 HG13 VAL A 60 21.294 18.644 2.178 1.00 0.00 H new ATOM 0 HG21 VAL A 60 22.196 17.029 4.642 1.00 0.00 H new ATOM 0 HG22 VAL A 60 20.538 16.983 3.998 1.00 0.00 H new ATOM 0 HG23 VAL A 60 21.456 15.472 4.199 1.00 0.00 H new ATOM 883 N ILE A 61 20.985 16.242 -0.889 1.00 0.00 N ATOM 884 CA ILE A 61 21.476 16.270 -2.257 1.00 0.00 C ATOM 885 C ILE A 61 21.902 17.680 -2.646 1.00 0.00 C ATOM 886 O ILE A 61 21.059 18.525 -2.959 1.00 0.00 O ATOM 887 CB ILE A 61 20.411 15.769 -3.259 1.00 0.00 C ATOM 888 CG1 ILE A 61 19.918 14.374 -2.865 1.00 0.00 C ATOM 889 CG2 ILE A 61 20.978 15.751 -4.674 1.00 0.00 C ATOM 890 CD1 ILE A 61 18.824 13.836 -3.766 1.00 0.00 C ATOM 0 H ILE A 61 19.984 16.416 -0.796 1.00 0.00 H new ATOM 0 HA ILE A 61 22.335 15.601 -2.300 1.00 0.00 H new ATOM 0 HB ILE A 61 19.564 16.455 -3.233 1.00 0.00 H new ATOM 0 HG12 ILE A 61 20.761 13.683 -2.880 1.00 0.00 H new ATOM 0 HG13 ILE A 61 19.549 14.405 -1.840 1.00 0.00 H new ATOM 0 HG21 ILE A 61 20.215 15.396 -5.367 1.00 0.00 H new ATOM 0 HG22 ILE A 61 21.284 16.758 -4.956 1.00 0.00 H new ATOM 0 HG23 ILE A 61 21.841 15.086 -4.712 1.00 0.00 H new ATOM 0 HD11 ILE A 61 18.526 12.845 -3.425 1.00 0.00 H new ATOM 0 HD12 ILE A 61 17.964 14.505 -3.733 1.00 0.00 H new ATOM 0 HD13 ILE A 61 19.194 13.771 -4.789 1.00 0.00 H new ATOM 902 N ASP A 62 23.209 17.938 -2.560 1.00 0.00 N ATOM 903 CA ASP A 62 23.804 19.202 -3.018 1.00 0.00 C ATOM 904 C ASP A 62 23.326 20.399 -2.178 1.00 0.00 C ATOM 905 O ASP A 62 23.678 21.548 -2.444 1.00 0.00 O ATOM 906 CB ASP A 62 23.491 19.409 -4.509 1.00 0.00 C ATOM 907 CG ASP A 62 24.196 20.606 -5.118 1.00 0.00 C ATOM 908 OD1 ASP A 62 25.411 20.772 -4.894 1.00 0.00 O ATOM 909 OD2 ASP A 62 23.541 21.371 -5.859 1.00 0.00 O ATOM 0 H ASP A 62 23.886 17.280 -2.172 1.00 0.00 H new ATOM 0 HA ASP A 62 24.884 19.140 -2.886 1.00 0.00 H new ATOM 0 HB2 ASP A 62 23.775 18.512 -5.059 1.00 0.00 H new ATOM 0 HB3 ASP A 62 22.415 19.531 -4.632 1.00 0.00 H new ATOM 914 N GLY A 63 22.547 20.117 -1.143 1.00 0.00 N ATOM 915 CA GLY A 63 22.041 21.169 -0.285 1.00 0.00 C ATOM 916 C GLY A 63 20.617 20.908 0.155 1.00 0.00 C ATOM 917 O GLY A 63 20.214 21.307 1.247 1.00 0.00 O ATOM 0 H GLY A 63 22.256 19.175 -0.882 1.00 0.00 H new ATOM 0 HA2 GLY A 63 22.681 21.259 0.593 1.00 0.00 H new ATOM 0 HA3 GLY A 63 22.088 22.121 -0.813 1.00 0.00 H new ATOM 921 N ALA A 64 19.855 20.232 -0.692 1.00 0.00 N ATOM 922 CA ALA A 64 18.467 19.917 -0.383 1.00 0.00 C ATOM 923 C ALA A 64 18.379 18.638 0.442 1.00 0.00 C ATOM 924 O ALA A 64 18.725 17.558 -0.035 1.00 0.00 O ATOM 925 CB ALA A 64 17.658 19.785 -1.664 1.00 0.00 C ATOM 0 H ALA A 64 20.174 19.891 -1.599 1.00 0.00 H new ATOM 0 HA ALA A 64 18.049 20.733 0.207 1.00 0.00 H new ATOM 0 HB1 ALA A 64 16.623 19.549 -1.418 1.00 0.00 H new ATOM 0 HB2 ALA A 64 17.695 20.724 -2.216 1.00 0.00 H new ATOM 0 HB3 ALA A 64 18.076 18.987 -2.277 1.00 0.00 H new ATOM 931 N ALA A 65 17.927 18.770 1.681 1.00 0.00 N ATOM 932 CA ALA A 65 17.828 17.630 2.580 1.00 0.00 C ATOM 933 C ALA A 65 16.472 16.947 2.455 1.00 0.00 C ATOM 934 O ALA A 65 15.438 17.522 2.807 1.00 0.00 O ATOM 935 CB ALA A 65 18.071 18.069 4.017 1.00 0.00 C ATOM 0 H ALA A 65 17.623 19.655 2.086 1.00 0.00 H new ATOM 0 HA ALA A 65 18.595 16.908 2.297 1.00 0.00 H new ATOM 0 HB1 ALA A 65 17.994 17.206 4.679 1.00 0.00 H new ATOM 0 HB2 ALA A 65 19.067 18.503 4.101 1.00 0.00 H new ATOM 0 HB3 ALA A 65 17.326 18.812 4.301 1.00 0.00 H new ATOM 941 N PHE A 66 16.481 15.728 1.937 1.00 0.00 N ATOM 942 CA PHE A 66 15.269 14.934 1.817 1.00 0.00 C ATOM 943 C PHE A 66 15.271 13.814 2.847 1.00 0.00 C ATOM 944 O PHE A 66 16.066 12.881 2.765 1.00 0.00 O ATOM 945 CB PHE A 66 15.143 14.350 0.408 1.00 0.00 C ATOM 946 CG PHE A 66 15.086 15.395 -0.667 1.00 0.00 C ATOM 947 CD1 PHE A 66 13.939 16.147 -0.858 1.00 0.00 C ATOM 948 CD2 PHE A 66 16.179 15.627 -1.483 1.00 0.00 C ATOM 949 CE1 PHE A 66 13.882 17.111 -1.843 1.00 0.00 C ATOM 950 CE2 PHE A 66 16.128 16.590 -2.472 1.00 0.00 C ATOM 951 CZ PHE A 66 14.978 17.333 -2.652 1.00 0.00 C ATOM 0 H PHE A 66 17.321 15.265 1.591 1.00 0.00 H new ATOM 0 HA PHE A 66 14.413 15.584 2.000 1.00 0.00 H new ATOM 0 HB2 PHE A 66 15.990 13.691 0.219 1.00 0.00 H new ATOM 0 HB3 PHE A 66 14.244 13.736 0.356 1.00 0.00 H new ATOM 0 HD1 PHE A 66 13.078 15.977 -0.228 1.00 0.00 H new ATOM 0 HD2 PHE A 66 17.081 15.049 -1.345 1.00 0.00 H new ATOM 0 HE1 PHE A 66 12.981 17.691 -1.981 1.00 0.00 H new ATOM 0 HE2 PHE A 66 16.987 16.762 -3.104 1.00 0.00 H new ATOM 0 HZ PHE A 66 14.936 18.087 -3.425 1.00 0.00 H new ATOM 961 N HIS A 67 14.388 13.919 3.820 1.00 0.00 N ATOM 962 CA HIS A 67 14.311 12.946 4.900 1.00 0.00 C ATOM 963 C HIS A 67 13.611 11.677 4.421 1.00 0.00 C ATOM 964 O HIS A 67 12.404 11.676 4.194 1.00 0.00 O ATOM 965 CB HIS A 67 13.566 13.550 6.094 1.00 0.00 C ATOM 966 CG HIS A 67 14.140 14.856 6.557 1.00 0.00 C ATOM 967 ND1 HIS A 67 13.658 16.089 6.171 1.00 0.00 N ATOM 968 CD2 HIS A 67 15.178 15.110 7.390 1.00 0.00 C ATOM 969 CE1 HIS A 67 14.398 17.029 6.769 1.00 0.00 C ATOM 970 NE2 HIS A 67 15.336 16.488 7.522 1.00 0.00 N ATOM 0 H HIS A 67 13.706 14.675 3.888 1.00 0.00 H new ATOM 0 HA HIS A 67 15.322 12.684 5.213 1.00 0.00 H new ATOM 0 HB2 HIS A 67 12.520 13.697 5.823 1.00 0.00 H new ATOM 0 HB3 HIS A 67 13.585 12.840 6.921 1.00 0.00 H new ATOM 0 HD1 HIS A 67 12.874 16.255 5.540 1.00 0.00 H new ATOM 0 HD2 HIS A 67 15.787 14.362 7.875 1.00 0.00 H new ATOM 0 HE1 HIS A 67 14.247 18.092 6.651 1.00 0.00 H new ATOM 978 N ILE A 68 14.373 10.607 4.260 1.00 0.00 N ATOM 979 CA ILE A 68 13.840 9.365 3.718 1.00 0.00 C ATOM 980 C ILE A 68 13.209 8.520 4.817 1.00 0.00 C ATOM 981 O ILE A 68 13.913 7.869 5.586 1.00 0.00 O ATOM 982 CB ILE A 68 14.937 8.544 3.006 1.00 0.00 C ATOM 983 CG1 ILE A 68 15.603 9.384 1.912 1.00 0.00 C ATOM 984 CG2 ILE A 68 14.348 7.269 2.415 1.00 0.00 C ATOM 985 CD1 ILE A 68 16.744 8.677 1.211 1.00 0.00 C ATOM 0 H ILE A 68 15.364 10.573 4.497 1.00 0.00 H new ATOM 0 HA ILE A 68 13.076 9.634 2.988 1.00 0.00 H new ATOM 0 HB ILE A 68 15.694 8.266 3.739 1.00 0.00 H new ATOM 0 HG12 ILE A 68 14.852 9.664 1.173 1.00 0.00 H new ATOM 0 HG13 ILE A 68 15.976 10.308 2.353 1.00 0.00 H new ATOM 0 HG21 ILE A 68 15.134 6.702 1.917 1.00 0.00 H new ATOM 0 HG22 ILE A 68 13.914 6.665 3.212 1.00 0.00 H new ATOM 0 HG23 ILE A 68 13.573 7.527 1.693 1.00 0.00 H new ATOM 0 HD11 ILE A 68 17.166 9.333 0.450 1.00 0.00 H new ATOM 0 HD12 ILE A 68 17.515 8.421 1.938 1.00 0.00 H new ATOM 0 HD13 ILE A 68 16.373 7.767 0.740 1.00 0.00 H new ATOM 997 N ASN A 69 11.879 8.542 4.870 1.00 0.00 N ATOM 998 CA ASN A 69 11.109 7.825 5.890 1.00 0.00 C ATOM 999 C ASN A 69 11.382 8.385 7.280 1.00 0.00 C ATOM 1000 O ASN A 69 12.416 8.109 7.887 1.00 0.00 O ATOM 1001 CB ASN A 69 11.390 6.317 5.857 1.00 0.00 C ATOM 1002 CG ASN A 69 10.667 5.609 4.726 1.00 0.00 C ATOM 1003 OD1 ASN A 69 9.583 6.020 4.315 1.00 0.00 O ATOM 1004 ND2 ASN A 69 11.257 4.541 4.215 1.00 0.00 N ATOM 0 H ASN A 69 11.301 9.058 4.206 1.00 0.00 H new ATOM 0 HA ASN A 69 10.054 7.975 5.658 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.463 6.154 5.755 1.00 0.00 H new ATOM 0 HB3 ASN A 69 11.090 5.875 6.807 1.00 0.00 H new ATOM 0 HD21 ASN A 69 10.813 4.028 3.454 1.00 0.00 H new ATOM 0 HD22 ASN A 69 12.156 4.230 4.582 1.00 0.00 H new ATOM 1011 N PHE A 70 10.439 9.177 7.774 1.00 0.00 N ATOM 1012 CA PHE A 70 10.569 9.814 9.078 1.00 0.00 C ATOM 1013 C PHE A 70 10.682 8.774 10.190 1.00 0.00 C ATOM 1014 O PHE A 70 9.698 8.133 10.563 1.00 0.00 O ATOM 1015 CB PHE A 70 9.375 10.741 9.338 1.00 0.00 C ATOM 1016 CG PHE A 70 9.416 11.435 10.674 1.00 0.00 C ATOM 1017 CD1 PHE A 70 10.238 12.532 10.875 1.00 0.00 C ATOM 1018 CD2 PHE A 70 8.628 10.992 11.725 1.00 0.00 C ATOM 1019 CE1 PHE A 70 10.275 13.173 12.099 1.00 0.00 C ATOM 1020 CE2 PHE A 70 8.661 11.629 12.951 1.00 0.00 C ATOM 1021 CZ PHE A 70 9.486 12.721 13.138 1.00 0.00 C ATOM 0 H PHE A 70 9.570 9.395 7.287 1.00 0.00 H new ATOM 0 HA PHE A 70 11.484 10.407 9.075 1.00 0.00 H new ATOM 0 HB2 PHE A 70 9.335 11.494 8.551 1.00 0.00 H new ATOM 0 HB3 PHE A 70 8.456 10.159 9.271 1.00 0.00 H new ATOM 0 HD1 PHE A 70 10.857 12.890 10.066 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.981 10.139 11.584 1.00 0.00 H new ATOM 0 HE1 PHE A 70 10.921 14.027 12.243 1.00 0.00 H new ATOM 0 HE2 PHE A 70 8.043 11.273 13.762 1.00 0.00 H new ATOM 0 HZ PHE A 70 9.514 13.220 14.095 1.00 0.00 H new ATOM 1031 N GLY A 71 11.894 8.595 10.691 1.00 0.00 N ATOM 1032 CA GLY A 71 12.107 7.720 11.821 1.00 0.00 C ATOM 1033 C GLY A 71 12.150 8.502 13.113 1.00 0.00 C ATOM 1034 O GLY A 71 11.331 8.292 14.006 1.00 0.00 O ATOM 0 H GLY A 71 12.737 9.043 10.332 1.00 0.00 H new ATOM 0 HA2 GLY A 71 11.309 6.979 11.867 1.00 0.00 H new ATOM 0 HA3 GLY A 71 13.041 7.174 11.691 1.00 0.00 H new ATOM 1038 N ALA A 72 13.107 9.413 13.202 1.00 0.00 N ATOM 1039 CA ALA A 72 13.228 10.293 14.352 1.00 0.00 C ATOM 1040 C ALA A 72 13.592 11.697 13.889 1.00 0.00 C ATOM 1041 O ALA A 72 14.040 11.880 12.757 1.00 0.00 O ATOM 1042 CB ALA A 72 14.272 9.763 15.324 1.00 0.00 C ATOM 0 H ALA A 72 13.816 9.562 12.484 1.00 0.00 H new ATOM 0 HA ALA A 72 12.270 10.329 14.872 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.348 10.435 16.178 1.00 0.00 H new ATOM 0 HB2 ALA A 72 13.979 8.771 15.668 1.00 0.00 H new ATOM 0 HB3 ALA A 72 15.238 9.702 14.823 1.00 0.00 H new ATOM 1048 N GLY A 73 13.399 12.683 14.750 1.00 0.00 N ATOM 1049 CA GLY A 73 13.779 14.037 14.410 1.00 0.00 C ATOM 1050 C GLY A 73 15.188 14.349 14.864 1.00 0.00 C ATOM 1051 O GLY A 73 15.767 13.604 15.654 1.00 0.00 O ATOM 0 H GLY A 73 12.987 12.571 15.676 1.00 0.00 H new ATOM 0 HA2 GLY A 73 13.704 14.177 13.332 1.00 0.00 H new ATOM 0 HA3 GLY A 73 13.083 14.738 14.872 1.00 0.00 H new ATOM 1055 N ILE A 74 15.747 15.450 14.378 1.00 0.00 N ATOM 1056 CA ILE A 74 17.088 15.851 14.786 1.00 0.00 C ATOM 1057 C ILE A 74 17.053 16.371 16.223 1.00 0.00 C ATOM 1058 O ILE A 74 18.076 16.450 16.906 1.00 0.00 O ATOM 1059 CB ILE A 74 17.683 16.923 13.839 1.00 0.00 C ATOM 1060 CG1 ILE A 74 19.188 17.072 14.082 1.00 0.00 C ATOM 1061 CG2 ILE A 74 16.977 18.261 14.023 1.00 0.00 C ATOM 1062 CD1 ILE A 74 19.882 17.976 13.086 1.00 0.00 C ATOM 0 H ILE A 74 15.299 16.075 13.708 1.00 0.00 H new ATOM 0 HA ILE A 74 17.734 14.975 14.729 1.00 0.00 H new ATOM 0 HB ILE A 74 17.527 16.596 12.811 1.00 0.00 H new ATOM 0 HG12 ILE A 74 19.347 17.464 15.086 1.00 0.00 H new ATOM 0 HG13 ILE A 74 19.651 16.086 14.048 1.00 0.00 H new ATOM 0 HG21 ILE A 74 17.412 18.998 13.348 1.00 0.00 H new ATOM 0 HG22 ILE A 74 15.916 18.146 13.800 1.00 0.00 H new ATOM 0 HG23 ILE A 74 17.097 18.597 15.053 1.00 0.00 H new ATOM 0 HD11 ILE A 74 20.944 18.031 13.324 1.00 0.00 H new ATOM 0 HD12 ILE A 74 19.755 17.575 12.081 1.00 0.00 H new ATOM 0 HD13 ILE A 74 19.447 18.974 13.136 1.00 0.00 H new ATOM 1074 N ASP A 75 15.852 16.695 16.682 1.00 0.00 N ATOM 1075 CA ASP A 75 15.640 17.139 18.047 1.00 0.00 C ATOM 1076 C ASP A 75 15.587 15.935 18.981 1.00 0.00 C ATOM 1077 O ASP A 75 15.889 16.047 20.168 1.00 0.00 O ATOM 1078 CB ASP A 75 14.356 17.970 18.148 1.00 0.00 C ATOM 1079 CG ASP A 75 13.112 17.204 17.740 1.00 0.00 C ATOM 1080 OD1 ASP A 75 13.066 16.693 16.599 1.00 0.00 O ATOM 1081 OD2 ASP A 75 12.162 17.133 18.548 1.00 0.00 O ATOM 0 H ASP A 75 15.002 16.657 16.119 1.00 0.00 H new ATOM 0 HA ASP A 75 16.473 17.774 18.348 1.00 0.00 H new ATOM 0 HB2 ASP A 75 14.238 18.321 19.173 1.00 0.00 H new ATOM 0 HB3 ASP A 75 14.453 18.854 17.518 1.00 0.00 H new ATOM 1086 N ASP A 76 15.235 14.777 18.428 1.00 0.00 N ATOM 1087 CA ASP A 76 15.268 13.525 19.181 1.00 0.00 C ATOM 1088 C ASP A 76 16.709 13.128 19.465 1.00 0.00 C ATOM 1089 O ASP A 76 17.001 12.451 20.452 1.00 0.00 O ATOM 1090 CB ASP A 76 14.572 12.396 18.414 1.00 0.00 C ATOM 1091 CG ASP A 76 13.063 12.518 18.420 1.00 0.00 C ATOM 1092 OD1 ASP A 76 12.444 12.155 19.441 1.00 0.00 O ATOM 1093 OD2 ASP A 76 12.490 12.958 17.400 1.00 0.00 O ATOM 0 H ASP A 76 14.924 14.679 17.462 1.00 0.00 H new ATOM 0 HA ASP A 76 14.736 13.685 20.119 1.00 0.00 H new ATOM 0 HB2 ASP A 76 14.926 12.392 17.383 1.00 0.00 H new ATOM 0 HB3 ASP A 76 14.855 11.439 18.852 1.00 0.00 H new ATOM 1098 N LEU A 77 17.608 13.563 18.587 1.00 0.00 N ATOM 1099 CA LEU A 77 19.033 13.306 18.749 1.00 0.00 C ATOM 1100 C LEU A 77 19.607 14.180 19.858 1.00 0.00 C ATOM 1101 O LEU A 77 20.625 13.847 20.462 1.00 0.00 O ATOM 1102 CB LEU A 77 19.775 13.571 17.437 1.00 0.00 C ATOM 1103 CG LEU A 77 19.305 12.738 16.242 1.00 0.00 C ATOM 1104 CD1 LEU A 77 20.073 13.127 14.991 1.00 0.00 C ATOM 1105 CD2 LEU A 77 19.466 11.252 16.527 1.00 0.00 C ATOM 0 H LEU A 77 17.371 14.098 17.752 1.00 0.00 H new ATOM 0 HA LEU A 77 19.165 12.259 19.022 1.00 0.00 H new ATOM 0 HB2 LEU A 77 19.671 14.627 17.187 1.00 0.00 H new ATOM 0 HB3 LEU A 77 20.837 13.384 17.595 1.00 0.00 H new ATOM 0 HG LEU A 77 18.247 12.941 16.076 1.00 0.00 H new ATOM 0 HD11 LEU A 77 19.727 12.526 14.150 1.00 0.00 H new ATOM 0 HD12 LEU A 77 19.906 14.182 14.775 1.00 0.00 H new ATOM 0 HD13 LEU A 77 21.137 12.952 15.148 1.00 0.00 H new ATOM 0 HD21 LEU A 77 19.126 10.677 15.665 1.00 0.00 H new ATOM 0 HD22 LEU A 77 20.516 11.030 16.720 1.00 0.00 H new ATOM 0 HD23 LEU A 77 18.872 10.982 17.400 1.00 0.00 H new ATOM 1117 N LYS A 78 18.940 15.299 20.119 1.00 0.00 N ATOM 1118 CA LYS A 78 19.334 16.193 21.200 1.00 0.00 C ATOM 1119 C LYS A 78 18.887 15.613 22.538 1.00 0.00 C ATOM 1120 O LYS A 78 19.420 15.959 23.595 1.00 0.00 O ATOM 1121 CB LYS A 78 18.723 17.584 20.998 1.00 0.00 C ATOM 1122 CG LYS A 78 19.159 18.264 19.708 1.00 0.00 C ATOM 1123 CD LYS A 78 18.413 19.572 19.492 1.00 0.00 C ATOM 1124 CE LYS A 78 18.821 20.251 18.193 1.00 0.00 C ATOM 1125 NZ LYS A 78 20.231 20.731 18.226 1.00 0.00 N ATOM 0 H LYS A 78 18.122 15.609 19.595 1.00 0.00 H new ATOM 0 HA LYS A 78 20.420 16.290 21.196 1.00 0.00 H new ATOM 0 HB2 LYS A 78 17.636 17.498 21.003 1.00 0.00 H new ATOM 0 HB3 LYS A 78 18.997 18.217 21.842 1.00 0.00 H new ATOM 0 HG2 LYS A 78 20.231 18.456 19.740 1.00 0.00 H new ATOM 0 HG3 LYS A 78 18.980 17.597 18.865 1.00 0.00 H new ATOM 0 HD2 LYS A 78 17.340 19.380 19.480 1.00 0.00 H new ATOM 0 HD3 LYS A 78 18.607 20.243 20.329 1.00 0.00 H new ATOM 0 HE2 LYS A 78 18.696 19.553 17.366 1.00 0.00 H new ATOM 0 HE3 LYS A 78 18.157 21.094 18.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 20.322 21.581 17.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 20.497 20.960 19.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 20.860 19.987 17.862 1.00 0.00 H new ATOM 1139 N GLY A 79 17.901 14.727 22.477 1.00 0.00 N ATOM 1140 CA GLY A 79 17.430 14.053 23.664 1.00 0.00 C ATOM 1141 C GLY A 79 18.376 12.954 24.094 1.00 0.00 C ATOM 1142 O GLY A 79 18.807 12.142 23.272 1.00 0.00 O ATOM 0 H GLY A 79 17.418 14.464 21.618 1.00 0.00 H new ATOM 0 HA2 GLY A 79 17.319 14.775 24.473 1.00 0.00 H new ATOM 0 HA3 GLY A 79 16.443 13.631 23.476 1.00 0.00 H new ATOM 1146 N SER A 80 18.713 12.944 25.371 1.00 0.00 N ATOM 1147 CA SER A 80 19.617 11.953 25.922 1.00 0.00 C ATOM 1148 C SER A 80 18.953 10.578 25.942 1.00 0.00 C ATOM 1149 O SER A 80 17.990 10.392 26.715 1.00 0.00 O ATOM 1150 CB SER A 80 20.039 12.374 27.329 1.00 0.00 C ATOM 1151 OG SER A 80 20.495 13.720 27.335 1.00 0.00 O ATOM 1152 OXT SER A 80 19.386 9.692 25.175 1.00 0.00 O ATOM 0 H SER A 80 18.369 13.620 26.053 1.00 0.00 H new ATOM 0 HA SER A 80 20.505 11.887 25.293 1.00 0.00 H new ATOM 0 HB2 SER A 80 19.198 12.267 28.014 1.00 0.00 H new ATOM 0 HB3 SER A 80 20.829 11.715 27.689 1.00 0.00 H new ATOM 0 HG SER A 80 20.759 13.972 28.245 1.00 0.00 H new TER 1158 SER A 80 ATOM 1159 N VAL B 1 17.593 -3.061 -17.865 1.00 0.00 N ATOM 1160 CA VAL B 1 16.153 -3.150 -17.536 1.00 0.00 C ATOM 1161 C VAL B 1 15.817 -2.174 -16.421 1.00 0.00 C ATOM 1162 O VAL B 1 16.712 -1.683 -15.731 1.00 0.00 O ATOM 1163 CB VAL B 1 15.741 -4.577 -17.110 1.00 0.00 C ATOM 1164 CG1 VAL B 1 15.990 -5.565 -18.239 1.00 0.00 C ATOM 1165 CG2 VAL B 1 16.479 -5.004 -15.850 1.00 0.00 C ATOM 0 H1 VAL B 1 17.705 -2.802 -18.866 1.00 0.00 H new ATOM 0 H2 VAL B 1 18.042 -2.337 -17.268 1.00 0.00 H new ATOM 0 H3 VAL B 1 18.046 -3.981 -17.693 1.00 0.00 H new ATOM 0 HA VAL B 1 15.597 -2.897 -18.438 1.00 0.00 H new ATOM 0 HB VAL B 1 14.674 -4.569 -16.889 1.00 0.00 H new ATOM 0 HG11 VAL B 1 15.694 -6.564 -17.920 1.00 0.00 H new ATOM 0 HG12 VAL B 1 15.406 -5.275 -19.112 1.00 0.00 H new ATOM 0 HG13 VAL B 1 17.049 -5.565 -18.495 1.00 0.00 H new ATOM 0 HG21 VAL B 1 16.171 -6.012 -15.572 1.00 0.00 H new ATOM 0 HG22 VAL B 1 17.553 -4.991 -16.035 1.00 0.00 H new ATOM 0 HG23 VAL B 1 16.243 -4.315 -15.039 1.00 0.00 H new ATOM 1177 N ALA B 2 14.535 -1.891 -16.240 1.00 0.00 N ATOM 1178 CA ALA B 2 14.116 -0.908 -15.259 1.00 0.00 C ATOM 1179 C ALA B 2 12.839 -1.330 -14.552 1.00 0.00 C ATOM 1180 O ALA B 2 11.822 -1.591 -15.192 1.00 0.00 O ATOM 1181 CB ALA B 2 13.921 0.445 -15.926 1.00 0.00 C ATOM 0 H ALA B 2 13.772 -2.327 -16.758 1.00 0.00 H new ATOM 0 HA ALA B 2 14.902 -0.832 -14.508 1.00 0.00 H new ATOM 0 HB1 ALA B 2 13.606 1.176 -15.181 1.00 0.00 H new ATOM 0 HB2 ALA B 2 14.860 0.767 -16.377 1.00 0.00 H new ATOM 0 HB3 ALA B 2 13.157 0.363 -16.699 1.00 0.00 H new ATOM 1187 N SER B 3 12.909 -1.420 -13.235 1.00 0.00 N ATOM 1188 CA SER B 3 11.723 -1.599 -12.420 1.00 0.00 C ATOM 1189 C SER B 3 11.087 -0.234 -12.193 1.00 0.00 C ATOM 1190 O SER B 3 11.782 0.781 -12.240 1.00 0.00 O ATOM 1191 CB SER B 3 12.095 -2.248 -11.087 1.00 0.00 C ATOM 1192 OG SER B 3 12.812 -3.453 -11.297 1.00 0.00 O ATOM 0 H SER B 3 13.780 -1.372 -12.706 1.00 0.00 H new ATOM 0 HA SER B 3 11.014 -2.255 -12.926 1.00 0.00 H new ATOM 0 HB2 SER B 3 12.699 -1.558 -10.497 1.00 0.00 H new ATOM 0 HB3 SER B 3 11.192 -2.452 -10.512 1.00 0.00 H new ATOM 0 HG SER B 3 13.042 -3.852 -10.432 1.00 0.00 H new ATOM 1198 N LYS B 4 9.785 -0.183 -11.968 1.00 0.00 N ATOM 1199 CA LYS B 4 9.131 1.107 -11.840 1.00 0.00 C ATOM 1200 C LYS B 4 9.183 1.614 -10.402 1.00 0.00 C ATOM 1201 O LYS B 4 8.982 0.863 -9.444 1.00 0.00 O ATOM 1202 CB LYS B 4 7.684 1.070 -12.352 1.00 0.00 C ATOM 1203 CG LYS B 4 6.682 0.400 -11.425 1.00 0.00 C ATOM 1204 CD LYS B 4 5.265 0.651 -11.911 1.00 0.00 C ATOM 1205 CE LYS B 4 4.218 0.157 -10.928 1.00 0.00 C ATOM 1206 NZ LYS B 4 2.843 0.503 -11.382 1.00 0.00 N ATOM 0 H LYS B 4 9.175 -0.995 -11.872 1.00 0.00 H new ATOM 0 HA LYS B 4 9.683 1.806 -12.468 1.00 0.00 H new ATOM 0 HB2 LYS B 4 7.355 2.093 -12.537 1.00 0.00 H new ATOM 0 HB3 LYS B 4 7.669 0.552 -13.311 1.00 0.00 H new ATOM 0 HG2 LYS B 4 6.875 -0.672 -11.383 1.00 0.00 H new ATOM 0 HG3 LYS B 4 6.800 0.785 -10.412 1.00 0.00 H new ATOM 0 HD2 LYS B 4 5.126 1.719 -12.079 1.00 0.00 H new ATOM 0 HD3 LYS B 4 5.120 0.155 -12.871 1.00 0.00 H new ATOM 0 HE2 LYS B 4 4.304 -0.924 -10.814 1.00 0.00 H new ATOM 0 HE3 LYS B 4 4.401 0.597 -9.947 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 2.156 -0.124 -10.917 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 2.634 1.491 -11.134 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 2.778 0.384 -12.413 1.00 0.00 H new ATOM 1220 N ALA B 5 9.483 2.891 -10.275 1.00 0.00 N ATOM 1221 CA ALA B 5 9.489 3.566 -8.996 1.00 0.00 C ATOM 1222 C ALA B 5 8.346 4.565 -8.968 1.00 0.00 C ATOM 1223 O ALA B 5 8.277 5.461 -9.808 1.00 0.00 O ATOM 1224 CB ALA B 5 10.824 4.258 -8.765 1.00 0.00 C ATOM 0 H ALA B 5 9.731 3.491 -11.061 1.00 0.00 H new ATOM 0 HA ALA B 5 9.354 2.840 -8.194 1.00 0.00 H new ATOM 0 HB1 ALA B 5 10.811 4.761 -7.798 1.00 0.00 H new ATOM 0 HB2 ALA B 5 11.624 3.518 -8.778 1.00 0.00 H new ATOM 0 HB3 ALA B 5 10.995 4.992 -9.553 1.00 0.00 H new ATOM 1230 N ILE B 6 7.451 4.408 -8.011 1.00 0.00 N ATOM 1231 CA ILE B 6 6.224 5.188 -8.002 1.00 0.00 C ATOM 1232 C ILE B 6 6.369 6.417 -7.114 1.00 0.00 C ATOM 1233 O ILE B 6 6.623 6.309 -5.917 1.00 0.00 O ATOM 1234 CB ILE B 6 5.031 4.349 -7.504 1.00 0.00 C ATOM 1235 CG1 ILE B 6 4.969 3.011 -8.246 1.00 0.00 C ATOM 1236 CG2 ILE B 6 3.737 5.124 -7.700 1.00 0.00 C ATOM 1237 CD1 ILE B 6 3.901 2.074 -7.723 1.00 0.00 C ATOM 0 H ILE B 6 7.547 3.753 -7.235 1.00 0.00 H new ATOM 0 HA ILE B 6 6.036 5.501 -9.029 1.00 0.00 H new ATOM 0 HB ILE B 6 5.164 4.145 -6.442 1.00 0.00 H new ATOM 0 HG12 ILE B 6 4.787 3.200 -9.304 1.00 0.00 H new ATOM 0 HG13 ILE B 6 5.939 2.519 -8.172 1.00 0.00 H new ATOM 0 HG21 ILE B 6 2.897 4.526 -7.346 1.00 0.00 H new ATOM 0 HG22 ILE B 6 3.782 6.056 -7.136 1.00 0.00 H new ATOM 0 HG23 ILE B 6 3.603 5.347 -8.759 1.00 0.00 H new ATOM 0 HD11 ILE B 6 3.917 1.147 -8.297 1.00 0.00 H new ATOM 0 HD12 ILE B 6 4.093 1.854 -6.673 1.00 0.00 H new ATOM 0 HD13 ILE B 6 2.923 2.545 -7.822 1.00 0.00 H new ATOM 1249 N PHE B 7 6.202 7.582 -7.716 1.00 0.00 N ATOM 1250 CA PHE B 7 6.294 8.833 -6.991 1.00 0.00 C ATOM 1251 C PHE B 7 4.896 9.350 -6.674 1.00 0.00 C ATOM 1252 O PHE B 7 4.190 9.850 -7.553 1.00 0.00 O ATOM 1253 CB PHE B 7 7.080 9.864 -7.808 1.00 0.00 C ATOM 1254 CG PHE B 7 7.323 11.162 -7.089 1.00 0.00 C ATOM 1255 CD1 PHE B 7 8.264 11.244 -6.074 1.00 0.00 C ATOM 1256 CD2 PHE B 7 6.618 12.304 -7.436 1.00 0.00 C ATOM 1257 CE1 PHE B 7 8.494 12.439 -5.418 1.00 0.00 C ATOM 1258 CE2 PHE B 7 6.843 13.500 -6.782 1.00 0.00 C ATOM 1259 CZ PHE B 7 7.782 13.568 -5.773 1.00 0.00 C ATOM 0 H PHE B 7 6.001 7.685 -8.711 1.00 0.00 H new ATOM 0 HA PHE B 7 6.825 8.664 -6.054 1.00 0.00 H new ATOM 0 HB2 PHE B 7 8.040 9.432 -8.090 1.00 0.00 H new ATOM 0 HB3 PHE B 7 6.539 10.069 -8.732 1.00 0.00 H new ATOM 0 HD1 PHE B 7 8.824 10.364 -5.793 1.00 0.00 H new ATOM 0 HD2 PHE B 7 5.884 12.258 -8.227 1.00 0.00 H new ATOM 0 HE1 PHE B 7 9.230 12.490 -4.629 1.00 0.00 H new ATOM 0 HE2 PHE B 7 6.284 14.381 -7.060 1.00 0.00 H new ATOM 0 HZ PHE B 7 7.960 14.503 -5.262 1.00 0.00 H new ATOM 1269 N TYR B 8 4.495 9.199 -5.421 1.00 0.00 N ATOM 1270 CA TYR B 8 3.188 9.657 -4.979 1.00 0.00 C ATOM 1271 C TYR B 8 3.279 11.077 -4.447 1.00 0.00 C ATOM 1272 O TYR B 8 4.051 11.356 -3.530 1.00 0.00 O ATOM 1273 CB TYR B 8 2.625 8.738 -3.890 1.00 0.00 C ATOM 1274 CG TYR B 8 2.134 7.402 -4.400 1.00 0.00 C ATOM 1275 CD1 TYR B 8 1.018 7.325 -5.221 1.00 0.00 C ATOM 1276 CD2 TYR B 8 2.778 6.221 -4.057 1.00 0.00 C ATOM 1277 CE1 TYR B 8 0.556 6.111 -5.685 1.00 0.00 C ATOM 1278 CE2 TYR B 8 2.321 5.000 -4.519 1.00 0.00 C ATOM 1279 CZ TYR B 8 1.208 4.952 -5.333 1.00 0.00 C ATOM 1280 OH TYR B 8 0.747 3.743 -5.799 1.00 0.00 O ATOM 0 H TYR B 8 5.058 8.762 -4.691 1.00 0.00 H new ATOM 0 HA TYR B 8 2.517 9.634 -5.838 1.00 0.00 H new ATOM 0 HB2 TYR B 8 3.397 8.567 -3.140 1.00 0.00 H new ATOM 0 HB3 TYR B 8 1.802 9.248 -3.389 1.00 0.00 H new ATOM 0 HD1 TYR B 8 0.502 8.231 -5.502 1.00 0.00 H new ATOM 0 HD2 TYR B 8 3.649 6.256 -3.420 1.00 0.00 H new ATOM 0 HE1 TYR B 8 -0.315 6.071 -6.323 1.00 0.00 H new ATOM 0 HE2 TYR B 8 2.832 4.089 -4.244 1.00 0.00 H new ATOM 0 HH TYR B 8 1.318 3.022 -5.460 1.00 0.00 H new ATOM 1290 N HIS B 9 2.496 11.971 -5.028 1.00 0.00 N ATOM 1291 CA HIS B 9 2.472 13.353 -4.583 1.00 0.00 C ATOM 1292 C HIS B 9 1.062 13.922 -4.688 1.00 0.00 C ATOM 1293 O HIS B 9 0.142 13.236 -5.135 1.00 0.00 O ATOM 1294 CB HIS B 9 3.465 14.200 -5.388 1.00 0.00 C ATOM 1295 CG HIS B 9 3.075 14.432 -6.817 1.00 0.00 C ATOM 1296 ND1 HIS B 9 2.596 15.650 -7.231 1.00 0.00 N ATOM 1297 CD2 HIS B 9 3.126 13.592 -7.878 1.00 0.00 C ATOM 1298 CE1 HIS B 9 2.369 15.527 -8.526 1.00 0.00 C ATOM 1299 NE2 HIS B 9 2.675 14.298 -8.962 1.00 0.00 N ATOM 0 H HIS B 9 1.870 11.765 -5.807 1.00 0.00 H new ATOM 0 HA HIS B 9 2.775 13.383 -3.537 1.00 0.00 H new ATOM 0 HB2 HIS B 9 3.581 15.166 -4.896 1.00 0.00 H new ATOM 0 HB3 HIS B 9 4.439 13.712 -5.366 1.00 0.00 H new ATOM 0 HD2 HIS B 9 3.458 12.564 -7.871 1.00 0.00 H new ATOM 0 HE1 HIS B 9 1.985 16.317 -9.154 1.00 0.00 H new ATOM 0 HE2 HIS B 9 2.589 13.954 -9.918 1.00 0.00 H new ATOM 1307 N ALA B 10 0.897 15.173 -4.278 1.00 0.00 N ATOM 1308 CA ALA B 10 -0.420 15.798 -4.256 1.00 0.00 C ATOM 1309 C ALA B 10 -0.426 17.126 -5.009 1.00 0.00 C ATOM 1310 O ALA B 10 -1.397 17.876 -4.947 1.00 0.00 O ATOM 1311 CB ALA B 10 -0.874 16.005 -2.819 1.00 0.00 C ATOM 0 H ALA B 10 1.656 15.774 -3.957 1.00 0.00 H new ATOM 0 HA ALA B 10 -1.116 15.129 -4.762 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -1.859 16.472 -2.812 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -0.926 15.042 -2.312 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.163 16.649 -2.302 1.00 0.00 H new ATOM 1317 N GLY B 11 0.659 17.416 -5.718 1.00 0.00 N ATOM 1318 CA GLY B 11 0.729 18.645 -6.495 1.00 0.00 C ATOM 1319 C GLY B 11 1.321 19.810 -5.723 1.00 0.00 C ATOM 1320 O GLY B 11 1.851 20.746 -6.321 1.00 0.00 O ATOM 0 H GLY B 11 1.490 16.826 -5.770 1.00 0.00 H new ATOM 0 HA2 GLY B 11 1.328 18.468 -7.388 1.00 0.00 H new ATOM 0 HA3 GLY B 11 -0.273 18.912 -6.831 1.00 0.00 H new ATOM 1324 N CYS B 12 1.224 19.752 -4.396 1.00 0.00 N ATOM 1325 CA CYS B 12 1.766 20.795 -3.524 1.00 0.00 C ATOM 1326 C CYS B 12 3.231 21.090 -3.859 1.00 0.00 C ATOM 1327 O CYS B 12 3.964 20.194 -4.275 1.00 0.00 O ATOM 1328 CB CYS B 12 1.645 20.353 -2.064 1.00 0.00 C ATOM 1329 SG CYS B 12 -0.016 19.818 -1.594 1.00 0.00 S ATOM 0 H CYS B 12 0.771 18.987 -3.897 1.00 0.00 H new ATOM 0 HA CYS B 12 1.193 21.709 -3.682 1.00 0.00 H new ATOM 0 HB2 CYS B 12 2.344 19.536 -1.883 1.00 0.00 H new ATOM 0 HB3 CYS B 12 1.946 21.178 -1.419 1.00 0.00 H new ATOM 0 HG CYS B 12 -0.020 19.461 -0.344 1.00 0.00 H new ATOM 1335 N PRO B 13 3.672 22.350 -3.683 1.00 0.00 N ATOM 1336 CA PRO B 13 5.047 22.782 -3.995 1.00 0.00 C ATOM 1337 C PRO B 13 6.130 21.880 -3.390 1.00 0.00 C ATOM 1338 O PRO B 13 7.212 21.740 -3.959 1.00 0.00 O ATOM 1339 CB PRO B 13 5.115 24.184 -3.393 1.00 0.00 C ATOM 1340 CG PRO B 13 3.712 24.676 -3.445 1.00 0.00 C ATOM 1341 CD PRO B 13 2.849 23.473 -3.186 1.00 0.00 C ATOM 0 HA PRO B 13 5.242 22.742 -5.067 1.00 0.00 H new ATOM 0 HB2 PRO B 13 5.490 24.160 -2.370 1.00 0.00 H new ATOM 0 HB3 PRO B 13 5.784 24.829 -3.962 1.00 0.00 H new ATOM 0 HG2 PRO B 13 3.540 25.449 -2.696 1.00 0.00 H new ATOM 0 HG3 PRO B 13 3.488 25.117 -4.416 1.00 0.00 H new ATOM 0 HD2 PRO B 13 2.618 23.364 -2.126 1.00 0.00 H new ATOM 0 HD3 PRO B 13 1.898 23.539 -3.714 1.00 0.00 H new ATOM 1349 N VAL B 14 5.832 21.267 -2.246 1.00 0.00 N ATOM 1350 CA VAL B 14 6.755 20.319 -1.617 1.00 0.00 C ATOM 1351 C VAL B 14 7.069 19.159 -2.564 1.00 0.00 C ATOM 1352 O VAL B 14 8.200 18.673 -2.623 1.00 0.00 O ATOM 1353 CB VAL B 14 6.173 19.755 -0.299 1.00 0.00 C ATOM 1354 CG1 VAL B 14 7.133 18.765 0.346 1.00 0.00 C ATOM 1355 CG2 VAL B 14 5.847 20.882 0.666 1.00 0.00 C ATOM 0 H VAL B 14 4.961 21.408 -1.735 1.00 0.00 H new ATOM 0 HA VAL B 14 7.672 20.864 -1.392 1.00 0.00 H new ATOM 0 HB VAL B 14 5.252 19.225 -0.540 1.00 0.00 H new ATOM 0 HG11 VAL B 14 6.697 18.385 1.270 1.00 0.00 H new ATOM 0 HG12 VAL B 14 7.314 17.935 -0.338 1.00 0.00 H new ATOM 0 HG13 VAL B 14 8.076 19.264 0.568 1.00 0.00 H new ATOM 0 HG21 VAL B 14 5.439 20.466 1.587 1.00 0.00 H new ATOM 0 HG22 VAL B 14 6.755 21.442 0.892 1.00 0.00 H new ATOM 0 HG23 VAL B 14 5.113 21.548 0.213 1.00 0.00 H new ATOM 1365 N CYS B 15 6.062 18.741 -3.322 1.00 0.00 N ATOM 1366 CA CYS B 15 6.208 17.644 -4.267 1.00 0.00 C ATOM 1367 C CYS B 15 7.163 18.039 -5.382 1.00 0.00 C ATOM 1368 O CYS B 15 7.996 17.247 -5.816 1.00 0.00 O ATOM 1369 CB CYS B 15 4.849 17.286 -4.868 1.00 0.00 C ATOM 1370 SG CYS B 15 3.495 17.229 -3.668 1.00 0.00 S ATOM 0 H CYS B 15 5.128 19.151 -3.298 1.00 0.00 H new ATOM 0 HA CYS B 15 6.609 16.780 -3.738 1.00 0.00 H new ATOM 0 HB2 CYS B 15 4.603 18.014 -5.641 1.00 0.00 H new ATOM 0 HB3 CYS B 15 4.926 16.315 -5.358 1.00 0.00 H new ATOM 0 HG CYS B 15 3.089 18.438 -3.414 1.00 0.00 H new ATOM 1376 N VAL B 16 7.040 19.287 -5.822 1.00 0.00 N ATOM 1377 CA VAL B 16 7.844 19.809 -6.918 1.00 0.00 C ATOM 1378 C VAL B 16 9.325 19.824 -6.547 1.00 0.00 C ATOM 1379 O VAL B 16 10.178 19.449 -7.351 1.00 0.00 O ATOM 1380 CB VAL B 16 7.393 21.234 -7.305 1.00 0.00 C ATOM 1381 CG1 VAL B 16 8.163 21.740 -8.516 1.00 0.00 C ATOM 1382 CG2 VAL B 16 5.895 21.265 -7.570 1.00 0.00 C ATOM 0 H VAL B 16 6.383 19.961 -5.430 1.00 0.00 H new ATOM 0 HA VAL B 16 7.700 19.149 -7.774 1.00 0.00 H new ATOM 0 HB VAL B 16 7.610 21.897 -6.468 1.00 0.00 H new ATOM 0 HG11 VAL B 16 7.826 22.746 -8.767 1.00 0.00 H new ATOM 0 HG12 VAL B 16 9.228 21.761 -8.287 1.00 0.00 H new ATOM 0 HG13 VAL B 16 7.987 21.076 -9.362 1.00 0.00 H new ATOM 0 HG21 VAL B 16 5.594 22.277 -7.841 1.00 0.00 H new ATOM 0 HG22 VAL B 16 5.656 20.584 -8.387 1.00 0.00 H new ATOM 0 HG23 VAL B 16 5.360 20.956 -6.672 1.00 0.00 H new ATOM 1392 N SER B 17 9.619 20.243 -5.320 1.00 0.00 N ATOM 1393 CA SER B 17 10.990 20.279 -4.827 1.00 0.00 C ATOM 1394 C SER B 17 11.612 18.881 -4.854 1.00 0.00 C ATOM 1395 O SER B 17 12.728 18.691 -5.349 1.00 0.00 O ATOM 1396 CB SER B 17 11.008 20.837 -3.404 1.00 0.00 C ATOM 1397 OG SER B 17 10.271 22.047 -3.324 1.00 0.00 O ATOM 0 H SER B 17 8.922 20.563 -4.647 1.00 0.00 H new ATOM 0 HA SER B 17 11.580 20.926 -5.476 1.00 0.00 H new ATOM 0 HB2 SER B 17 10.586 20.104 -2.716 1.00 0.00 H new ATOM 0 HB3 SER B 17 12.037 21.012 -3.091 1.00 0.00 H new ATOM 0 HG SER B 17 10.295 22.384 -2.404 1.00 0.00 H new ATOM 1403 N ALA B 18 10.872 17.905 -4.335 1.00 0.00 N ATOM 1404 CA ALA B 18 11.334 16.525 -4.309 1.00 0.00 C ATOM 1405 C ALA B 18 11.497 15.986 -5.725 1.00 0.00 C ATOM 1406 O ALA B 18 12.503 15.349 -6.047 1.00 0.00 O ATOM 1407 CB ALA B 18 10.366 15.657 -3.516 1.00 0.00 C ATOM 0 H ALA B 18 9.948 18.047 -3.927 1.00 0.00 H new ATOM 0 HA ALA B 18 12.307 16.497 -3.819 1.00 0.00 H new ATOM 0 HB1 ALA B 18 10.725 14.628 -3.506 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.298 16.028 -2.493 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.381 15.693 -3.981 1.00 0.00 H new ATOM 1413 N GLU B 19 10.506 16.261 -6.566 1.00 0.00 N ATOM 1414 CA GLU B 19 10.524 15.827 -7.957 1.00 0.00 C ATOM 1415 C GLU B 19 11.752 16.368 -8.682 1.00 0.00 C ATOM 1416 O GLU B 19 12.514 15.608 -9.274 1.00 0.00 O ATOM 1417 CB GLU B 19 9.251 16.294 -8.670 1.00 0.00 C ATOM 1418 CG GLU B 19 9.220 15.954 -10.152 1.00 0.00 C ATOM 1419 CD GLU B 19 8.022 16.549 -10.861 1.00 0.00 C ATOM 1420 OE1 GLU B 19 7.985 17.786 -11.036 1.00 0.00 O ATOM 1421 OE2 GLU B 19 7.120 15.781 -11.258 1.00 0.00 O ATOM 0 H GLU B 19 9.673 16.788 -6.304 1.00 0.00 H new ATOM 0 HA GLU B 19 10.567 14.738 -7.973 1.00 0.00 H new ATOM 0 HB2 GLU B 19 8.386 15.841 -8.184 1.00 0.00 H new ATOM 0 HB3 GLU B 19 9.154 17.373 -8.552 1.00 0.00 H new ATOM 0 HG2 GLU B 19 10.133 16.317 -10.623 1.00 0.00 H new ATOM 0 HG3 GLU B 19 9.208 14.871 -10.272 1.00 0.00 H new ATOM 1428 N GLN B 20 11.944 17.681 -8.610 1.00 0.00 N ATOM 1429 CA GLN B 20 13.026 18.343 -9.327 1.00 0.00 C ATOM 1430 C GLN B 20 14.379 17.701 -9.024 1.00 0.00 C ATOM 1431 O GLN B 20 15.115 17.323 -9.935 1.00 0.00 O ATOM 1432 CB GLN B 20 13.070 19.831 -8.973 1.00 0.00 C ATOM 1433 CG GLN B 20 14.134 20.598 -9.738 1.00 0.00 C ATOM 1434 CD GLN B 20 14.223 22.056 -9.338 1.00 0.00 C ATOM 1435 OE1 GLN B 20 13.232 22.666 -8.930 1.00 0.00 O ATOM 1436 NE2 GLN B 20 15.410 22.628 -9.465 1.00 0.00 N ATOM 0 H GLN B 20 11.360 18.310 -8.059 1.00 0.00 H new ATOM 0 HA GLN B 20 12.827 18.230 -10.393 1.00 0.00 H new ATOM 0 HB2 GLN B 20 12.095 20.275 -9.176 1.00 0.00 H new ATOM 0 HB3 GLN B 20 13.253 19.938 -7.904 1.00 0.00 H new ATOM 0 HG2 GLN B 20 15.102 20.124 -9.575 1.00 0.00 H new ATOM 0 HG3 GLN B 20 13.923 20.533 -10.805 1.00 0.00 H new ATOM 0 HE21 GLN B 20 16.204 22.086 -9.807 1.00 0.00 H new ATOM 0 HE22 GLN B 20 15.531 23.611 -9.221 1.00 0.00 H new ATOM 1445 N ALA B 21 14.694 17.559 -7.746 1.00 0.00 N ATOM 1446 CA ALA B 21 16.010 17.080 -7.349 1.00 0.00 C ATOM 1447 C ALA B 21 16.165 15.573 -7.552 1.00 0.00 C ATOM 1448 O ALA B 21 17.085 15.123 -8.238 1.00 0.00 O ATOM 1449 CB ALA B 21 16.286 17.451 -5.902 1.00 0.00 C ATOM 0 H ALA B 21 14.063 17.766 -6.972 1.00 0.00 H new ATOM 0 HA ALA B 21 16.742 17.566 -7.994 1.00 0.00 H new ATOM 0 HB1 ALA B 21 17.273 17.088 -5.615 1.00 0.00 H new ATOM 0 HB2 ALA B 21 16.252 18.535 -5.791 1.00 0.00 H new ATOM 0 HB3 ALA B 21 15.532 16.997 -5.260 1.00 0.00 H new ATOM 1455 N VAL B 22 15.258 14.794 -6.977 1.00 0.00 N ATOM 1456 CA VAL B 22 15.432 13.345 -6.924 1.00 0.00 C ATOM 1457 C VAL B 22 15.166 12.682 -8.279 1.00 0.00 C ATOM 1458 O VAL B 22 15.867 11.741 -8.659 1.00 0.00 O ATOM 1459 CB VAL B 22 14.530 12.704 -5.844 1.00 0.00 C ATOM 1460 CG1 VAL B 22 14.877 11.234 -5.651 1.00 0.00 C ATOM 1461 CG2 VAL B 22 14.653 13.454 -4.525 1.00 0.00 C ATOM 0 H VAL B 22 14.400 15.136 -6.543 1.00 0.00 H new ATOM 0 HA VAL B 22 16.475 13.173 -6.659 1.00 0.00 H new ATOM 0 HB VAL B 22 13.497 12.771 -6.185 1.00 0.00 H new ATOM 0 HG11 VAL B 22 14.229 10.805 -4.887 1.00 0.00 H new ATOM 0 HG12 VAL B 22 14.733 10.700 -6.590 1.00 0.00 H new ATOM 0 HG13 VAL B 22 15.917 11.144 -5.338 1.00 0.00 H new ATOM 0 HG21 VAL B 22 14.010 12.986 -3.779 1.00 0.00 H new ATOM 0 HG22 VAL B 22 15.688 13.422 -4.183 1.00 0.00 H new ATOM 0 HG23 VAL B 22 14.349 14.491 -4.667 1.00 0.00 H new ATOM 1471 N ALA B 23 14.180 13.181 -9.022 1.00 0.00 N ATOM 1472 CA ALA B 23 13.800 12.560 -10.291 1.00 0.00 C ATOM 1473 C ALA B 23 14.831 12.821 -11.387 1.00 0.00 C ATOM 1474 O ALA B 23 14.796 12.188 -12.441 1.00 0.00 O ATOM 1475 CB ALA B 23 12.422 13.028 -10.735 1.00 0.00 C ATOM 0 H ALA B 23 13.634 14.005 -8.771 1.00 0.00 H new ATOM 0 HA ALA B 23 13.765 11.484 -10.122 1.00 0.00 H new ATOM 0 HB1 ALA B 23 12.163 12.552 -11.681 1.00 0.00 H new ATOM 0 HB2 ALA B 23 11.685 12.758 -9.979 1.00 0.00 H new ATOM 0 HB3 ALA B 23 12.429 14.110 -10.864 1.00 0.00 H new ATOM 1481 N ASN B 24 15.738 13.764 -11.152 1.00 0.00 N ATOM 1482 CA ASN B 24 16.835 13.995 -12.088 1.00 0.00 C ATOM 1483 C ASN B 24 18.084 13.258 -11.629 1.00 0.00 C ATOM 1484 O ASN B 24 18.974 12.958 -12.428 1.00 0.00 O ATOM 1485 CB ASN B 24 17.138 15.487 -12.260 1.00 0.00 C ATOM 1486 CG ASN B 24 16.157 16.178 -13.190 1.00 0.00 C ATOM 1487 OD1 ASN B 24 16.300 16.125 -14.414 1.00 0.00 O ATOM 1488 ND2 ASN B 24 15.175 16.857 -12.623 1.00 0.00 N ATOM 0 H ASN B 24 15.737 14.373 -10.334 1.00 0.00 H new ATOM 0 HA ASN B 24 16.522 13.608 -13.058 1.00 0.00 H new ATOM 0 HB2 ASN B 24 17.113 15.974 -11.285 1.00 0.00 H new ATOM 0 HB3 ASN B 24 18.149 15.606 -12.650 1.00 0.00 H new ATOM 0 HD21 ASN B 24 14.503 17.361 -13.202 1.00 0.00 H new ATOM 0 HD22 ASN B 24 15.089 16.877 -11.607 1.00 0.00 H new ATOM 1495 N ALA B 25 18.145 12.966 -10.334 1.00 0.00 N ATOM 1496 CA ALA B 25 19.241 12.191 -9.778 1.00 0.00 C ATOM 1497 C ALA B 25 19.141 10.742 -10.237 1.00 0.00 C ATOM 1498 O ALA B 25 20.100 10.178 -10.770 1.00 0.00 O ATOM 1499 CB ALA B 25 19.235 12.273 -8.258 1.00 0.00 C ATOM 0 H ALA B 25 17.445 13.256 -9.651 1.00 0.00 H new ATOM 0 HA ALA B 25 20.182 12.607 -10.137 1.00 0.00 H new ATOM 0 HB1 ALA B 25 20.063 11.687 -7.859 1.00 0.00 H new ATOM 0 HB2 ALA B 25 19.345 13.313 -7.949 1.00 0.00 H new ATOM 0 HB3 ALA B 25 18.293 11.878 -7.876 1.00 0.00 H new ATOM 1505 N ILE B 26 17.968 10.155 -10.052 1.00 0.00 N ATOM 1506 CA ILE B 26 17.727 8.783 -10.465 1.00 0.00 C ATOM 1507 C ILE B 26 17.341 8.742 -11.939 1.00 0.00 C ATOM 1508 O ILE B 26 16.382 9.389 -12.353 1.00 0.00 O ATOM 1509 CB ILE B 26 16.608 8.129 -9.625 1.00 0.00 C ATOM 1510 CG1 ILE B 26 16.946 8.216 -8.133 1.00 0.00 C ATOM 1511 CG2 ILE B 26 16.404 6.678 -10.045 1.00 0.00 C ATOM 1512 CD1 ILE B 26 15.852 7.691 -7.227 1.00 0.00 C ATOM 0 H ILE B 26 17.166 10.611 -9.617 1.00 0.00 H new ATOM 0 HA ILE B 26 18.648 8.222 -10.307 1.00 0.00 H new ATOM 0 HB ILE B 26 15.678 8.670 -9.802 1.00 0.00 H new ATOM 0 HG12 ILE B 26 17.862 7.655 -7.944 1.00 0.00 H new ATOM 0 HG13 ILE B 26 17.150 9.255 -7.876 1.00 0.00 H new ATOM 0 HG21 ILE B 26 15.612 6.233 -9.443 1.00 0.00 H new ATOM 0 HG22 ILE B 26 16.124 6.640 -11.098 1.00 0.00 H new ATOM 0 HG23 ILE B 26 17.330 6.122 -9.895 1.00 0.00 H new ATOM 0 HD11 ILE B 26 16.164 7.786 -6.187 1.00 0.00 H new ATOM 0 HD12 ILE B 26 14.940 8.267 -7.386 1.00 0.00 H new ATOM 0 HD13 ILE B 26 15.663 6.642 -7.455 1.00 0.00 H new ATOM 1524 N ASP B 27 18.103 8.000 -12.729 1.00 0.00 N ATOM 1525 CA ASP B 27 17.839 7.898 -14.160 1.00 0.00 C ATOM 1526 C ASP B 27 16.639 7.001 -14.423 1.00 0.00 C ATOM 1527 O ASP B 27 16.558 5.892 -13.888 1.00 0.00 O ATOM 1528 CB ASP B 27 19.053 7.340 -14.909 1.00 0.00 C ATOM 1529 CG ASP B 27 20.279 8.215 -14.789 1.00 0.00 C ATOM 1530 OD1 ASP B 27 20.330 9.283 -15.436 1.00 0.00 O ATOM 1531 OD2 ASP B 27 21.208 7.834 -14.050 1.00 0.00 O ATOM 0 H ASP B 27 18.907 7.461 -12.407 1.00 0.00 H new ATOM 0 HA ASP B 27 17.629 8.904 -14.523 1.00 0.00 H new ATOM 0 HB2 ASP B 27 19.284 6.347 -14.524 1.00 0.00 H new ATOM 0 HB3 ASP B 27 18.800 7.223 -15.963 1.00 0.00 H new ATOM 1536 N PRO B 28 15.697 7.465 -15.261 1.00 0.00 N ATOM 1537 CA PRO B 28 14.539 6.666 -15.676 1.00 0.00 C ATOM 1538 C PRO B 28 14.958 5.401 -16.425 1.00 0.00 C ATOM 1539 O PRO B 28 14.174 4.462 -16.581 1.00 0.00 O ATOM 1540 CB PRO B 28 13.760 7.606 -16.606 1.00 0.00 C ATOM 1541 CG PRO B 28 14.240 8.974 -16.264 1.00 0.00 C ATOM 1542 CD PRO B 28 15.674 8.813 -15.849 1.00 0.00 C ATOM 0 HA PRO B 28 13.956 6.320 -14.823 1.00 0.00 H new ATOM 0 HB2 PRO B 28 13.950 7.372 -17.653 1.00 0.00 H new ATOM 0 HB3 PRO B 28 12.685 7.514 -16.449 1.00 0.00 H new ATOM 0 HG2 PRO B 28 14.153 9.644 -17.119 1.00 0.00 H new ATOM 0 HG3 PRO B 28 13.646 9.407 -15.459 1.00 0.00 H new ATOM 0 HD2 PRO B 28 16.352 8.895 -16.699 1.00 0.00 H new ATOM 0 HD3 PRO B 28 15.974 9.573 -15.128 1.00 0.00 H new ATOM 1550 N SER B 29 16.200 5.390 -16.889 1.00 0.00 N ATOM 1551 CA SER B 29 16.761 4.229 -17.557 1.00 0.00 C ATOM 1552 C SER B 29 17.072 3.124 -16.547 1.00 0.00 C ATOM 1553 O SER B 29 17.059 1.939 -16.886 1.00 0.00 O ATOM 1554 CB SER B 29 18.024 4.634 -18.312 1.00 0.00 C ATOM 1555 OG SER B 29 17.775 5.761 -19.137 1.00 0.00 O ATOM 0 H SER B 29 16.841 6.180 -16.813 1.00 0.00 H new ATOM 0 HA SER B 29 16.030 3.841 -18.267 1.00 0.00 H new ATOM 0 HB2 SER B 29 18.819 4.865 -17.603 1.00 0.00 H new ATOM 0 HB3 SER B 29 18.372 3.800 -18.922 1.00 0.00 H new ATOM 0 HG SER B 29 18.596 6.007 -19.612 1.00 0.00 H new ATOM 1561 N LYS B 30 17.337 3.518 -15.303 1.00 0.00 N ATOM 1562 CA LYS B 30 17.581 2.559 -14.232 1.00 0.00 C ATOM 1563 C LYS B 30 16.255 2.092 -13.656 1.00 0.00 C ATOM 1564 O LYS B 30 16.012 0.896 -13.495 1.00 0.00 O ATOM 1565 CB LYS B 30 18.408 3.179 -13.104 1.00 0.00 C ATOM 1566 CG LYS B 30 19.750 3.744 -13.528 1.00 0.00 C ATOM 1567 CD LYS B 30 20.520 4.237 -12.315 1.00 0.00 C ATOM 1568 CE LYS B 30 21.815 4.931 -12.695 1.00 0.00 C ATOM 1569 NZ LYS B 30 22.729 4.046 -13.465 1.00 0.00 N ATOM 0 H LYS B 30 17.388 4.495 -15.014 1.00 0.00 H new ATOM 0 HA LYS B 30 18.135 1.721 -14.656 1.00 0.00 H new ATOM 0 HB2 LYS B 30 17.825 3.976 -12.642 1.00 0.00 H new ATOM 0 HB3 LYS B 30 18.575 2.422 -12.338 1.00 0.00 H new ATOM 0 HG2 LYS B 30 20.327 2.979 -14.047 1.00 0.00 H new ATOM 0 HG3 LYS B 30 19.602 4.564 -14.231 1.00 0.00 H new ATOM 0 HD2 LYS B 30 19.895 4.926 -11.747 1.00 0.00 H new ATOM 0 HD3 LYS B 30 20.741 3.394 -11.661 1.00 0.00 H new ATOM 0 HE2 LYS B 30 21.588 5.818 -13.287 1.00 0.00 H new ATOM 0 HE3 LYS B 30 22.320 5.272 -11.791 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 23.702 4.408 -13.397 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 22.690 3.083 -13.075 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 22.436 4.028 -14.463 1.00 0.00 H new ATOM 1583 N TYR B 31 15.409 3.059 -13.332 1.00 0.00 N ATOM 1584 CA TYR B 31 14.091 2.786 -12.788 1.00 0.00 C ATOM 1585 C TYR B 31 13.064 3.683 -13.458 1.00 0.00 C ATOM 1586 O TYR B 31 13.280 4.887 -13.596 1.00 0.00 O ATOM 1587 CB TYR B 31 14.064 3.017 -11.272 1.00 0.00 C ATOM 1588 CG TYR B 31 14.973 2.093 -10.491 1.00 0.00 C ATOM 1589 CD1 TYR B 31 14.577 0.797 -10.181 1.00 0.00 C ATOM 1590 CD2 TYR B 31 16.225 2.515 -10.064 1.00 0.00 C ATOM 1591 CE1 TYR B 31 15.403 -0.049 -9.468 1.00 0.00 C ATOM 1592 CE2 TYR B 31 17.058 1.675 -9.352 1.00 0.00 C ATOM 1593 CZ TYR B 31 16.642 0.395 -9.055 1.00 0.00 C ATOM 1594 OH TYR B 31 17.469 -0.443 -8.344 1.00 0.00 O ATOM 0 H TYR B 31 15.618 4.052 -13.439 1.00 0.00 H new ATOM 0 HA TYR B 31 13.850 1.741 -12.982 1.00 0.00 H new ATOM 0 HB2 TYR B 31 14.349 4.049 -11.067 1.00 0.00 H new ATOM 0 HB3 TYR B 31 13.042 2.892 -10.914 1.00 0.00 H new ATOM 0 HD1 TYR B 31 13.608 0.446 -10.503 1.00 0.00 H new ATOM 0 HD2 TYR B 31 16.553 3.518 -10.293 1.00 0.00 H new ATOM 0 HE1 TYR B 31 15.081 -1.053 -9.235 1.00 0.00 H new ATOM 0 HE2 TYR B 31 18.030 2.019 -9.030 1.00 0.00 H new ATOM 0 HH TYR B 31 18.304 0.024 -8.132 1.00 0.00 H new ATOM 1604 N THR B 32 11.957 3.100 -13.880 1.00 0.00 N ATOM 1605 CA THR B 32 10.909 3.858 -14.536 1.00 0.00 C ATOM 1606 C THR B 32 10.129 4.668 -13.508 1.00 0.00 C ATOM 1607 O THR B 32 9.437 4.107 -12.663 1.00 0.00 O ATOM 1608 CB THR B 32 9.953 2.925 -15.302 1.00 0.00 C ATOM 1609 OG1 THR B 32 10.715 2.063 -16.157 1.00 0.00 O ATOM 1610 CG2 THR B 32 8.959 3.721 -16.135 1.00 0.00 C ATOM 0 H THR B 32 11.761 2.104 -13.780 1.00 0.00 H new ATOM 0 HA THR B 32 11.375 4.536 -15.251 1.00 0.00 H new ATOM 0 HB THR B 32 9.393 2.334 -14.577 1.00 0.00 H new ATOM 0 HG1 THR B 32 10.109 1.467 -16.645 1.00 0.00 H new ATOM 0 HG21 THR B 32 8.297 3.036 -16.665 1.00 0.00 H new ATOM 0 HG22 THR B 32 8.369 4.363 -15.481 1.00 0.00 H new ATOM 0 HG23 THR B 32 9.498 4.335 -16.856 1.00 0.00 H new ATOM 1618 N VAL B 33 10.255 5.984 -13.574 1.00 0.00 N ATOM 1619 CA VAL B 33 9.615 6.854 -12.602 1.00 0.00 C ATOM 1620 C VAL B 33 8.145 7.053 -12.951 1.00 0.00 C ATOM 1621 O VAL B 33 7.812 7.701 -13.944 1.00 0.00 O ATOM 1622 CB VAL B 33 10.317 8.227 -12.521 1.00 0.00 C ATOM 1623 CG1 VAL B 33 9.707 9.082 -11.419 1.00 0.00 C ATOM 1624 CG2 VAL B 33 11.813 8.053 -12.300 1.00 0.00 C ATOM 0 H VAL B 33 10.794 6.472 -14.290 1.00 0.00 H new ATOM 0 HA VAL B 33 9.695 6.369 -11.629 1.00 0.00 H new ATOM 0 HB VAL B 33 10.169 8.741 -13.471 1.00 0.00 H new ATOM 0 HG11 VAL B 33 10.217 10.044 -11.381 1.00 0.00 H new ATOM 0 HG12 VAL B 33 8.649 9.241 -11.625 1.00 0.00 H new ATOM 0 HG13 VAL B 33 9.818 8.574 -10.461 1.00 0.00 H new ATOM 0 HG21 VAL B 33 12.289 9.032 -12.246 1.00 0.00 H new ATOM 0 HG22 VAL B 33 11.983 7.515 -11.367 1.00 0.00 H new ATOM 0 HG23 VAL B 33 12.240 7.487 -13.128 1.00 0.00 H new ATOM 1634 N GLU B 34 7.278 6.475 -12.136 1.00 0.00 N ATOM 1635 CA GLU B 34 5.843 6.551 -12.347 1.00 0.00 C ATOM 1636 C GLU B 34 5.247 7.648 -11.472 1.00 0.00 C ATOM 1637 O GLU B 34 5.111 7.486 -10.259 1.00 0.00 O ATOM 1638 CB GLU B 34 5.202 5.191 -12.041 1.00 0.00 C ATOM 1639 CG GLU B 34 3.710 5.119 -12.334 1.00 0.00 C ATOM 1640 CD GLU B 34 3.163 3.709 -12.209 1.00 0.00 C ATOM 1641 OE1 GLU B 34 2.754 3.313 -11.097 1.00 0.00 O ATOM 1642 OE2 GLU B 34 3.142 2.984 -13.224 1.00 0.00 O ATOM 0 H GLU B 34 7.549 5.941 -11.311 1.00 0.00 H new ATOM 0 HA GLU B 34 5.640 6.800 -13.389 1.00 0.00 H new ATOM 0 HB2 GLU B 34 5.712 4.423 -12.623 1.00 0.00 H new ATOM 0 HB3 GLU B 34 5.365 4.954 -10.990 1.00 0.00 H new ATOM 0 HG2 GLU B 34 3.176 5.775 -11.647 1.00 0.00 H new ATOM 0 HG3 GLU B 34 3.522 5.491 -13.341 1.00 0.00 H new ATOM 1649 N ILE B 35 4.924 8.776 -12.089 1.00 0.00 N ATOM 1650 CA ILE B 35 4.375 9.917 -11.369 1.00 0.00 C ATOM 1651 C ILE B 35 2.877 9.733 -11.147 1.00 0.00 C ATOM 1652 O ILE B 35 2.125 9.519 -12.099 1.00 0.00 O ATOM 1653 CB ILE B 35 4.621 11.235 -12.143 1.00 0.00 C ATOM 1654 CG1 ILE B 35 6.118 11.443 -12.401 1.00 0.00 C ATOM 1655 CG2 ILE B 35 4.042 12.423 -11.384 1.00 0.00 C ATOM 1656 CD1 ILE B 35 6.947 11.592 -11.141 1.00 0.00 C ATOM 0 H ILE B 35 5.033 8.926 -13.092 1.00 0.00 H new ATOM 0 HA ILE B 35 4.881 9.977 -10.406 1.00 0.00 H new ATOM 0 HB ILE B 35 4.114 11.161 -13.105 1.00 0.00 H new ATOM 0 HG12 ILE B 35 6.498 10.598 -12.975 1.00 0.00 H new ATOM 0 HG13 ILE B 35 6.250 12.332 -13.017 1.00 0.00 H new ATOM 0 HG21 ILE B 35 4.226 13.339 -11.946 1.00 0.00 H new ATOM 0 HG22 ILE B 35 2.968 12.285 -11.257 1.00 0.00 H new ATOM 0 HG23 ILE B 35 4.517 12.496 -10.406 1.00 0.00 H new ATOM 0 HD11 ILE B 35 7.994 11.735 -11.409 1.00 0.00 H new ATOM 0 HD12 ILE B 35 6.596 12.455 -10.574 1.00 0.00 H new ATOM 0 HD13 ILE B 35 6.848 10.693 -10.532 1.00 0.00 H new ATOM 1668 N VAL B 36 2.446 9.792 -9.893 1.00 0.00 N ATOM 1669 CA VAL B 36 1.035 9.635 -9.567 1.00 0.00 C ATOM 1670 C VAL B 36 0.530 10.818 -8.744 1.00 0.00 C ATOM 1671 O VAL B 36 1.031 11.090 -7.651 1.00 0.00 O ATOM 1672 CB VAL B 36 0.767 8.325 -8.794 1.00 0.00 C ATOM 1673 CG1 VAL B 36 -0.719 8.163 -8.513 1.00 0.00 C ATOM 1674 CG2 VAL B 36 1.296 7.125 -9.564 1.00 0.00 C ATOM 0 H VAL B 36 3.052 9.947 -9.087 1.00 0.00 H new ATOM 0 HA VAL B 36 0.496 9.595 -10.514 1.00 0.00 H new ATOM 0 HB VAL B 36 1.295 8.380 -7.842 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -0.887 7.234 -7.968 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -1.070 9.004 -7.915 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -1.266 8.135 -9.455 1.00 0.00 H new ATOM 0 HG21 VAL B 36 1.096 6.214 -9.000 1.00 0.00 H new ATOM 0 HG22 VAL B 36 0.801 7.068 -10.534 1.00 0.00 H new ATOM 0 HG23 VAL B 36 2.371 7.232 -9.711 1.00 0.00 H new ATOM 1684 N HIS B 37 -0.462 11.513 -9.281 1.00 0.00 N ATOM 1685 CA HIS B 37 -1.040 12.672 -8.616 1.00 0.00 C ATOM 1686 C HIS B 37 -2.243 12.246 -7.775 1.00 0.00 C ATOM 1687 O HIS B 37 -3.346 12.061 -8.297 1.00 0.00 O ATOM 1688 CB HIS B 37 -1.467 13.711 -9.659 1.00 0.00 C ATOM 1689 CG HIS B 37 -1.640 15.099 -9.118 1.00 0.00 C ATOM 1690 ND1 HIS B 37 -2.708 15.442 -8.322 1.00 0.00 N ATOM 1691 CD2 HIS B 37 -0.858 16.190 -9.298 1.00 0.00 C ATOM 1692 CE1 HIS B 37 -2.551 16.727 -8.044 1.00 0.00 C ATOM 1693 NE2 HIS B 37 -1.445 17.220 -8.613 1.00 0.00 N ATOM 0 H HIS B 37 -0.886 11.292 -10.182 1.00 0.00 H new ATOM 0 HA HIS B 37 -0.292 13.116 -7.959 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -0.723 13.735 -10.455 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -2.406 13.390 -10.110 1.00 0.00 H new ATOM 0 HD2 HIS B 37 0.055 16.238 -9.873 1.00 0.00 H new ATOM 0 HE1 HIS B 37 -3.230 17.305 -7.435 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -1.104 18.179 -8.549 1.00 0.00 H new ATOM 1701 N LEU B 38 -2.031 12.087 -6.474 1.00 0.00 N ATOM 1702 CA LEU B 38 -3.089 11.628 -5.578 1.00 0.00 C ATOM 1703 C LEU B 38 -4.015 12.774 -5.189 1.00 0.00 C ATOM 1704 O LEU B 38 -4.985 12.584 -4.460 1.00 0.00 O ATOM 1705 CB LEU B 38 -2.505 10.973 -4.324 1.00 0.00 C ATOM 1706 CG LEU B 38 -1.755 9.661 -4.563 1.00 0.00 C ATOM 1707 CD1 LEU B 38 -1.338 9.039 -3.241 1.00 0.00 C ATOM 1708 CD2 LEU B 38 -2.613 8.688 -5.360 1.00 0.00 C ATOM 0 H LEU B 38 -1.138 12.268 -6.015 1.00 0.00 H new ATOM 0 HA LEU B 38 -3.672 10.881 -6.117 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -1.826 11.680 -3.847 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -3.316 10.786 -3.620 1.00 0.00 H new ATOM 0 HG LEU B 38 -0.858 9.881 -5.142 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -0.806 8.107 -3.429 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -0.685 9.728 -2.705 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -2.224 8.836 -2.639 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -2.061 7.762 -5.519 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -3.529 8.475 -4.809 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -2.865 9.130 -6.324 1.00 0.00 H new ATOM 1720 N GLY B 39 -3.712 13.965 -5.683 1.00 0.00 N ATOM 1721 CA GLY B 39 -4.591 15.093 -5.470 1.00 0.00 C ATOM 1722 C GLY B 39 -5.692 15.128 -6.508 1.00 0.00 C ATOM 1723 O GLY B 39 -6.576 15.985 -6.471 1.00 0.00 O ATOM 0 H GLY B 39 -2.874 14.169 -6.227 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -5.028 15.034 -4.473 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -4.017 16.019 -5.512 1.00 0.00 H new ATOM 1727 N THR B 40 -5.629 14.189 -7.442 1.00 0.00 N ATOM 1728 CA THR B 40 -6.611 14.106 -8.507 1.00 0.00 C ATOM 1729 C THR B 40 -7.354 12.771 -8.466 1.00 0.00 C ATOM 1730 O THR B 40 -8.583 12.737 -8.388 1.00 0.00 O ATOM 1731 CB THR B 40 -5.945 14.278 -9.885 1.00 0.00 C ATOM 1732 OG1 THR B 40 -5.085 15.426 -9.874 1.00 0.00 O ATOM 1733 CG2 THR B 40 -6.993 14.444 -10.975 1.00 0.00 C ATOM 0 H THR B 40 -4.904 13.473 -7.481 1.00 0.00 H new ATOM 0 HA THR B 40 -7.326 14.914 -8.353 1.00 0.00 H new ATOM 0 HB THR B 40 -5.359 13.383 -10.094 1.00 0.00 H new ATOM 0 HG1 THR B 40 -4.228 15.189 -9.463 1.00 0.00 H new ATOM 0 HG21 THR B 40 -6.499 14.564 -11.939 1.00 0.00 H new ATOM 0 HG22 THR B 40 -7.633 13.562 -11.002 1.00 0.00 H new ATOM 0 HG23 THR B 40 -7.599 15.325 -10.766 1.00 0.00 H new ATOM 1741 N ASP B 41 -6.606 11.676 -8.498 1.00 0.00 N ATOM 1742 CA ASP B 41 -7.206 10.349 -8.566 1.00 0.00 C ATOM 1743 C ASP B 41 -7.322 9.724 -7.181 1.00 0.00 C ATOM 1744 O ASP B 41 -6.323 9.544 -6.487 1.00 0.00 O ATOM 1745 CB ASP B 41 -6.383 9.441 -9.477 1.00 0.00 C ATOM 1746 CG ASP B 41 -7.024 8.085 -9.664 1.00 0.00 C ATOM 1747 OD1 ASP B 41 -7.915 7.960 -10.531 1.00 0.00 O ATOM 1748 OD2 ASP B 41 -6.647 7.139 -8.949 1.00 0.00 O ATOM 0 H ASP B 41 -5.586 11.679 -8.478 1.00 0.00 H new ATOM 0 HA ASP B 41 -8.209 10.458 -8.978 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -6.260 9.920 -10.449 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -5.386 9.314 -9.056 1.00 0.00 H new ATOM 1753 N LYS B 42 -8.549 9.392 -6.786 1.00 0.00 N ATOM 1754 CA LYS B 42 -8.796 8.796 -5.477 1.00 0.00 C ATOM 1755 C LYS B 42 -8.713 7.273 -5.531 1.00 0.00 C ATOM 1756 O LYS B 42 -8.552 6.619 -4.496 1.00 0.00 O ATOM 1757 CB LYS B 42 -10.168 9.206 -4.937 1.00 0.00 C ATOM 1758 CG LYS B 42 -10.225 10.633 -4.422 1.00 0.00 C ATOM 1759 CD LYS B 42 -11.531 10.890 -3.690 1.00 0.00 C ATOM 1760 CE LYS B 42 -11.537 12.244 -3.003 1.00 0.00 C ATOM 1761 NZ LYS B 42 -12.760 12.428 -2.181 1.00 0.00 N ATOM 0 H LYS B 42 -9.386 9.526 -7.353 1.00 0.00 H new ATOM 0 HA LYS B 42 -8.019 9.167 -4.808 1.00 0.00 H new ATOM 0 HB2 LYS B 42 -10.909 9.085 -5.727 1.00 0.00 H new ATOM 0 HB3 LYS B 42 -10.448 8.528 -4.131 1.00 0.00 H new ATOM 0 HG2 LYS B 42 -9.385 10.816 -3.752 1.00 0.00 H new ATOM 0 HG3 LYS B 42 -10.126 11.329 -5.255 1.00 0.00 H new ATOM 0 HD2 LYS B 42 -12.360 10.837 -4.396 1.00 0.00 H new ATOM 0 HD3 LYS B 42 -11.693 10.106 -2.950 1.00 0.00 H new ATOM 0 HE2 LYS B 42 -10.654 12.337 -2.371 1.00 0.00 H new ATOM 0 HE3 LYS B 42 -11.477 13.034 -3.752 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 -12.734 13.362 -1.725 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 -13.601 12.363 -2.790 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 -12.803 11.688 -1.452 1.00 0.00 H new ATOM 1775 N ALA B 43 -8.827 6.717 -6.728 1.00 0.00 N ATOM 1776 CA ALA B 43 -8.784 5.270 -6.906 1.00 0.00 C ATOM 1777 C ALA B 43 -7.435 4.713 -6.472 1.00 0.00 C ATOM 1778 O ALA B 43 -7.366 3.750 -5.706 1.00 0.00 O ATOM 1779 CB ALA B 43 -9.075 4.903 -8.354 1.00 0.00 C ATOM 0 H ALA B 43 -8.950 7.245 -7.592 1.00 0.00 H new ATOM 0 HA ALA B 43 -9.554 4.824 -6.276 1.00 0.00 H new ATOM 0 HB1 ALA B 43 -9.039 3.820 -8.469 1.00 0.00 H new ATOM 0 HB2 ALA B 43 -10.066 5.264 -8.629 1.00 0.00 H new ATOM 0 HB3 ALA B 43 -8.329 5.362 -9.003 1.00 0.00 H new ATOM 1785 N ARG B 44 -6.368 5.343 -6.949 1.00 0.00 N ATOM 1786 CA ARG B 44 -5.012 4.925 -6.615 1.00 0.00 C ATOM 1787 C ARG B 44 -4.713 5.184 -5.136 1.00 0.00 C ATOM 1788 O ARG B 44 -3.886 4.497 -4.539 1.00 0.00 O ATOM 1789 CB ARG B 44 -4.002 5.664 -7.498 1.00 0.00 C ATOM 1790 CG ARG B 44 -2.556 5.219 -7.308 1.00 0.00 C ATOM 1791 CD ARG B 44 -2.118 4.197 -8.353 1.00 0.00 C ATOM 1792 NE ARG B 44 -2.727 2.879 -8.167 1.00 0.00 N ATOM 1793 CZ ARG B 44 -2.040 1.733 -8.221 1.00 0.00 C ATOM 1794 NH1 ARG B 44 -0.724 1.748 -8.404 1.00 0.00 N ATOM 1795 NH2 ARG B 44 -2.673 0.575 -8.097 1.00 0.00 N ATOM 0 H ARG B 44 -6.417 6.149 -7.572 1.00 0.00 H new ATOM 0 HA ARG B 44 -4.926 3.854 -6.798 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -4.279 5.522 -8.543 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -4.071 6.732 -7.292 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -1.902 6.089 -7.359 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -2.439 4.790 -6.313 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -2.373 4.570 -9.345 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -1.033 4.096 -8.320 1.00 0.00 H new ATOM 0 HE ARG B 44 -3.730 2.832 -7.986 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -0.233 2.636 -8.504 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -0.205 0.871 -8.444 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -3.684 0.558 -7.960 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -2.149 -0.299 -8.138 1.00 0.00 H new ATOM 1809 N ILE B 45 -5.392 6.173 -4.550 1.00 0.00 N ATOM 1810 CA ILE B 45 -5.207 6.500 -3.133 1.00 0.00 C ATOM 1811 C ILE B 45 -5.511 5.291 -2.254 1.00 0.00 C ATOM 1812 O ILE B 45 -4.674 4.866 -1.456 1.00 0.00 O ATOM 1813 CB ILE B 45 -6.104 7.678 -2.683 1.00 0.00 C ATOM 1814 CG1 ILE B 45 -5.711 8.966 -3.409 1.00 0.00 C ATOM 1815 CG2 ILE B 45 -6.020 7.876 -1.173 1.00 0.00 C ATOM 1816 CD1 ILE B 45 -6.543 10.166 -3.008 1.00 0.00 C ATOM 0 H ILE B 45 -6.073 6.760 -5.032 1.00 0.00 H new ATOM 0 HA ILE B 45 -4.164 6.793 -3.018 1.00 0.00 H new ATOM 0 HB ILE B 45 -7.134 7.435 -2.943 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -4.661 9.180 -3.210 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.806 8.811 -4.484 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -6.658 8.709 -0.879 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -6.352 6.969 -0.668 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -4.989 8.092 -0.891 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -6.208 11.043 -3.563 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -7.592 9.973 -3.233 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -6.429 10.347 -1.939 1.00 0.00 H new ATOM 1828 N ALA B 46 -6.702 4.728 -2.425 1.00 0.00 N ATOM 1829 CA ALA B 46 -7.134 3.590 -1.622 1.00 0.00 C ATOM 1830 C ALA B 46 -6.206 2.398 -1.822 1.00 0.00 C ATOM 1831 O ALA B 46 -5.929 1.643 -0.887 1.00 0.00 O ATOM 1832 CB ALA B 46 -8.565 3.218 -1.968 1.00 0.00 C ATOM 0 H ALA B 46 -7.386 5.042 -3.113 1.00 0.00 H new ATOM 0 HA ALA B 46 -7.091 3.875 -0.571 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -8.876 2.367 -1.362 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -9.220 4.066 -1.767 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -8.627 2.954 -3.024 1.00 0.00 H new ATOM 1838 N GLU B 47 -5.716 2.246 -3.045 1.00 0.00 N ATOM 1839 CA GLU B 47 -4.784 1.176 -3.368 1.00 0.00 C ATOM 1840 C GLU B 47 -3.459 1.394 -2.649 1.00 0.00 C ATOM 1841 O GLU B 47 -2.865 0.454 -2.121 1.00 0.00 O ATOM 1842 CB GLU B 47 -4.549 1.116 -4.874 1.00 0.00 C ATOM 1843 CG GLU B 47 -5.823 0.956 -5.686 1.00 0.00 C ATOM 1844 CD GLU B 47 -5.539 0.854 -7.165 1.00 0.00 C ATOM 1845 OE1 GLU B 47 -5.357 1.901 -7.817 1.00 0.00 O ATOM 1846 OE2 GLU B 47 -5.450 -0.281 -7.677 1.00 0.00 O ATOM 0 H GLU B 47 -5.950 2.852 -3.831 1.00 0.00 H new ATOM 0 HA GLU B 47 -5.216 0.231 -3.038 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -4.040 2.027 -5.190 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -3.881 0.284 -5.095 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -6.354 0.063 -5.356 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -6.481 1.805 -5.500 1.00 0.00 H new ATOM 1853 N ALA B 48 -3.013 2.646 -2.621 1.00 0.00 N ATOM 1854 CA ALA B 48 -1.766 3.007 -1.962 1.00 0.00 C ATOM 1855 C ALA B 48 -1.859 2.767 -0.459 1.00 0.00 C ATOM 1856 O ALA B 48 -0.893 2.315 0.163 1.00 0.00 O ATOM 1857 CB ALA B 48 -1.413 4.459 -2.253 1.00 0.00 C ATOM 0 H ALA B 48 -3.502 3.431 -3.051 1.00 0.00 H new ATOM 0 HA ALA B 48 -0.973 2.373 -2.357 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -0.478 4.713 -1.753 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -1.299 4.597 -3.328 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -2.209 5.107 -1.886 1.00 0.00 H new ATOM 1863 N GLU B 49 -3.027 3.058 0.112 1.00 0.00 N ATOM 1864 CA GLU B 49 -3.276 2.810 1.530 1.00 0.00 C ATOM 1865 C GLU B 49 -3.026 1.342 1.867 1.00 0.00 C ATOM 1866 O GLU B 49 -2.415 1.021 2.886 1.00 0.00 O ATOM 1867 CB GLU B 49 -4.716 3.180 1.906 1.00 0.00 C ATOM 1868 CG GLU B 49 -5.048 4.655 1.736 1.00 0.00 C ATOM 1869 CD GLU B 49 -6.460 4.988 2.179 1.00 0.00 C ATOM 1870 OE1 GLU B 49 -6.672 5.223 3.390 1.00 0.00 O ATOM 1871 OE2 GLU B 49 -7.375 5.013 1.328 1.00 0.00 O ATOM 0 H GLU B 49 -3.817 3.467 -0.387 1.00 0.00 H new ATOM 0 HA GLU B 49 -2.590 3.434 2.102 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -5.401 2.593 1.295 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -4.892 2.897 2.944 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -4.340 5.252 2.311 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -4.924 4.934 0.690 1.00 0.00 H new ATOM 1878 N LYS B 50 -3.488 0.456 0.992 1.00 0.00 N ATOM 1879 CA LYS B 50 -3.349 -0.979 1.212 1.00 0.00 C ATOM 1880 C LYS B 50 -1.963 -1.469 0.804 1.00 0.00 C ATOM 1881 O LYS B 50 -1.533 -2.549 1.210 1.00 0.00 O ATOM 1882 CB LYS B 50 -4.417 -1.749 0.433 1.00 0.00 C ATOM 1883 CG LYS B 50 -5.844 -1.346 0.771 1.00 0.00 C ATOM 1884 CD LYS B 50 -6.111 -1.404 2.266 1.00 0.00 C ATOM 1885 CE LYS B 50 -7.582 -1.190 2.580 1.00 0.00 C ATOM 1886 NZ LYS B 50 -8.120 0.046 1.951 1.00 0.00 N ATOM 0 H LYS B 50 -3.962 0.706 0.124 1.00 0.00 H new ATOM 0 HA LYS B 50 -3.481 -1.162 2.278 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -4.252 -1.599 -0.634 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -4.296 -2.815 0.628 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -6.031 -0.336 0.408 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -6.540 -2.005 0.252 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -5.792 -2.371 2.656 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -5.516 -0.644 2.772 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -8.154 -2.050 2.233 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -7.716 -1.133 3.660 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -9.063 0.251 2.339 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -7.483 0.843 2.151 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -8.191 -0.090 0.922 1.00 0.00 H new ATOM 1900 N ALA B 51 -1.271 -0.679 -0.006 1.00 0.00 N ATOM 1901 CA ALA B 51 0.066 -1.035 -0.459 1.00 0.00 C ATOM 1902 C ALA B 51 1.096 -0.773 0.632 1.00 0.00 C ATOM 1903 O ALA B 51 2.108 -1.470 0.727 1.00 0.00 O ATOM 1904 CB ALA B 51 0.422 -0.266 -1.723 1.00 0.00 C ATOM 0 H ALA B 51 -1.614 0.213 -0.363 1.00 0.00 H new ATOM 0 HA ALA B 51 0.075 -2.101 -0.687 1.00 0.00 H new ATOM 0 HB1 ALA B 51 1.425 -0.544 -2.048 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -0.294 -0.506 -2.509 1.00 0.00 H new ATOM 0 HB3 ALA B 51 0.391 0.804 -1.519 1.00 0.00 H new ATOM 1910 N GLY B 52 0.833 0.229 1.458 1.00 0.00 N ATOM 1911 CA GLY B 52 1.746 0.559 2.535 1.00 0.00 C ATOM 1912 C GLY B 52 2.196 2.004 2.490 1.00 0.00 C ATOM 1913 O GLY B 52 3.050 2.420 3.271 1.00 0.00 O ATOM 0 H GLY B 52 0.004 0.820 1.402 1.00 0.00 H new ATOM 0 HA2 GLY B 52 1.261 0.362 3.491 1.00 0.00 H new ATOM 0 HA3 GLY B 52 2.619 -0.092 2.480 1.00 0.00 H new ATOM 1917 N VAL B 53 1.620 2.772 1.576 1.00 0.00 N ATOM 1918 CA VAL B 53 1.939 4.185 1.460 1.00 0.00 C ATOM 1919 C VAL B 53 1.208 4.968 2.544 1.00 0.00 C ATOM 1920 O VAL B 53 -0.016 5.069 2.530 1.00 0.00 O ATOM 1921 CB VAL B 53 1.558 4.739 0.069 1.00 0.00 C ATOM 1922 CG1 VAL B 53 1.956 6.202 -0.060 1.00 0.00 C ATOM 1923 CG2 VAL B 53 2.205 3.908 -1.028 1.00 0.00 C ATOM 0 H VAL B 53 0.929 2.438 0.904 1.00 0.00 H new ATOM 0 HA VAL B 53 3.016 4.299 1.584 1.00 0.00 H new ATOM 0 HB VAL B 53 0.475 4.674 -0.040 1.00 0.00 H new ATOM 0 HG11 VAL B 53 1.677 6.569 -1.048 1.00 0.00 H new ATOM 0 HG12 VAL B 53 1.443 6.787 0.703 1.00 0.00 H new ATOM 0 HG13 VAL B 53 3.034 6.299 0.072 1.00 0.00 H new ATOM 0 HG21 VAL B 53 1.927 4.311 -2.002 1.00 0.00 H new ATOM 0 HG22 VAL B 53 3.289 3.941 -0.918 1.00 0.00 H new ATOM 0 HG23 VAL B 53 1.864 2.876 -0.952 1.00 0.00 H new ATOM 1933 N LYS B 54 1.966 5.500 3.492 1.00 0.00 N ATOM 1934 CA LYS B 54 1.384 6.174 4.644 1.00 0.00 C ATOM 1935 C LYS B 54 1.187 7.662 4.377 1.00 0.00 C ATOM 1936 O LYS B 54 0.334 8.306 4.993 1.00 0.00 O ATOM 1937 CB LYS B 54 2.274 5.977 5.875 1.00 0.00 C ATOM 1938 CG LYS B 54 2.409 4.524 6.305 1.00 0.00 C ATOM 1939 CD LYS B 54 3.421 4.367 7.430 1.00 0.00 C ATOM 1940 CE LYS B 54 3.564 2.913 7.856 1.00 0.00 C ATOM 1941 NZ LYS B 54 2.370 2.419 8.595 1.00 0.00 N ATOM 0 H LYS B 54 2.986 5.478 3.486 1.00 0.00 H new ATOM 0 HA LYS B 54 0.405 5.732 4.831 1.00 0.00 H new ATOM 0 HB2 LYS B 54 3.265 6.378 5.664 1.00 0.00 H new ATOM 0 HB3 LYS B 54 1.866 6.556 6.704 1.00 0.00 H new ATOM 0 HG2 LYS B 54 1.439 4.149 6.632 1.00 0.00 H new ATOM 0 HG3 LYS B 54 2.715 3.918 5.452 1.00 0.00 H new ATOM 0 HD2 LYS B 54 4.389 4.748 7.105 1.00 0.00 H new ATOM 0 HD3 LYS B 54 3.112 4.968 8.285 1.00 0.00 H new ATOM 0 HE2 LYS B 54 3.725 2.293 6.974 1.00 0.00 H new ATOM 0 HE3 LYS B 54 4.447 2.807 8.486 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 2.529 1.435 8.893 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 2.210 3.013 9.433 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 1.536 2.462 7.975 1.00 0.00 H new ATOM 1955 N SER B 55 1.979 8.220 3.475 1.00 0.00 N ATOM 1956 CA SER B 55 1.886 9.640 3.173 1.00 0.00 C ATOM 1957 C SER B 55 2.262 9.933 1.724 1.00 0.00 C ATOM 1958 O SER B 55 2.964 9.152 1.082 1.00 0.00 O ATOM 1959 CB SER B 55 2.802 10.428 4.116 1.00 0.00 C ATOM 1960 OG SER B 55 2.454 10.200 5.473 1.00 0.00 O ATOM 0 H SER B 55 2.688 7.716 2.943 1.00 0.00 H new ATOM 0 HA SER B 55 0.850 9.948 3.318 1.00 0.00 H new ATOM 0 HB2 SER B 55 3.839 10.136 3.949 1.00 0.00 H new ATOM 0 HB3 SER B 55 2.730 11.492 3.893 1.00 0.00 H new ATOM 0 HG SER B 55 3.054 10.712 6.055 1.00 0.00 H new ATOM 1966 N VAL B 56 1.767 11.057 1.212 1.00 0.00 N ATOM 1967 CA VAL B 56 2.225 11.581 -0.063 1.00 0.00 C ATOM 1968 C VAL B 56 3.567 12.297 0.152 1.00 0.00 C ATOM 1969 O VAL B 56 4.054 12.314 1.288 1.00 0.00 O ATOM 1970 CB VAL B 56 1.172 12.491 -0.740 1.00 0.00 C ATOM 1971 CG1 VAL B 56 0.027 11.656 -1.282 1.00 0.00 C ATOM 1972 CG2 VAL B 56 0.646 13.538 0.220 1.00 0.00 C ATOM 0 H VAL B 56 1.047 11.620 1.665 1.00 0.00 H new ATOM 0 HA VAL B 56 2.371 10.753 -0.756 1.00 0.00 H new ATOM 0 HB VAL B 56 1.660 13.008 -1.566 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -0.707 12.308 -1.756 1.00 0.00 H new ATOM 0 HG12 VAL B 56 0.410 10.947 -2.016 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -0.446 11.112 -0.464 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -0.091 14.160 -0.288 1.00 0.00 H new ATOM 0 HG22 VAL B 56 0.180 13.047 1.074 1.00 0.00 H new ATOM 0 HG23 VAL B 56 1.470 14.162 0.565 1.00 0.00 H new ATOM 1982 N PRO B 57 4.071 13.081 -0.832 1.00 0.00 N ATOM 1983 CA PRO B 57 5.455 13.059 -1.241 1.00 0.00 C ATOM 1984 C PRO B 57 6.258 11.877 -0.700 1.00 0.00 C ATOM 1985 O PRO B 57 6.932 11.952 0.326 1.00 0.00 O ATOM 1986 CB PRO B 57 5.882 14.430 -0.753 1.00 0.00 C ATOM 1987 CG PRO B 57 4.671 15.281 -1.082 1.00 0.00 C ATOM 1988 CD PRO B 57 3.514 14.314 -1.352 1.00 0.00 C ATOM 0 HA PRO B 57 5.623 12.897 -2.306 1.00 0.00 H new ATOM 0 HB2 PRO B 57 6.102 14.431 0.315 1.00 0.00 H new ATOM 0 HB3 PRO B 57 6.778 14.783 -1.264 1.00 0.00 H new ATOM 0 HG2 PRO B 57 4.432 15.950 -0.255 1.00 0.00 H new ATOM 0 HG3 PRO B 57 4.863 15.907 -1.953 1.00 0.00 H new ATOM 0 HD2 PRO B 57 2.600 14.606 -0.834 1.00 0.00 H new ATOM 0 HD3 PRO B 57 3.271 14.244 -2.412 1.00 0.00 H new ATOM 1996 N ALA B 58 6.145 10.773 -1.434 1.00 0.00 N ATOM 1997 CA ALA B 58 6.839 9.535 -1.127 1.00 0.00 C ATOM 1998 C ALA B 58 7.237 8.830 -2.418 1.00 0.00 C ATOM 1999 O ALA B 58 6.537 8.935 -3.427 1.00 0.00 O ATOM 2000 CB ALA B 58 5.957 8.627 -0.286 1.00 0.00 C ATOM 0 H ALA B 58 5.561 10.717 -2.268 1.00 0.00 H new ATOM 0 HA ALA B 58 7.738 9.769 -0.557 1.00 0.00 H new ATOM 0 HB1 ALA B 58 6.492 7.703 -0.065 1.00 0.00 H new ATOM 0 HB2 ALA B 58 5.701 9.130 0.646 1.00 0.00 H new ATOM 0 HB3 ALA B 58 5.045 8.395 -0.836 1.00 0.00 H new ATOM 2006 N LEU B 59 8.354 8.121 -2.389 1.00 0.00 N ATOM 2007 CA LEU B 59 8.839 7.423 -3.568 1.00 0.00 C ATOM 2008 C LEU B 59 8.913 5.924 -3.287 1.00 0.00 C ATOM 2009 O LEU B 59 9.714 5.470 -2.470 1.00 0.00 O ATOM 2010 CB LEU B 59 10.218 7.968 -3.966 1.00 0.00 C ATOM 2011 CG LEU B 59 10.544 7.941 -5.466 1.00 0.00 C ATOM 2012 CD1 LEU B 59 11.878 8.620 -5.728 1.00 0.00 C ATOM 2013 CD2 LEU B 59 10.567 6.518 -5.999 1.00 0.00 C ATOM 0 H LEU B 59 8.941 8.014 -1.562 1.00 0.00 H new ATOM 0 HA LEU B 59 8.149 7.588 -4.396 1.00 0.00 H new ATOM 0 HB2 LEU B 59 10.295 8.997 -3.616 1.00 0.00 H new ATOM 0 HB3 LEU B 59 10.980 7.394 -3.438 1.00 0.00 H new ATOM 0 HG LEU B 59 9.758 8.486 -5.990 1.00 0.00 H new ATOM 0 HD11 LEU B 59 12.096 8.593 -6.796 1.00 0.00 H new ATOM 0 HD12 LEU B 59 11.831 9.656 -5.393 1.00 0.00 H new ATOM 0 HD13 LEU B 59 12.665 8.098 -5.184 1.00 0.00 H new ATOM 0 HD21 LEU B 59 10.801 6.532 -7.064 1.00 0.00 H new ATOM 0 HD22 LEU B 59 11.326 5.943 -5.469 1.00 0.00 H new ATOM 0 HD23 LEU B 59 9.591 6.057 -5.848 1.00 0.00 H new ATOM 2025 N VAL B 60 8.062 5.164 -3.953 1.00 0.00 N ATOM 2026 CA VAL B 60 8.031 3.721 -3.784 1.00 0.00 C ATOM 2027 C VAL B 60 8.957 3.053 -4.792 1.00 0.00 C ATOM 2028 O VAL B 60 8.618 2.917 -5.970 1.00 0.00 O ATOM 2029 CB VAL B 60 6.601 3.160 -3.951 1.00 0.00 C ATOM 2030 CG1 VAL B 60 6.572 1.659 -3.695 1.00 0.00 C ATOM 2031 CG2 VAL B 60 5.632 3.881 -3.025 1.00 0.00 C ATOM 0 H VAL B 60 7.379 5.524 -4.620 1.00 0.00 H new ATOM 0 HA VAL B 60 8.369 3.502 -2.771 1.00 0.00 H new ATOM 0 HB VAL B 60 6.287 3.333 -4.980 1.00 0.00 H new ATOM 0 HG11 VAL B 60 5.554 1.288 -3.819 1.00 0.00 H new ATOM 0 HG12 VAL B 60 7.230 1.156 -4.404 1.00 0.00 H new ATOM 0 HG13 VAL B 60 6.911 1.457 -2.679 1.00 0.00 H new ATOM 0 HG21 VAL B 60 4.630 3.472 -3.157 1.00 0.00 H new ATOM 0 HG22 VAL B 60 5.947 3.743 -1.991 1.00 0.00 H new ATOM 0 HG23 VAL B 60 5.624 4.945 -3.263 1.00 0.00 H new ATOM 2041 N ILE B 61 10.125 2.644 -4.329 1.00 0.00 N ATOM 2042 CA ILE B 61 11.109 2.017 -5.194 1.00 0.00 C ATOM 2043 C ILE B 61 10.915 0.506 -5.202 1.00 0.00 C ATOM 2044 O ILE B 61 11.379 -0.191 -4.298 1.00 0.00 O ATOM 2045 CB ILE B 61 12.554 2.347 -4.757 1.00 0.00 C ATOM 2046 CG1 ILE B 61 12.754 3.864 -4.675 1.00 0.00 C ATOM 2047 CG2 ILE B 61 13.558 1.729 -5.725 1.00 0.00 C ATOM 2048 CD1 ILE B 61 14.128 4.275 -4.192 1.00 0.00 C ATOM 0 H ILE B 61 10.416 2.735 -3.356 1.00 0.00 H new ATOM 0 HA ILE B 61 10.959 2.415 -6.197 1.00 0.00 H new ATOM 0 HB ILE B 61 12.722 1.922 -3.768 1.00 0.00 H new ATOM 0 HG12 ILE B 61 12.581 4.297 -5.660 1.00 0.00 H new ATOM 0 HG13 ILE B 61 12.003 4.284 -4.006 1.00 0.00 H new ATOM 0 HG21 ILE B 61 14.571 1.971 -5.403 1.00 0.00 H new ATOM 0 HG22 ILE B 61 13.431 0.647 -5.739 1.00 0.00 H new ATOM 0 HG23 ILE B 61 13.391 2.127 -6.726 1.00 0.00 H new ATOM 0 HD11 ILE B 61 14.192 5.363 -4.161 1.00 0.00 H new ATOM 0 HD12 ILE B 61 14.298 3.873 -3.193 1.00 0.00 H new ATOM 0 HD13 ILE B 61 14.885 3.886 -4.873 1.00 0.00 H new ATOM 2060 N ASP B 62 10.182 0.033 -6.209 1.00 0.00 N ATOM 2061 CA ASP B 62 9.949 -1.398 -6.434 1.00 0.00 C ATOM 2062 C ASP B 62 9.573 -2.131 -5.145 1.00 0.00 C ATOM 2063 O ASP B 62 10.396 -2.816 -4.535 1.00 0.00 O ATOM 2064 CB ASP B 62 11.175 -2.047 -7.083 1.00 0.00 C ATOM 2065 CG ASP B 62 10.950 -3.506 -7.430 1.00 0.00 C ATOM 2066 OD1 ASP B 62 10.125 -3.788 -8.322 1.00 0.00 O ATOM 2067 OD2 ASP B 62 11.608 -4.378 -6.826 1.00 0.00 O ATOM 0 H ASP B 62 9.729 0.634 -6.898 1.00 0.00 H new ATOM 0 HA ASP B 62 9.101 -1.484 -7.114 1.00 0.00 H new ATOM 0 HB2 ASP B 62 11.435 -1.498 -7.988 1.00 0.00 H new ATOM 0 HB3 ASP B 62 12.025 -1.966 -6.406 1.00 0.00 H new ATOM 2072 N GLY B 63 8.336 -1.944 -4.707 1.00 0.00 N ATOM 2073 CA GLY B 63 7.846 -2.653 -3.540 1.00 0.00 C ATOM 2074 C GLY B 63 8.106 -1.918 -2.237 1.00 0.00 C ATOM 2075 O GLY B 63 7.259 -1.921 -1.343 1.00 0.00 O ATOM 0 H GLY B 63 7.661 -1.313 -5.139 1.00 0.00 H new ATOM 0 HA2 GLY B 63 6.774 -2.819 -3.648 1.00 0.00 H new ATOM 0 HA3 GLY B 63 8.317 -3.635 -3.496 1.00 0.00 H new ATOM 2079 N ALA B 64 9.268 -1.288 -2.121 1.00 0.00 N ATOM 2080 CA ALA B 64 9.643 -0.608 -0.887 1.00 0.00 C ATOM 2081 C ALA B 64 9.290 0.874 -0.947 1.00 0.00 C ATOM 2082 O ALA B 64 9.719 1.587 -1.853 1.00 0.00 O ATOM 2083 CB ALA B 64 11.127 -0.794 -0.616 1.00 0.00 C ATOM 0 H ALA B 64 9.965 -1.233 -2.863 1.00 0.00 H new ATOM 0 HA ALA B 64 9.078 -1.052 -0.067 1.00 0.00 H new ATOM 0 HB1 ALA B 64 11.395 -0.282 0.308 1.00 0.00 H new ATOM 0 HB2 ALA B 64 11.349 -1.857 -0.519 1.00 0.00 H new ATOM 0 HB3 ALA B 64 11.703 -0.377 -1.442 1.00 0.00 H new ATOM 2089 N ALA B 65 8.506 1.333 0.016 1.00 0.00 N ATOM 2090 CA ALA B 65 8.064 2.719 0.045 1.00 0.00 C ATOM 2091 C ALA B 65 9.021 3.590 0.854 1.00 0.00 C ATOM 2092 O ALA B 65 9.223 3.372 2.050 1.00 0.00 O ATOM 2093 CB ALA B 65 6.654 2.812 0.611 1.00 0.00 C ATOM 0 H ALA B 65 8.162 0.765 0.790 1.00 0.00 H new ATOM 0 HA ALA B 65 8.059 3.091 -0.979 1.00 0.00 H new ATOM 0 HB1 ALA B 65 6.336 3.855 0.627 1.00 0.00 H new ATOM 0 HB2 ALA B 65 5.972 2.234 -0.013 1.00 0.00 H new ATOM 0 HB3 ALA B 65 6.642 2.414 1.626 1.00 0.00 H new ATOM 2099 N PHE B 66 9.618 4.571 0.193 1.00 0.00 N ATOM 2100 CA PHE B 66 10.503 5.513 0.859 1.00 0.00 C ATOM 2101 C PHE B 66 9.925 6.919 0.783 1.00 0.00 C ATOM 2102 O PHE B 66 9.966 7.563 -0.264 1.00 0.00 O ATOM 2103 CB PHE B 66 11.899 5.484 0.230 1.00 0.00 C ATOM 2104 CG PHE B 66 12.589 4.154 0.348 1.00 0.00 C ATOM 2105 CD1 PHE B 66 13.191 3.775 1.537 1.00 0.00 C ATOM 2106 CD2 PHE B 66 12.634 3.285 -0.729 1.00 0.00 C ATOM 2107 CE1 PHE B 66 13.826 2.553 1.650 1.00 0.00 C ATOM 2108 CE2 PHE B 66 13.266 2.061 -0.622 1.00 0.00 C ATOM 2109 CZ PHE B 66 13.863 1.695 0.568 1.00 0.00 C ATOM 0 H PHE B 66 9.504 4.735 -0.807 1.00 0.00 H new ATOM 0 HA PHE B 66 10.591 5.220 1.905 1.00 0.00 H new ATOM 0 HB2 PHE B 66 11.818 5.749 -0.824 1.00 0.00 H new ATOM 0 HB3 PHE B 66 12.517 6.247 0.704 1.00 0.00 H new ATOM 0 HD1 PHE B 66 13.164 4.443 2.386 1.00 0.00 H new ATOM 0 HD2 PHE B 66 12.170 3.567 -1.663 1.00 0.00 H new ATOM 0 HE1 PHE B 66 14.292 2.269 2.582 1.00 0.00 H new ATOM 0 HE2 PHE B 66 13.293 1.391 -1.469 1.00 0.00 H new ATOM 0 HZ PHE B 66 14.358 0.739 0.653 1.00 0.00 H new ATOM 2119 N HIS B 67 9.359 7.378 1.888 1.00 0.00 N ATOM 2120 CA HIS B 67 8.773 8.710 1.953 1.00 0.00 C ATOM 2121 C HIS B 67 9.867 9.769 1.847 1.00 0.00 C ATOM 2122 O HIS B 67 10.848 9.729 2.589 1.00 0.00 O ATOM 2123 CB HIS B 67 7.984 8.888 3.257 1.00 0.00 C ATOM 2124 CG HIS B 67 6.827 7.941 3.405 1.00 0.00 C ATOM 2125 ND1 HIS B 67 6.940 6.658 3.896 1.00 0.00 N ATOM 2126 CD2 HIS B 67 5.510 8.115 3.120 1.00 0.00 C ATOM 2127 CE1 HIS B 67 5.722 6.104 3.890 1.00 0.00 C ATOM 2128 NE2 HIS B 67 4.816 6.946 3.429 1.00 0.00 N ATOM 0 H HIS B 67 9.292 6.846 2.756 1.00 0.00 H new ATOM 0 HA HIS B 67 8.085 8.829 1.116 1.00 0.00 H new ATOM 0 HB2 HIS B 67 8.661 8.753 4.101 1.00 0.00 H new ATOM 0 HB3 HIS B 67 7.612 9.911 3.308 1.00 0.00 H new ATOM 0 HD1 HIS B 67 7.801 6.210 4.209 1.00 0.00 H new ATOM 0 HD2 HIS B 67 5.071 9.016 2.718 1.00 0.00 H new ATOM 0 HE1 HIS B 67 5.508 5.098 4.220 1.00 0.00 H new ATOM 2136 N ILE B 68 9.699 10.700 0.921 1.00 0.00 N ATOM 2137 CA ILE B 68 10.684 11.745 0.700 1.00 0.00 C ATOM 2138 C ILE B 68 10.246 13.000 1.435 1.00 0.00 C ATOM 2139 O ILE B 68 9.465 13.797 0.910 1.00 0.00 O ATOM 2140 CB ILE B 68 10.869 12.049 -0.804 1.00 0.00 C ATOM 2141 CG1 ILE B 68 11.233 10.771 -1.570 1.00 0.00 C ATOM 2142 CG2 ILE B 68 11.939 13.113 -1.012 1.00 0.00 C ATOM 2143 CD1 ILE B 68 12.517 10.115 -1.099 1.00 0.00 C ATOM 0 H ILE B 68 8.885 10.752 0.308 1.00 0.00 H new ATOM 0 HA ILE B 68 11.645 11.400 1.083 1.00 0.00 H new ATOM 0 HB ILE B 68 9.925 12.431 -1.192 1.00 0.00 H new ATOM 0 HG12 ILE B 68 10.415 10.057 -1.474 1.00 0.00 H new ATOM 0 HG13 ILE B 68 11.326 11.009 -2.630 1.00 0.00 H new ATOM 0 HG21 ILE B 68 12.053 13.311 -2.078 1.00 0.00 H new ATOM 0 HG22 ILE B 68 11.644 14.030 -0.502 1.00 0.00 H new ATOM 0 HG23 ILE B 68 12.887 12.760 -0.606 1.00 0.00 H new ATOM 0 HD11 ILE B 68 12.705 9.218 -1.689 1.00 0.00 H new ATOM 0 HD12 ILE B 68 13.347 10.811 -1.221 1.00 0.00 H new ATOM 0 HD13 ILE B 68 12.423 9.844 -0.047 1.00 0.00 H new ATOM 2155 N ASN B 69 10.742 13.141 2.664 1.00 0.00 N ATOM 2156 CA ASN B 69 10.258 14.145 3.608 1.00 0.00 C ATOM 2157 C ASN B 69 8.870 13.751 4.086 1.00 0.00 C ATOM 2158 O ASN B 69 8.281 12.791 3.590 1.00 0.00 O ATOM 2159 CB ASN B 69 10.231 15.556 3.000 1.00 0.00 C ATOM 2160 CG ASN B 69 11.613 16.161 2.856 1.00 0.00 C ATOM 2161 OD1 ASN B 69 12.502 15.907 3.665 1.00 0.00 O ATOM 2162 ND2 ASN B 69 11.805 16.966 1.822 1.00 0.00 N ATOM 0 H ASN B 69 11.494 12.559 3.033 1.00 0.00 H new ATOM 0 HA ASN B 69 10.951 14.178 4.449 1.00 0.00 H new ATOM 0 HB2 ASN B 69 9.753 15.516 2.021 1.00 0.00 H new ATOM 0 HB3 ASN B 69 9.619 16.205 3.627 1.00 0.00 H new ATOM 0 HD21 ASN B 69 12.717 17.400 1.676 1.00 0.00 H new ATOM 0 HD22 ASN B 69 11.041 17.152 1.172 1.00 0.00 H new ATOM 2169 N PHE B 70 8.351 14.460 5.065 1.00 0.00 N ATOM 2170 CA PHE B 70 7.001 14.205 5.512 1.00 0.00 C ATOM 2171 C PHE B 70 6.048 15.090 4.730 1.00 0.00 C ATOM 2172 O PHE B 70 5.827 16.246 5.090 1.00 0.00 O ATOM 2173 CB PHE B 70 6.861 14.448 7.018 1.00 0.00 C ATOM 2174 CG PHE B 70 5.550 13.973 7.583 1.00 0.00 C ATOM 2175 CD1 PHE B 70 5.337 12.625 7.828 1.00 0.00 C ATOM 2176 CD2 PHE B 70 4.533 14.871 7.867 1.00 0.00 C ATOM 2177 CE1 PHE B 70 4.135 12.182 8.346 1.00 0.00 C ATOM 2178 CE2 PHE B 70 3.328 14.432 8.385 1.00 0.00 C ATOM 2179 CZ PHE B 70 3.130 13.087 8.624 1.00 0.00 C ATOM 0 H PHE B 70 8.836 15.208 5.560 1.00 0.00 H new ATOM 0 HA PHE B 70 6.756 13.158 5.331 1.00 0.00 H new ATOM 0 HB2 PHE B 70 7.676 13.943 7.537 1.00 0.00 H new ATOM 0 HB3 PHE B 70 6.969 15.514 7.218 1.00 0.00 H new ATOM 0 HD1 PHE B 70 6.120 11.913 7.611 1.00 0.00 H new ATOM 0 HD2 PHE B 70 4.683 15.924 7.682 1.00 0.00 H new ATOM 0 HE1 PHE B 70 3.982 11.129 8.533 1.00 0.00 H new ATOM 0 HE2 PHE B 70 2.543 15.141 8.602 1.00 0.00 H new ATOM 0 HZ PHE B 70 2.190 12.743 9.028 1.00 0.00 H new ATOM 2189 N GLY B 71 5.535 14.563 3.623 1.00 0.00 N ATOM 2190 CA GLY B 71 4.623 15.320 2.807 1.00 0.00 C ATOM 2191 C GLY B 71 3.279 15.461 3.469 1.00 0.00 C ATOM 2192 O GLY B 71 3.070 16.354 4.293 1.00 0.00 O ATOM 0 H GLY B 71 5.739 13.624 3.282 1.00 0.00 H new ATOM 0 HA2 GLY B 71 5.040 16.308 2.614 1.00 0.00 H new ATOM 0 HA3 GLY B 71 4.504 14.830 1.841 1.00 0.00 H new ATOM 2196 N ALA B 72 2.353 14.592 3.113 1.00 0.00 N ATOM 2197 CA ALA B 72 1.027 14.647 3.727 1.00 0.00 C ATOM 2198 C ALA B 72 0.491 13.260 4.023 1.00 0.00 C ATOM 2199 O ALA B 72 0.536 12.389 3.163 1.00 0.00 O ATOM 2200 CB ALA B 72 0.053 15.433 2.859 1.00 0.00 C ATOM 0 H ALA B 72 2.481 13.854 2.420 1.00 0.00 H new ATOM 0 HA ALA B 72 1.130 15.169 4.678 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -0.925 15.458 3.340 1.00 0.00 H new ATOM 0 HB2 ALA B 72 0.420 16.451 2.731 1.00 0.00 H new ATOM 0 HB3 ALA B 72 -0.034 14.953 1.884 1.00 0.00 H new ATOM 2206 N GLY B 73 -0.021 13.059 5.229 1.00 0.00 N ATOM 2207 CA GLY B 73 -0.619 11.781 5.571 1.00 0.00 C ATOM 2208 C GLY B 73 -1.720 11.403 4.599 1.00 0.00 C ATOM 2209 O GLY B 73 -2.621 12.200 4.341 1.00 0.00 O ATOM 0 H GLY B 73 -0.034 13.754 5.975 1.00 0.00 H new ATOM 0 HA2 GLY B 73 0.149 11.007 5.571 1.00 0.00 H new ATOM 0 HA3 GLY B 73 -1.025 11.827 6.582 1.00 0.00 H new ATOM 2213 N ILE B 74 -1.646 10.196 4.050 1.00 0.00 N ATOM 2214 CA ILE B 74 -2.607 9.760 3.040 1.00 0.00 C ATOM 2215 C ILE B 74 -3.999 9.618 3.655 1.00 0.00 C ATOM 2216 O ILE B 74 -5.017 9.720 2.970 1.00 0.00 O ATOM 2217 CB ILE B 74 -2.172 8.427 2.379 1.00 0.00 C ATOM 2218 CG1 ILE B 74 -2.989 8.163 1.113 1.00 0.00 C ATOM 2219 CG2 ILE B 74 -2.311 7.265 3.355 1.00 0.00 C ATOM 2220 CD1 ILE B 74 -2.517 6.960 0.324 1.00 0.00 C ATOM 0 H ILE B 74 -0.935 9.504 4.285 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.639 10.523 2.262 1.00 0.00 H new ATOM 0 HB ILE B 74 -1.122 8.514 2.102 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -4.034 8.018 1.389 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -2.947 9.045 0.474 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -2.000 6.341 2.867 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -1.682 7.445 4.227 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.351 7.177 3.670 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -3.143 6.836 -0.559 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -1.482 7.110 0.017 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.585 6.067 0.946 1.00 0.00 H new ATOM 2232 N ASP B 75 -4.026 9.416 4.963 1.00 0.00 N ATOM 2233 CA ASP B 75 -5.274 9.313 5.702 1.00 0.00 C ATOM 2234 C ASP B 75 -5.875 10.702 5.905 1.00 0.00 C ATOM 2235 O ASP B 75 -7.093 10.879 5.906 1.00 0.00 O ATOM 2236 CB ASP B 75 -5.021 8.631 7.047 1.00 0.00 C ATOM 2237 CG ASP B 75 -6.288 8.422 7.846 1.00 0.00 C ATOM 2238 OD1 ASP B 75 -7.173 7.679 7.372 1.00 0.00 O ATOM 2239 OD2 ASP B 75 -6.388 8.973 8.960 1.00 0.00 O ATOM 0 H ASP B 75 -3.190 9.319 5.539 1.00 0.00 H new ATOM 0 HA ASP B 75 -5.984 8.711 5.134 1.00 0.00 H new ATOM 0 HB2 ASP B 75 -4.542 7.667 6.876 1.00 0.00 H new ATOM 0 HB3 ASP B 75 -4.325 9.234 7.630 1.00 0.00 H new ATOM 2244 N ASP B 76 -4.996 11.690 6.032 1.00 0.00 N ATOM 2245 CA ASP B 76 -5.402 13.081 6.218 1.00 0.00 C ATOM 2246 C ASP B 76 -6.001 13.648 4.938 1.00 0.00 C ATOM 2247 O ASP B 76 -6.746 14.628 4.968 1.00 0.00 O ATOM 2248 CB ASP B 76 -4.201 13.940 6.631 1.00 0.00 C ATOM 2249 CG ASP B 76 -3.639 13.569 7.987 1.00 0.00 C ATOM 2250 OD1 ASP B 76 -2.917 12.556 8.083 1.00 0.00 O ATOM 2251 OD2 ASP B 76 -3.901 14.305 8.963 1.00 0.00 O ATOM 0 H ASP B 76 -3.986 11.552 6.009 1.00 0.00 H new ATOM 0 HA ASP B 76 -6.155 13.103 7.006 1.00 0.00 H new ATOM 0 HB2 ASP B 76 -3.417 13.841 5.881 1.00 0.00 H new ATOM 0 HB3 ASP B 76 -4.500 14.988 6.643 1.00 0.00 H new ATOM 2256 N LEU B 77 -5.674 13.021 3.813 1.00 0.00 N ATOM 2257 CA LEU B 77 -6.123 13.490 2.505 1.00 0.00 C ATOM 2258 C LEU B 77 -7.626 13.300 2.326 1.00 0.00 C ATOM 2259 O LEU B 77 -8.233 13.904 1.442 1.00 0.00 O ATOM 2260 CB LEU B 77 -5.373 12.759 1.389 1.00 0.00 C ATOM 2261 CG LEU B 77 -3.857 12.967 1.374 1.00 0.00 C ATOM 2262 CD1 LEU B 77 -3.227 12.183 0.234 1.00 0.00 C ATOM 2263 CD2 LEU B 77 -3.520 14.447 1.253 1.00 0.00 C ATOM 0 H LEU B 77 -5.096 12.181 3.780 1.00 0.00 H new ATOM 0 HA LEU B 77 -5.906 14.557 2.448 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -5.576 11.692 1.476 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -5.777 13.083 0.430 1.00 0.00 H new ATOM 0 HG LEU B 77 -3.449 12.599 2.315 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -2.149 12.341 0.236 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.439 11.121 0.362 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -3.642 12.524 -0.715 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -2.437 14.574 1.244 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -3.939 14.841 0.327 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -3.942 14.987 2.101 1.00 0.00 H new ATOM 2275 N LYS B 78 -8.224 12.460 3.163 1.00 0.00 N ATOM 2276 CA LYS B 78 -9.658 12.218 3.094 1.00 0.00 C ATOM 2277 C LYS B 78 -10.419 13.476 3.502 1.00 0.00 C ATOM 2278 O LYS B 78 -11.424 13.838 2.890 1.00 0.00 O ATOM 2279 CB LYS B 78 -10.054 11.049 3.996 1.00 0.00 C ATOM 2280 CG LYS B 78 -9.282 9.770 3.712 1.00 0.00 C ATOM 2281 CD LYS B 78 -9.787 8.618 4.565 1.00 0.00 C ATOM 2282 CE LYS B 78 -8.895 7.394 4.440 1.00 0.00 C ATOM 2283 NZ LYS B 78 -8.766 6.930 3.034 1.00 0.00 N ATOM 0 H LYS B 78 -7.740 11.938 3.893 1.00 0.00 H new ATOM 0 HA LYS B 78 -9.916 11.961 2.067 1.00 0.00 H new ATOM 0 HB2 LYS B 78 -9.897 11.335 5.036 1.00 0.00 H new ATOM 0 HB3 LYS B 78 -11.120 10.854 3.876 1.00 0.00 H new ATOM 0 HG2 LYS B 78 -9.376 9.513 2.657 1.00 0.00 H new ATOM 0 HG3 LYS B 78 -8.222 9.932 3.907 1.00 0.00 H new ATOM 0 HD2 LYS B 78 -9.833 8.930 5.608 1.00 0.00 H new ATOM 0 HD3 LYS B 78 -10.803 8.361 4.265 1.00 0.00 H new ATOM 0 HE2 LYS B 78 -7.906 7.626 4.836 1.00 0.00 H new ATOM 0 HE3 LYS B 78 -9.301 6.587 5.050 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 -8.371 5.968 3.021 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 -9.703 6.926 2.583 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 -8.134 7.571 2.513 1.00 0.00 H new ATOM 2297 N GLY B 79 -9.916 14.147 4.530 1.00 0.00 N ATOM 2298 CA GLY B 79 -10.521 15.383 4.981 1.00 0.00 C ATOM 2299 C GLY B 79 -11.772 15.158 5.802 1.00 0.00 C ATOM 2300 O GLY B 79 -12.875 15.495 5.372 1.00 0.00 O ATOM 0 H GLY B 79 -9.096 13.855 5.061 1.00 0.00 H new ATOM 0 HA2 GLY B 79 -9.797 15.941 5.575 1.00 0.00 H new ATOM 0 HA3 GLY B 79 -10.766 15.999 4.116 1.00 0.00 H new ATOM 2304 N SER B 80 -11.606 14.571 6.975 1.00 0.00 N ATOM 2305 CA SER B 80 -12.716 14.341 7.885 1.00 0.00 C ATOM 2306 C SER B 80 -12.212 14.289 9.322 1.00 0.00 C ATOM 2307 O SER B 80 -11.867 13.191 9.798 1.00 0.00 O ATOM 2308 CB SER B 80 -13.446 13.045 7.524 1.00 0.00 C ATOM 2309 OG SER B 80 -13.999 13.121 6.219 1.00 0.00 O ATOM 2310 OXT SER B 80 -12.146 15.356 9.966 1.00 0.00 O ATOM 0 H SER B 80 -10.705 14.242 7.322 1.00 0.00 H new ATOM 0 HA SER B 80 -13.422 15.167 7.792 1.00 0.00 H new ATOM 0 HB2 SER B 80 -12.754 12.205 7.581 1.00 0.00 H new ATOM 0 HB3 SER B 80 -14.238 12.855 8.248 1.00 0.00 H new ATOM 0 HG SER B 80 -13.803 14.000 5.831 1.00 0.00 H new TER 2316 SER B 80