USER MOD reduce.3.24.130724 H: found=0, std=0, add=772, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 766 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 82 SER OG : rot 180:sc= -0.15 USER MOD Set 1.2: A 89 HIS : no HD1:sc= -2.64 K(o=-3.2,f=-4.1!) USER MOD Set 1.3: A 93 SER OG : rot -167:sc= -0.384 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.00915 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 23:sc= 0.624 USER MOD Single : A 14 THR OG1 : rot 23:sc= 0.102 USER MOD Single : A 16 THR OG1 : rot 38:sc= 0.0521 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.5 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot -28:sc= -0.368 USER MOD Single : A 32 ASN : amide:sc= 0.0405 K(o=0.04,f=-6.9!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 ASN : amide:sc= -0.0308 X(o=-0.031,f=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 134:sc= -6.43! (180deg=-7.85!) USER MOD Single : A 44 SER OG : rot -47:sc= 0.279 USER MOD Single : A 46 HIS : no HD1:sc= -0.982 K(o=-0.98,f=-5.8!) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot -10:sc= -1.12 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot -120:sc= -0.828 USER MOD Single : A 62 MET CE :methyl -122:sc= -1.2 (180deg=-5.22!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= -0.0227 (180deg=-0.0227) USER MOD Single : A 65 ASN : amide:sc= -5.53 K(o=-5.5,f=-15!) USER MOD Single : A 66 SER OG : rot 80:sc= 0.0353 USER MOD Single : A 67 HIS : no HD1:sc= -1.02 X(o=-1,f=-1.3) USER MOD Single : A 68 CYS SG : rot 180:sc= -0.007 USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 MET CE :methyl -167:sc=-0.00161 (180deg=-0.2) USER MOD Single : A 79 HIS : no HD1:sc= -8.82! C(o=-8.8!,f=-8.8!) USER MOD Single : A 80 THR OG1 : rot 180:sc= -0.116 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.00635 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.972 21.923 26.807 1.00 0.00 N ATOM 2 CA GLY A 1 6.670 21.198 28.027 1.00 0.00 C ATOM 3 C GLY A 1 6.593 19.700 27.807 1.00 0.00 C ATOM 4 O GLY A 1 7.277 18.931 28.483 1.00 0.00 O ATOM 0 H1 GLY A 1 7.014 22.942 27.010 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.889 21.607 26.433 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.230 21.741 26.102 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.435 21.414 28.773 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.722 21.552 28.431 1.00 0.00 H new ATOM 8 N SER A 2 5.758 19.284 26.861 1.00 0.00 N ATOM 9 CA SER A 2 5.591 17.868 26.557 1.00 0.00 C ATOM 10 C SER A 2 6.608 17.411 25.516 1.00 0.00 C ATOM 11 O SER A 2 7.008 18.182 24.643 1.00 0.00 O ATOM 12 CB SER A 2 4.172 17.597 26.054 1.00 0.00 C ATOM 13 OG SER A 2 3.817 18.498 25.019 1.00 0.00 O ATOM 0 H SER A 2 5.186 19.908 26.291 1.00 0.00 H new ATOM 0 HA SER A 2 5.758 17.303 27.474 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.102 16.573 25.689 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.466 17.690 26.879 1.00 0.00 H new ATOM 0 HG SER A 2 2.906 18.303 24.714 1.00 0.00 H new ATOM 19 N SER A 3 7.023 16.152 25.615 1.00 0.00 N ATOM 20 CA SER A 3 7.997 15.593 24.685 1.00 0.00 C ATOM 21 C SER A 3 7.299 14.857 23.545 1.00 0.00 C ATOM 22 O SER A 3 6.246 14.250 23.736 1.00 0.00 O ATOM 23 CB SER A 3 8.944 14.640 25.417 1.00 0.00 C ATOM 24 OG SER A 3 9.908 14.099 24.531 1.00 0.00 O ATOM 0 H SER A 3 6.700 15.500 26.330 1.00 0.00 H new ATOM 0 HA SER A 3 8.574 16.416 24.264 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.446 15.171 26.226 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.371 13.833 25.873 1.00 0.00 H new ATOM 0 HG SER A 3 10.502 13.495 25.023 1.00 0.00 H new ATOM 30 N GLY A 4 7.895 14.916 22.358 1.00 0.00 N ATOM 31 CA GLY A 4 7.317 14.252 21.204 1.00 0.00 C ATOM 32 C GLY A 4 8.158 14.426 19.955 1.00 0.00 C ATOM 33 O GLY A 4 7.979 15.386 19.206 1.00 0.00 O ATOM 0 H GLY A 4 8.768 15.412 22.175 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.205 13.189 21.418 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.317 14.648 21.024 1.00 0.00 H new ATOM 37 N SER A 5 9.079 13.494 19.729 1.00 0.00 N ATOM 38 CA SER A 5 9.954 13.551 18.564 1.00 0.00 C ATOM 39 C SER A 5 10.530 12.174 18.250 1.00 0.00 C ATOM 40 O SER A 5 10.518 11.276 19.092 1.00 0.00 O ATOM 41 CB SER A 5 11.089 14.549 18.801 1.00 0.00 C ATOM 42 OG SER A 5 11.702 14.924 17.579 1.00 0.00 O ATOM 0 H SER A 5 9.238 12.691 20.337 1.00 0.00 H new ATOM 0 HA SER A 5 9.361 13.881 17.711 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.700 15.435 19.303 1.00 0.00 H new ATOM 0 HB3 SER A 5 11.833 14.108 19.464 1.00 0.00 H new ATOM 0 HG SER A 5 12.423 15.564 17.757 1.00 0.00 H new ATOM 48 N SER A 6 11.035 12.015 17.030 1.00 0.00 N ATOM 49 CA SER A 6 11.613 10.747 16.602 1.00 0.00 C ATOM 50 C SER A 6 12.372 10.081 17.746 1.00 0.00 C ATOM 51 O SER A 6 13.218 10.701 18.388 1.00 0.00 O ATOM 52 CB SER A 6 12.550 10.965 15.412 1.00 0.00 C ATOM 53 OG SER A 6 11.818 11.224 14.227 1.00 0.00 O ATOM 0 H SER A 6 11.055 12.748 16.321 1.00 0.00 H new ATOM 0 HA SER A 6 10.798 10.089 16.299 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.219 11.800 15.620 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.175 10.083 15.271 1.00 0.00 H new ATOM 0 HG SER A 6 12.440 11.361 13.482 1.00 0.00 H new ATOM 59 N GLY A 7 12.061 8.812 17.995 1.00 0.00 N ATOM 60 CA GLY A 7 12.721 8.082 19.061 1.00 0.00 C ATOM 61 C GLY A 7 14.114 7.627 18.675 1.00 0.00 C ATOM 62 O GLY A 7 14.407 6.431 18.681 1.00 0.00 O ATOM 0 H GLY A 7 11.364 8.277 17.477 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.781 8.714 19.947 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.120 7.213 19.329 1.00 0.00 H new ATOM 66 N ARG A 8 14.975 8.581 18.337 1.00 0.00 N ATOM 67 CA ARG A 8 16.344 8.271 17.944 1.00 0.00 C ATOM 68 C ARG A 8 16.382 7.061 17.015 1.00 0.00 C ATOM 69 O ARG A 8 17.220 6.172 17.170 1.00 0.00 O ATOM 70 CB ARG A 8 17.205 8.005 19.180 1.00 0.00 C ATOM 71 CG ARG A 8 17.511 9.255 19.990 1.00 0.00 C ATOM 72 CD ARG A 8 16.325 9.666 20.849 1.00 0.00 C ATOM 73 NE ARG A 8 16.038 8.683 21.890 1.00 0.00 N ATOM 74 CZ ARG A 8 14.851 8.557 22.474 1.00 0.00 C ATOM 75 NH1 ARG A 8 13.847 9.347 22.120 1.00 0.00 N ATOM 76 NH2 ARG A 8 14.667 7.638 23.414 1.00 0.00 N ATOM 0 H ARG A 8 14.749 9.575 18.327 1.00 0.00 H new ATOM 0 HA ARG A 8 16.745 9.132 17.409 1.00 0.00 H new ATOM 0 HB2 ARG A 8 16.695 7.284 19.819 1.00 0.00 H new ATOM 0 HB3 ARG A 8 18.143 7.546 18.867 1.00 0.00 H new ATOM 0 HG2 ARG A 8 18.377 9.075 20.626 1.00 0.00 H new ATOM 0 HG3 ARG A 8 17.774 10.071 19.317 1.00 0.00 H new ATOM 0 HD2 ARG A 8 16.528 10.633 21.309 1.00 0.00 H new ATOM 0 HD3 ARG A 8 15.446 9.792 20.217 1.00 0.00 H new ATOM 0 HE ARG A 8 16.789 8.059 22.185 1.00 0.00 H new ATOM 0 HH11 ARG A 8 13.985 10.054 21.398 1.00 0.00 H new ATOM 0 HH12 ARG A 8 12.937 9.248 22.570 1.00 0.00 H new ATOM 0 HH21 ARG A 8 15.437 7.028 23.689 1.00 0.00 H new ATOM 0 HH22 ARG A 8 13.756 7.542 23.862 1.00 0.00 H new ATOM 90 N VAL A 9 15.468 7.033 16.050 1.00 0.00 N ATOM 91 CA VAL A 9 15.397 5.932 15.096 1.00 0.00 C ATOM 92 C VAL A 9 15.472 6.443 13.662 1.00 0.00 C ATOM 93 O VAL A 9 14.706 7.321 13.263 1.00 0.00 O ATOM 94 CB VAL A 9 14.101 5.119 15.273 1.00 0.00 C ATOM 95 CG1 VAL A 9 14.024 4.005 14.240 1.00 0.00 C ATOM 96 CG2 VAL A 9 14.015 4.555 16.684 1.00 0.00 C ATOM 0 H VAL A 9 14.767 7.760 15.908 1.00 0.00 H new ATOM 0 HA VAL A 9 16.252 5.286 15.294 1.00 0.00 H new ATOM 0 HB VAL A 9 13.251 5.784 15.119 1.00 0.00 H new ATOM 0 HG11 VAL A 9 13.102 3.441 14.381 1.00 0.00 H new ATOM 0 HG12 VAL A 9 14.037 4.436 13.239 1.00 0.00 H new ATOM 0 HG13 VAL A 9 14.878 3.339 14.359 1.00 0.00 H new ATOM 0 HG21 VAL A 9 13.093 3.983 16.792 1.00 0.00 H new ATOM 0 HG22 VAL A 9 14.869 3.904 16.868 1.00 0.00 H new ATOM 0 HG23 VAL A 9 14.021 5.373 17.404 1.00 0.00 H new ATOM 106 N LYS A 10 16.399 5.888 12.890 1.00 0.00 N ATOM 107 CA LYS A 10 16.574 6.285 11.497 1.00 0.00 C ATOM 108 C LYS A 10 15.483 5.682 10.619 1.00 0.00 C ATOM 109 O LYS A 10 15.123 4.516 10.774 1.00 0.00 O ATOM 110 CB LYS A 10 17.951 5.849 10.991 1.00 0.00 C ATOM 111 CG LYS A 10 19.085 6.738 11.470 1.00 0.00 C ATOM 112 CD LYS A 10 20.365 6.477 10.694 1.00 0.00 C ATOM 113 CE LYS A 10 21.561 7.151 11.349 1.00 0.00 C ATOM 114 NZ LYS A 10 21.706 8.568 10.915 1.00 0.00 N ATOM 0 H LYS A 10 17.042 5.161 13.205 1.00 0.00 H new ATOM 0 HA LYS A 10 16.501 7.371 11.442 1.00 0.00 H new ATOM 0 HB2 LYS A 10 18.141 4.826 11.316 1.00 0.00 H new ATOM 0 HB3 LYS A 10 17.942 5.841 9.901 1.00 0.00 H new ATOM 0 HG2 LYS A 10 18.799 7.784 11.361 1.00 0.00 H new ATOM 0 HG3 LYS A 10 19.261 6.565 12.532 1.00 0.00 H new ATOM 0 HD2 LYS A 10 20.541 5.403 10.631 1.00 0.00 H new ATOM 0 HD3 LYS A 10 20.254 6.843 9.673 1.00 0.00 H new ATOM 0 HE2 LYS A 10 21.451 7.113 12.433 1.00 0.00 H new ATOM 0 HE3 LYS A 10 22.469 6.601 11.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 22.532 8.992 11.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 21.837 8.604 9.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 20.851 9.100 11.174 1.00 0.00 H new ATOM 128 N GLU A 11 14.963 6.484 9.695 1.00 0.00 N ATOM 129 CA GLU A 11 13.913 6.028 8.791 1.00 0.00 C ATOM 130 C GLU A 11 14.128 6.581 7.385 1.00 0.00 C ATOM 131 O GLU A 11 14.178 7.794 7.185 1.00 0.00 O ATOM 132 CB GLU A 11 12.539 6.452 9.314 1.00 0.00 C ATOM 133 CG GLU A 11 12.274 7.943 9.189 1.00 0.00 C ATOM 134 CD GLU A 11 11.642 8.314 7.862 1.00 0.00 C ATOM 135 OE1 GLU A 11 11.797 7.541 6.894 1.00 0.00 O ATOM 136 OE2 GLU A 11 10.991 9.378 7.792 1.00 0.00 O ATOM 0 H GLU A 11 15.251 7.452 9.553 1.00 0.00 H new ATOM 0 HA GLU A 11 13.956 4.940 8.745 1.00 0.00 H new ATOM 0 HB2 GLU A 11 11.768 5.908 8.769 1.00 0.00 H new ATOM 0 HB3 GLU A 11 12.453 6.163 10.361 1.00 0.00 H new ATOM 0 HG2 GLU A 11 11.619 8.261 10.000 1.00 0.00 H new ATOM 0 HG3 GLU A 11 13.212 8.486 9.305 1.00 0.00 H new ATOM 143 N SER A 12 14.253 5.681 6.415 1.00 0.00 N ATOM 144 CA SER A 12 14.467 6.078 5.028 1.00 0.00 C ATOM 145 C SER A 12 14.001 4.984 4.072 1.00 0.00 C ATOM 146 O SER A 12 14.391 3.823 4.203 1.00 0.00 O ATOM 147 CB SER A 12 15.945 6.387 4.785 1.00 0.00 C ATOM 148 OG SER A 12 16.270 7.697 5.218 1.00 0.00 O ATOM 0 H SER A 12 14.210 4.673 6.564 1.00 0.00 H new ATOM 0 HA SER A 12 13.880 6.977 4.839 1.00 0.00 H new ATOM 0 HB2 SER A 12 16.563 5.662 5.314 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.171 6.285 3.724 1.00 0.00 H new ATOM 0 HG SER A 12 15.615 7.993 5.885 1.00 0.00 H new ATOM 154 N ILE A 13 13.164 5.363 3.112 1.00 0.00 N ATOM 155 CA ILE A 13 12.646 4.415 2.133 1.00 0.00 C ATOM 156 C ILE A 13 12.968 4.861 0.711 1.00 0.00 C ATOM 157 O ILE A 13 13.581 5.909 0.500 1.00 0.00 O ATOM 158 CB ILE A 13 11.122 4.240 2.271 1.00 0.00 C ATOM 159 CG1 ILE A 13 10.483 5.530 2.788 1.00 0.00 C ATOM 160 CG2 ILE A 13 10.805 3.077 3.199 1.00 0.00 C ATOM 161 CD1 ILE A 13 8.971 5.497 2.792 1.00 0.00 C ATOM 0 H ILE A 13 12.830 6.319 2.991 1.00 0.00 H new ATOM 0 HA ILE A 13 13.133 3.460 2.331 1.00 0.00 H new ATOM 0 HB ILE A 13 10.706 4.020 1.288 1.00 0.00 H new ATOM 0 HG12 ILE A 13 10.837 5.720 3.801 1.00 0.00 H new ATOM 0 HG13 ILE A 13 10.818 6.364 2.172 1.00 0.00 H new ATOM 0 HG21 ILE A 13 9.724 2.966 3.287 1.00 0.00 H new ATOM 0 HG22 ILE A 13 11.232 2.160 2.793 1.00 0.00 H new ATOM 0 HG23 ILE A 13 11.231 3.271 4.184 1.00 0.00 H new ATOM 0 HD11 ILE A 13 8.587 6.444 3.171 1.00 0.00 H new ATOM 0 HD12 ILE A 13 8.608 5.338 1.777 1.00 0.00 H new ATOM 0 HD13 ILE A 13 8.626 4.684 3.432 1.00 0.00 H new ATOM 173 N THR A 14 12.549 4.061 -0.264 1.00 0.00 N ATOM 174 CA THR A 14 12.792 4.373 -1.667 1.00 0.00 C ATOM 175 C THR A 14 11.598 5.093 -2.284 1.00 0.00 C ATOM 176 O THR A 14 10.459 4.643 -2.162 1.00 0.00 O ATOM 177 CB THR A 14 13.088 3.100 -2.483 1.00 0.00 C ATOM 178 OG1 THR A 14 11.996 2.181 -2.369 1.00 0.00 O ATOM 179 CG2 THR A 14 14.369 2.436 -2.003 1.00 0.00 C ATOM 0 H THR A 14 12.039 3.191 -0.108 1.00 0.00 H new ATOM 0 HA THR A 14 13.664 5.027 -1.699 1.00 0.00 H new ATOM 0 HB THR A 14 13.215 3.385 -3.527 1.00 0.00 H new ATOM 0 HG1 THR A 14 11.182 2.669 -2.122 1.00 0.00 H new ATOM 0 HG21 THR A 14 14.558 1.540 -2.594 1.00 0.00 H new ATOM 0 HG22 THR A 14 15.203 3.128 -2.118 1.00 0.00 H new ATOM 0 HG23 THR A 14 14.266 2.163 -0.953 1.00 0.00 H new ATOM 187 N ARG A 15 11.867 6.212 -2.948 1.00 0.00 N ATOM 188 CA ARG A 15 10.814 6.995 -3.585 1.00 0.00 C ATOM 189 C ARG A 15 10.669 6.615 -5.056 1.00 0.00 C ATOM 190 O ARG A 15 10.438 7.472 -5.910 1.00 0.00 O ATOM 191 CB ARG A 15 11.114 8.489 -3.460 1.00 0.00 C ATOM 192 CG ARG A 15 12.444 8.897 -4.072 1.00 0.00 C ATOM 193 CD ARG A 15 12.676 10.395 -3.952 1.00 0.00 C ATOM 194 NE ARG A 15 13.721 10.862 -4.860 1.00 0.00 N ATOM 195 CZ ARG A 15 13.566 10.948 -6.176 1.00 0.00 C ATOM 196 NH1 ARG A 15 12.415 10.602 -6.736 1.00 0.00 N ATOM 197 NH2 ARG A 15 14.564 11.382 -6.936 1.00 0.00 N ATOM 0 H ARG A 15 12.805 6.597 -3.059 1.00 0.00 H new ATOM 0 HA ARG A 15 9.875 6.777 -3.077 1.00 0.00 H new ATOM 0 HB2 ARG A 15 10.314 9.053 -3.941 1.00 0.00 H new ATOM 0 HB3 ARG A 15 11.109 8.765 -2.405 1.00 0.00 H new ATOM 0 HG2 ARG A 15 13.254 8.361 -3.576 1.00 0.00 H new ATOM 0 HG3 ARG A 15 12.467 8.607 -5.123 1.00 0.00 H new ATOM 0 HD2 ARG A 15 11.747 10.924 -4.166 1.00 0.00 H new ATOM 0 HD3 ARG A 15 12.952 10.638 -2.926 1.00 0.00 H new ATOM 0 HE ARG A 15 14.619 11.137 -4.461 1.00 0.00 H new ATOM 0 HH11 ARG A 15 11.645 10.269 -6.156 1.00 0.00 H new ATOM 0 HH12 ARG A 15 12.299 10.669 -7.747 1.00 0.00 H new ATOM 0 HH21 ARG A 15 15.451 11.650 -6.509 1.00 0.00 H new ATOM 0 HH22 ARG A 15 14.444 11.448 -7.947 1.00 0.00 H new ATOM 211 N THR A 16 10.807 5.325 -5.346 1.00 0.00 N ATOM 212 CA THR A 16 10.693 4.832 -6.712 1.00 0.00 C ATOM 213 C THR A 16 10.002 3.474 -6.751 1.00 0.00 C ATOM 214 O THR A 16 10.368 2.559 -6.014 1.00 0.00 O ATOM 215 CB THR A 16 12.074 4.712 -7.383 1.00 0.00 C ATOM 216 OG1 THR A 16 12.948 3.924 -6.567 1.00 0.00 O ATOM 217 CG2 THR A 16 12.687 6.085 -7.611 1.00 0.00 C ATOM 0 H THR A 16 10.998 4.603 -4.652 1.00 0.00 H new ATOM 0 HA THR A 16 10.093 5.558 -7.260 1.00 0.00 H new ATOM 0 HB THR A 16 11.942 4.226 -8.350 1.00 0.00 H new ATOM 0 HG1 THR A 16 12.443 3.187 -6.164 1.00 0.00 H new ATOM 0 HG21 THR A 16 13.662 5.974 -8.086 1.00 0.00 H new ATOM 0 HG22 THR A 16 12.034 6.672 -8.256 1.00 0.00 H new ATOM 0 HG23 THR A 16 12.805 6.594 -6.654 1.00 0.00 H new ATOM 225 N SER A 17 9.000 3.350 -7.617 1.00 0.00 N ATOM 226 CA SER A 17 8.256 2.103 -7.750 1.00 0.00 C ATOM 227 C SER A 17 8.371 1.549 -9.166 1.00 0.00 C ATOM 228 O SER A 17 7.864 2.141 -10.119 1.00 0.00 O ATOM 229 CB SER A 17 6.784 2.324 -7.395 1.00 0.00 C ATOM 230 OG SER A 17 6.172 1.114 -6.981 1.00 0.00 O ATOM 0 H SER A 17 8.686 4.097 -8.236 1.00 0.00 H new ATOM 0 HA SER A 17 8.685 1.377 -7.059 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.706 3.065 -6.600 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.255 2.726 -8.259 1.00 0.00 H new ATOM 0 HG SER A 17 5.233 1.282 -6.758 1.00 0.00 H new ATOM 236 N ARG A 18 9.043 0.410 -9.296 1.00 0.00 N ATOM 237 CA ARG A 18 9.227 -0.225 -10.596 1.00 0.00 C ATOM 238 C ARG A 18 8.669 -1.645 -10.592 1.00 0.00 C ATOM 239 O ARG A 18 9.298 -2.568 -10.074 1.00 0.00 O ATOM 240 CB ARG A 18 10.710 -0.249 -10.970 1.00 0.00 C ATOM 241 CG ARG A 18 11.343 1.132 -11.040 1.00 0.00 C ATOM 242 CD ARG A 18 12.851 1.045 -11.216 1.00 0.00 C ATOM 243 NE ARG A 18 13.529 0.712 -9.966 1.00 0.00 N ATOM 244 CZ ARG A 18 14.830 0.891 -9.766 1.00 0.00 C ATOM 245 NH1 ARG A 18 15.589 1.396 -10.728 1.00 0.00 N ATOM 246 NH2 ARG A 18 15.374 0.564 -8.601 1.00 0.00 N ATOM 0 H ARG A 18 9.469 -0.092 -8.517 1.00 0.00 H new ATOM 0 HA ARG A 18 8.682 0.359 -11.338 1.00 0.00 H new ATOM 0 HB2 ARG A 18 11.251 -0.851 -10.239 1.00 0.00 H new ATOM 0 HB3 ARG A 18 10.825 -0.741 -11.936 1.00 0.00 H new ATOM 0 HG2 ARG A 18 10.910 1.690 -11.870 1.00 0.00 H new ATOM 0 HG3 ARG A 18 11.113 1.685 -10.130 1.00 0.00 H new ATOM 0 HD2 ARG A 18 13.085 0.291 -11.968 1.00 0.00 H new ATOM 0 HD3 ARG A 18 13.228 1.997 -11.591 1.00 0.00 H new ATOM 0 HE ARG A 18 12.973 0.321 -9.205 1.00 0.00 H new ATOM 0 HH11 ARG A 18 15.174 1.648 -11.625 1.00 0.00 H new ATOM 0 HH12 ARG A 18 16.588 1.532 -10.571 1.00 0.00 H new ATOM 0 HH21 ARG A 18 14.793 0.175 -7.858 1.00 0.00 H new ATOM 0 HH22 ARG A 18 16.373 0.702 -8.448 1.00 0.00 H new ATOM 260 N ALA A 19 7.485 -1.812 -11.172 1.00 0.00 N ATOM 261 CA ALA A 19 6.844 -3.120 -11.236 1.00 0.00 C ATOM 262 C ALA A 19 5.592 -3.075 -12.106 1.00 0.00 C ATOM 263 O ALA A 19 4.871 -2.078 -12.146 1.00 0.00 O ATOM 264 CB ALA A 19 6.500 -3.608 -9.837 1.00 0.00 C ATOM 0 H ALA A 19 6.950 -1.058 -11.604 1.00 0.00 H new ATOM 0 HA ALA A 19 7.546 -3.820 -11.690 1.00 0.00 H new ATOM 0 HB1 ALA A 19 6.022 -4.586 -9.900 1.00 0.00 H new ATOM 0 HB2 ALA A 19 7.412 -3.687 -9.245 1.00 0.00 H new ATOM 0 HB3 ALA A 19 5.819 -2.901 -9.362 1.00 0.00 H new ATOM 270 N PRO A 20 5.327 -4.179 -12.820 1.00 0.00 N ATOM 271 CA PRO A 20 4.162 -4.290 -13.702 1.00 0.00 C ATOM 272 C PRO A 20 2.851 -4.358 -12.926 1.00 0.00 C ATOM 273 O PRO A 20 2.517 -5.390 -12.344 1.00 0.00 O ATOM 274 CB PRO A 20 4.408 -5.601 -14.452 1.00 0.00 C ATOM 275 CG PRO A 20 5.279 -6.399 -13.545 1.00 0.00 C ATOM 276 CD PRO A 20 6.144 -5.404 -12.821 1.00 0.00 C ATOM 0 HA PRO A 20 4.061 -3.422 -14.354 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.472 -6.120 -14.660 1.00 0.00 H new ATOM 0 HB3 PRO A 20 4.893 -5.423 -15.412 1.00 0.00 H new ATOM 0 HG2 PRO A 20 4.682 -6.981 -12.843 1.00 0.00 H new ATOM 0 HG3 PRO A 20 5.886 -7.106 -14.110 1.00 0.00 H new ATOM 0 HD2 PRO A 20 6.375 -5.734 -11.808 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.095 -5.252 -13.331 1.00 0.00 H new ATOM 284 N SER A 21 2.112 -3.253 -12.922 1.00 0.00 N ATOM 285 CA SER A 21 0.839 -3.188 -12.214 1.00 0.00 C ATOM 286 C SER A 21 -0.255 -2.621 -13.115 1.00 0.00 C ATOM 287 O SER A 21 -0.075 -1.582 -13.751 1.00 0.00 O ATOM 288 CB SER A 21 0.975 -2.329 -10.955 1.00 0.00 C ATOM 289 OG SER A 21 1.989 -2.832 -10.102 1.00 0.00 O ATOM 0 H SER A 21 2.373 -2.391 -13.401 1.00 0.00 H new ATOM 0 HA SER A 21 0.559 -4.201 -11.925 1.00 0.00 H new ATOM 0 HB2 SER A 21 1.208 -1.302 -11.235 1.00 0.00 H new ATOM 0 HB3 SER A 21 0.025 -2.307 -10.422 1.00 0.00 H new ATOM 0 HG SER A 21 2.058 -2.265 -9.306 1.00 0.00 H new ATOM 295 N VAL A 22 -1.390 -3.311 -13.163 1.00 0.00 N ATOM 296 CA VAL A 22 -2.514 -2.877 -13.983 1.00 0.00 C ATOM 297 C VAL A 22 -3.718 -2.517 -13.120 1.00 0.00 C ATOM 298 O VAL A 22 -4.857 -2.828 -13.465 1.00 0.00 O ATOM 299 CB VAL A 22 -2.927 -3.967 -14.991 1.00 0.00 C ATOM 300 CG1 VAL A 22 -4.005 -3.446 -15.929 1.00 0.00 C ATOM 301 CG2 VAL A 22 -1.717 -4.453 -15.774 1.00 0.00 C ATOM 0 H VAL A 22 -1.555 -4.173 -12.643 1.00 0.00 H new ATOM 0 HA VAL A 22 -2.184 -1.993 -14.529 1.00 0.00 H new ATOM 0 HB VAL A 22 -3.338 -4.812 -14.439 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -4.284 -4.229 -16.634 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -4.880 -3.151 -15.350 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.625 -2.584 -16.477 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -2.026 -5.222 -16.481 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -1.275 -3.617 -16.317 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -0.981 -4.868 -15.086 1.00 0.00 H new ATOM 311 N ALA A 23 -3.457 -1.857 -11.996 1.00 0.00 N ATOM 312 CA ALA A 23 -4.519 -1.451 -11.084 1.00 0.00 C ATOM 313 C ALA A 23 -5.717 -0.898 -11.848 1.00 0.00 C ATOM 314 O ALA A 23 -5.590 -0.463 -12.993 1.00 0.00 O ATOM 315 CB ALA A 23 -3.999 -0.419 -10.095 1.00 0.00 C ATOM 0 H ALA A 23 -2.519 -1.592 -11.695 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.848 -2.332 -10.533 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.803 -0.125 -9.420 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.180 -0.848 -9.518 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.642 0.457 -10.637 1.00 0.00 H new ATOM 321 N THR A 24 -6.882 -0.919 -11.208 1.00 0.00 N ATOM 322 CA THR A 24 -8.103 -0.421 -11.828 1.00 0.00 C ATOM 323 C THR A 24 -8.928 0.396 -10.840 1.00 0.00 C ATOM 324 O THR A 24 -8.579 0.504 -9.664 1.00 0.00 O ATOM 325 CB THR A 24 -8.968 -1.575 -12.370 1.00 0.00 C ATOM 326 OG1 THR A 24 -10.193 -1.060 -12.904 1.00 0.00 O ATOM 327 CG2 THR A 24 -9.272 -2.585 -11.275 1.00 0.00 C ATOM 0 H THR A 24 -7.005 -1.276 -10.260 1.00 0.00 H new ATOM 0 HA THR A 24 -7.799 0.217 -12.658 1.00 0.00 H new ATOM 0 HB THR A 24 -8.410 -2.077 -13.160 1.00 0.00 H new ATOM 0 HG1 THR A 24 -10.736 -1.799 -13.248 1.00 0.00 H new ATOM 0 HG21 THR A 24 -9.884 -3.390 -11.682 1.00 0.00 H new ATOM 0 HG22 THR A 24 -8.339 -2.997 -10.891 1.00 0.00 H new ATOM 0 HG23 THR A 24 -9.812 -2.093 -10.466 1.00 0.00 H new ATOM 335 N VAL A 25 -10.025 0.971 -11.325 1.00 0.00 N ATOM 336 CA VAL A 25 -10.901 1.777 -10.483 1.00 0.00 C ATOM 337 C VAL A 25 -12.343 1.291 -10.566 1.00 0.00 C ATOM 338 O VAL A 25 -12.752 0.696 -11.562 1.00 0.00 O ATOM 339 CB VAL A 25 -10.848 3.264 -10.881 1.00 0.00 C ATOM 340 CG1 VAL A 25 -11.122 3.429 -12.368 1.00 0.00 C ATOM 341 CG2 VAL A 25 -11.839 4.071 -10.056 1.00 0.00 C ATOM 0 H VAL A 25 -10.328 0.893 -12.296 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.543 1.669 -9.459 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.846 3.642 -10.676 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.080 4.486 -12.631 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -10.371 2.883 -12.939 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.111 3.036 -12.601 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -11.788 5.119 -10.350 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -12.847 3.694 -10.228 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.592 3.979 -8.998 1.00 0.00 H new ATOM 351 N GLY A 26 -13.111 1.548 -9.511 1.00 0.00 N ATOM 352 CA GLY A 26 -14.500 1.130 -9.485 1.00 0.00 C ATOM 353 C GLY A 26 -14.655 -0.373 -9.603 1.00 0.00 C ATOM 354 O GLY A 26 -15.459 -0.860 -10.399 1.00 0.00 O ATOM 0 H GLY A 26 -12.795 2.038 -8.674 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -14.961 1.468 -8.557 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -15.037 1.613 -10.302 1.00 0.00 H new ATOM 358 N SER A 27 -13.883 -1.110 -8.811 1.00 0.00 N ATOM 359 CA SER A 27 -13.935 -2.567 -8.835 1.00 0.00 C ATOM 360 C SER A 27 -13.091 -3.159 -7.710 1.00 0.00 C ATOM 361 O SER A 27 -12.063 -2.597 -7.329 1.00 0.00 O ATOM 362 CB SER A 27 -13.446 -3.095 -10.185 1.00 0.00 C ATOM 363 OG SER A 27 -13.953 -4.393 -10.440 1.00 0.00 O ATOM 0 H SER A 27 -13.215 -0.722 -8.145 1.00 0.00 H new ATOM 0 HA SER A 27 -14.971 -2.871 -8.688 1.00 0.00 H new ATOM 0 HB2 SER A 27 -13.759 -2.417 -10.979 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.356 -3.118 -10.197 1.00 0.00 H new ATOM 0 HG SER A 27 -13.627 -4.707 -11.309 1.00 0.00 H new ATOM 369 N ILE A 28 -13.533 -4.296 -7.183 1.00 0.00 N ATOM 370 CA ILE A 28 -12.818 -4.964 -6.102 1.00 0.00 C ATOM 371 C ILE A 28 -11.531 -5.606 -6.609 1.00 0.00 C ATOM 372 O ILE A 28 -11.553 -6.692 -7.190 1.00 0.00 O ATOM 373 CB ILE A 28 -13.689 -6.046 -5.436 1.00 0.00 C ATOM 374 CG1 ILE A 28 -14.972 -5.426 -4.877 1.00 0.00 C ATOM 375 CG2 ILE A 28 -12.911 -6.748 -4.334 1.00 0.00 C ATOM 376 CD1 ILE A 28 -15.978 -6.448 -4.397 1.00 0.00 C ATOM 0 H ILE A 28 -14.382 -4.773 -7.486 1.00 0.00 H new ATOM 0 HA ILE A 28 -12.574 -4.199 -5.365 1.00 0.00 H new ATOM 0 HB ILE A 28 -13.962 -6.785 -6.189 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -14.716 -4.764 -4.050 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -15.433 -4.808 -5.648 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -13.540 -7.510 -3.873 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -12.024 -7.218 -4.758 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.611 -6.020 -3.580 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -16.861 -5.937 -4.014 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -16.264 -7.095 -5.227 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -15.535 -7.050 -3.604 1.00 0.00 H new ATOM 388 N CYS A 29 -10.411 -4.928 -6.383 1.00 0.00 N ATOM 389 CA CYS A 29 -9.112 -5.432 -6.816 1.00 0.00 C ATOM 390 C CYS A 29 -8.398 -6.148 -5.674 1.00 0.00 C ATOM 391 O CYS A 29 -8.546 -5.779 -4.509 1.00 0.00 O ATOM 392 CB CYS A 29 -8.244 -4.286 -7.337 1.00 0.00 C ATOM 393 SG CYS A 29 -7.797 -3.068 -6.078 1.00 0.00 S ATOM 0 H CYS A 29 -10.376 -4.029 -5.903 1.00 0.00 H new ATOM 0 HA CYS A 29 -9.278 -6.147 -7.622 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -7.332 -4.701 -7.766 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -8.774 -3.781 -8.144 1.00 0.00 H new ATOM 0 HG CYS A 29 -8.722 -3.027 -5.166 1.00 0.00 H new ATOM 399 N ASP A 30 -7.626 -7.173 -6.016 1.00 0.00 N ATOM 400 CA ASP A 30 -6.889 -7.941 -5.019 1.00 0.00 C ATOM 401 C ASP A 30 -5.451 -7.445 -4.904 1.00 0.00 C ATOM 402 O ASP A 30 -4.783 -7.207 -5.912 1.00 0.00 O ATOM 403 CB ASP A 30 -6.902 -9.428 -5.378 1.00 0.00 C ATOM 404 CG ASP A 30 -8.288 -9.924 -5.738 1.00 0.00 C ATOM 405 OD1 ASP A 30 -9.202 -9.800 -4.895 1.00 0.00 O ATOM 406 OD2 ASP A 30 -8.461 -10.436 -6.864 1.00 0.00 O ATOM 0 H ASP A 30 -7.494 -7.492 -6.976 1.00 0.00 H new ATOM 0 HA ASP A 30 -7.379 -7.803 -4.055 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -6.228 -9.602 -6.216 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -6.520 -10.005 -4.536 1.00 0.00 H new ATOM 411 N LEU A 31 -4.980 -7.291 -3.672 1.00 0.00 N ATOM 412 CA LEU A 31 -3.621 -6.822 -3.425 1.00 0.00 C ATOM 413 C LEU A 31 -2.785 -7.905 -2.751 1.00 0.00 C ATOM 414 O LEU A 31 -2.922 -8.154 -1.554 1.00 0.00 O ATOM 415 CB LEU A 31 -3.645 -5.564 -2.554 1.00 0.00 C ATOM 416 CG LEU A 31 -2.303 -4.855 -2.363 1.00 0.00 C ATOM 417 CD1 LEU A 31 -1.834 -4.238 -3.671 1.00 0.00 C ATOM 418 CD2 LEU A 31 -2.411 -3.793 -1.279 1.00 0.00 C ATOM 0 H LEU A 31 -5.519 -7.484 -2.828 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.165 -6.583 -4.386 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -4.348 -4.856 -2.992 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.034 -5.833 -1.572 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.565 -5.593 -2.049 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.878 -3.738 -3.515 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.717 -5.020 -4.421 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.571 -3.513 -4.016 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.447 -3.299 -1.157 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -3.163 -3.057 -1.564 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.701 -4.261 -0.338 1.00 0.00 H new ATOM 430 N ASN A 32 -1.918 -8.546 -3.529 1.00 0.00 N ATOM 431 CA ASN A 32 -1.059 -9.602 -3.006 1.00 0.00 C ATOM 432 C ASN A 32 0.168 -9.013 -2.317 1.00 0.00 C ATOM 433 O ASN A 32 0.966 -8.310 -2.938 1.00 0.00 O ATOM 434 CB ASN A 32 -0.623 -10.538 -4.135 1.00 0.00 C ATOM 435 CG ASN A 32 0.054 -9.797 -5.272 1.00 0.00 C ATOM 436 OD1 ASN A 32 -0.187 -8.608 -5.483 1.00 0.00 O ATOM 437 ND2 ASN A 32 0.905 -10.499 -6.012 1.00 0.00 N ATOM 0 H ASN A 32 -1.792 -8.353 -4.523 1.00 0.00 H new ATOM 0 HA ASN A 32 -1.629 -10.170 -2.271 1.00 0.00 H new ATOM 0 HB2 ASN A 32 0.059 -11.289 -3.737 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.494 -11.070 -4.519 1.00 0.00 H new ATOM 0 HD21 ASN A 32 1.390 -10.055 -6.792 1.00 0.00 H new ATOM 0 HD22 ASN A 32 1.074 -11.482 -5.800 1.00 0.00 H new ATOM 444 N LEU A 33 0.313 -9.305 -1.029 1.00 0.00 N ATOM 445 CA LEU A 33 1.444 -8.805 -0.254 1.00 0.00 C ATOM 446 C LEU A 33 2.137 -9.941 0.491 1.00 0.00 C ATOM 447 O LEU A 33 1.495 -10.900 0.922 1.00 0.00 O ATOM 448 CB LEU A 33 0.975 -7.740 0.740 1.00 0.00 C ATOM 449 CG LEU A 33 0.360 -6.479 0.131 1.00 0.00 C ATOM 450 CD1 LEU A 33 -0.635 -5.852 1.095 1.00 0.00 C ATOM 451 CD2 LEU A 33 1.448 -5.481 -0.239 1.00 0.00 C ATOM 0 H LEU A 33 -0.338 -9.885 -0.499 1.00 0.00 H new ATOM 0 HA LEU A 33 2.159 -8.359 -0.946 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.241 -8.192 1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 33 1.826 -7.445 1.354 1.00 0.00 H new ATOM 0 HG LEU A 33 -0.173 -6.759 -0.778 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -1.063 -4.956 0.645 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.431 -6.565 1.311 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -0.126 -5.585 2.021 1.00 0.00 H new ATOM 0 HD21 LEU A 33 0.993 -4.590 -0.671 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.008 -5.206 0.655 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.123 -5.932 -0.966 1.00 0.00 H new ATOM 463 N LYS A 34 3.453 -9.827 0.642 1.00 0.00 N ATOM 464 CA LYS A 34 4.235 -10.842 1.338 1.00 0.00 C ATOM 465 C LYS A 34 4.354 -10.513 2.823 1.00 0.00 C ATOM 466 O LYS A 34 5.199 -9.713 3.225 1.00 0.00 O ATOM 467 CB LYS A 34 5.629 -10.955 0.716 1.00 0.00 C ATOM 468 CG LYS A 34 5.710 -11.967 -0.414 1.00 0.00 C ATOM 469 CD LYS A 34 5.146 -11.404 -1.708 1.00 0.00 C ATOM 470 CE LYS A 34 6.130 -10.458 -2.379 1.00 0.00 C ATOM 471 NZ LYS A 34 5.454 -9.546 -3.342 1.00 0.00 N ATOM 0 H LYS A 34 4.000 -9.041 0.291 1.00 0.00 H new ATOM 0 HA LYS A 34 3.719 -11.797 1.236 1.00 0.00 H new ATOM 0 HB2 LYS A 34 5.930 -9.977 0.339 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.343 -11.231 1.492 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.748 -12.261 -0.566 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.161 -12.867 -0.138 1.00 0.00 H new ATOM 0 HD2 LYS A 34 4.905 -12.222 -2.387 1.00 0.00 H new ATOM 0 HD3 LYS A 34 4.215 -10.876 -1.501 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.643 -9.868 -1.619 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.892 -11.037 -2.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 6.159 -8.917 -3.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 4.986 -10.107 -4.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 4.744 -8.975 -2.840 1.00 0.00 H new ATOM 485 N ILE A 35 3.504 -11.137 3.632 1.00 0.00 N ATOM 486 CA ILE A 35 3.517 -10.912 5.072 1.00 0.00 C ATOM 487 C ILE A 35 3.888 -12.186 5.824 1.00 0.00 C ATOM 488 O ILE A 35 3.380 -13.272 5.543 1.00 0.00 O ATOM 489 CB ILE A 35 2.150 -10.411 5.576 1.00 0.00 C ATOM 490 CG1 ILE A 35 1.840 -9.032 4.990 1.00 0.00 C ATOM 491 CG2 ILE A 35 2.131 -10.364 7.096 1.00 0.00 C ATOM 492 CD1 ILE A 35 0.360 -8.723 4.922 1.00 0.00 C ATOM 0 H ILE A 35 2.798 -11.802 3.315 1.00 0.00 H new ATOM 0 HA ILE A 35 4.269 -10.147 5.265 1.00 0.00 H new ATOM 0 HB ILE A 35 1.379 -11.107 5.244 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.335 -8.270 5.593 1.00 0.00 H new ATOM 0 HG13 ILE A 35 2.263 -8.969 3.987 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.159 -10.008 7.437 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.311 -11.363 7.493 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.909 -9.687 7.449 1.00 0.00 H new ATOM 0 HD11 ILE A 35 0.215 -7.730 4.497 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.138 -9.463 4.295 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.065 -8.753 5.925 1.00 0.00 H new ATOM 504 N PRO A 36 4.793 -12.051 6.804 1.00 0.00 N ATOM 505 CA PRO A 36 5.251 -13.181 7.619 1.00 0.00 C ATOM 506 C PRO A 36 4.166 -13.695 8.558 1.00 0.00 C ATOM 507 O PRO A 36 2.987 -13.387 8.387 1.00 0.00 O ATOM 508 CB PRO A 36 6.416 -12.592 8.419 1.00 0.00 C ATOM 509 CG PRO A 36 6.131 -11.131 8.483 1.00 0.00 C ATOM 510 CD PRO A 36 5.440 -10.787 7.193 1.00 0.00 C ATOM 0 HA PRO A 36 5.527 -14.040 7.007 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.472 -13.028 9.416 1.00 0.00 H new ATOM 0 HB3 PRO A 36 7.371 -12.788 7.931 1.00 0.00 H new ATOM 0 HG2 PRO A 36 5.500 -10.894 9.339 1.00 0.00 H new ATOM 0 HG3 PRO A 36 7.051 -10.558 8.597 1.00 0.00 H new ATOM 0 HD2 PRO A 36 4.711 -9.988 7.328 1.00 0.00 H new ATOM 0 HD3 PRO A 36 6.148 -10.448 6.436 1.00 0.00 H new ATOM 518 N GLU A 37 4.572 -14.481 9.551 1.00 0.00 N ATOM 519 CA GLU A 37 3.633 -15.038 10.517 1.00 0.00 C ATOM 520 C GLU A 37 2.694 -13.959 11.047 1.00 0.00 C ATOM 521 O GLU A 37 1.615 -14.257 11.562 1.00 0.00 O ATOM 522 CB GLU A 37 4.387 -15.689 11.678 1.00 0.00 C ATOM 523 CG GLU A 37 4.866 -17.099 11.378 1.00 0.00 C ATOM 524 CD GLU A 37 3.788 -18.142 11.602 1.00 0.00 C ATOM 525 OE1 GLU A 37 2.803 -18.149 10.835 1.00 0.00 O ATOM 526 OE2 GLU A 37 3.930 -18.949 12.544 1.00 0.00 O ATOM 0 H GLU A 37 5.545 -14.746 9.707 1.00 0.00 H new ATOM 0 HA GLU A 37 3.037 -15.797 10.010 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.246 -15.069 11.935 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.738 -15.713 12.553 1.00 0.00 H new ATOM 0 HG2 GLU A 37 5.207 -17.151 10.344 1.00 0.00 H new ATOM 0 HG3 GLU A 37 5.725 -17.329 12.008 1.00 0.00 H new ATOM 533 N ILE A 38 3.111 -12.704 10.918 1.00 0.00 N ATOM 534 CA ILE A 38 2.308 -11.580 11.384 1.00 0.00 C ATOM 535 C ILE A 38 0.820 -11.848 11.184 1.00 0.00 C ATOM 536 O ILE A 38 0.382 -12.184 10.085 1.00 0.00 O ATOM 537 CB ILE A 38 2.686 -10.277 10.654 1.00 0.00 C ATOM 538 CG1 ILE A 38 4.055 -9.782 11.126 1.00 0.00 C ATOM 539 CG2 ILE A 38 1.623 -9.214 10.885 1.00 0.00 C ATOM 540 CD1 ILE A 38 4.691 -8.781 10.187 1.00 0.00 C ATOM 0 H ILE A 38 4.001 -12.440 10.495 1.00 0.00 H new ATOM 0 HA ILE A 38 2.515 -11.464 12.448 1.00 0.00 H new ATOM 0 HB ILE A 38 2.743 -10.479 9.584 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.948 -9.328 12.111 1.00 0.00 H new ATOM 0 HG13 ILE A 38 4.722 -10.636 11.240 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.904 -8.299 10.363 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.665 -9.569 10.505 1.00 0.00 H new ATOM 0 HG23 ILE A 38 1.537 -9.011 11.953 1.00 0.00 H new ATOM 0 HD11 ILE A 38 5.658 -8.473 10.584 1.00 0.00 H new ATOM 0 HD12 ILE A 38 4.830 -9.238 9.207 1.00 0.00 H new ATOM 0 HD13 ILE A 38 4.044 -7.909 10.092 1.00 0.00 H new ATOM 552 N ASN A 39 0.048 -11.694 12.255 1.00 0.00 N ATOM 553 CA ASN A 39 -1.392 -11.918 12.198 1.00 0.00 C ATOM 554 C ASN A 39 -2.111 -10.695 11.636 1.00 0.00 C ATOM 555 O ASN A 39 -1.559 -9.595 11.611 1.00 0.00 O ATOM 556 CB ASN A 39 -1.934 -12.248 13.590 1.00 0.00 C ATOM 557 CG ASN A 39 -1.901 -13.735 13.886 1.00 0.00 C ATOM 558 OD1 ASN A 39 -1.148 -14.191 14.746 1.00 0.00 O ATOM 559 ND2 ASN A 39 -2.721 -14.498 13.173 1.00 0.00 N ATOM 0 H ASN A 39 0.395 -11.415 13.173 1.00 0.00 H new ATOM 0 HA ASN A 39 -1.577 -12.763 11.534 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -1.347 -11.718 14.340 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -2.959 -11.887 13.673 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -2.744 -15.506 13.328 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -3.328 -14.076 12.470 1.00 0.00 H new ATOM 566 N SER A 40 -3.345 -10.896 11.187 1.00 0.00 N ATOM 567 CA SER A 40 -4.139 -9.810 10.623 1.00 0.00 C ATOM 568 C SER A 40 -4.879 -9.051 11.720 1.00 0.00 C ATOM 569 O SER A 40 -5.096 -7.844 11.617 1.00 0.00 O ATOM 570 CB SER A 40 -5.139 -10.358 9.603 1.00 0.00 C ATOM 571 OG SER A 40 -6.243 -10.969 10.248 1.00 0.00 O ATOM 0 H SER A 40 -3.817 -11.800 11.202 1.00 0.00 H new ATOM 0 HA SER A 40 -3.461 -9.119 10.122 1.00 0.00 H new ATOM 0 HB2 SER A 40 -5.490 -9.549 8.963 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.644 -11.083 8.957 1.00 0.00 H new ATOM 0 HG SER A 40 -6.868 -11.309 9.574 1.00 0.00 H new ATOM 577 N SER A 41 -5.265 -9.769 12.770 1.00 0.00 N ATOM 578 CA SER A 41 -5.984 -9.165 13.886 1.00 0.00 C ATOM 579 C SER A 41 -5.146 -8.076 14.547 1.00 0.00 C ATOM 580 O SER A 41 -5.654 -7.278 15.335 1.00 0.00 O ATOM 581 CB SER A 41 -6.358 -10.232 14.916 1.00 0.00 C ATOM 582 OG SER A 41 -5.201 -10.824 15.481 1.00 0.00 O ATOM 0 H SER A 41 -5.092 -10.769 12.871 1.00 0.00 H new ATOM 0 HA SER A 41 -6.895 -8.711 13.496 1.00 0.00 H new ATOM 0 HB2 SER A 41 -6.963 -9.784 15.704 1.00 0.00 H new ATOM 0 HB3 SER A 41 -6.969 -11.000 14.443 1.00 0.00 H new ATOM 0 HG SER A 41 -5.467 -11.501 16.137 1.00 0.00 H new ATOM 588 N ASP A 42 -3.858 -8.049 14.221 1.00 0.00 N ATOM 589 CA ASP A 42 -2.948 -7.057 14.781 1.00 0.00 C ATOM 590 C ASP A 42 -2.545 -6.032 13.726 1.00 0.00 C ATOM 591 O ASP A 42 -2.014 -4.969 14.050 1.00 0.00 O ATOM 592 CB ASP A 42 -1.702 -7.740 15.348 1.00 0.00 C ATOM 593 CG ASP A 42 -1.945 -8.345 16.717 1.00 0.00 C ATOM 594 OD1 ASP A 42 -2.167 -7.575 17.675 1.00 0.00 O ATOM 595 OD2 ASP A 42 -1.915 -9.588 16.830 1.00 0.00 O ATOM 0 H ASP A 42 -3.421 -8.703 13.572 1.00 0.00 H new ATOM 0 HA ASP A 42 -3.467 -6.538 15.586 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -1.376 -8.521 14.662 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.891 -7.014 15.414 1.00 0.00 H new ATOM 600 N MET A 43 -2.800 -6.358 12.464 1.00 0.00 N ATOM 601 CA MET A 43 -2.464 -5.464 11.361 1.00 0.00 C ATOM 602 C MET A 43 -3.641 -4.557 11.019 1.00 0.00 C ATOM 603 O MET A 43 -4.724 -4.687 11.590 1.00 0.00 O ATOM 604 CB MET A 43 -2.053 -6.272 10.129 1.00 0.00 C ATOM 605 CG MET A 43 -0.573 -6.621 10.097 1.00 0.00 C ATOM 606 SD MET A 43 0.048 -6.861 8.421 1.00 0.00 S ATOM 607 CE MET A 43 -1.006 -8.196 7.858 1.00 0.00 C ATOM 0 H MET A 43 -3.238 -7.234 12.179 1.00 0.00 H new ATOM 0 HA MET A 43 -1.626 -4.840 11.674 1.00 0.00 H new ATOM 0 HB2 MET A 43 -2.636 -7.193 10.097 1.00 0.00 H new ATOM 0 HB3 MET A 43 -2.304 -5.705 9.232 1.00 0.00 H new ATOM 0 HG2 MET A 43 -0.006 -5.826 10.580 1.00 0.00 H new ATOM 0 HG3 MET A 43 -0.405 -7.529 10.676 1.00 0.00 H new ATOM 0 HE1 MET A 43 -1.379 -7.969 6.859 1.00 0.00 H new ATOM 0 HE2 MET A 43 -0.434 -9.124 7.830 1.00 0.00 H new ATOM 0 HE3 MET A 43 -1.847 -8.309 8.542 1.00 0.00 H new ATOM 617 N SER A 44 -3.422 -3.638 10.083 1.00 0.00 N ATOM 618 CA SER A 44 -4.464 -2.706 9.668 1.00 0.00 C ATOM 619 C SER A 44 -4.238 -2.243 8.232 1.00 0.00 C ATOM 620 O SER A 44 -3.103 -2.019 7.812 1.00 0.00 O ATOM 621 CB SER A 44 -4.501 -1.498 10.606 1.00 0.00 C ATOM 622 OG SER A 44 -3.330 -0.711 10.470 1.00 0.00 O ATOM 0 H SER A 44 -2.533 -3.519 9.598 1.00 0.00 H new ATOM 0 HA SER A 44 -5.422 -3.224 9.718 1.00 0.00 H new ATOM 0 HB2 SER A 44 -5.379 -0.890 10.387 1.00 0.00 H new ATOM 0 HB3 SER A 44 -4.597 -1.837 11.637 1.00 0.00 H new ATOM 0 HG SER A 44 -2.541 -1.292 10.489 1.00 0.00 H new ATOM 628 N ALA A 45 -5.327 -2.101 7.484 1.00 0.00 N ATOM 629 CA ALA A 45 -5.249 -1.663 6.096 1.00 0.00 C ATOM 630 C ALA A 45 -6.308 -0.608 5.793 1.00 0.00 C ATOM 631 O ALA A 45 -7.507 -0.866 5.910 1.00 0.00 O ATOM 632 CB ALA A 45 -5.401 -2.851 5.158 1.00 0.00 C ATOM 0 H ALA A 45 -6.274 -2.283 7.816 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.269 -1.213 5.938 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -5.341 -2.509 4.125 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -4.604 -3.570 5.349 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -6.367 -3.327 5.327 1.00 0.00 H new ATOM 638 N HIS A 46 -5.858 0.580 5.405 1.00 0.00 N ATOM 639 CA HIS A 46 -6.768 1.675 5.085 1.00 0.00 C ATOM 640 C HIS A 46 -6.241 2.494 3.910 1.00 0.00 C ATOM 641 O HIS A 46 -5.087 2.921 3.906 1.00 0.00 O ATOM 642 CB HIS A 46 -6.962 2.577 6.304 1.00 0.00 C ATOM 643 CG HIS A 46 -7.619 1.888 7.460 1.00 0.00 C ATOM 644 ND1 HIS A 46 -7.007 0.891 8.190 1.00 0.00 N ATOM 645 CD2 HIS A 46 -8.843 2.059 8.014 1.00 0.00 C ATOM 646 CE1 HIS A 46 -7.825 0.477 9.140 1.00 0.00 C ATOM 647 NE2 HIS A 46 -8.946 1.170 9.055 1.00 0.00 N ATOM 0 H HIS A 46 -4.869 0.810 5.304 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.729 1.245 4.803 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -5.991 2.958 6.622 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.564 3.439 6.016 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -9.597 2.763 7.696 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -7.613 -0.297 9.863 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -9.757 1.062 9.664 1.00 0.00 H new ATOM 655 N VAL A 47 -7.095 2.708 2.914 1.00 0.00 N ATOM 656 CA VAL A 47 -6.716 3.475 1.734 1.00 0.00 C ATOM 657 C VAL A 47 -6.955 4.966 1.948 1.00 0.00 C ATOM 658 O VAL A 47 -8.093 5.407 2.109 1.00 0.00 O ATOM 659 CB VAL A 47 -7.498 3.015 0.490 1.00 0.00 C ATOM 660 CG1 VAL A 47 -7.124 3.858 -0.719 1.00 0.00 C ATOM 661 CG2 VAL A 47 -7.247 1.539 0.219 1.00 0.00 C ATOM 0 H VAL A 47 -8.054 2.361 2.901 1.00 0.00 H new ATOM 0 HA VAL A 47 -5.653 3.299 1.571 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.562 3.150 0.681 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -7.687 3.518 -1.588 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -7.360 4.904 -0.521 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -6.057 3.758 -0.916 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -7.807 1.231 -0.664 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -6.183 1.376 0.048 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.571 0.951 1.078 1.00 0.00 H new ATOM 671 N THR A 48 -5.873 5.739 1.947 1.00 0.00 N ATOM 672 CA THR A 48 -5.964 7.180 2.142 1.00 0.00 C ATOM 673 C THR A 48 -6.113 7.907 0.810 1.00 0.00 C ATOM 674 O THR A 48 -5.284 7.756 -0.087 1.00 0.00 O ATOM 675 CB THR A 48 -4.725 7.727 2.875 1.00 0.00 C ATOM 676 OG1 THR A 48 -4.321 6.815 3.903 1.00 0.00 O ATOM 677 CG2 THR A 48 -5.015 9.091 3.485 1.00 0.00 C ATOM 0 H THR A 48 -4.924 5.391 1.813 1.00 0.00 H new ATOM 0 HA THR A 48 -6.848 7.361 2.753 1.00 0.00 H new ATOM 0 HB THR A 48 -3.919 7.835 2.149 1.00 0.00 H new ATOM 0 HG1 THR A 48 -3.532 7.169 4.363 1.00 0.00 H new ATOM 0 HG21 THR A 48 -4.125 9.457 3.997 1.00 0.00 H new ATOM 0 HG22 THR A 48 -5.293 9.790 2.697 1.00 0.00 H new ATOM 0 HG23 THR A 48 -5.834 9.004 4.198 1.00 0.00 H new ATOM 685 N SER A 49 -7.176 8.696 0.687 1.00 0.00 N ATOM 686 CA SER A 49 -7.436 9.443 -0.537 1.00 0.00 C ATOM 687 C SER A 49 -6.599 10.718 -0.583 1.00 0.00 C ATOM 688 O SER A 49 -6.209 11.273 0.445 1.00 0.00 O ATOM 689 CB SER A 49 -8.922 9.791 -0.642 1.00 0.00 C ATOM 690 OG SER A 49 -9.698 8.637 -0.910 1.00 0.00 O ATOM 0 H SER A 49 -7.871 8.834 1.421 1.00 0.00 H new ATOM 0 HA SER A 49 -7.157 8.815 -1.383 1.00 0.00 H new ATOM 0 HB2 SER A 49 -9.258 10.251 0.288 1.00 0.00 H new ATOM 0 HB3 SER A 49 -9.072 10.526 -1.433 1.00 0.00 H new ATOM 0 HG SER A 49 -9.105 7.886 -1.122 1.00 0.00 H new ATOM 696 N PRO A 50 -6.316 11.195 -1.804 1.00 0.00 N ATOM 697 CA PRO A 50 -5.523 12.410 -2.015 1.00 0.00 C ATOM 698 C PRO A 50 -6.268 13.670 -1.589 1.00 0.00 C ATOM 699 O PRO A 50 -5.725 14.773 -1.644 1.00 0.00 O ATOM 700 CB PRO A 50 -5.281 12.418 -3.527 1.00 0.00 C ATOM 701 CG PRO A 50 -6.415 11.637 -4.096 1.00 0.00 C ATOM 702 CD PRO A 50 -6.748 10.586 -3.073 1.00 0.00 C ATOM 0 HA PRO A 50 -4.608 12.407 -1.423 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -5.264 13.435 -3.920 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -4.322 11.963 -3.777 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -7.274 12.280 -4.289 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -6.137 11.182 -5.047 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -7.813 10.356 -3.066 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -6.221 9.652 -3.270 1.00 0.00 H new ATOM 710 N SER A 51 -7.516 13.499 -1.162 1.00 0.00 N ATOM 711 CA SER A 51 -8.337 14.623 -0.729 1.00 0.00 C ATOM 712 C SER A 51 -8.245 14.812 0.782 1.00 0.00 C ATOM 713 O SER A 51 -8.330 15.932 1.285 1.00 0.00 O ATOM 714 CB SER A 51 -9.794 14.406 -1.139 1.00 0.00 C ATOM 715 OG SER A 51 -10.479 13.612 -0.186 1.00 0.00 O ATOM 0 H SER A 51 -7.980 12.592 -1.107 1.00 0.00 H new ATOM 0 HA SER A 51 -7.961 15.524 -1.214 1.00 0.00 H new ATOM 0 HB2 SER A 51 -10.294 15.369 -1.241 1.00 0.00 H new ATOM 0 HB3 SER A 51 -9.832 13.922 -2.115 1.00 0.00 H new ATOM 0 HG SER A 51 -11.409 13.489 -0.470 1.00 0.00 H new ATOM 721 N GLY A 52 -8.070 13.708 1.502 1.00 0.00 N ATOM 722 CA GLY A 52 -7.970 13.772 2.948 1.00 0.00 C ATOM 723 C GLY A 52 -8.919 12.812 3.638 1.00 0.00 C ATOM 724 O GLY A 52 -9.230 12.978 4.818 1.00 0.00 O ATOM 0 H GLY A 52 -7.996 12.770 1.109 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.947 13.546 3.249 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -8.182 14.789 3.279 1.00 0.00 H new ATOM 728 N ARG A 53 -9.381 11.808 2.902 1.00 0.00 N ATOM 729 CA ARG A 53 -10.303 10.820 3.450 1.00 0.00 C ATOM 730 C ARG A 53 -9.593 9.491 3.694 1.00 0.00 C ATOM 731 O ARG A 53 -8.579 9.191 3.063 1.00 0.00 O ATOM 732 CB ARG A 53 -11.485 10.612 2.501 1.00 0.00 C ATOM 733 CG ARG A 53 -12.614 11.608 2.708 1.00 0.00 C ATOM 734 CD ARG A 53 -13.695 11.452 1.651 1.00 0.00 C ATOM 735 NE ARG A 53 -14.431 12.694 1.432 1.00 0.00 N ATOM 736 CZ ARG A 53 -15.415 12.820 0.549 1.00 0.00 C ATOM 737 NH1 ARG A 53 -15.780 11.784 -0.195 1.00 0.00 N ATOM 738 NH2 ARG A 53 -16.037 13.984 0.408 1.00 0.00 N ATOM 0 H ARG A 53 -9.132 11.656 1.924 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.674 11.195 4.404 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.132 10.685 1.472 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -11.874 9.602 2.634 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -13.048 11.467 3.698 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.216 12.622 2.676 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -13.241 11.130 0.714 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -14.389 10.668 1.955 1.00 0.00 H new ATOM 0 HE ARG A 53 -14.175 13.510 1.988 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -15.305 10.888 -0.090 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -16.536 11.884 -0.872 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -15.759 14.783 0.978 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -16.793 14.080 -0.271 1.00 0.00 H new ATOM 752 N VAL A 54 -10.133 8.698 4.614 1.00 0.00 N ATOM 753 CA VAL A 54 -9.552 7.401 4.942 1.00 0.00 C ATOM 754 C VAL A 54 -10.617 6.310 4.952 1.00 0.00 C ATOM 755 O VAL A 54 -11.648 6.438 5.612 1.00 0.00 O ATOM 756 CB VAL A 54 -8.850 7.431 6.312 1.00 0.00 C ATOM 757 CG1 VAL A 54 -8.306 6.054 6.663 1.00 0.00 C ATOM 758 CG2 VAL A 54 -7.738 8.470 6.318 1.00 0.00 C ATOM 0 H VAL A 54 -10.972 8.931 5.145 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.815 7.179 4.170 1.00 0.00 H new ATOM 0 HB VAL A 54 -9.582 7.711 7.070 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.813 6.094 7.634 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -9.127 5.338 6.702 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.588 5.742 5.905 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -7.253 8.478 7.294 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -7.005 8.223 5.550 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.159 9.455 6.114 1.00 0.00 H new ATOM 768 N THR A 55 -10.359 5.233 4.215 1.00 0.00 N ATOM 769 CA THR A 55 -11.295 4.118 4.139 1.00 0.00 C ATOM 770 C THR A 55 -10.744 2.888 4.851 1.00 0.00 C ATOM 771 O THR A 55 -9.582 2.863 5.255 1.00 0.00 O ATOM 772 CB THR A 55 -11.613 3.752 2.677 1.00 0.00 C ATOM 773 OG1 THR A 55 -10.398 3.530 1.952 1.00 0.00 O ATOM 774 CG2 THR A 55 -12.417 4.855 2.005 1.00 0.00 C ATOM 0 H THR A 55 -9.510 5.110 3.663 1.00 0.00 H new ATOM 0 HA THR A 55 -12.212 4.440 4.633 1.00 0.00 H new ATOM 0 HB THR A 55 -12.208 2.839 2.676 1.00 0.00 H new ATOM 0 HG1 THR A 55 -10.343 4.162 1.205 1.00 0.00 H new ATOM 0 HG21 THR A 55 -12.629 4.574 0.974 1.00 0.00 H new ATOM 0 HG22 THR A 55 -13.354 5.001 2.542 1.00 0.00 H new ATOM 0 HG23 THR A 55 -11.844 5.782 2.018 1.00 0.00 H new ATOM 782 N GLU A 56 -11.585 1.870 5.000 1.00 0.00 N ATOM 783 CA GLU A 56 -11.181 0.636 5.664 1.00 0.00 C ATOM 784 C GLU A 56 -11.210 -0.540 4.692 1.00 0.00 C ATOM 785 O GLU A 56 -12.116 -0.654 3.867 1.00 0.00 O ATOM 786 CB GLU A 56 -12.095 0.349 6.857 1.00 0.00 C ATOM 787 CG GLU A 56 -11.570 -0.738 7.779 1.00 0.00 C ATOM 788 CD GLU A 56 -12.031 -0.561 9.212 1.00 0.00 C ATOM 789 OE1 GLU A 56 -13.201 -0.885 9.503 1.00 0.00 O ATOM 790 OE2 GLU A 56 -11.222 -0.098 10.043 1.00 0.00 O ATOM 0 H GLU A 56 -12.550 1.875 4.670 1.00 0.00 H new ATOM 0 HA GLU A 56 -10.159 0.764 6.021 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -12.229 1.266 7.430 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -13.078 0.057 6.488 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -11.900 -1.710 7.413 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.480 -0.739 7.749 1.00 0.00 H new ATOM 797 N ALA A 57 -10.212 -1.411 4.797 1.00 0.00 N ATOM 798 CA ALA A 57 -10.124 -2.579 3.929 1.00 0.00 C ATOM 799 C ALA A 57 -10.117 -3.869 4.743 1.00 0.00 C ATOM 800 O ALA A 57 -9.768 -3.866 5.923 1.00 0.00 O ATOM 801 CB ALA A 57 -8.880 -2.496 3.058 1.00 0.00 C ATOM 0 H ALA A 57 -9.453 -1.330 5.474 1.00 0.00 H new ATOM 0 HA ALA A 57 -11.004 -2.591 3.286 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -8.827 -3.374 2.415 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -8.926 -1.598 2.442 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -7.994 -2.456 3.692 1.00 0.00 H new ATOM 807 N GLU A 58 -10.506 -4.968 4.105 1.00 0.00 N ATOM 808 CA GLU A 58 -10.546 -6.264 4.772 1.00 0.00 C ATOM 809 C GLU A 58 -9.363 -7.131 4.348 1.00 0.00 C ATOM 810 O GLU A 58 -8.933 -7.090 3.195 1.00 0.00 O ATOM 811 CB GLU A 58 -11.859 -6.984 4.458 1.00 0.00 C ATOM 812 CG GLU A 58 -12.113 -8.197 5.336 1.00 0.00 C ATOM 813 CD GLU A 58 -12.106 -7.859 6.815 1.00 0.00 C ATOM 814 OE1 GLU A 58 -13.170 -7.473 7.341 1.00 0.00 O ATOM 815 OE2 GLU A 58 -11.034 -7.980 7.445 1.00 0.00 O ATOM 0 H GLU A 58 -10.798 -4.987 3.128 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.482 -6.093 5.847 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.685 -6.282 4.574 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -11.851 -7.297 3.414 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -13.075 -8.637 5.072 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -11.352 -8.951 5.136 1.00 0.00 H new ATOM 822 N ILE A 59 -8.844 -7.913 5.288 1.00 0.00 N ATOM 823 CA ILE A 59 -7.712 -8.789 5.012 1.00 0.00 C ATOM 824 C ILE A 59 -8.147 -10.250 4.965 1.00 0.00 C ATOM 825 O ILE A 59 -8.249 -10.912 5.997 1.00 0.00 O ATOM 826 CB ILE A 59 -6.605 -8.629 6.071 1.00 0.00 C ATOM 827 CG1 ILE A 59 -6.060 -7.199 6.059 1.00 0.00 C ATOM 828 CG2 ILE A 59 -5.486 -9.630 5.823 1.00 0.00 C ATOM 829 CD1 ILE A 59 -5.298 -6.832 7.312 1.00 0.00 C ATOM 0 H ILE A 59 -9.189 -7.958 6.247 1.00 0.00 H new ATOM 0 HA ILE A 59 -7.317 -8.498 4.039 1.00 0.00 H new ATOM 0 HB ILE A 59 -7.032 -8.827 7.054 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -5.405 -7.076 5.196 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -6.890 -6.504 5.931 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -4.711 -9.504 6.579 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.885 -10.643 5.877 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -5.059 -9.461 4.835 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -4.941 -5.805 7.233 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.955 -6.923 8.177 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -4.448 -7.503 7.430 1.00 0.00 H new ATOM 841 N VAL A 60 -8.400 -10.747 3.758 1.00 0.00 N ATOM 842 CA VAL A 60 -8.821 -12.131 3.574 1.00 0.00 C ATOM 843 C VAL A 60 -7.727 -13.100 4.007 1.00 0.00 C ATOM 844 O VAL A 60 -6.549 -12.926 3.693 1.00 0.00 O ATOM 845 CB VAL A 60 -9.192 -12.414 2.107 1.00 0.00 C ATOM 846 CG1 VAL A 60 -9.575 -13.875 1.925 1.00 0.00 C ATOM 847 CG2 VAL A 60 -10.321 -11.499 1.657 1.00 0.00 C ATOM 0 H VAL A 60 -8.321 -10.212 2.893 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.702 -12.280 4.199 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.320 -12.211 1.485 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.834 -14.056 0.882 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -8.734 -14.509 2.205 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -10.432 -14.108 2.557 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -10.570 -11.713 0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -11.197 -11.668 2.283 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -10.005 -10.460 1.748 1.00 0.00 H new ATOM 857 N PRO A 61 -8.122 -14.148 4.745 1.00 0.00 N ATOM 858 CA PRO A 61 -7.190 -15.167 5.235 1.00 0.00 C ATOM 859 C PRO A 61 -6.642 -16.040 4.112 1.00 0.00 C ATOM 860 O PRO A 61 -7.283 -17.003 3.692 1.00 0.00 O ATOM 861 CB PRO A 61 -8.047 -16.001 6.191 1.00 0.00 C ATOM 862 CG PRO A 61 -9.444 -15.817 5.706 1.00 0.00 C ATOM 863 CD PRO A 61 -9.510 -14.419 5.156 1.00 0.00 C ATOM 0 HA PRO A 61 -6.312 -14.724 5.704 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -7.756 -17.051 6.170 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -7.937 -15.660 7.221 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -9.690 -16.551 4.938 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -10.160 -15.952 6.517 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -10.199 -14.351 4.314 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -9.853 -13.707 5.907 1.00 0.00 H new ATOM 871 N MET A 62 -5.451 -15.698 3.630 1.00 0.00 N ATOM 872 CA MET A 62 -4.816 -16.453 2.556 1.00 0.00 C ATOM 873 C MET A 62 -4.312 -17.800 3.063 1.00 0.00 C ATOM 874 O MET A 62 -4.850 -18.849 2.709 1.00 0.00 O ATOM 875 CB MET A 62 -3.657 -15.653 1.958 1.00 0.00 C ATOM 876 CG MET A 62 -4.104 -14.547 1.016 1.00 0.00 C ATOM 877 SD MET A 62 -4.560 -15.165 -0.615 1.00 0.00 S ATOM 878 CE MET A 62 -6.283 -14.680 -0.692 1.00 0.00 C ATOM 0 H MET A 62 -4.907 -14.903 3.966 1.00 0.00 H new ATOM 0 HA MET A 62 -5.562 -16.633 1.781 1.00 0.00 H new ATOM 0 HB2 MET A 62 -3.073 -15.215 2.767 1.00 0.00 H new ATOM 0 HB3 MET A 62 -2.997 -16.333 1.420 1.00 0.00 H new ATOM 0 HG2 MET A 62 -4.955 -14.025 1.453 1.00 0.00 H new ATOM 0 HG3 MET A 62 -3.301 -13.817 0.912 1.00 0.00 H new ATOM 0 HE1 MET A 62 -6.903 -15.562 -0.851 1.00 0.00 H new ATOM 0 HE2 MET A 62 -6.568 -14.201 0.244 1.00 0.00 H new ATOM 0 HE3 MET A 62 -6.428 -13.981 -1.516 1.00 0.00 H new ATOM 888 N GLY A 63 -3.275 -17.764 3.894 1.00 0.00 N ATOM 889 CA GLY A 63 -2.715 -18.989 4.435 1.00 0.00 C ATOM 890 C GLY A 63 -1.409 -18.755 5.169 1.00 0.00 C ATOM 891 O GLY A 63 -1.267 -17.777 5.903 1.00 0.00 O ATOM 0 H GLY A 63 -2.813 -16.909 4.202 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.434 -19.444 5.116 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -2.550 -19.699 3.624 1.00 0.00 H new ATOM 895 N LYS A 64 -0.453 -19.657 4.974 1.00 0.00 N ATOM 896 CA LYS A 64 0.848 -19.545 5.623 1.00 0.00 C ATOM 897 C LYS A 64 1.539 -18.242 5.235 1.00 0.00 C ATOM 898 O LYS A 64 1.764 -17.975 4.056 1.00 0.00 O ATOM 899 CB LYS A 64 1.732 -20.736 5.245 1.00 0.00 C ATOM 900 CG LYS A 64 2.745 -21.105 6.316 1.00 0.00 C ATOM 901 CD LYS A 64 3.898 -20.116 6.357 1.00 0.00 C ATOM 902 CE LYS A 64 4.772 -20.331 7.583 1.00 0.00 C ATOM 903 NZ LYS A 64 4.224 -19.640 8.783 1.00 0.00 N ATOM 0 H LYS A 64 -0.555 -20.474 4.372 1.00 0.00 H new ATOM 0 HA LYS A 64 0.690 -19.544 6.702 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.098 -21.599 5.044 1.00 0.00 H new ATOM 0 HB3 LYS A 64 2.261 -20.506 4.320 1.00 0.00 H new ATOM 0 HG2 LYS A 64 2.254 -21.133 7.289 1.00 0.00 H new ATOM 0 HG3 LYS A 64 3.130 -22.107 6.124 1.00 0.00 H new ATOM 0 HD2 LYS A 64 4.501 -20.221 5.455 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.506 -19.099 6.362 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.857 -21.399 7.786 1.00 0.00 H new ATOM 0 HE3 LYS A 64 5.778 -19.964 7.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 4.848 -19.811 9.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 4.167 -18.618 8.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 3.274 -20.008 8.992 1.00 0.00 H new ATOM 917 N ASN A 65 1.875 -17.435 6.237 1.00 0.00 N ATOM 918 CA ASN A 65 2.542 -16.160 6.000 1.00 0.00 C ATOM 919 C ASN A 65 2.036 -15.511 4.716 1.00 0.00 C ATOM 920 O ASN A 65 2.817 -14.980 3.926 1.00 0.00 O ATOM 921 CB ASN A 65 4.057 -16.360 5.921 1.00 0.00 C ATOM 922 CG ASN A 65 4.482 -17.055 4.642 1.00 0.00 C ATOM 923 OD1 ASN A 65 4.169 -18.225 4.424 1.00 0.00 O ATOM 924 ND2 ASN A 65 5.200 -16.334 3.788 1.00 0.00 N ATOM 0 H ASN A 65 1.696 -17.642 7.220 1.00 0.00 H new ATOM 0 HA ASN A 65 2.312 -15.498 6.835 1.00 0.00 H new ATOM 0 HB2 ASN A 65 4.553 -15.391 5.987 1.00 0.00 H new ATOM 0 HB3 ASN A 65 4.389 -16.947 6.778 1.00 0.00 H new ATOM 0 HD21 ASN A 65 5.515 -16.747 2.910 1.00 0.00 H new ATOM 0 HD22 ASN A 65 5.436 -15.367 4.010 1.00 0.00 H new ATOM 931 N SER A 66 0.723 -15.558 4.513 1.00 0.00 N ATOM 932 CA SER A 66 0.112 -14.978 3.323 1.00 0.00 C ATOM 933 C SER A 66 -1.137 -14.181 3.687 1.00 0.00 C ATOM 934 O SER A 66 -1.928 -14.597 4.534 1.00 0.00 O ATOM 935 CB SER A 66 -0.245 -16.077 2.320 1.00 0.00 C ATOM 936 OG SER A 66 0.867 -16.406 1.507 1.00 0.00 O ATOM 0 H SER A 66 0.062 -15.992 5.157 1.00 0.00 H new ATOM 0 HA SER A 66 0.834 -14.301 2.867 1.00 0.00 H new ATOM 0 HB2 SER A 66 -0.584 -16.965 2.854 1.00 0.00 H new ATOM 0 HB3 SER A 66 -1.073 -15.746 1.693 1.00 0.00 H new ATOM 0 HG SER A 66 1.469 -17.001 2.001 1.00 0.00 H new ATOM 942 N HIS A 67 -1.307 -13.032 3.041 1.00 0.00 N ATOM 943 CA HIS A 67 -2.460 -12.175 3.296 1.00 0.00 C ATOM 944 C HIS A 67 -2.865 -11.421 2.033 1.00 0.00 C ATOM 945 O HIS A 67 -2.014 -10.925 1.294 1.00 0.00 O ATOM 946 CB HIS A 67 -2.147 -11.184 4.418 1.00 0.00 C ATOM 947 CG HIS A 67 -2.141 -11.805 5.781 1.00 0.00 C ATOM 948 ND1 HIS A 67 -3.283 -11.976 6.535 1.00 0.00 N ATOM 949 CD2 HIS A 67 -1.123 -12.298 6.524 1.00 0.00 C ATOM 950 CE1 HIS A 67 -2.967 -12.546 7.684 1.00 0.00 C ATOM 951 NE2 HIS A 67 -1.663 -12.752 7.702 1.00 0.00 N ATOM 0 H HIS A 67 -0.662 -12.673 2.338 1.00 0.00 H new ATOM 0 HA HIS A 67 -3.292 -12.808 3.603 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -1.174 -10.730 4.230 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -2.883 -10.380 4.397 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -0.081 -12.329 6.243 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -3.658 -12.800 8.474 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -1.141 -13.179 8.467 1.00 0.00 H new ATOM 959 N CYS A 68 -4.169 -11.338 1.792 1.00 0.00 N ATOM 960 CA CYS A 68 -4.687 -10.645 0.618 1.00 0.00 C ATOM 961 C CYS A 68 -5.697 -9.575 1.020 1.00 0.00 C ATOM 962 O CYS A 68 -6.615 -9.833 1.797 1.00 0.00 O ATOM 963 CB CYS A 68 -5.338 -11.643 -0.342 1.00 0.00 C ATOM 964 SG CYS A 68 -5.350 -11.105 -2.068 1.00 0.00 S ATOM 0 H CYS A 68 -4.887 -11.742 2.394 1.00 0.00 H new ATOM 0 HA CYS A 68 -3.851 -10.159 0.115 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -4.811 -12.595 -0.273 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -6.364 -11.823 -0.021 1.00 0.00 H new ATOM 0 HG CYS A 68 -5.918 -12.015 -2.802 1.00 0.00 H new ATOM 970 N VAL A 69 -5.519 -8.371 0.485 1.00 0.00 N ATOM 971 CA VAL A 69 -6.413 -7.260 0.788 1.00 0.00 C ATOM 972 C VAL A 69 -7.238 -6.870 -0.434 1.00 0.00 C ATOM 973 O VAL A 69 -6.691 -6.580 -1.498 1.00 0.00 O ATOM 974 CB VAL A 69 -5.632 -6.028 1.281 1.00 0.00 C ATOM 975 CG1 VAL A 69 -6.491 -4.777 1.185 1.00 0.00 C ATOM 976 CG2 VAL A 69 -5.143 -6.242 2.705 1.00 0.00 C ATOM 0 H VAL A 69 -4.764 -8.140 -0.160 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.080 -7.598 1.581 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.761 -5.891 0.640 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -5.922 -3.917 1.538 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.786 -4.617 0.148 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.382 -4.900 1.800 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.593 -5.361 3.037 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -5.997 -6.406 3.362 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -4.488 -7.113 2.738 1.00 0.00 H new ATOM 986 N ARG A 70 -8.557 -6.864 -0.273 1.00 0.00 N ATOM 987 CA ARG A 70 -9.458 -6.510 -1.363 1.00 0.00 C ATOM 988 C ARG A 70 -10.238 -5.241 -1.033 1.00 0.00 C ATOM 989 O ARG A 70 -10.871 -5.144 0.018 1.00 0.00 O ATOM 990 CB ARG A 70 -10.429 -7.659 -1.644 1.00 0.00 C ATOM 991 CG ARG A 70 -11.119 -8.192 -0.399 1.00 0.00 C ATOM 992 CD ARG A 70 -12.226 -9.172 -0.753 1.00 0.00 C ATOM 993 NE ARG A 70 -11.699 -10.478 -1.142 1.00 0.00 N ATOM 994 CZ ARG A 70 -12.413 -11.597 -1.111 1.00 0.00 C ATOM 995 NH1 ARG A 70 -13.677 -11.571 -0.711 1.00 0.00 N ATOM 996 NH2 ARG A 70 -11.862 -12.747 -1.480 1.00 0.00 N ATOM 0 H ARG A 70 -9.025 -7.100 0.602 1.00 0.00 H new ATOM 0 HA ARG A 70 -8.856 -6.325 -2.253 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -11.186 -7.319 -2.351 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -9.886 -8.473 -2.125 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -10.387 -8.684 0.242 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -11.535 -7.362 0.172 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -12.892 -9.290 0.102 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -12.823 -8.765 -1.569 1.00 0.00 H new ATOM 0 HE ARG A 70 -10.730 -10.533 -1.454 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -14.104 -10.689 -0.426 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -14.223 -12.433 -0.688 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -10.890 -12.771 -1.787 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -12.411 -13.606 -1.456 1.00 0.00 H new ATOM 1010 N PHE A 71 -10.187 -4.269 -1.939 1.00 0.00 N ATOM 1011 CA PHE A 71 -10.887 -3.005 -1.744 1.00 0.00 C ATOM 1012 C PHE A 71 -11.074 -2.277 -3.072 1.00 0.00 C ATOM 1013 O PHE A 71 -10.474 -2.641 -4.083 1.00 0.00 O ATOM 1014 CB PHE A 71 -10.115 -2.116 -0.767 1.00 0.00 C ATOM 1015 CG PHE A 71 -8.702 -1.840 -1.195 1.00 0.00 C ATOM 1016 CD1 PHE A 71 -8.442 -1.081 -2.325 1.00 0.00 C ATOM 1017 CD2 PHE A 71 -7.633 -2.338 -0.468 1.00 0.00 C ATOM 1018 CE1 PHE A 71 -7.143 -0.826 -2.722 1.00 0.00 C ATOM 1019 CE2 PHE A 71 -6.332 -2.086 -0.859 1.00 0.00 C ATOM 1020 CZ PHE A 71 -6.087 -1.328 -1.988 1.00 0.00 C ATOM 0 H PHE A 71 -9.668 -4.333 -2.815 1.00 0.00 H new ATOM 0 HA PHE A 71 -11.870 -3.223 -1.327 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -10.643 -1.169 -0.655 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -10.103 -2.593 0.213 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -9.264 -0.684 -2.902 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -7.819 -2.931 0.416 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -6.954 -0.235 -3.606 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -5.508 -2.481 -0.283 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.071 -1.129 -2.296 1.00 0.00 H new ATOM 1030 N VAL A 72 -11.913 -1.246 -3.061 1.00 0.00 N ATOM 1031 CA VAL A 72 -12.181 -0.465 -4.263 1.00 0.00 C ATOM 1032 C VAL A 72 -11.436 0.865 -4.232 1.00 0.00 C ATOM 1033 O VAL A 72 -11.898 1.850 -3.656 1.00 0.00 O ATOM 1034 CB VAL A 72 -13.687 -0.194 -4.432 1.00 0.00 C ATOM 1035 CG1 VAL A 72 -13.948 0.600 -5.703 1.00 0.00 C ATOM 1036 CG2 VAL A 72 -14.466 -1.500 -4.441 1.00 0.00 C ATOM 0 H VAL A 72 -12.419 -0.932 -2.233 1.00 0.00 H new ATOM 0 HA VAL A 72 -11.829 -1.055 -5.109 1.00 0.00 H new ATOM 0 HB VAL A 72 -14.028 0.400 -3.584 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -15.018 0.782 -5.805 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -13.421 1.553 -5.651 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -13.592 0.035 -6.565 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -15.529 -1.289 -4.561 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -14.124 -2.122 -5.268 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -14.305 -2.026 -3.500 1.00 0.00 H new ATOM 1046 N PRO A 73 -10.255 0.896 -4.867 1.00 0.00 N ATOM 1047 CA PRO A 73 -9.421 2.100 -4.927 1.00 0.00 C ATOM 1048 C PRO A 73 -10.033 3.186 -5.806 1.00 0.00 C ATOM 1049 O PRO A 73 -9.678 3.322 -6.976 1.00 0.00 O ATOM 1050 CB PRO A 73 -8.111 1.594 -5.537 1.00 0.00 C ATOM 1051 CG PRO A 73 -8.499 0.389 -6.321 1.00 0.00 C ATOM 1052 CD PRO A 73 -9.643 -0.241 -5.575 1.00 0.00 C ATOM 0 HA PRO A 73 -9.301 2.562 -3.947 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -7.653 2.350 -6.174 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -7.384 1.346 -4.764 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.797 0.662 -7.334 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.663 -0.304 -6.410 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -10.350 -0.720 -6.253 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -9.297 -1.007 -4.881 1.00 0.00 H new ATOM 1060 N GLN A 74 -10.953 3.956 -5.233 1.00 0.00 N ATOM 1061 CA GLN A 74 -11.614 5.029 -5.966 1.00 0.00 C ATOM 1062 C GLN A 74 -11.238 6.391 -5.393 1.00 0.00 C ATOM 1063 O GLN A 74 -11.597 6.720 -4.263 1.00 0.00 O ATOM 1064 CB GLN A 74 -13.132 4.846 -5.922 1.00 0.00 C ATOM 1065 CG GLN A 74 -13.881 5.735 -6.902 1.00 0.00 C ATOM 1066 CD GLN A 74 -15.356 5.396 -6.987 1.00 0.00 C ATOM 1067 OE1 GLN A 74 -16.206 6.149 -6.509 1.00 0.00 O ATOM 1068 NE2 GLN A 74 -15.669 4.260 -7.597 1.00 0.00 N ATOM 0 H GLN A 74 -11.257 3.857 -4.264 1.00 0.00 H new ATOM 0 HA GLN A 74 -11.280 4.986 -7.003 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -13.370 3.804 -6.135 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -13.486 5.054 -4.912 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -13.768 6.777 -6.601 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -13.432 5.638 -7.891 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -14.933 3.666 -7.979 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -16.646 3.980 -7.684 1.00 0.00 H new ATOM 1077 N GLU A 75 -10.512 7.179 -6.180 1.00 0.00 N ATOM 1078 CA GLU A 75 -10.086 8.506 -5.749 1.00 0.00 C ATOM 1079 C GLU A 75 -10.102 9.488 -6.916 1.00 0.00 C ATOM 1080 O GLU A 75 -10.464 9.131 -8.037 1.00 0.00 O ATOM 1081 CB GLU A 75 -8.684 8.443 -5.139 1.00 0.00 C ATOM 1082 CG GLU A 75 -8.682 8.184 -3.642 1.00 0.00 C ATOM 1083 CD GLU A 75 -9.140 6.781 -3.292 1.00 0.00 C ATOM 1084 OE1 GLU A 75 -8.740 5.833 -4.000 1.00 0.00 O ATOM 1085 OE2 GLU A 75 -9.897 6.632 -2.311 1.00 0.00 O ATOM 0 H GLU A 75 -10.207 6.922 -7.119 1.00 0.00 H new ATOM 0 HA GLU A 75 -10.788 8.857 -4.992 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.116 7.657 -5.636 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -8.168 9.383 -5.337 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.677 8.342 -3.251 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -9.333 8.908 -3.151 1.00 0.00 H new ATOM 1092 N MET A 76 -9.707 10.728 -6.644 1.00 0.00 N ATOM 1093 CA MET A 76 -9.674 11.762 -7.671 1.00 0.00 C ATOM 1094 C MET A 76 -8.239 12.080 -8.078 1.00 0.00 C ATOM 1095 O MET A 76 -8.001 12.907 -8.957 1.00 0.00 O ATOM 1096 CB MET A 76 -10.368 13.030 -7.171 1.00 0.00 C ATOM 1097 CG MET A 76 -10.283 13.215 -5.664 1.00 0.00 C ATOM 1098 SD MET A 76 -11.012 14.769 -5.113 1.00 0.00 S ATOM 1099 CE MET A 76 -9.780 15.941 -5.676 1.00 0.00 C ATOM 0 H MET A 76 -9.405 11.040 -5.721 1.00 0.00 H new ATOM 0 HA MET A 76 -10.205 11.387 -8.546 1.00 0.00 H new ATOM 0 HB2 MET A 76 -9.922 13.896 -7.661 1.00 0.00 H new ATOM 0 HB3 MET A 76 -11.417 13.001 -7.467 1.00 0.00 H new ATOM 0 HG2 MET A 76 -10.790 12.385 -5.171 1.00 0.00 H new ATOM 0 HG3 MET A 76 -9.238 13.179 -5.356 1.00 0.00 H new ATOM 0 HE1 MET A 76 -9.964 16.912 -5.216 1.00 0.00 H new ATOM 0 HE2 MET A 76 -8.788 15.589 -5.395 1.00 0.00 H new ATOM 0 HE3 MET A 76 -9.837 16.037 -6.760 1.00 0.00 H new ATOM 1109 N GLY A 77 -7.285 11.418 -7.430 1.00 0.00 N ATOM 1110 CA GLY A 77 -5.885 11.645 -7.738 1.00 0.00 C ATOM 1111 C GLY A 77 -5.035 10.409 -7.521 1.00 0.00 C ATOM 1112 O GLY A 77 -5.235 9.387 -8.177 1.00 0.00 O ATOM 0 H GLY A 77 -7.457 10.729 -6.698 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.792 11.968 -8.775 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -5.506 12.456 -7.116 1.00 0.00 H new ATOM 1116 N VAL A 78 -4.083 10.502 -6.598 1.00 0.00 N ATOM 1117 CA VAL A 78 -3.199 9.382 -6.296 1.00 0.00 C ATOM 1118 C VAL A 78 -3.726 8.567 -5.121 1.00 0.00 C ATOM 1119 O VAL A 78 -4.263 9.119 -4.160 1.00 0.00 O ATOM 1120 CB VAL A 78 -1.772 9.865 -5.974 1.00 0.00 C ATOM 1121 CG1 VAL A 78 -1.799 10.912 -4.871 1.00 0.00 C ATOM 1122 CG2 VAL A 78 -0.889 8.690 -5.583 1.00 0.00 C ATOM 0 H VAL A 78 -3.904 11.341 -6.046 1.00 0.00 H new ATOM 0 HA VAL A 78 -3.169 8.753 -7.186 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.352 10.325 -6.868 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.782 11.241 -4.657 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.396 11.765 -5.193 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.238 10.481 -3.971 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.116 9.049 -5.359 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.304 8.200 -4.702 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -0.845 7.978 -6.407 1.00 0.00 H new ATOM 1132 N HIS A 79 -3.569 7.250 -5.203 1.00 0.00 N ATOM 1133 CA HIS A 79 -4.029 6.358 -4.145 1.00 0.00 C ATOM 1134 C HIS A 79 -2.865 5.919 -3.261 1.00 0.00 C ATOM 1135 O HIS A 79 -1.824 5.486 -3.756 1.00 0.00 O ATOM 1136 CB HIS A 79 -4.718 5.132 -4.745 1.00 0.00 C ATOM 1137 CG HIS A 79 -5.838 5.473 -5.679 1.00 0.00 C ATOM 1138 ND1 HIS A 79 -5.751 6.471 -6.627 1.00 0.00 N ATOM 1139 CD2 HIS A 79 -7.076 4.942 -5.809 1.00 0.00 C ATOM 1140 CE1 HIS A 79 -6.887 6.539 -7.298 1.00 0.00 C ATOM 1141 NE2 HIS A 79 -7.708 5.621 -6.821 1.00 0.00 N ATOM 0 H HIS A 79 -3.127 6.777 -5.991 1.00 0.00 H new ATOM 0 HA HIS A 79 -4.745 6.903 -3.530 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -3.979 4.535 -5.279 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -5.105 4.511 -3.937 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -7.490 4.134 -5.225 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -7.107 7.228 -8.100 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -8.657 5.445 -7.151 1.00 0.00 H new ATOM 1149 N THR A 80 -3.048 6.034 -1.949 1.00 0.00 N ATOM 1150 CA THR A 80 -2.014 5.652 -0.996 1.00 0.00 C ATOM 1151 C THR A 80 -2.551 4.661 0.031 1.00 0.00 C ATOM 1152 O THR A 80 -3.505 4.955 0.752 1.00 0.00 O ATOM 1153 CB THR A 80 -1.446 6.880 -0.260 1.00 0.00 C ATOM 1154 OG1 THR A 80 -0.980 7.847 -1.208 1.00 0.00 O ATOM 1155 CG2 THR A 80 -0.306 6.478 0.664 1.00 0.00 C ATOM 0 H THR A 80 -3.904 6.389 -1.522 1.00 0.00 H new ATOM 0 HA THR A 80 -1.216 5.180 -1.569 1.00 0.00 H new ATOM 0 HB THR A 80 -2.243 7.316 0.342 1.00 0.00 H new ATOM 0 HG1 THR A 80 -0.622 8.625 -0.732 1.00 0.00 H new ATOM 0 HG21 THR A 80 0.079 7.362 1.173 1.00 0.00 H new ATOM 0 HG22 THR A 80 -0.671 5.764 1.403 1.00 0.00 H new ATOM 0 HG23 THR A 80 0.492 6.020 0.080 1.00 0.00 H new ATOM 1163 N VAL A 81 -1.933 3.486 0.093 1.00 0.00 N ATOM 1164 CA VAL A 81 -2.348 2.453 1.033 1.00 0.00 C ATOM 1165 C VAL A 81 -1.605 2.584 2.358 1.00 0.00 C ATOM 1166 O VAL A 81 -0.374 2.575 2.395 1.00 0.00 O ATOM 1167 CB VAL A 81 -2.109 1.043 0.461 1.00 0.00 C ATOM 1168 CG1 VAL A 81 -2.552 -0.020 1.454 1.00 0.00 C ATOM 1169 CG2 VAL A 81 -2.832 0.878 -0.868 1.00 0.00 C ATOM 0 H VAL A 81 -1.143 3.226 -0.497 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.416 2.592 1.203 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.040 0.918 0.286 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.375 -1.009 1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.984 0.086 2.378 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -3.615 0.100 1.665 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -2.652 -0.124 -1.258 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -3.902 1.024 -0.721 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.460 1.616 -1.579 1.00 0.00 H new ATOM 1179 N SER A 82 -2.360 2.706 3.445 1.00 0.00 N ATOM 1180 CA SER A 82 -1.773 2.843 4.772 1.00 0.00 C ATOM 1181 C SER A 82 -1.760 1.503 5.501 1.00 0.00 C ATOM 1182 O SER A 82 -2.733 1.129 6.156 1.00 0.00 O ATOM 1183 CB SER A 82 -2.550 3.875 5.593 1.00 0.00 C ATOM 1184 OG SER A 82 -1.707 4.516 6.535 1.00 0.00 O ATOM 0 H SER A 82 -3.380 2.713 3.432 1.00 0.00 H new ATOM 0 HA SER A 82 -0.744 3.183 4.654 1.00 0.00 H new ATOM 0 HB2 SER A 82 -2.988 4.619 4.927 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.374 3.386 6.112 1.00 0.00 H new ATOM 0 HG SER A 82 -2.226 5.172 7.046 1.00 0.00 H new ATOM 1190 N VAL A 83 -0.649 0.782 5.382 1.00 0.00 N ATOM 1191 CA VAL A 83 -0.507 -0.516 6.030 1.00 0.00 C ATOM 1192 C VAL A 83 0.420 -0.430 7.237 1.00 0.00 C ATOM 1193 O VAL A 83 1.639 -0.329 7.093 1.00 0.00 O ATOM 1194 CB VAL A 83 0.039 -1.574 5.052 1.00 0.00 C ATOM 1195 CG1 VAL A 83 0.278 -2.893 5.771 1.00 0.00 C ATOM 1196 CG2 VAL A 83 -0.915 -1.760 3.882 1.00 0.00 C ATOM 0 H VAL A 83 0.166 1.075 4.843 1.00 0.00 H new ATOM 0 HA VAL A 83 -1.502 -0.815 6.361 1.00 0.00 H new ATOM 0 HB VAL A 83 0.994 -1.223 4.660 1.00 0.00 H new ATOM 0 HG11 VAL A 83 0.663 -3.628 5.064 1.00 0.00 H new ATOM 0 HG12 VAL A 83 1.002 -2.745 6.572 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.660 -3.253 6.193 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.514 -2.511 3.201 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.886 -2.088 4.253 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -1.030 -0.814 3.352 1.00 0.00 H new ATOM 1206 N LYS A 84 -0.165 -0.469 8.429 1.00 0.00 N ATOM 1207 CA LYS A 84 0.607 -0.397 9.664 1.00 0.00 C ATOM 1208 C LYS A 84 0.409 -1.655 10.504 1.00 0.00 C ATOM 1209 O LYS A 84 -0.663 -2.261 10.488 1.00 0.00 O ATOM 1210 CB LYS A 84 0.202 0.838 10.472 1.00 0.00 C ATOM 1211 CG LYS A 84 0.386 2.144 9.719 1.00 0.00 C ATOM 1212 CD LYS A 84 0.003 3.340 10.575 1.00 0.00 C ATOM 1213 CE LYS A 84 -1.488 3.628 10.493 1.00 0.00 C ATOM 1214 NZ LYS A 84 -1.971 4.390 11.678 1.00 0.00 N ATOM 0 H LYS A 84 -1.172 -0.550 8.566 1.00 0.00 H new ATOM 0 HA LYS A 84 1.662 -0.321 9.400 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.843 0.742 10.767 1.00 0.00 H new ATOM 0 HB3 LYS A 84 0.790 0.871 11.389 1.00 0.00 H new ATOM 0 HG2 LYS A 84 1.425 2.239 9.403 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.223 2.133 8.815 1.00 0.00 H new ATOM 0 HD2 LYS A 84 0.282 3.151 11.612 1.00 0.00 H new ATOM 0 HD3 LYS A 84 0.563 4.217 10.249 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -1.699 4.194 9.586 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -2.036 2.689 10.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.992 4.567 11.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.793 3.839 12.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -1.467 5.298 11.736 1.00 0.00 H new ATOM 1228 N TYR A 85 1.447 -2.041 11.238 1.00 0.00 N ATOM 1229 CA TYR A 85 1.386 -3.227 12.084 1.00 0.00 C ATOM 1230 C TYR A 85 1.589 -2.860 13.551 1.00 0.00 C ATOM 1231 O TYR A 85 2.707 -2.576 13.982 1.00 0.00 O ATOM 1232 CB TYR A 85 2.442 -4.243 11.649 1.00 0.00 C ATOM 1233 CG TYR A 85 2.736 -5.296 12.694 1.00 0.00 C ATOM 1234 CD1 TYR A 85 1.710 -5.878 13.429 1.00 0.00 C ATOM 1235 CD2 TYR A 85 4.038 -5.709 12.946 1.00 0.00 C ATOM 1236 CE1 TYR A 85 1.973 -6.840 14.385 1.00 0.00 C ATOM 1237 CE2 TYR A 85 4.310 -6.672 13.899 1.00 0.00 C ATOM 1238 CZ TYR A 85 3.274 -7.234 14.616 1.00 0.00 C ATOM 1239 OH TYR A 85 3.541 -8.191 15.567 1.00 0.00 O ATOM 0 H TYR A 85 2.341 -1.550 11.264 1.00 0.00 H new ATOM 0 HA TYR A 85 0.397 -3.672 11.974 1.00 0.00 H new ATOM 0 HB2 TYR A 85 2.107 -4.734 10.735 1.00 0.00 H new ATOM 0 HB3 TYR A 85 3.365 -3.715 11.408 1.00 0.00 H new ATOM 0 HD1 TYR A 85 0.690 -5.573 13.250 1.00 0.00 H new ATOM 0 HD2 TYR A 85 4.852 -5.270 12.388 1.00 0.00 H new ATOM 0 HE1 TYR A 85 1.164 -7.281 14.948 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.328 -6.983 14.082 1.00 0.00 H new ATOM 0 HH TYR A 85 4.507 -8.355 15.604 1.00 0.00 H new ATOM 1249 N ARG A 86 0.501 -2.870 14.313 1.00 0.00 N ATOM 1250 CA ARG A 86 0.558 -2.539 15.731 1.00 0.00 C ATOM 1251 C ARG A 86 1.133 -1.141 15.940 1.00 0.00 C ATOM 1252 O ARG A 86 1.721 -0.850 16.981 1.00 0.00 O ATOM 1253 CB ARG A 86 1.405 -3.568 16.483 1.00 0.00 C ATOM 1254 CG ARG A 86 0.604 -4.748 17.009 1.00 0.00 C ATOM 1255 CD ARG A 86 1.510 -5.817 17.601 1.00 0.00 C ATOM 1256 NE ARG A 86 0.815 -6.637 18.589 1.00 0.00 N ATOM 1257 CZ ARG A 86 0.476 -6.203 19.797 1.00 0.00 C ATOM 1258 NH1 ARG A 86 0.765 -4.962 20.165 1.00 0.00 N ATOM 1259 NH2 ARG A 86 -0.155 -7.010 20.641 1.00 0.00 N ATOM 0 H ARG A 86 -0.431 -3.104 13.972 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.458 -2.558 16.124 1.00 0.00 H new ATOM 0 HB2 ARG A 86 2.187 -3.937 15.819 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.902 -3.076 17.319 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.098 -4.403 17.768 1.00 0.00 H new ATOM 0 HG3 ARG A 86 0.013 -5.178 16.200 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.888 -6.455 16.802 1.00 0.00 H new ATOM 0 HD3 ARG A 86 2.374 -5.343 18.067 1.00 0.00 H new ATOM 0 HE ARG A 86 0.577 -7.596 18.337 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.249 -4.338 19.519 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.503 -4.631 21.094 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.380 -7.965 20.362 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.415 -6.675 21.569 1.00 0.00 H new ATOM 1273 N GLY A 87 0.959 -0.280 14.943 1.00 0.00 N ATOM 1274 CA GLY A 87 1.466 1.077 15.036 1.00 0.00 C ATOM 1275 C GLY A 87 2.869 1.211 14.478 1.00 0.00 C ATOM 1276 O GLY A 87 3.738 1.816 15.105 1.00 0.00 O ATOM 0 H GLY A 87 0.476 -0.498 14.072 1.00 0.00 H new ATOM 0 HA2 GLY A 87 0.798 1.749 14.497 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.462 1.393 16.079 1.00 0.00 H new ATOM 1280 N GLN A 88 3.090 0.644 13.296 1.00 0.00 N ATOM 1281 CA GLN A 88 4.398 0.702 12.655 1.00 0.00 C ATOM 1282 C GLN A 88 4.284 0.429 11.158 1.00 0.00 C ATOM 1283 O GLN A 88 3.975 -0.688 10.742 1.00 0.00 O ATOM 1284 CB GLN A 88 5.350 -0.309 13.298 1.00 0.00 C ATOM 1285 CG GLN A 88 5.756 0.055 14.717 1.00 0.00 C ATOM 1286 CD GLN A 88 6.861 -0.832 15.253 1.00 0.00 C ATOM 1287 OE1 GLN A 88 7.851 -1.094 14.568 1.00 0.00 O ATOM 1288 NE2 GLN A 88 6.700 -1.300 16.485 1.00 0.00 N ATOM 0 H GLN A 88 2.381 0.140 12.764 1.00 0.00 H new ATOM 0 HA GLN A 88 4.798 1.707 12.793 1.00 0.00 H new ATOM 0 HB2 GLN A 88 4.874 -1.290 13.305 1.00 0.00 H new ATOM 0 HB3 GLN A 88 6.246 -0.394 12.683 1.00 0.00 H new ATOM 0 HG2 GLN A 88 6.085 1.094 14.742 1.00 0.00 H new ATOM 0 HG3 GLN A 88 4.886 -0.019 15.370 1.00 0.00 H new ATOM 0 HE21 GLN A 88 5.864 -1.058 17.017 1.00 0.00 H new ATOM 0 HE22 GLN A 88 7.412 -1.902 16.899 1.00 0.00 H new ATOM 1297 N HIS A 89 4.534 1.457 10.354 1.00 0.00 N ATOM 1298 CA HIS A 89 4.459 1.328 8.903 1.00 0.00 C ATOM 1299 C HIS A 89 5.489 0.325 8.392 1.00 0.00 C ATOM 1300 O HIS A 89 6.694 0.534 8.528 1.00 0.00 O ATOM 1301 CB HIS A 89 4.679 2.687 8.237 1.00 0.00 C ATOM 1302 CG HIS A 89 3.442 3.529 8.170 1.00 0.00 C ATOM 1303 ND1 HIS A 89 2.374 3.233 7.349 1.00 0.00 N ATOM 1304 CD2 HIS A 89 3.106 4.662 8.829 1.00 0.00 C ATOM 1305 CE1 HIS A 89 1.435 4.149 7.505 1.00 0.00 C ATOM 1306 NE2 HIS A 89 1.854 5.028 8.398 1.00 0.00 N ATOM 0 H HIS A 89 4.790 2.388 10.682 1.00 0.00 H new ATOM 0 HA HIS A 89 3.465 0.963 8.647 1.00 0.00 H new ATOM 0 HB2 HIS A 89 5.449 3.230 8.785 1.00 0.00 H new ATOM 0 HB3 HIS A 89 5.057 2.530 7.227 1.00 0.00 H new ATOM 0 HD2 HIS A 89 3.710 5.182 9.558 1.00 0.00 H new ATOM 0 HE1 HIS A 89 0.486 4.175 6.990 1.00 0.00 H new ATOM 0 HE2 HIS A 89 1.333 5.845 8.716 1.00 0.00 H new ATOM 1314 N VAL A 90 5.006 -0.765 7.806 1.00 0.00 N ATOM 1315 CA VAL A 90 5.884 -1.801 7.275 1.00 0.00 C ATOM 1316 C VAL A 90 6.808 -1.240 6.199 1.00 0.00 C ATOM 1317 O VAL A 90 6.724 -0.064 5.844 1.00 0.00 O ATOM 1318 CB VAL A 90 5.078 -2.972 6.683 1.00 0.00 C ATOM 1319 CG1 VAL A 90 4.198 -3.607 7.749 1.00 0.00 C ATOM 1320 CG2 VAL A 90 4.243 -2.501 5.502 1.00 0.00 C ATOM 0 H VAL A 90 4.011 -0.954 7.687 1.00 0.00 H new ATOM 0 HA VAL A 90 6.482 -2.167 8.110 1.00 0.00 H new ATOM 0 HB VAL A 90 5.777 -3.728 6.325 1.00 0.00 H new ATOM 0 HG11 VAL A 90 3.636 -4.433 7.312 1.00 0.00 H new ATOM 0 HG12 VAL A 90 4.822 -3.982 8.560 1.00 0.00 H new ATOM 0 HG13 VAL A 90 3.504 -2.862 8.139 1.00 0.00 H new ATOM 0 HG21 VAL A 90 3.680 -3.342 5.096 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.551 -1.726 5.832 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.899 -2.097 4.731 1.00 0.00 H new ATOM 1330 N THR A 91 7.691 -2.089 5.683 1.00 0.00 N ATOM 1331 CA THR A 91 8.632 -1.679 4.649 1.00 0.00 C ATOM 1332 C THR A 91 7.902 -1.230 3.388 1.00 0.00 C ATOM 1333 O THR A 91 7.110 -1.980 2.818 1.00 0.00 O ATOM 1334 CB THR A 91 9.603 -2.819 4.288 1.00 0.00 C ATOM 1335 OG1 THR A 91 9.992 -3.523 5.472 1.00 0.00 O ATOM 1336 CG2 THR A 91 10.838 -2.276 3.585 1.00 0.00 C ATOM 0 H THR A 91 7.774 -3.066 5.965 1.00 0.00 H new ATOM 0 HA THR A 91 9.201 -0.842 5.054 1.00 0.00 H new ATOM 0 HB THR A 91 9.091 -3.503 3.611 1.00 0.00 H new ATOM 0 HG1 THR A 91 10.608 -4.247 5.234 1.00 0.00 H new ATOM 0 HG21 THR A 91 11.509 -3.099 3.340 1.00 0.00 H new ATOM 0 HG22 THR A 91 10.540 -1.766 2.669 1.00 0.00 H new ATOM 0 HG23 THR A 91 11.351 -1.573 4.242 1.00 0.00 H new ATOM 1344 N GLY A 92 8.173 -0.002 2.957 1.00 0.00 N ATOM 1345 CA GLY A 92 7.533 0.525 1.766 1.00 0.00 C ATOM 1346 C GLY A 92 6.094 0.932 2.012 1.00 0.00 C ATOM 1347 O GLY A 92 5.243 0.789 1.135 1.00 0.00 O ATOM 0 H GLY A 92 8.825 0.638 3.412 1.00 0.00 H new ATOM 0 HA2 GLY A 92 8.095 1.387 1.407 1.00 0.00 H new ATOM 0 HA3 GLY A 92 7.565 -0.227 0.977 1.00 0.00 H new ATOM 1351 N SER A 93 5.821 1.439 3.210 1.00 0.00 N ATOM 1352 CA SER A 93 4.473 1.862 3.571 1.00 0.00 C ATOM 1353 C SER A 93 4.464 3.322 4.016 1.00 0.00 C ATOM 1354 O SER A 93 5.386 3.803 4.674 1.00 0.00 O ATOM 1355 CB SER A 93 3.918 0.974 4.687 1.00 0.00 C ATOM 1356 OG SER A 93 2.510 0.854 4.590 1.00 0.00 O ATOM 0 H SER A 93 6.515 1.567 3.947 1.00 0.00 H new ATOM 0 HA SER A 93 3.839 1.764 2.690 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.375 -0.014 4.631 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.184 1.394 5.657 1.00 0.00 H new ATOM 0 HG SER A 93 2.158 0.456 5.413 1.00 0.00 H new ATOM 1362 N PRO A 94 3.395 4.045 3.648 1.00 0.00 N ATOM 1363 CA PRO A 94 2.291 3.483 2.864 1.00 0.00 C ATOM 1364 C PRO A 94 2.699 3.173 1.428 1.00 0.00 C ATOM 1365 O PRO A 94 3.707 3.681 0.935 1.00 0.00 O ATOM 1366 CB PRO A 94 1.236 4.591 2.893 1.00 0.00 C ATOM 1367 CG PRO A 94 2.009 5.845 3.108 1.00 0.00 C ATOM 1368 CD PRO A 94 3.183 5.466 3.968 1.00 0.00 C ATOM 0 HA PRO A 94 1.943 2.534 3.272 1.00 0.00 H new ATOM 0 HB2 PRO A 94 0.674 4.627 1.959 1.00 0.00 H new ATOM 0 HB3 PRO A 94 0.514 4.429 3.693 1.00 0.00 H new ATOM 0 HG2 PRO A 94 2.340 6.267 2.159 1.00 0.00 H new ATOM 0 HG3 PRO A 94 1.396 6.602 3.596 1.00 0.00 H new ATOM 0 HD2 PRO A 94 4.063 6.066 3.735 1.00 0.00 H new ATOM 0 HD3 PRO A 94 2.969 5.612 5.027 1.00 0.00 H new ATOM 1376 N PHE A 95 1.910 2.337 0.761 1.00 0.00 N ATOM 1377 CA PHE A 95 2.190 1.960 -0.620 1.00 0.00 C ATOM 1378 C PHE A 95 1.443 2.867 -1.594 1.00 0.00 C ATOM 1379 O PHE A 95 0.213 2.866 -1.640 1.00 0.00 O ATOM 1380 CB PHE A 95 1.797 0.501 -0.861 1.00 0.00 C ATOM 1381 CG PHE A 95 2.514 -0.469 0.034 1.00 0.00 C ATOM 1382 CD1 PHE A 95 3.815 -0.857 -0.243 1.00 0.00 C ATOM 1383 CD2 PHE A 95 1.886 -0.992 1.153 1.00 0.00 C ATOM 1384 CE1 PHE A 95 4.477 -1.749 0.580 1.00 0.00 C ATOM 1385 CE2 PHE A 95 2.544 -1.884 1.980 1.00 0.00 C ATOM 1386 CZ PHE A 95 3.840 -2.264 1.692 1.00 0.00 C ATOM 0 H PHE A 95 1.072 1.908 1.154 1.00 0.00 H new ATOM 0 HA PHE A 95 3.260 2.075 -0.792 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.722 0.393 -0.713 1.00 0.00 H new ATOM 0 HB3 PHE A 95 2.003 0.245 -1.900 1.00 0.00 H new ATOM 0 HD1 PHE A 95 4.318 -0.458 -1.112 1.00 0.00 H new ATOM 0 HD2 PHE A 95 0.872 -0.700 1.382 1.00 0.00 H new ATOM 0 HE1 PHE A 95 5.491 -2.043 0.354 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.045 -2.283 2.850 1.00 0.00 H new ATOM 0 HZ PHE A 95 4.355 -2.963 2.335 1.00 0.00 H new ATOM 1396 N GLN A 96 2.197 3.640 -2.369 1.00 0.00 N ATOM 1397 CA GLN A 96 1.607 4.553 -3.341 1.00 0.00 C ATOM 1398 C GLN A 96 1.577 3.924 -4.731 1.00 0.00 C ATOM 1399 O GLN A 96 2.550 3.306 -5.164 1.00 0.00 O ATOM 1400 CB GLN A 96 2.389 5.866 -3.379 1.00 0.00 C ATOM 1401 CG GLN A 96 2.080 6.792 -2.213 1.00 0.00 C ATOM 1402 CD GLN A 96 3.123 7.879 -2.039 1.00 0.00 C ATOM 1403 OE1 GLN A 96 4.107 7.701 -1.321 1.00 0.00 O ATOM 1404 NE2 GLN A 96 2.912 9.013 -2.697 1.00 0.00 N ATOM 0 H GLN A 96 3.217 3.652 -2.343 1.00 0.00 H new ATOM 0 HA GLN A 96 0.582 4.758 -3.033 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.456 5.644 -3.383 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.168 6.384 -4.312 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.104 7.252 -2.368 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.015 6.206 -1.296 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.082 9.117 -3.281 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.580 9.780 -2.618 1.00 0.00 H new ATOM 1413 N PHE A 97 0.456 4.086 -5.424 1.00 0.00 N ATOM 1414 CA PHE A 97 0.299 3.534 -6.765 1.00 0.00 C ATOM 1415 C PHE A 97 -0.740 4.319 -7.559 1.00 0.00 C ATOM 1416 O PHE A 97 -1.667 4.897 -6.991 1.00 0.00 O ATOM 1417 CB PHE A 97 -0.108 2.061 -6.688 1.00 0.00 C ATOM 1418 CG PHE A 97 -1.510 1.852 -6.192 1.00 0.00 C ATOM 1419 CD1 PHE A 97 -1.780 1.816 -4.833 1.00 0.00 C ATOM 1420 CD2 PHE A 97 -2.558 1.691 -7.084 1.00 0.00 C ATOM 1421 CE1 PHE A 97 -3.070 1.623 -4.374 1.00 0.00 C ATOM 1422 CE2 PHE A 97 -3.850 1.498 -6.631 1.00 0.00 C ATOM 1423 CZ PHE A 97 -4.106 1.465 -5.274 1.00 0.00 C ATOM 0 H PHE A 97 -0.358 4.595 -5.080 1.00 0.00 H new ATOM 0 HA PHE A 97 1.258 3.613 -7.278 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -0.010 1.613 -7.677 1.00 0.00 H new ATOM 0 HB3 PHE A 97 0.584 1.535 -6.030 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -0.974 1.940 -4.125 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -2.363 1.717 -8.146 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -3.267 1.596 -3.313 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -4.658 1.373 -7.337 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.114 1.316 -4.917 1.00 0.00 H new ATOM 1433 N THR A 98 -0.578 4.337 -8.879 1.00 0.00 N ATOM 1434 CA THR A 98 -1.499 5.053 -9.752 1.00 0.00 C ATOM 1435 C THR A 98 -2.547 4.112 -10.335 1.00 0.00 C ATOM 1436 O THR A 98 -2.236 2.987 -10.727 1.00 0.00 O ATOM 1437 CB THR A 98 -0.753 5.750 -10.906 1.00 0.00 C ATOM 1438 OG1 THR A 98 0.215 6.665 -10.381 1.00 0.00 O ATOM 1439 CG2 THR A 98 -1.726 6.494 -11.808 1.00 0.00 C ATOM 0 H THR A 98 0.183 3.864 -9.366 1.00 0.00 H new ATOM 0 HA THR A 98 -1.992 5.808 -9.140 1.00 0.00 H new ATOM 0 HB THR A 98 -0.247 4.986 -11.497 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.686 7.103 -11.120 1.00 0.00 H new ATOM 0 HG21 THR A 98 -1.176 6.978 -12.615 1.00 0.00 H new ATOM 0 HG22 THR A 98 -2.443 5.789 -12.229 1.00 0.00 H new ATOM 0 HG23 THR A 98 -2.257 7.248 -11.227 1.00 0.00 H new ATOM 1447 N VAL A 99 -3.790 4.579 -10.390 1.00 0.00 N ATOM 1448 CA VAL A 99 -4.885 3.779 -10.927 1.00 0.00 C ATOM 1449 C VAL A 99 -5.263 4.238 -12.331 1.00 0.00 C ATOM 1450 O VAL A 99 -4.926 5.346 -12.745 1.00 0.00 O ATOM 1451 CB VAL A 99 -6.129 3.851 -10.022 1.00 0.00 C ATOM 1452 CG1 VAL A 99 -7.133 2.775 -10.408 1.00 0.00 C ATOM 1453 CG2 VAL A 99 -5.732 3.722 -8.560 1.00 0.00 C ATOM 0 H VAL A 99 -4.064 5.508 -10.069 1.00 0.00 H new ATOM 0 HA VAL A 99 -4.534 2.748 -10.967 1.00 0.00 H new ATOM 0 HB VAL A 99 -6.603 4.823 -10.161 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -8.005 2.841 -9.758 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -7.441 2.919 -11.444 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -6.673 1.793 -10.299 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -6.623 3.775 -7.935 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -5.234 2.766 -8.401 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.054 4.533 -8.294 1.00 0.00 H new ATOM 1463 N GLY A 100 -5.967 3.377 -13.059 1.00 0.00 N ATOM 1464 CA GLY A 100 -6.381 3.712 -14.409 1.00 0.00 C ATOM 1465 C GLY A 100 -7.845 3.410 -14.659 1.00 0.00 C ATOM 1466 O GLY A 100 -8.452 2.575 -13.989 1.00 0.00 O ATOM 0 H GLY A 100 -6.258 2.454 -12.738 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -6.196 4.771 -14.590 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -5.772 3.155 -15.121 1.00 0.00 H new ATOM 1470 N PRO A 101 -8.437 4.103 -15.643 1.00 0.00 N ATOM 1471 CA PRO A 101 -9.847 3.923 -16.001 1.00 0.00 C ATOM 1472 C PRO A 101 -10.110 2.574 -16.660 1.00 0.00 C ATOM 1473 O PRO A 101 -9.178 1.871 -17.053 1.00 0.00 O ATOM 1474 CB PRO A 101 -10.110 5.062 -16.990 1.00 0.00 C ATOM 1475 CG PRO A 101 -8.775 5.370 -17.576 1.00 0.00 C ATOM 1476 CD PRO A 101 -7.774 5.115 -16.483 1.00 0.00 C ATOM 0 HA PRO A 101 -10.496 3.942 -15.125 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -10.821 4.762 -17.760 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -10.533 5.932 -16.488 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -8.575 4.741 -18.443 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -8.727 6.405 -17.915 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -6.828 4.749 -16.882 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -7.553 6.022 -15.921 1.00 0.00 H new ATOM 1484 N LEU A 102 -11.384 2.217 -16.778 1.00 0.00 N ATOM 1485 CA LEU A 102 -11.771 0.950 -17.390 1.00 0.00 C ATOM 1486 C LEU A 102 -12.612 1.184 -18.641 1.00 0.00 C ATOM 1487 O LEU A 102 -13.467 2.068 -18.670 1.00 0.00 O ATOM 1488 CB LEU A 102 -12.550 0.094 -16.390 1.00 0.00 C ATOM 1489 CG LEU A 102 -13.844 0.704 -15.850 1.00 0.00 C ATOM 1490 CD1 LEU A 102 -14.761 -0.382 -15.310 1.00 0.00 C ATOM 1491 CD2 LEU A 102 -13.538 1.731 -14.770 1.00 0.00 C ATOM 0 H LEU A 102 -12.167 2.787 -16.458 1.00 0.00 H new ATOM 0 HA LEU A 102 -10.862 0.422 -17.679 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -12.791 -0.857 -16.866 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -11.897 -0.128 -15.546 1.00 0.00 H new ATOM 0 HG LEU A 102 -14.356 1.209 -16.670 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -15.677 0.071 -14.930 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -15.007 -1.081 -16.109 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -14.258 -0.915 -14.503 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -14.470 2.155 -14.397 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -13.005 1.249 -13.950 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -12.920 2.525 -15.188 1.00 0.00 H new ATOM 1503 N GLY A 103 -12.365 0.383 -19.673 1.00 0.00 N ATOM 1504 CA GLY A 103 -13.109 0.518 -20.911 1.00 0.00 C ATOM 1505 C GLY A 103 -12.818 -0.604 -21.888 1.00 0.00 C ATOM 1506 O GLY A 103 -12.901 -1.780 -21.534 1.00 0.00 O ATOM 0 H GLY A 103 -11.663 -0.357 -19.673 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -14.176 0.535 -20.690 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -12.864 1.473 -21.376 1.00 0.00 H new ATOM 1510 N GLU A 104 -12.478 -0.241 -23.121 1.00 0.00 N ATOM 1511 CA GLU A 104 -12.177 -1.228 -24.151 1.00 0.00 C ATOM 1512 C GLU A 104 -10.882 -0.876 -24.879 1.00 0.00 C ATOM 1513 O GLU A 104 -10.273 0.160 -24.618 1.00 0.00 O ATOM 1514 CB GLU A 104 -13.329 -1.320 -25.153 1.00 0.00 C ATOM 1515 CG GLU A 104 -13.573 -0.031 -25.920 1.00 0.00 C ATOM 1516 CD GLU A 104 -14.282 -0.262 -27.241 1.00 0.00 C ATOM 1517 OE1 GLU A 104 -15.453 -0.694 -27.218 1.00 0.00 O ATOM 1518 OE2 GLU A 104 -13.664 -0.012 -28.297 1.00 0.00 O ATOM 0 H GLU A 104 -12.404 0.728 -23.430 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.050 -2.195 -23.665 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -13.119 -2.121 -25.862 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -14.240 -1.595 -24.622 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -14.168 0.645 -25.306 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -12.619 0.463 -26.106 1.00 0.00 H new ATOM 1525 N GLY A 105 -10.468 -1.749 -25.793 1.00 0.00 N ATOM 1526 CA GLY A 105 -9.249 -1.514 -26.544 1.00 0.00 C ATOM 1527 C GLY A 105 -8.198 -2.577 -26.291 1.00 0.00 C ATOM 1528 O GLY A 105 -8.065 -3.524 -27.065 1.00 0.00 O ATOM 0 H GLY A 105 -10.955 -2.614 -26.026 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -9.482 -1.484 -27.608 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -8.845 -0.537 -26.278 1.00 0.00 H new ATOM 1532 N GLY A 106 -7.449 -2.420 -25.204 1.00 0.00 N ATOM 1533 CA GLY A 106 -6.413 -3.381 -24.872 1.00 0.00 C ATOM 1534 C GLY A 106 -5.363 -3.500 -25.958 1.00 0.00 C ATOM 1535 O GLY A 106 -4.727 -2.513 -26.327 1.00 0.00 O ATOM 0 H GLY A 106 -7.541 -1.645 -24.547 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -5.934 -3.086 -23.938 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -6.868 -4.357 -24.702 1.00 0.00 H new TER 1539 GLY A 106