USER MOD reduce.3.24.130724 H: found=0, std=0, add=1296, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1286 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 74 MET CE :methyl 166:sc= -0.0685 (180deg=0) USER MOD Set 1.2: B 74 MET CE :methyl 160:sc= -0.109 (180deg=0) USER MOD Set 2.1: B 25 HIS : no HE2:sc= -1.82! C(o=-1.9!,f=-4.3!) USER MOD Set 2.2: B 26 LYS NZ :NH3+ -156:sc= -0.0767 (180deg=-0.679) USER MOD Set 3.1: A 25 HIS : no HE2:sc= -1.89! C(o=-2!,f=-4.3!) USER MOD Set 3.2: A 26 LYS NZ :NH3+ -158:sc= -0.102 (180deg=-0.685) USER MOD Single : A 1 SER N :NH3+ -113:sc= 0.117 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -162:sc=-0.000617 (180deg=-0.317) USER MOD Single : A 7 MET CE :methyl -170:sc= 0 (180deg=-0.0511) USER MOD Single : A 15 HIS : no HD1:sc= -0.417 X(o=-0.42,f=-0.0081) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot -71:sc= 1.15 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -150:sc= -0.204 (180deg=-0.911) USER MOD Single : A 29 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.094) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 157:sc= -0.905 (180deg=-1.61) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0.16) USER MOD Single : A 38 ASN : amide:sc= -4.77! K(o=-4.8!,f=-0.26) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -1.96! C(o=-2!,f=-2!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -0.987! K(o=-0.99!,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 161:sc= -0.0186 (180deg=-0.545) USER MOD Single : A 59 THR OG1 : rot 78:sc= 0.861 USER MOD Single : A 68 CYS SG : rot -160:sc= -0.442 USER MOD Single : A 71 GLN : amide:sc= -0.0133 X(o=-0.013,f=0) USER MOD Single : A 78 SER OG : rot -69:sc= -0.106 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot -106:sc= -0.0853 USER MOD Single : A 82 THR OG1 : rot -4:sc= -0.822 USER MOD Single : B 1 SER N :NH3+ -119:sc= 0.0972 (180deg=0) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.349) USER MOD Single : B 7 MET CE :methyl -169:sc= 0 (180deg=-0.0277) USER MOD Single : B 15 HIS : no HD1:sc= -0.372 X(o=-0.37,f=0) USER MOD Single : B 16 GLN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 18 SER OG : rot -70:sc= 1.17 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ -148:sc= -0.132 (180deg=-0.892) USER MOD Single : B 29 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.117) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 156:sc= -0.909 (180deg=-1.59) USER MOD Single : B 37 ASN : amide:sc= 0 X(o=0,f=0.14) USER MOD Single : B 38 ASN : amide:sc= -4.75! K(o=-4.7!,f=-0.28) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= -2.04! C(o=-2!,f=-2!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 GLN : amide:sc= -0.964! K(o=-0.96!,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 162:sc= -0.019 (180deg=-0.516) USER MOD Single : B 59 THR OG1 : rot 83:sc= 0.862 USER MOD Single : B 68 CYS SG : rot -150:sc= -0.421 USER MOD Single : B 71 GLN : amide:sc= -0.0136 X(o=-0.014,f=0) USER MOD Single : B 78 SER OG : rot -69:sc= -0.0709 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot -109:sc= 0.115 USER MOD Single : B 82 THR OG1 : rot 8:sc= -0.969 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 1 -10.874 4.886 12.370 1.00 0.00 N ATOM 21 CA SER A 1 -11.021 3.400 12.474 1.00 0.00 C ATOM 22 C SER A 1 -9.665 2.776 12.815 1.00 0.00 C ATOM 23 O SER A 1 -8.643 3.431 12.770 1.00 0.00 O ATOM 24 CB SER A 1 -11.523 2.838 11.141 1.00 0.00 C ATOM 25 OG SER A 1 -10.411 2.562 10.299 1.00 0.00 O ATOM 0 H1 SER A 1 -11.397 5.342 13.145 1.00 0.00 H new ATOM 0 H2 SER A 1 -9.868 5.141 12.435 1.00 0.00 H new ATOM 0 H3 SER A 1 -11.255 5.209 11.458 1.00 0.00 H new ATOM 0 HA SER A 1 -11.739 3.161 13.259 1.00 0.00 H new ATOM 0 HB2 SER A 1 -12.100 1.929 11.311 1.00 0.00 H new ATOM 0 HB3 SER A 1 -12.190 3.553 10.660 1.00 0.00 H new ATOM 0 HG SER A 1 -10.729 2.201 9.445 1.00 0.00 H new ATOM 31 N GLU A 2 -9.649 1.517 13.167 1.00 0.00 N ATOM 32 CA GLU A 2 -8.357 0.862 13.522 1.00 0.00 C ATOM 33 C GLU A 2 -7.383 0.969 12.348 1.00 0.00 C ATOM 34 O GLU A 2 -6.197 1.160 12.531 1.00 0.00 O ATOM 35 CB GLU A 2 -8.606 -0.613 13.843 1.00 0.00 C ATOM 36 CG GLU A 2 -7.347 -1.224 14.464 1.00 0.00 C ATOM 37 CD GLU A 2 -7.164 -0.687 15.885 1.00 0.00 C ATOM 38 OE1 GLU A 2 -8.103 -0.105 16.403 1.00 0.00 O ATOM 39 OE2 GLU A 2 -6.088 -0.868 16.431 1.00 0.00 O ATOM 0 H GLU A 2 -10.472 0.917 13.224 1.00 0.00 H new ATOM 0 HA GLU A 2 -7.928 1.359 14.392 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -9.446 -0.709 14.531 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -8.874 -1.153 12.935 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -7.429 -2.311 14.483 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -6.475 -0.981 13.857 1.00 0.00 H new ATOM 46 N LEU A 3 -7.870 0.848 11.144 1.00 0.00 N ATOM 47 CA LEU A 3 -6.963 0.943 9.966 1.00 0.00 C ATOM 48 C LEU A 3 -6.310 2.322 9.949 1.00 0.00 C ATOM 49 O LEU A 3 -5.141 2.464 9.650 1.00 0.00 O ATOM 50 CB LEU A 3 -7.772 0.736 8.675 1.00 0.00 C ATOM 51 CG LEU A 3 -6.829 0.662 7.439 1.00 0.00 C ATOM 52 CD1 LEU A 3 -7.357 -0.375 6.437 1.00 0.00 C ATOM 53 CD2 LEU A 3 -6.752 2.031 6.740 1.00 0.00 C ATOM 0 H LEU A 3 -8.853 0.688 10.925 1.00 0.00 H new ATOM 0 HA LEU A 3 -6.193 0.175 10.031 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.355 -0.182 8.749 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -8.481 1.555 8.549 1.00 0.00 H new ATOM 0 HG LEU A 3 -5.836 0.373 7.784 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -6.691 -0.420 5.575 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -7.399 -1.354 6.915 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -8.356 -0.088 6.109 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -6.089 1.962 5.878 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -7.748 2.327 6.409 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -6.365 2.774 7.437 1.00 0.00 H new ATOM 65 N GLU A 4 -7.056 3.343 10.270 1.00 0.00 N ATOM 66 CA GLU A 4 -6.479 4.713 10.275 1.00 0.00 C ATOM 67 C GLU A 4 -5.266 4.745 11.206 1.00 0.00 C ATOM 68 O GLU A 4 -4.206 5.221 10.855 1.00 0.00 O ATOM 69 CB GLU A 4 -7.533 5.699 10.773 1.00 0.00 C ATOM 70 CG GLU A 4 -6.999 7.125 10.656 1.00 0.00 C ATOM 71 CD GLU A 4 -8.098 8.105 11.063 1.00 0.00 C ATOM 72 OE1 GLU A 4 -9.253 7.711 11.032 1.00 0.00 O ATOM 73 OE2 GLU A 4 -7.768 9.231 11.396 1.00 0.00 O ATOM 0 H GLU A 4 -8.041 3.286 10.529 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.170 4.989 9.267 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.448 5.594 10.190 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.789 5.480 11.810 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -6.125 7.253 11.295 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -6.678 7.324 9.634 1.00 0.00 H new ATOM 80 N LYS A 5 -5.424 4.223 12.391 1.00 0.00 N ATOM 81 CA LYS A 5 -4.298 4.196 13.367 1.00 0.00 C ATOM 82 C LYS A 5 -3.040 3.672 12.675 1.00 0.00 C ATOM 83 O LYS A 5 -1.947 4.166 12.872 1.00 0.00 O ATOM 84 CB LYS A 5 -4.654 3.240 14.512 1.00 0.00 C ATOM 85 CG LYS A 5 -6.000 3.635 15.138 1.00 0.00 C ATOM 86 CD LYS A 5 -5.862 4.962 15.900 1.00 0.00 C ATOM 87 CE LYS A 5 -7.040 5.124 16.865 1.00 0.00 C ATOM 88 NZ LYS A 5 -8.320 4.986 16.115 1.00 0.00 N ATOM 0 H LYS A 5 -6.294 3.810 12.728 1.00 0.00 H new ATOM 0 HA LYS A 5 -4.123 5.202 13.750 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.705 2.217 14.138 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -3.872 3.263 15.271 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -6.757 3.731 14.360 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -6.338 2.851 15.816 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.922 4.981 16.451 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.836 5.795 15.198 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -6.985 4.372 17.652 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -6.994 6.099 17.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -9.097 5.388 16.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -8.249 5.494 15.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -8.509 3.980 15.933 1.00 0.00 H new ATOM 102 N ALA A 6 -3.202 2.655 11.875 1.00 0.00 N ATOM 103 CA ALA A 6 -2.048 2.046 11.159 1.00 0.00 C ATOM 104 C ALA A 6 -1.658 2.880 9.931 1.00 0.00 C ATOM 105 O ALA A 6 -0.501 2.939 9.571 1.00 0.00 O ATOM 106 CB ALA A 6 -2.436 0.623 10.730 1.00 0.00 C ATOM 0 H ALA A 6 -4.101 2.213 11.685 1.00 0.00 H new ATOM 0 HA ALA A 6 -1.186 2.017 11.825 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.601 0.161 10.203 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.681 0.031 11.612 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.302 0.665 10.070 1.00 0.00 H new ATOM 112 N MET A 7 -2.585 3.527 9.283 1.00 0.00 N ATOM 113 CA MET A 7 -2.191 4.335 8.094 1.00 0.00 C ATOM 114 C MET A 7 -1.175 5.395 8.541 1.00 0.00 C ATOM 115 O MET A 7 -0.199 5.657 7.867 1.00 0.00 O ATOM 116 CB MET A 7 -3.433 5.002 7.475 1.00 0.00 C ATOM 117 CG MET A 7 -3.211 5.232 5.971 1.00 0.00 C ATOM 118 SD MET A 7 -3.484 3.677 5.075 1.00 0.00 S ATOM 119 CE MET A 7 -1.993 3.705 4.042 1.00 0.00 C ATOM 0 H MET A 7 -3.578 3.534 9.517 1.00 0.00 H new ATOM 0 HA MET A 7 -1.740 3.694 7.337 1.00 0.00 H new ATOM 0 HB2 MET A 7 -4.309 4.372 7.630 1.00 0.00 H new ATOM 0 HB3 MET A 7 -3.631 5.952 7.971 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.893 6.000 5.605 1.00 0.00 H new ATOM 0 HG3 MET A 7 -2.198 5.594 5.793 1.00 0.00 H new ATOM 0 HE1 MET A 7 -2.058 2.921 3.287 1.00 0.00 H new ATOM 0 HE2 MET A 7 -1.908 4.675 3.551 1.00 0.00 H new ATOM 0 HE3 MET A 7 -1.115 3.536 4.666 1.00 0.00 H new ATOM 129 N VAL A 8 -1.391 5.992 9.684 1.00 0.00 N ATOM 130 CA VAL A 8 -0.432 7.018 10.188 1.00 0.00 C ATOM 131 C VAL A 8 0.867 6.329 10.619 1.00 0.00 C ATOM 132 O VAL A 8 1.947 6.863 10.462 1.00 0.00 O ATOM 133 CB VAL A 8 -1.043 7.744 11.390 1.00 0.00 C ATOM 134 CG1 VAL A 8 -0.230 9.006 11.688 1.00 0.00 C ATOM 135 CG2 VAL A 8 -2.488 8.140 11.072 1.00 0.00 C ATOM 0 H VAL A 8 -2.191 5.813 10.291 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.221 7.738 9.397 1.00 0.00 H new ATOM 0 HB VAL A 8 -1.029 7.083 12.256 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.663 9.524 12.543 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.800 8.730 11.914 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.247 9.663 10.819 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -2.921 8.656 11.929 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.502 8.801 10.205 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -3.071 7.245 10.855 1.00 0.00 H new ATOM 145 N ALA A 9 0.767 5.143 11.159 1.00 0.00 N ATOM 146 CA ALA A 9 1.989 4.407 11.600 1.00 0.00 C ATOM 147 C ALA A 9 2.905 4.162 10.398 1.00 0.00 C ATOM 148 O ALA A 9 4.091 4.423 10.437 1.00 0.00 O ATOM 149 CB ALA A 9 1.562 3.054 12.174 1.00 0.00 C ATOM 0 H ALA A 9 -0.112 4.650 11.314 1.00 0.00 H new ATOM 0 HA ALA A 9 2.520 4.993 12.350 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.444 2.503 12.501 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.897 3.212 13.023 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.040 2.482 11.407 1.00 0.00 H new ATOM 155 N LEU A 10 2.354 3.643 9.338 1.00 0.00 N ATOM 156 CA LEU A 10 3.164 3.347 8.122 1.00 0.00 C ATOM 157 C LEU A 10 3.962 4.585 7.718 1.00 0.00 C ATOM 158 O LEU A 10 5.167 4.554 7.571 1.00 0.00 O ATOM 159 CB LEU A 10 2.188 2.986 6.970 1.00 0.00 C ATOM 160 CG LEU A 10 1.981 1.464 6.880 1.00 0.00 C ATOM 161 CD1 LEU A 10 1.240 0.961 8.120 1.00 0.00 C ATOM 162 CD2 LEU A 10 1.152 1.142 5.634 1.00 0.00 C ATOM 0 H LEU A 10 1.365 3.408 9.260 1.00 0.00 H new ATOM 0 HA LEU A 10 3.851 2.525 8.324 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.229 3.478 7.133 1.00 0.00 H new ATOM 0 HB3 LEU A 10 2.581 3.360 6.025 1.00 0.00 H new ATOM 0 HG LEU A 10 2.953 0.974 6.820 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.098 -0.117 8.047 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.824 1.191 9.011 1.00 0.00 H new ATOM 0 HD13 LEU A 10 0.269 1.451 8.187 1.00 0.00 H new ATOM 0 HD21 LEU A 10 1.002 0.065 5.565 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.184 1.639 5.702 1.00 0.00 H new ATOM 0 HD23 LEU A 10 1.678 1.493 4.746 1.00 0.00 H new ATOM 174 N ILE A 11 3.271 5.668 7.514 1.00 0.00 N ATOM 175 CA ILE A 11 3.938 6.924 7.087 1.00 0.00 C ATOM 176 C ILE A 11 5.031 7.316 8.079 1.00 0.00 C ATOM 177 O ILE A 11 6.062 7.833 7.696 1.00 0.00 O ATOM 178 CB ILE A 11 2.892 8.041 7.012 1.00 0.00 C ATOM 179 CG1 ILE A 11 1.894 7.725 5.895 1.00 0.00 C ATOM 180 CG2 ILE A 11 3.579 9.378 6.720 1.00 0.00 C ATOM 181 CD1 ILE A 11 0.662 8.619 6.044 1.00 0.00 C ATOM 0 H ILE A 11 2.260 5.737 7.627 1.00 0.00 H new ATOM 0 HA ILE A 11 4.396 6.770 6.110 1.00 0.00 H new ATOM 0 HB ILE A 11 2.368 8.109 7.965 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.358 7.886 4.922 1.00 0.00 H new ATOM 0 HG13 ILE A 11 1.603 6.676 5.939 1.00 0.00 H new ATOM 0 HG21 ILE A 11 2.830 10.168 6.668 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.289 9.603 7.515 1.00 0.00 H new ATOM 0 HG23 ILE A 11 4.107 9.315 5.769 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.049 8.394 5.249 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.194 8.436 7.011 1.00 0.00 H new ATOM 0 HD13 ILE A 11 0.961 9.665 5.978 1.00 0.00 H new ATOM 193 N ASP A 12 4.817 7.113 9.351 1.00 0.00 N ATOM 194 CA ASP A 12 5.858 7.526 10.331 1.00 0.00 C ATOM 195 C ASP A 12 7.090 6.621 10.218 1.00 0.00 C ATOM 196 O ASP A 12 8.206 7.077 10.368 1.00 0.00 O ATOM 197 CB ASP A 12 5.297 7.480 11.752 1.00 0.00 C ATOM 198 CG ASP A 12 3.917 8.141 11.780 1.00 0.00 C ATOM 199 OD1 ASP A 12 3.578 8.800 10.811 1.00 0.00 O ATOM 200 OD2 ASP A 12 3.222 7.976 12.769 1.00 0.00 O ATOM 0 H ASP A 12 3.980 6.686 9.748 1.00 0.00 H new ATOM 0 HA ASP A 12 6.158 8.550 10.106 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.224 6.447 12.092 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.972 7.994 12.437 1.00 0.00 H new ATOM 205 N VAL A 13 6.921 5.347 9.959 1.00 0.00 N ATOM 206 CA VAL A 13 8.126 4.471 9.853 1.00 0.00 C ATOM 207 C VAL A 13 8.872 4.791 8.555 1.00 0.00 C ATOM 208 O VAL A 13 10.088 4.772 8.516 1.00 0.00 O ATOM 209 CB VAL A 13 7.722 2.995 9.897 1.00 0.00 C ATOM 210 CG1 VAL A 13 8.937 2.117 9.578 1.00 0.00 C ATOM 211 CG2 VAL A 13 7.204 2.656 11.298 1.00 0.00 C ATOM 0 H VAL A 13 6.022 4.885 9.819 1.00 0.00 H new ATOM 0 HA VAL A 13 8.786 4.662 10.699 1.00 0.00 H new ATOM 0 HB VAL A 13 6.941 2.810 9.160 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.646 1.067 9.610 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.310 2.360 8.583 1.00 0.00 H new ATOM 0 HG13 VAL A 13 9.721 2.299 10.314 1.00 0.00 H new ATOM 0 HG21 VAL A 13 6.915 1.606 11.335 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.989 2.842 12.031 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.339 3.279 11.527 1.00 0.00 H new ATOM 221 N PHE A 14 8.175 5.108 7.501 1.00 0.00 N ATOM 222 CA PHE A 14 8.889 5.447 6.239 1.00 0.00 C ATOM 223 C PHE A 14 9.738 6.692 6.491 1.00 0.00 C ATOM 224 O PHE A 14 10.815 6.849 5.948 1.00 0.00 O ATOM 225 CB PHE A 14 7.883 5.733 5.121 1.00 0.00 C ATOM 226 CG PHE A 14 8.632 6.075 3.854 1.00 0.00 C ATOM 227 CD1 PHE A 14 9.110 7.376 3.652 1.00 0.00 C ATOM 228 CD2 PHE A 14 8.853 5.090 2.883 1.00 0.00 C ATOM 229 CE1 PHE A 14 9.807 7.692 2.478 1.00 0.00 C ATOM 230 CE2 PHE A 14 9.549 5.406 1.711 1.00 0.00 C ATOM 231 CZ PHE A 14 10.026 6.707 1.508 1.00 0.00 C ATOM 0 H PHE A 14 7.157 5.147 7.457 1.00 0.00 H new ATOM 0 HA PHE A 14 9.517 4.610 5.934 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.246 4.864 4.958 1.00 0.00 H new ATOM 0 HB3 PHE A 14 7.230 6.558 5.405 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.941 8.136 4.401 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.486 4.086 3.039 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.175 8.695 2.322 1.00 0.00 H new ATOM 0 HE2 PHE A 14 9.718 4.646 0.962 1.00 0.00 H new ATOM 0 HZ PHE A 14 10.563 6.950 0.603 1.00 0.00 H new ATOM 241 N HIS A 15 9.257 7.578 7.320 1.00 0.00 N ATOM 242 CA HIS A 15 10.023 8.816 7.625 1.00 0.00 C ATOM 243 C HIS A 15 11.186 8.481 8.562 1.00 0.00 C ATOM 244 O HIS A 15 12.216 9.125 8.550 1.00 0.00 O ATOM 245 CB HIS A 15 9.100 9.831 8.303 1.00 0.00 C ATOM 246 CG HIS A 15 9.772 11.175 8.346 1.00 0.00 C ATOM 247 ND1 HIS A 15 9.381 12.223 7.528 1.00 0.00 N ATOM 248 CD2 HIS A 15 10.808 11.660 9.106 1.00 0.00 C ATOM 249 CE1 HIS A 15 10.169 13.276 7.812 1.00 0.00 C ATOM 250 NE2 HIS A 15 11.057 12.987 8.767 1.00 0.00 N ATOM 0 H HIS A 15 8.361 7.495 7.801 1.00 0.00 H new ATOM 0 HA HIS A 15 10.413 9.238 6.699 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.158 9.901 7.759 1.00 0.00 H new ATOM 0 HB3 HIS A 15 8.860 9.501 9.314 1.00 0.00 H new ATOM 0 HD2 HIS A 15 11.348 11.097 9.853 1.00 0.00 H new ATOM 0 HE1 HIS A 15 10.093 14.238 7.327 1.00 0.00 H new ATOM 0 HE2 HIS A 15 11.765 13.605 9.163 1.00 0.00 H new ATOM 258 N GLN A 16 11.016 7.481 9.389 1.00 0.00 N ATOM 259 CA GLN A 16 12.093 7.102 10.346 1.00 0.00 C ATOM 260 C GLN A 16 13.395 6.832 9.591 1.00 0.00 C ATOM 261 O GLN A 16 14.458 7.256 10.001 1.00 0.00 O ATOM 262 CB GLN A 16 11.677 5.845 11.115 1.00 0.00 C ATOM 263 CG GLN A 16 12.783 5.456 12.103 1.00 0.00 C ATOM 264 CD GLN A 16 12.219 4.492 13.150 1.00 0.00 C ATOM 265 OE1 GLN A 16 11.526 3.551 12.816 1.00 0.00 O ATOM 266 NE2 GLN A 16 12.486 4.690 14.412 1.00 0.00 N ATOM 0 H GLN A 16 10.173 6.910 9.441 1.00 0.00 H new ATOM 0 HA GLN A 16 12.251 7.923 11.046 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.745 6.026 11.650 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.492 5.026 10.420 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.611 4.988 11.571 1.00 0.00 H new ATOM 0 HG3 GLN A 16 13.180 6.347 12.590 1.00 0.00 H new ATOM 0 HE21 GLN A 16 13.068 5.480 14.692 1.00 0.00 H new ATOM 0 HE22 GLN A 16 12.113 4.055 15.118 1.00 0.00 H new ATOM 275 N TYR A 17 13.328 6.127 8.494 1.00 0.00 N ATOM 276 CA TYR A 17 14.568 5.831 7.724 1.00 0.00 C ATOM 277 C TYR A 17 15.054 7.106 7.035 1.00 0.00 C ATOM 278 O TYR A 17 16.222 7.440 7.080 1.00 0.00 O ATOM 279 CB TYR A 17 14.269 4.761 6.668 1.00 0.00 C ATOM 280 CG TYR A 17 14.168 3.404 7.332 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.074 3.109 8.152 1.00 0.00 C ATOM 282 CD2 TYR A 17 15.168 2.444 7.127 1.00 0.00 C ATOM 283 CE1 TYR A 17 12.977 1.855 8.768 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.071 1.190 7.743 1.00 0.00 C ATOM 285 CZ TYR A 17 13.976 0.896 8.564 1.00 0.00 C ATOM 286 OH TYR A 17 13.880 -0.340 9.172 1.00 0.00 O ATOM 0 H TYR A 17 12.469 5.744 8.099 1.00 0.00 H new ATOM 0 HA TYR A 17 15.340 5.467 8.402 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.337 4.995 6.153 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.056 4.750 5.914 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.303 3.849 8.310 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.013 2.671 6.494 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.131 1.628 9.400 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.841 0.450 7.585 1.00 0.00 H new ATOM 0 HH TYR A 17 14.655 -0.887 8.925 1.00 0.00 H new ATOM 296 N SER A 18 14.167 7.821 6.392 1.00 0.00 N ATOM 297 CA SER A 18 14.573 9.077 5.690 1.00 0.00 C ATOM 298 C SER A 18 14.257 10.292 6.567 1.00 0.00 C ATOM 299 O SER A 18 13.506 11.164 6.173 1.00 0.00 O ATOM 300 CB SER A 18 13.800 9.195 4.374 1.00 0.00 C ATOM 301 OG SER A 18 13.950 10.511 3.858 1.00 0.00 O ATOM 0 H SER A 18 13.176 7.589 6.322 1.00 0.00 H new ATOM 0 HA SER A 18 15.644 9.044 5.491 1.00 0.00 H new ATOM 0 HB2 SER A 18 14.171 8.465 3.654 1.00 0.00 H new ATOM 0 HB3 SER A 18 12.745 8.974 4.537 1.00 0.00 H new ATOM 0 HG SER A 18 13.446 11.140 4.415 1.00 0.00 H new ATOM 307 N GLY A 19 14.842 10.377 7.742 1.00 0.00 N ATOM 308 CA GLY A 19 14.604 11.556 8.642 1.00 0.00 C ATOM 309 C GLY A 19 15.947 12.255 8.860 1.00 0.00 C ATOM 310 O GLY A 19 16.012 13.381 9.311 1.00 0.00 O ATOM 0 H GLY A 19 15.479 9.675 8.119 1.00 0.00 H new ATOM 0 HA2 GLY A 19 13.885 12.241 8.192 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.183 11.232 9.594 1.00 0.00 H new ATOM 314 N ARG A 20 17.017 11.601 8.502 1.00 0.00 N ATOM 315 CA ARG A 20 18.367 12.216 8.635 1.00 0.00 C ATOM 316 C ARG A 20 18.441 13.449 7.737 1.00 0.00 C ATOM 317 O ARG A 20 19.132 14.397 8.053 1.00 0.00 O ATOM 318 CB ARG A 20 19.436 11.206 8.217 1.00 0.00 C ATOM 319 CG ARG A 20 20.819 11.737 8.596 1.00 0.00 C ATOM 320 CD ARG A 20 21.886 10.720 8.189 1.00 0.00 C ATOM 321 NE ARG A 20 23.225 11.369 8.219 1.00 0.00 N ATOM 322 CZ ARG A 20 23.632 11.972 9.302 1.00 0.00 C ATOM 323 NH1 ARG A 20 23.652 11.329 10.438 1.00 0.00 N ATOM 324 NH2 ARG A 20 24.015 13.218 9.250 1.00 0.00 N ATOM 0 H ARG A 20 17.013 10.656 8.119 1.00 0.00 H new ATOM 0 HA ARG A 20 18.540 12.506 9.671 1.00 0.00 H new ATOM 0 HB2 ARG A 20 19.257 10.248 8.705 1.00 0.00 H new ATOM 0 HB3 ARG A 20 19.385 11.030 7.142 1.00 0.00 H new ATOM 0 HG2 ARG A 20 21.002 12.690 8.100 1.00 0.00 H new ATOM 0 HG3 ARG A 20 20.868 11.921 9.669 1.00 0.00 H new ATOM 0 HD2 ARG A 20 21.868 9.867 8.867 1.00 0.00 H new ATOM 0 HD3 ARG A 20 21.677 10.338 7.190 1.00 0.00 H new ATOM 0 HE ARG A 20 23.824 11.342 7.394 1.00 0.00 H new ATOM 0 HH11 ARG A 20 23.350 10.356 10.479 1.00 0.00 H new ATOM 0 HH12 ARG A 20 23.970 11.800 11.285 1.00 0.00 H new ATOM 0 HH21 ARG A 20 23.996 13.721 8.363 1.00 0.00 H new ATOM 0 HH22 ARG A 20 24.333 13.689 10.097 1.00 0.00 H new ATOM 338 N GLU A 21 17.729 13.479 6.642 1.00 0.00 N ATOM 339 CA GLU A 21 17.775 14.701 5.781 1.00 0.00 C ATOM 340 C GLU A 21 16.432 14.896 5.080 1.00 0.00 C ATOM 341 O GLU A 21 15.904 15.989 5.034 1.00 0.00 O ATOM 342 CB GLU A 21 18.882 14.553 4.736 1.00 0.00 C ATOM 343 CG GLU A 21 20.244 14.538 5.432 1.00 0.00 C ATOM 344 CD GLU A 21 21.352 14.685 4.388 1.00 0.00 C ATOM 345 OE1 GLU A 21 21.094 14.391 3.232 1.00 0.00 O ATOM 346 OE2 GLU A 21 22.441 15.088 4.762 1.00 0.00 O ATOM 0 H GLU A 21 17.127 12.726 6.309 1.00 0.00 H new ATOM 0 HA GLU A 21 17.981 15.569 6.407 1.00 0.00 H new ATOM 0 HB2 GLU A 21 18.741 13.632 4.170 1.00 0.00 H new ATOM 0 HB3 GLU A 21 18.836 15.376 4.023 1.00 0.00 H new ATOM 0 HG2 GLU A 21 20.303 15.350 6.157 1.00 0.00 H new ATOM 0 HG3 GLU A 21 20.372 13.607 5.985 1.00 0.00 H new ATOM 353 N GLY A 22 15.869 13.854 4.531 1.00 0.00 N ATOM 354 CA GLY A 22 14.558 14.002 3.834 1.00 0.00 C ATOM 355 C GLY A 22 14.624 15.199 2.883 1.00 0.00 C ATOM 356 O GLY A 22 13.618 15.654 2.377 1.00 0.00 O ATOM 0 H GLY A 22 16.257 12.911 4.534 1.00 0.00 H new ATOM 0 HA2 GLY A 22 14.324 13.094 3.279 1.00 0.00 H new ATOM 0 HA3 GLY A 22 13.760 14.145 4.562 1.00 0.00 H new ATOM 360 N ASP A 23 15.800 15.715 2.632 1.00 0.00 N ATOM 361 CA ASP A 23 15.914 16.880 1.709 1.00 0.00 C ATOM 362 C ASP A 23 15.128 16.561 0.437 1.00 0.00 C ATOM 363 O ASP A 23 14.249 17.297 0.037 1.00 0.00 O ATOM 364 CB ASP A 23 17.385 17.121 1.359 1.00 0.00 C ATOM 365 CG ASP A 23 18.088 17.803 2.535 1.00 0.00 C ATOM 366 OD1 ASP A 23 17.527 17.800 3.618 1.00 0.00 O ATOM 367 OD2 ASP A 23 19.176 18.318 2.332 1.00 0.00 O ATOM 0 H ASP A 23 16.680 15.381 3.024 1.00 0.00 H new ATOM 0 HA ASP A 23 15.516 17.776 2.184 1.00 0.00 H new ATOM 0 HB2 ASP A 23 17.874 16.174 1.129 1.00 0.00 H new ATOM 0 HB3 ASP A 23 17.460 17.743 0.467 1.00 0.00 H new ATOM 372 N LYS A 24 15.420 15.449 -0.183 1.00 0.00 N ATOM 373 CA LYS A 24 14.672 15.053 -1.410 1.00 0.00 C ATOM 374 C LYS A 24 13.484 14.183 -0.984 1.00 0.00 C ATOM 375 O LYS A 24 13.311 13.883 0.181 1.00 0.00 O ATOM 376 CB LYS A 24 15.591 14.254 -2.339 1.00 0.00 C ATOM 377 CG LYS A 24 16.928 14.984 -2.495 1.00 0.00 C ATOM 378 CD LYS A 24 17.866 14.150 -3.371 1.00 0.00 C ATOM 379 CE LYS A 24 19.290 14.698 -3.257 1.00 0.00 C ATOM 380 NZ LYS A 24 20.202 13.897 -4.123 1.00 0.00 N ATOM 0 H LYS A 24 16.147 14.796 0.109 1.00 0.00 H new ATOM 0 HA LYS A 24 14.321 15.938 -1.941 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.756 13.256 -1.933 1.00 0.00 H new ATOM 0 HB3 LYS A 24 15.119 14.128 -3.313 1.00 0.00 H new ATOM 0 HG2 LYS A 24 16.769 15.964 -2.945 1.00 0.00 H new ATOM 0 HG3 LYS A 24 17.379 15.151 -1.517 1.00 0.00 H new ATOM 0 HD2 LYS A 24 17.840 13.106 -3.059 1.00 0.00 H new ATOM 0 HD3 LYS A 24 17.535 14.181 -4.409 1.00 0.00 H new ATOM 0 HE2 LYS A 24 19.313 15.746 -3.557 1.00 0.00 H new ATOM 0 HE3 LYS A 24 19.625 14.656 -2.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 21.170 14.269 -4.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 20.188 12.903 -3.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 19.885 13.959 -5.112 1.00 0.00 H new ATOM 394 N HIS A 25 12.682 13.761 -1.925 1.00 0.00 N ATOM 395 CA HIS A 25 11.509 12.885 -1.611 1.00 0.00 C ATOM 396 C HIS A 25 11.579 11.665 -2.530 1.00 0.00 C ATOM 397 O HIS A 25 10.602 11.278 -3.142 1.00 0.00 O ATOM 398 CB HIS A 25 10.217 13.662 -1.874 1.00 0.00 C ATOM 399 CG HIS A 25 10.099 13.971 -3.343 1.00 0.00 C ATOM 400 ND1 HIS A 25 9.439 13.129 -4.225 1.00 0.00 N ATOM 401 CD2 HIS A 25 10.552 15.024 -4.098 1.00 0.00 C ATOM 402 CE1 HIS A 25 9.513 13.686 -5.448 1.00 0.00 C ATOM 403 NE2 HIS A 25 10.181 14.842 -5.427 1.00 0.00 N ATOM 0 H HIS A 25 12.790 13.988 -2.914 1.00 0.00 H new ATOM 0 HA HIS A 25 11.525 12.572 -0.567 1.00 0.00 H new ATOM 0 HB2 HIS A 25 9.357 13.078 -1.545 1.00 0.00 H new ATOM 0 HB3 HIS A 25 10.214 14.587 -1.297 1.00 0.00 H new ATOM 0 HD1 HIS A 25 8.981 12.248 -3.990 1.00 0.00 H new ATOM 0 HD2 HIS A 25 11.112 15.866 -3.718 1.00 0.00 H new ATOM 0 HE1 HIS A 25 9.084 13.251 -6.338 1.00 0.00 H new ATOM 411 N LYS A 26 12.736 11.060 -2.630 1.00 0.00 N ATOM 412 CA LYS A 26 12.902 9.862 -3.507 1.00 0.00 C ATOM 413 C LYS A 26 13.677 8.774 -2.760 1.00 0.00 C ATOM 414 O LYS A 26 14.476 9.056 -1.888 1.00 0.00 O ATOM 415 CB LYS A 26 13.677 10.258 -4.765 1.00 0.00 C ATOM 416 CG LYS A 26 12.944 11.394 -5.482 1.00 0.00 C ATOM 417 CD LYS A 26 13.669 11.724 -6.788 1.00 0.00 C ATOM 418 CE LYS A 26 12.841 12.728 -7.591 1.00 0.00 C ATOM 419 NZ LYS A 26 11.562 12.090 -8.014 1.00 0.00 N ATOM 0 H LYS A 26 13.581 11.348 -2.136 1.00 0.00 H new ATOM 0 HA LYS A 26 11.919 9.481 -3.783 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.686 10.573 -4.499 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.776 9.399 -5.429 1.00 0.00 H new ATOM 0 HG2 LYS A 26 11.914 11.103 -5.689 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.904 12.276 -4.843 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.655 12.137 -6.575 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.823 10.816 -7.370 1.00 0.00 H new ATOM 0 HE2 LYS A 26 12.637 13.612 -6.988 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.401 13.061 -8.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.177 12.596 -8.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 11.737 11.097 -8.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 10.878 12.132 -7.232 1.00 0.00 H new ATOM 433 N LEU A 27 13.448 7.530 -3.102 1.00 0.00 N ATOM 434 CA LEU A 27 14.163 6.397 -2.430 1.00 0.00 C ATOM 435 C LEU A 27 14.812 5.534 -3.511 1.00 0.00 C ATOM 436 O LEU A 27 14.263 5.359 -4.579 1.00 0.00 O ATOM 437 CB LEU A 27 13.147 5.559 -1.644 1.00 0.00 C ATOM 438 CG LEU A 27 13.877 4.566 -0.718 1.00 0.00 C ATOM 439 CD1 LEU A 27 14.305 5.257 0.584 1.00 0.00 C ATOM 440 CD2 LEU A 27 12.939 3.404 -0.377 1.00 0.00 C ATOM 0 H LEU A 27 12.788 7.247 -3.827 1.00 0.00 H new ATOM 0 HA LEU A 27 14.923 6.775 -1.746 1.00 0.00 H new ATOM 0 HB2 LEU A 27 12.505 6.213 -1.054 1.00 0.00 H new ATOM 0 HB3 LEU A 27 12.501 5.016 -2.334 1.00 0.00 H new ATOM 0 HG LEU A 27 14.763 4.197 -1.234 1.00 0.00 H new ATOM 0 HD11 LEU A 27 14.819 4.540 1.225 1.00 0.00 H new ATOM 0 HD12 LEU A 27 14.977 6.084 0.353 1.00 0.00 H new ATOM 0 HD13 LEU A 27 13.424 5.639 1.100 1.00 0.00 H new ATOM 0 HD21 LEU A 27 13.454 2.701 0.278 1.00 0.00 H new ATOM 0 HD22 LEU A 27 12.053 3.788 0.128 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.642 2.895 -1.294 1.00 0.00 H new ATOM 452 N LYS A 28 15.983 5.001 -3.257 1.00 0.00 N ATOM 453 CA LYS A 28 16.663 4.159 -4.292 1.00 0.00 C ATOM 454 C LYS A 28 16.368 2.677 -4.046 1.00 0.00 C ATOM 455 O LYS A 28 16.080 2.264 -2.939 1.00 0.00 O ATOM 456 CB LYS A 28 18.174 4.391 -4.225 1.00 0.00 C ATOM 457 CG LYS A 28 18.496 5.817 -4.675 1.00 0.00 C ATOM 458 CD LYS A 28 20.013 6.004 -4.727 1.00 0.00 C ATOM 459 CE LYS A 28 20.338 7.452 -5.096 1.00 0.00 C ATOM 460 NZ LYS A 28 19.597 7.827 -6.332 1.00 0.00 N ATOM 0 H LYS A 28 16.495 5.112 -2.382 1.00 0.00 H new ATOM 0 HA LYS A 28 16.288 4.438 -5.277 1.00 0.00 H new ATOM 0 HB2 LYS A 28 18.532 4.231 -3.208 1.00 0.00 H new ATOM 0 HB3 LYS A 28 18.691 3.673 -4.862 1.00 0.00 H new ATOM 0 HG2 LYS A 28 18.061 6.007 -5.656 1.00 0.00 H new ATOM 0 HG3 LYS A 28 18.053 6.536 -3.986 1.00 0.00 H new ATOM 0 HD2 LYS A 28 20.454 5.756 -3.761 1.00 0.00 H new ATOM 0 HD3 LYS A 28 20.449 5.325 -5.460 1.00 0.00 H new ATOM 0 HE2 LYS A 28 20.063 8.118 -4.278 1.00 0.00 H new ATOM 0 HE3 LYS A 28 21.411 7.567 -5.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 20.142 8.537 -6.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 19.461 6.983 -6.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 18.670 8.223 -6.075 1.00 0.00 H new ATOM 474 N LYS A 29 16.457 1.872 -5.069 1.00 0.00 N ATOM 475 CA LYS A 29 16.204 0.412 -4.907 1.00 0.00 C ATOM 476 C LYS A 29 17.208 -0.187 -3.913 1.00 0.00 C ATOM 477 O LYS A 29 16.884 -1.068 -3.141 1.00 0.00 O ATOM 478 CB LYS A 29 16.336 -0.283 -6.278 1.00 0.00 C ATOM 479 CG LYS A 29 17.782 -0.254 -6.813 1.00 0.00 C ATOM 480 CD LYS A 29 18.222 1.189 -7.105 1.00 0.00 C ATOM 481 CE LYS A 29 19.405 1.180 -8.077 1.00 0.00 C ATOM 482 NZ LYS A 29 20.559 0.481 -7.445 1.00 0.00 N ATOM 0 H LYS A 29 16.696 2.165 -6.016 1.00 0.00 H new ATOM 0 HA LYS A 29 15.197 0.258 -4.520 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.004 -1.318 -6.192 1.00 0.00 H new ATOM 0 HB3 LYS A 29 15.676 0.205 -6.995 1.00 0.00 H new ATOM 0 HG2 LYS A 29 18.455 -0.704 -6.083 1.00 0.00 H new ATOM 0 HG3 LYS A 29 17.851 -0.852 -7.722 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.393 1.753 -7.531 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.504 1.688 -6.178 1.00 0.00 H new ATOM 0 HE2 LYS A 29 19.125 0.679 -9.003 1.00 0.00 H new ATOM 0 HE3 LYS A 29 19.683 2.201 -8.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.426 0.689 -7.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.670 0.810 -6.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.388 -0.545 -7.449 1.00 0.00 H new ATOM 496 N SER A 30 18.429 0.272 -3.945 1.00 0.00 N ATOM 497 CA SER A 30 19.470 -0.275 -3.028 1.00 0.00 C ATOM 498 C SER A 30 19.070 -0.064 -1.566 1.00 0.00 C ATOM 499 O SER A 30 19.237 -0.940 -0.734 1.00 0.00 O ATOM 500 CB SER A 30 20.796 0.438 -3.293 1.00 0.00 C ATOM 501 OG SER A 30 21.799 -0.102 -2.442 1.00 0.00 O ATOM 0 H SER A 30 18.753 1.008 -4.572 1.00 0.00 H new ATOM 0 HA SER A 30 19.571 -1.345 -3.212 1.00 0.00 H new ATOM 0 HB2 SER A 30 21.085 0.317 -4.337 1.00 0.00 H new ATOM 0 HB3 SER A 30 20.689 1.508 -3.114 1.00 0.00 H new ATOM 0 HG SER A 30 22.651 0.352 -2.611 1.00 0.00 H new ATOM 507 N GLU A 31 18.541 1.085 -1.236 1.00 0.00 N ATOM 508 CA GLU A 31 18.147 1.321 0.184 1.00 0.00 C ATOM 509 C GLU A 31 16.807 0.637 0.441 1.00 0.00 C ATOM 510 O GLU A 31 16.547 0.128 1.513 1.00 0.00 O ATOM 511 CB GLU A 31 18.036 2.822 0.463 1.00 0.00 C ATOM 512 CG GLU A 31 17.695 3.043 1.939 1.00 0.00 C ATOM 513 CD GLU A 31 17.826 4.529 2.278 1.00 0.00 C ATOM 514 OE1 GLU A 31 17.764 5.334 1.363 1.00 0.00 O ATOM 515 OE2 GLU A 31 17.987 4.838 3.448 1.00 0.00 O ATOM 0 H GLU A 31 18.367 1.859 -1.877 1.00 0.00 H new ATOM 0 HA GLU A 31 18.906 0.907 0.848 1.00 0.00 H new ATOM 0 HB2 GLU A 31 18.975 3.319 0.217 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.266 3.264 -0.169 1.00 0.00 H new ATOM 0 HG2 GLU A 31 16.681 2.701 2.144 1.00 0.00 H new ATOM 0 HG3 GLU A 31 18.363 2.455 2.569 1.00 0.00 H new ATOM 522 N LEU A 32 15.961 0.608 -0.554 1.00 0.00 N ATOM 523 CA LEU A 32 14.641 -0.058 -0.396 1.00 0.00 C ATOM 524 C LEU A 32 14.881 -1.546 -0.126 1.00 0.00 C ATOM 525 O LEU A 32 14.277 -2.128 0.753 1.00 0.00 O ATOM 526 CB LEU A 32 13.816 0.131 -1.682 1.00 0.00 C ATOM 527 CG LEU A 32 12.311 0.041 -1.383 1.00 0.00 C ATOM 528 CD1 LEU A 32 11.528 0.440 -2.637 1.00 0.00 C ATOM 529 CD2 LEU A 32 11.933 -1.393 -0.973 1.00 0.00 C ATOM 0 H LEU A 32 16.131 1.019 -1.472 1.00 0.00 H new ATOM 0 HA LEU A 32 14.088 0.378 0.436 1.00 0.00 H new ATOM 0 HB2 LEU A 32 14.046 1.099 -2.128 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.092 -0.630 -2.412 1.00 0.00 H new ATOM 0 HG LEU A 32 12.067 0.715 -0.562 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.459 0.379 -2.433 1.00 0.00 H new ATOM 0 HD12 LEU A 32 11.786 1.461 -2.918 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.781 -0.236 -3.454 1.00 0.00 H new ATOM 0 HD21 LEU A 32 10.864 -1.442 -0.764 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.176 -2.079 -1.784 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.490 -1.675 -0.080 1.00 0.00 H new ATOM 541 N LYS A 33 15.748 -2.180 -0.873 1.00 0.00 N ATOM 542 CA LYS A 33 15.982 -3.630 -0.640 1.00 0.00 C ATOM 543 C LYS A 33 16.295 -3.845 0.836 1.00 0.00 C ATOM 544 O LYS A 33 15.637 -4.605 1.518 1.00 0.00 O ATOM 545 CB LYS A 33 17.159 -4.112 -1.493 1.00 0.00 C ATOM 546 CG LYS A 33 17.366 -5.613 -1.276 1.00 0.00 C ATOM 547 CD LYS A 33 18.287 -6.169 -2.365 1.00 0.00 C ATOM 548 CE LYS A 33 19.618 -5.413 -2.353 1.00 0.00 C ATOM 549 NZ LYS A 33 20.065 -5.213 -0.946 1.00 0.00 N ATOM 0 H LYS A 33 16.296 -1.760 -1.624 1.00 0.00 H new ATOM 0 HA LYS A 33 15.093 -4.196 -0.918 1.00 0.00 H new ATOM 0 HB2 LYS A 33 16.965 -3.909 -2.546 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.064 -3.567 -1.224 1.00 0.00 H new ATOM 0 HG2 LYS A 33 17.801 -5.792 -0.292 1.00 0.00 H new ATOM 0 HG3 LYS A 33 16.406 -6.129 -1.299 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.461 -7.232 -2.200 1.00 0.00 H new ATOM 0 HD3 LYS A 33 17.812 -6.072 -3.341 1.00 0.00 H new ATOM 0 HE2 LYS A 33 20.371 -5.972 -2.909 1.00 0.00 H new ATOM 0 HE3 LYS A 33 19.505 -4.450 -2.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 21.095 -5.069 -0.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 19.591 -4.378 -0.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 19.822 -6.052 -0.382 1.00 0.00 H new ATOM 563 N GLU A 34 17.303 -3.180 1.335 1.00 0.00 N ATOM 564 CA GLU A 34 17.659 -3.353 2.776 1.00 0.00 C ATOM 565 C GLU A 34 16.383 -3.232 3.617 1.00 0.00 C ATOM 566 O GLU A 34 16.218 -3.915 4.608 1.00 0.00 O ATOM 567 CB GLU A 34 18.662 -2.276 3.196 1.00 0.00 C ATOM 568 CG GLU A 34 19.902 -2.357 2.304 1.00 0.00 C ATOM 569 CD GLU A 34 20.703 -3.611 2.655 1.00 0.00 C ATOM 570 OE1 GLU A 34 21.411 -3.579 3.648 1.00 0.00 O ATOM 571 OE2 GLU A 34 20.595 -4.583 1.926 1.00 0.00 O ATOM 0 H GLU A 34 17.891 -2.530 0.814 1.00 0.00 H new ATOM 0 HA GLU A 34 18.112 -4.333 2.930 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.207 -1.289 3.115 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.943 -2.413 4.240 1.00 0.00 H new ATOM 0 HG2 GLU A 34 19.607 -2.383 1.255 1.00 0.00 H new ATOM 0 HG3 GLU A 34 20.519 -1.469 2.440 1.00 0.00 H new ATOM 578 N LEU A 35 15.472 -2.386 3.222 1.00 0.00 N ATOM 579 CA LEU A 35 14.205 -2.249 3.996 1.00 0.00 C ATOM 580 C LEU A 35 13.403 -3.553 3.854 1.00 0.00 C ATOM 581 O LEU A 35 12.855 -4.051 4.814 1.00 0.00 O ATOM 582 CB LEU A 35 13.394 -1.040 3.459 1.00 0.00 C ATOM 583 CG LEU A 35 13.347 0.094 4.501 1.00 0.00 C ATOM 584 CD1 LEU A 35 12.946 1.403 3.817 1.00 0.00 C ATOM 585 CD2 LEU A 35 12.317 -0.240 5.587 1.00 0.00 C ATOM 0 H LEU A 35 15.549 -1.786 2.401 1.00 0.00 H new ATOM 0 HA LEU A 35 14.419 -2.072 5.050 1.00 0.00 H new ATOM 0 HB2 LEU A 35 13.846 -0.674 2.537 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.380 -1.357 3.214 1.00 0.00 H new ATOM 0 HG LEU A 35 14.333 0.201 4.954 1.00 0.00 H new ATOM 0 HD11 LEU A 35 12.913 2.204 4.555 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.676 1.649 3.046 1.00 0.00 H new ATOM 0 HD13 LEU A 35 11.962 1.289 3.361 1.00 0.00 H new ATOM 0 HD21 LEU A 35 12.288 0.565 6.321 1.00 0.00 H new ATOM 0 HD22 LEU A 35 11.333 -0.352 5.133 1.00 0.00 H new ATOM 0 HD23 LEU A 35 12.597 -1.171 6.080 1.00 0.00 H new ATOM 597 N ILE A 36 13.343 -4.125 2.681 1.00 0.00 N ATOM 598 CA ILE A 36 12.592 -5.404 2.512 1.00 0.00 C ATOM 599 C ILE A 36 13.118 -6.437 3.511 1.00 0.00 C ATOM 600 O ILE A 36 12.382 -7.262 4.015 1.00 0.00 O ATOM 601 CB ILE A 36 12.813 -5.933 1.086 1.00 0.00 C ATOM 602 CG1 ILE A 36 12.381 -4.869 0.048 1.00 0.00 C ATOM 603 CG2 ILE A 36 12.011 -7.227 0.886 1.00 0.00 C ATOM 604 CD1 ILE A 36 10.864 -4.915 -0.203 1.00 0.00 C ATOM 0 H ILE A 36 13.781 -3.763 1.834 1.00 0.00 H new ATOM 0 HA ILE A 36 11.530 -5.230 2.685 1.00 0.00 H new ATOM 0 HB ILE A 36 13.873 -6.145 0.944 1.00 0.00 H new ATOM 0 HG12 ILE A 36 12.663 -3.877 0.402 1.00 0.00 H new ATOM 0 HG13 ILE A 36 12.912 -5.036 -0.889 1.00 0.00 H new ATOM 0 HG21 ILE A 36 12.169 -7.600 -0.126 1.00 0.00 H new ATOM 0 HG22 ILE A 36 12.343 -7.976 1.605 1.00 0.00 H new ATOM 0 HG23 ILE A 36 10.951 -7.025 1.036 1.00 0.00 H new ATOM 0 HD11 ILE A 36 10.593 -4.156 -0.937 1.00 0.00 H new ATOM 0 HD12 ILE A 36 10.587 -5.899 -0.581 1.00 0.00 H new ATOM 0 HD13 ILE A 36 10.335 -4.723 0.730 1.00 0.00 H new ATOM 616 N ASN A 37 14.395 -6.414 3.779 1.00 0.00 N ATOM 617 CA ASN A 37 14.987 -7.410 4.719 1.00 0.00 C ATOM 618 C ASN A 37 14.451 -7.206 6.140 1.00 0.00 C ATOM 619 O ASN A 37 14.306 -8.149 6.891 1.00 0.00 O ATOM 620 CB ASN A 37 16.508 -7.244 4.732 1.00 0.00 C ATOM 621 CG ASN A 37 17.092 -7.770 3.419 1.00 0.00 C ATOM 622 OD1 ASN A 37 16.990 -7.125 2.395 1.00 0.00 O ATOM 623 ND2 ASN A 37 17.704 -8.922 3.407 1.00 0.00 N ATOM 0 H ASN A 37 15.057 -5.745 3.386 1.00 0.00 H new ATOM 0 HA ASN A 37 14.715 -8.410 4.383 1.00 0.00 H new ATOM 0 HB2 ASN A 37 16.768 -6.194 4.863 1.00 0.00 H new ATOM 0 HB3 ASN A 37 16.936 -7.786 5.575 1.00 0.00 H new ATOM 0 HD21 ASN A 37 18.097 -9.282 2.537 1.00 0.00 H new ATOM 0 HD22 ASN A 37 17.789 -9.463 4.267 1.00 0.00 H new ATOM 630 N ASN A 38 14.179 -5.982 6.522 1.00 0.00 N ATOM 631 CA ASN A 38 13.677 -5.704 7.909 1.00 0.00 C ATOM 632 C ASN A 38 12.226 -5.218 7.870 1.00 0.00 C ATOM 633 O ASN A 38 11.592 -5.067 8.896 1.00 0.00 O ATOM 634 CB ASN A 38 14.546 -4.612 8.537 1.00 0.00 C ATOM 635 CG ASN A 38 15.927 -5.182 8.868 1.00 0.00 C ATOM 636 OD1 ASN A 38 16.495 -4.871 9.897 1.00 0.00 O ATOM 637 ND2 ASN A 38 16.495 -6.009 8.034 1.00 0.00 N ATOM 0 H ASN A 38 14.283 -5.157 5.931 1.00 0.00 H new ATOM 0 HA ASN A 38 13.727 -6.622 8.494 1.00 0.00 H new ATOM 0 HB2 ASN A 38 14.644 -3.771 7.850 1.00 0.00 H new ATOM 0 HB3 ASN A 38 14.072 -4.231 9.442 1.00 0.00 H new ATOM 0 HD21 ASN A 38 17.415 -6.395 8.245 1.00 0.00 H new ATOM 0 HD22 ASN A 38 16.019 -6.270 7.171 1.00 0.00 H new ATOM 644 N GLU A 39 11.693 -4.952 6.708 1.00 0.00 N ATOM 645 CA GLU A 39 10.285 -4.454 6.629 1.00 0.00 C ATOM 646 C GLU A 39 9.313 -5.623 6.449 1.00 0.00 C ATOM 647 O GLU A 39 8.190 -5.579 6.910 1.00 0.00 O ATOM 648 CB GLU A 39 10.157 -3.507 5.433 1.00 0.00 C ATOM 649 CG GLU A 39 8.829 -2.751 5.518 1.00 0.00 C ATOM 650 CD GLU A 39 8.929 -1.662 6.587 1.00 0.00 C ATOM 651 OE1 GLU A 39 8.708 -1.975 7.745 1.00 0.00 O ATOM 652 OE2 GLU A 39 9.224 -0.534 6.230 1.00 0.00 O ATOM 0 H GLU A 39 12.168 -5.057 5.811 1.00 0.00 H new ATOM 0 HA GLU A 39 10.041 -3.931 7.554 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.988 -2.802 5.423 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.207 -4.072 4.502 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.589 -2.306 4.552 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.021 -3.441 5.761 1.00 0.00 H new ATOM 659 N LEU A 40 9.738 -6.670 5.784 1.00 0.00 N ATOM 660 CA LEU A 40 8.848 -7.859 5.568 1.00 0.00 C ATOM 661 C LEU A 40 9.564 -9.127 6.037 1.00 0.00 C ATOM 662 O LEU A 40 9.455 -10.175 5.433 1.00 0.00 O ATOM 663 CB LEU A 40 8.524 -7.987 4.078 1.00 0.00 C ATOM 664 CG LEU A 40 7.891 -6.686 3.568 1.00 0.00 C ATOM 665 CD1 LEU A 40 7.738 -6.764 2.047 1.00 0.00 C ATOM 666 CD2 LEU A 40 6.510 -6.482 4.213 1.00 0.00 C ATOM 0 H LEU A 40 10.670 -6.754 5.378 1.00 0.00 H new ATOM 0 HA LEU A 40 7.927 -7.729 6.136 1.00 0.00 H new ATOM 0 HB2 LEU A 40 9.433 -8.204 3.517 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.842 -8.822 3.916 1.00 0.00 H new ATOM 0 HG LEU A 40 8.533 -5.846 3.833 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.288 -5.842 1.679 1.00 0.00 H new ATOM 0 HD12 LEU A 40 8.718 -6.898 1.589 1.00 0.00 H new ATOM 0 HD13 LEU A 40 7.098 -7.608 1.788 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.069 -5.556 3.844 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.861 -7.320 3.957 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.619 -6.426 5.296 1.00 0.00 H new ATOM 678 N SER A 41 10.307 -9.033 7.105 1.00 0.00 N ATOM 679 CA SER A 41 11.046 -10.223 7.612 1.00 0.00 C ATOM 680 C SER A 41 10.070 -11.229 8.228 1.00 0.00 C ATOM 681 O SER A 41 10.321 -12.417 8.244 1.00 0.00 O ATOM 682 CB SER A 41 12.048 -9.777 8.676 1.00 0.00 C ATOM 683 OG SER A 41 11.348 -9.423 9.861 1.00 0.00 O ATOM 0 H SER A 41 10.434 -8.180 7.650 1.00 0.00 H new ATOM 0 HA SER A 41 11.569 -10.698 6.782 1.00 0.00 H new ATOM 0 HB2 SER A 41 12.756 -10.579 8.884 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.626 -8.927 8.314 1.00 0.00 H new ATOM 0 HG SER A 41 11.988 -9.138 10.546 1.00 0.00 H new ATOM 689 N HIS A 42 8.962 -10.768 8.741 1.00 0.00 N ATOM 690 CA HIS A 42 7.984 -11.710 9.357 1.00 0.00 C ATOM 691 C HIS A 42 7.249 -12.487 8.264 1.00 0.00 C ATOM 692 O HIS A 42 7.179 -13.700 8.294 1.00 0.00 O ATOM 693 CB HIS A 42 6.974 -10.920 10.189 1.00 0.00 C ATOM 694 CG HIS A 42 5.973 -11.865 10.791 1.00 0.00 C ATOM 695 ND1 HIS A 42 4.628 -11.828 10.460 1.00 0.00 N ATOM 696 CD2 HIS A 42 6.105 -12.880 11.706 1.00 0.00 C ATOM 697 CE1 HIS A 42 4.009 -12.793 11.164 1.00 0.00 C ATOM 698 NE2 HIS A 42 4.864 -13.465 11.940 1.00 0.00 N ATOM 0 H HIS A 42 8.692 -9.785 8.761 1.00 0.00 H new ATOM 0 HA HIS A 42 8.517 -12.413 9.997 1.00 0.00 H new ATOM 0 HB2 HIS A 42 7.488 -10.368 10.976 1.00 0.00 H new ATOM 0 HB3 HIS A 42 6.466 -10.186 9.563 1.00 0.00 H new ATOM 0 HD2 HIS A 42 7.032 -13.179 12.173 1.00 0.00 H new ATOM 0 HE1 HIS A 42 2.950 -12.999 11.109 1.00 0.00 H new ATOM 0 HE2 HIS A 42 4.653 -14.240 12.569 1.00 0.00 H new ATOM 706 N PHE A 43 6.701 -11.802 7.298 1.00 0.00 N ATOM 707 CA PHE A 43 5.973 -12.511 6.208 1.00 0.00 C ATOM 708 C PHE A 43 6.951 -13.409 5.452 1.00 0.00 C ATOM 709 O PHE A 43 6.562 -14.343 4.780 1.00 0.00 O ATOM 710 CB PHE A 43 5.363 -11.486 5.249 1.00 0.00 C ATOM 711 CG PHE A 43 4.289 -10.704 5.968 1.00 0.00 C ATOM 712 CD1 PHE A 43 4.623 -9.537 6.665 1.00 0.00 C ATOM 713 CD2 PHE A 43 2.960 -11.146 5.939 1.00 0.00 C ATOM 714 CE1 PHE A 43 3.629 -8.811 7.331 1.00 0.00 C ATOM 715 CE2 PHE A 43 1.966 -10.419 6.605 1.00 0.00 C ATOM 716 CZ PHE A 43 2.301 -9.251 7.301 1.00 0.00 C ATOM 0 H PHE A 43 6.726 -10.786 7.216 1.00 0.00 H new ATOM 0 HA PHE A 43 5.176 -13.120 6.634 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.136 -10.811 4.881 1.00 0.00 H new ATOM 0 HB3 PHE A 43 4.941 -11.991 4.380 1.00 0.00 H new ATOM 0 HD1 PHE A 43 5.648 -9.197 6.689 1.00 0.00 H new ATOM 0 HD2 PHE A 43 2.702 -12.047 5.403 1.00 0.00 H new ATOM 0 HE1 PHE A 43 3.887 -7.911 7.868 1.00 0.00 H new ATOM 0 HE2 PHE A 43 0.941 -10.759 6.582 1.00 0.00 H new ATOM 0 HZ PHE A 43 1.534 -8.690 7.815 1.00 0.00 H new ATOM 726 N LEU A 44 8.221 -13.125 5.552 1.00 0.00 N ATOM 727 CA LEU A 44 9.237 -13.948 4.835 1.00 0.00 C ATOM 728 C LEU A 44 8.958 -15.437 5.082 1.00 0.00 C ATOM 729 O LEU A 44 8.981 -16.242 4.173 1.00 0.00 O ATOM 730 CB LEU A 44 10.639 -13.574 5.359 1.00 0.00 C ATOM 731 CG LEU A 44 11.714 -13.801 4.277 1.00 0.00 C ATOM 732 CD1 LEU A 44 11.619 -15.233 3.739 1.00 0.00 C ATOM 733 CD2 LEU A 44 11.543 -12.794 3.117 1.00 0.00 C ATOM 0 H LEU A 44 8.601 -12.355 6.102 1.00 0.00 H new ATOM 0 HA LEU A 44 9.187 -13.756 3.763 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.647 -12.530 5.671 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.873 -14.172 6.240 1.00 0.00 H new ATOM 0 HG LEU A 44 12.695 -13.648 4.728 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.381 -15.386 2.975 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.775 -15.939 4.554 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.632 -15.394 3.304 1.00 0.00 H new ATOM 0 HD21 LEU A 44 12.311 -12.972 2.365 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.558 -12.921 2.667 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.638 -11.778 3.500 1.00 0.00 H new ATOM 745 N GLU A 45 8.701 -15.807 6.304 1.00 0.00 N ATOM 746 CA GLU A 45 8.431 -17.241 6.604 1.00 0.00 C ATOM 747 C GLU A 45 7.184 -17.710 5.849 1.00 0.00 C ATOM 748 O GLU A 45 7.110 -18.832 5.389 1.00 0.00 O ATOM 749 CB GLU A 45 8.208 -17.410 8.109 1.00 0.00 C ATOM 750 CG GLU A 45 8.215 -18.898 8.464 1.00 0.00 C ATOM 751 CD GLU A 45 8.068 -19.061 9.979 1.00 0.00 C ATOM 752 OE1 GLU A 45 8.302 -18.094 10.684 1.00 0.00 O ATOM 753 OE2 GLU A 45 7.725 -20.151 10.407 1.00 0.00 O ATOM 0 H GLU A 45 8.666 -15.180 7.108 1.00 0.00 H new ATOM 0 HA GLU A 45 9.285 -17.840 6.287 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.989 -16.890 8.663 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.258 -16.961 8.399 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.400 -19.409 7.952 1.00 0.00 H new ATOM 0 HG3 GLU A 45 9.143 -19.359 8.126 1.00 0.00 H new ATOM 760 N GLU A 46 6.196 -16.865 5.730 1.00 0.00 N ATOM 761 CA GLU A 46 4.943 -17.264 5.019 1.00 0.00 C ATOM 762 C GLU A 46 5.055 -16.960 3.520 1.00 0.00 C ATOM 763 O GLU A 46 4.296 -16.178 2.983 1.00 0.00 O ATOM 764 CB GLU A 46 3.765 -16.484 5.605 1.00 0.00 C ATOM 765 CG GLU A 46 3.519 -16.938 7.045 1.00 0.00 C ATOM 766 CD GLU A 46 2.960 -18.362 7.044 1.00 0.00 C ATOM 767 OE1 GLU A 46 2.421 -18.765 6.026 1.00 0.00 O ATOM 768 OE2 GLU A 46 3.081 -19.026 8.061 1.00 0.00 O ATOM 0 H GLU A 46 6.201 -15.913 6.095 1.00 0.00 H new ATOM 0 HA GLU A 46 4.788 -18.335 5.149 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.975 -15.415 5.580 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.871 -16.648 5.003 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.449 -16.902 7.613 1.00 0.00 H new ATOM 0 HG3 GLU A 46 2.819 -16.262 7.536 1.00 0.00 H new ATOM 775 N ILE A 47 5.988 -17.585 2.839 1.00 0.00 N ATOM 776 CA ILE A 47 6.152 -17.354 1.364 1.00 0.00 C ATOM 777 C ILE A 47 6.073 -18.697 0.637 1.00 0.00 C ATOM 778 O ILE A 47 6.899 -19.566 0.834 1.00 0.00 O ATOM 779 CB ILE A 47 7.520 -16.720 1.091 1.00 0.00 C ATOM 780 CG1 ILE A 47 7.649 -15.389 1.863 1.00 0.00 C ATOM 781 CG2 ILE A 47 7.687 -16.485 -0.415 1.00 0.00 C ATOM 782 CD1 ILE A 47 6.966 -14.230 1.113 1.00 0.00 C ATOM 0 H ILE A 47 6.648 -18.250 3.243 1.00 0.00 H new ATOM 0 HA ILE A 47 5.364 -16.689 1.011 1.00 0.00 H new ATOM 0 HB ILE A 47 8.305 -17.395 1.432 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.203 -15.496 2.852 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.703 -15.155 2.013 1.00 0.00 H new ATOM 0 HG21 ILE A 47 8.661 -16.034 -0.607 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.618 -17.437 -0.942 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.902 -15.817 -0.768 1.00 0.00 H new ATOM 0 HD11 ILE A 47 7.077 -13.310 1.686 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.430 -14.106 0.135 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.907 -14.453 0.987 1.00 0.00 H new ATOM 794 N LYS A 48 5.084 -18.880 -0.202 1.00 0.00 N ATOM 795 CA LYS A 48 4.953 -20.175 -0.939 1.00 0.00 C ATOM 796 C LYS A 48 5.605 -20.052 -2.319 1.00 0.00 C ATOM 797 O LYS A 48 6.490 -20.808 -2.667 1.00 0.00 O ATOM 798 CB LYS A 48 3.470 -20.515 -1.109 1.00 0.00 C ATOM 799 CG LYS A 48 2.874 -20.898 0.247 1.00 0.00 C ATOM 800 CD LYS A 48 1.348 -20.982 0.135 1.00 0.00 C ATOM 801 CE LYS A 48 0.959 -21.944 -0.993 1.00 0.00 C ATOM 802 NZ LYS A 48 -0.443 -22.407 -0.788 1.00 0.00 N ATOM 0 H LYS A 48 4.362 -18.189 -0.408 1.00 0.00 H new ATOM 0 HA LYS A 48 5.449 -20.964 -0.373 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.936 -19.661 -1.524 1.00 0.00 H new ATOM 0 HB3 LYS A 48 3.353 -21.338 -1.815 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.278 -21.856 0.575 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.153 -20.160 0.999 1.00 0.00 H new ATOM 0 HD2 LYS A 48 0.924 -21.324 1.079 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.934 -19.993 -0.060 1.00 0.00 H new ATOM 0 HE2 LYS A 48 1.052 -21.446 -1.958 1.00 0.00 H new ATOM 0 HE3 LYS A 48 1.637 -22.797 -1.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -0.708 -23.060 -1.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -0.517 -22.897 0.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -1.084 -21.588 -0.794 1.00 0.00 H new ATOM 816 N GLU A 49 5.169 -19.108 -3.112 1.00 0.00 N ATOM 817 CA GLU A 49 5.759 -18.942 -4.474 1.00 0.00 C ATOM 818 C GLU A 49 7.078 -18.167 -4.368 1.00 0.00 C ATOM 819 O GLU A 49 7.088 -16.978 -4.118 1.00 0.00 O ATOM 820 CB GLU A 49 4.764 -18.183 -5.367 1.00 0.00 C ATOM 821 CG GLU A 49 5.019 -18.514 -6.842 1.00 0.00 C ATOM 822 CD GLU A 49 4.619 -19.965 -7.121 1.00 0.00 C ATOM 823 OE1 GLU A 49 3.442 -20.203 -7.335 1.00 0.00 O ATOM 824 OE2 GLU A 49 5.496 -20.812 -7.115 1.00 0.00 O ATOM 0 H GLU A 49 4.431 -18.445 -2.876 1.00 0.00 H new ATOM 0 HA GLU A 49 5.959 -19.919 -4.914 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.743 -18.453 -5.097 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.864 -17.110 -5.205 1.00 0.00 H new ATOM 0 HG2 GLU A 49 4.448 -17.840 -7.480 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.072 -18.364 -7.082 1.00 0.00 H new ATOM 831 N GLN A 50 8.190 -18.826 -4.551 1.00 0.00 N ATOM 832 CA GLN A 50 9.502 -18.120 -4.457 1.00 0.00 C ATOM 833 C GLN A 50 9.821 -17.412 -5.779 1.00 0.00 C ATOM 834 O GLN A 50 10.623 -16.500 -5.824 1.00 0.00 O ATOM 835 CB GLN A 50 10.602 -19.141 -4.153 1.00 0.00 C ATOM 836 CG GLN A 50 11.943 -18.419 -4.010 1.00 0.00 C ATOM 837 CD GLN A 50 12.982 -19.382 -3.431 1.00 0.00 C ATOM 838 OE1 GLN A 50 14.025 -18.962 -2.969 1.00 0.00 O ATOM 839 NE2 GLN A 50 12.741 -20.664 -3.436 1.00 0.00 N ATOM 0 H GLN A 50 8.248 -19.822 -4.761 1.00 0.00 H new ATOM 0 HA GLN A 50 9.450 -17.377 -3.661 1.00 0.00 H new ATOM 0 HB2 GLN A 50 10.368 -19.681 -3.236 1.00 0.00 H new ATOM 0 HB3 GLN A 50 10.658 -19.880 -4.952 1.00 0.00 H new ATOM 0 HG2 GLN A 50 12.275 -18.050 -4.980 1.00 0.00 H new ATOM 0 HG3 GLN A 50 11.833 -17.551 -3.359 1.00 0.00 H new ATOM 0 HE21 GLN A 50 11.866 -21.017 -3.824 1.00 0.00 H new ATOM 0 HE22 GLN A 50 13.428 -21.313 -3.052 1.00 0.00 H new ATOM 848 N GLU A 51 9.219 -17.832 -6.858 1.00 0.00 N ATOM 849 CA GLU A 51 9.513 -17.187 -8.174 1.00 0.00 C ATOM 850 C GLU A 51 8.899 -15.784 -8.240 1.00 0.00 C ATOM 851 O GLU A 51 9.377 -14.935 -8.966 1.00 0.00 O ATOM 852 CB GLU A 51 8.981 -18.052 -9.319 1.00 0.00 C ATOM 853 CG GLU A 51 9.816 -19.330 -9.425 1.00 0.00 C ATOM 854 CD GLU A 51 11.179 -19.002 -10.037 1.00 0.00 C ATOM 855 OE1 GLU A 51 11.217 -18.679 -11.213 1.00 0.00 O ATOM 856 OE2 GLU A 51 12.162 -19.080 -9.319 1.00 0.00 O ATOM 0 H GLU A 51 8.538 -18.591 -6.888 1.00 0.00 H new ATOM 0 HA GLU A 51 10.594 -17.094 -8.276 1.00 0.00 H new ATOM 0 HB2 GLU A 51 7.935 -18.302 -9.144 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.024 -17.498 -10.257 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.946 -19.774 -8.438 1.00 0.00 H new ATOM 0 HG3 GLU A 51 9.297 -20.066 -10.040 1.00 0.00 H new ATOM 863 N VAL A 52 7.882 -15.504 -7.476 1.00 0.00 N ATOM 864 CA VAL A 52 7.313 -14.126 -7.505 1.00 0.00 C ATOM 865 C VAL A 52 8.260 -13.208 -6.735 1.00 0.00 C ATOM 866 O VAL A 52 8.636 -12.156 -7.213 1.00 0.00 O ATOM 867 CB VAL A 52 5.934 -14.113 -6.840 1.00 0.00 C ATOM 868 CG1 VAL A 52 5.442 -12.668 -6.714 1.00 0.00 C ATOM 869 CG2 VAL A 52 4.947 -14.912 -7.694 1.00 0.00 C ATOM 0 H VAL A 52 7.424 -16.158 -6.841 1.00 0.00 H new ATOM 0 HA VAL A 52 7.204 -13.788 -8.535 1.00 0.00 H new ATOM 0 HB VAL A 52 6.005 -14.562 -5.849 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.460 -12.658 -6.241 1.00 0.00 H new ATOM 0 HG12 VAL A 52 6.144 -12.096 -6.106 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.372 -12.220 -7.705 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.965 -14.903 -7.220 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.876 -14.463 -8.685 1.00 0.00 H new ATOM 0 HG23 VAL A 52 5.295 -15.941 -7.786 1.00 0.00 H new ATOM 879 N VAL A 53 8.663 -13.590 -5.557 1.00 0.00 N ATOM 880 CA VAL A 53 9.598 -12.724 -4.790 1.00 0.00 C ATOM 881 C VAL A 53 10.914 -12.618 -5.560 1.00 0.00 C ATOM 882 O VAL A 53 11.587 -11.608 -5.530 1.00 0.00 O ATOM 883 CB VAL A 53 9.855 -13.342 -3.415 1.00 0.00 C ATOM 884 CG1 VAL A 53 10.909 -12.519 -2.672 1.00 0.00 C ATOM 885 CG2 VAL A 53 8.555 -13.349 -2.609 1.00 0.00 C ATOM 0 H VAL A 53 8.388 -14.457 -5.095 1.00 0.00 H new ATOM 0 HA VAL A 53 9.165 -11.732 -4.660 1.00 0.00 H new ATOM 0 HB VAL A 53 10.214 -14.364 -3.539 1.00 0.00 H new ATOM 0 HG11 VAL A 53 11.091 -12.961 -1.692 1.00 0.00 H new ATOM 0 HG12 VAL A 53 11.836 -12.513 -3.245 1.00 0.00 H new ATOM 0 HG13 VAL A 53 10.552 -11.497 -2.548 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.737 -13.789 -1.629 1.00 0.00 H new ATOM 0 HG22 VAL A 53 8.197 -12.327 -2.487 1.00 0.00 H new ATOM 0 HG23 VAL A 53 7.803 -13.936 -3.136 1.00 0.00 H new ATOM 895 N ASP A 54 11.287 -13.661 -6.248 1.00 0.00 N ATOM 896 CA ASP A 54 12.558 -13.628 -7.022 1.00 0.00 C ATOM 897 C ASP A 54 12.504 -12.497 -8.051 1.00 0.00 C ATOM 898 O ASP A 54 13.439 -11.736 -8.198 1.00 0.00 O ATOM 899 CB ASP A 54 12.751 -14.961 -7.747 1.00 0.00 C ATOM 900 CG ASP A 54 14.028 -14.904 -8.589 1.00 0.00 C ATOM 901 OD1 ASP A 54 13.945 -14.468 -9.725 1.00 0.00 O ATOM 902 OD2 ASP A 54 15.066 -15.298 -8.083 1.00 0.00 O ATOM 0 H ASP A 54 10.765 -14.536 -6.307 1.00 0.00 H new ATOM 0 HA ASP A 54 13.390 -13.460 -6.339 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.815 -15.774 -7.024 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.891 -15.168 -8.384 1.00 0.00 H new ATOM 907 N LYS A 55 11.421 -12.389 -8.777 1.00 0.00 N ATOM 908 CA LYS A 55 11.325 -11.316 -9.807 1.00 0.00 C ATOM 909 C LYS A 55 11.287 -9.947 -9.128 1.00 0.00 C ATOM 910 O LYS A 55 11.722 -8.962 -9.692 1.00 0.00 O ATOM 911 CB LYS A 55 10.073 -11.515 -10.662 1.00 0.00 C ATOM 912 CG LYS A 55 10.081 -10.527 -11.832 1.00 0.00 C ATOM 913 CD LYS A 55 9.070 -10.977 -12.891 1.00 0.00 C ATOM 914 CE LYS A 55 7.682 -11.104 -12.258 1.00 0.00 C ATOM 915 NZ LYS A 55 6.650 -11.158 -13.332 1.00 0.00 N ATOM 0 H LYS A 55 10.604 -12.995 -8.701 1.00 0.00 H new ATOM 0 HA LYS A 55 12.201 -11.367 -10.454 1.00 0.00 H new ATOM 0 HB2 LYS A 55 10.037 -12.538 -11.038 1.00 0.00 H new ATOM 0 HB3 LYS A 55 9.180 -11.367 -10.055 1.00 0.00 H new ATOM 0 HG2 LYS A 55 9.831 -9.527 -11.478 1.00 0.00 H new ATOM 0 HG3 LYS A 55 11.079 -10.471 -12.267 1.00 0.00 H new ATOM 0 HD2 LYS A 55 9.042 -10.258 -13.710 1.00 0.00 H new ATOM 0 HD3 LYS A 55 9.375 -11.933 -13.316 1.00 0.00 H new ATOM 0 HE2 LYS A 55 7.631 -12.003 -11.644 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.492 -10.257 -11.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 5.707 -11.244 -12.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 6.694 -10.288 -13.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 6.828 -11.980 -13.944 1.00 0.00 H new ATOM 929 N VAL A 56 10.818 -9.864 -7.913 1.00 0.00 N ATOM 930 CA VAL A 56 10.818 -8.549 -7.217 1.00 0.00 C ATOM 931 C VAL A 56 12.275 -8.137 -7.004 1.00 0.00 C ATOM 932 O VAL A 56 12.701 -7.081 -7.428 1.00 0.00 O ATOM 933 CB VAL A 56 10.099 -8.687 -5.868 1.00 0.00 C ATOM 934 CG1 VAL A 56 10.384 -7.464 -4.989 1.00 0.00 C ATOM 935 CG2 VAL A 56 8.592 -8.793 -6.119 1.00 0.00 C ATOM 0 H VAL A 56 10.438 -10.644 -7.377 1.00 0.00 H new ATOM 0 HA VAL A 56 10.299 -7.794 -7.807 1.00 0.00 H new ATOM 0 HB VAL A 56 10.459 -9.580 -5.356 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.869 -7.574 -4.035 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.457 -7.383 -4.815 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.029 -6.564 -5.492 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.071 -8.892 -5.167 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.245 -7.896 -6.632 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.387 -9.667 -6.737 1.00 0.00 H new ATOM 945 N MET A 57 13.045 -8.967 -6.355 1.00 0.00 N ATOM 946 CA MET A 57 14.475 -8.624 -6.125 1.00 0.00 C ATOM 947 C MET A 57 15.126 -8.246 -7.456 1.00 0.00 C ATOM 948 O MET A 57 16.054 -7.462 -7.498 1.00 0.00 O ATOM 949 CB MET A 57 15.204 -9.826 -5.521 1.00 0.00 C ATOM 950 CG MET A 57 14.600 -10.160 -4.156 1.00 0.00 C ATOM 951 SD MET A 57 14.976 -8.829 -2.989 1.00 0.00 S ATOM 952 CE MET A 57 13.780 -9.298 -1.714 1.00 0.00 C ATOM 0 H MET A 57 12.746 -9.865 -5.975 1.00 0.00 H new ATOM 0 HA MET A 57 14.539 -7.782 -5.435 1.00 0.00 H new ATOM 0 HB2 MET A 57 15.122 -10.686 -6.186 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.266 -9.605 -5.416 1.00 0.00 H new ATOM 0 HG2 MET A 57 13.521 -10.286 -4.245 1.00 0.00 H new ATOM 0 HG3 MET A 57 15.002 -11.104 -3.789 1.00 0.00 H new ATOM 0 HE1 MET A 57 14.056 -8.833 -0.768 1.00 0.00 H new ATOM 0 HE2 MET A 57 12.785 -8.962 -2.007 1.00 0.00 H new ATOM 0 HE3 MET A 57 13.778 -10.382 -1.599 1.00 0.00 H new ATOM 962 N GLU A 58 14.631 -8.766 -8.554 1.00 0.00 N ATOM 963 CA GLU A 58 15.205 -8.398 -9.882 1.00 0.00 C ATOM 964 C GLU A 58 14.511 -7.130 -10.383 1.00 0.00 C ATOM 965 O GLU A 58 15.123 -6.290 -11.009 1.00 0.00 O ATOM 966 CB GLU A 58 15.018 -9.543 -10.881 1.00 0.00 C ATOM 967 CG GLU A 58 15.936 -9.327 -12.085 1.00 0.00 C ATOM 968 CD GLU A 58 15.687 -10.426 -13.119 1.00 0.00 C ATOM 969 OE1 GLU A 58 14.535 -10.641 -13.460 1.00 0.00 O ATOM 970 OE2 GLU A 58 16.651 -11.034 -13.554 1.00 0.00 O ATOM 0 H GLU A 58 13.856 -9.428 -8.585 1.00 0.00 H new ATOM 0 HA GLU A 58 16.275 -8.214 -9.781 1.00 0.00 H new ATOM 0 HB2 GLU A 58 15.245 -10.496 -10.404 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.979 -9.589 -11.207 1.00 0.00 H new ATOM 0 HG2 GLU A 58 15.750 -8.348 -12.527 1.00 0.00 H new ATOM 0 HG3 GLU A 58 16.979 -9.341 -11.768 1.00 0.00 H new ATOM 977 N THR A 59 13.249 -6.966 -10.095 1.00 0.00 N ATOM 978 CA THR A 59 12.548 -5.730 -10.543 1.00 0.00 C ATOM 979 C THR A 59 13.137 -4.547 -9.778 1.00 0.00 C ATOM 980 O THR A 59 13.478 -3.538 -10.363 1.00 0.00 O ATOM 981 CB THR A 59 11.045 -5.844 -10.276 1.00 0.00 C ATOM 982 OG1 THR A 59 10.591 -7.129 -10.678 1.00 0.00 O ATOM 983 CG2 THR A 59 10.299 -4.768 -11.066 1.00 0.00 C ATOM 0 H THR A 59 12.676 -7.629 -9.573 1.00 0.00 H new ATOM 0 HA THR A 59 12.686 -5.588 -11.615 1.00 0.00 H new ATOM 0 HB THR A 59 10.854 -5.706 -9.212 1.00 0.00 H new ATOM 0 HG1 THR A 59 10.843 -7.791 -10.001 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.229 -4.852 -10.874 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.647 -3.782 -10.757 1.00 0.00 H new ATOM 0 HG23 THR A 59 10.488 -4.902 -12.131 1.00 0.00 H new ATOM 991 N LEU A 60 13.305 -4.657 -8.492 1.00 0.00 N ATOM 992 CA LEU A 60 13.923 -3.532 -7.739 1.00 0.00 C ATOM 993 C LEU A 60 15.337 -3.313 -8.275 1.00 0.00 C ATOM 994 O LEU A 60 15.684 -2.235 -8.714 1.00 0.00 O ATOM 995 CB LEU A 60 13.999 -3.893 -6.250 1.00 0.00 C ATOM 996 CG LEU A 60 12.599 -3.805 -5.605 1.00 0.00 C ATOM 997 CD1 LEU A 60 12.548 -4.688 -4.354 1.00 0.00 C ATOM 998 CD2 LEU A 60 12.290 -2.357 -5.198 1.00 0.00 C ATOM 0 H LEU A 60 13.044 -5.469 -7.933 1.00 0.00 H new ATOM 0 HA LEU A 60 13.326 -2.628 -7.860 1.00 0.00 H new ATOM 0 HB2 LEU A 60 14.398 -4.901 -6.133 1.00 0.00 H new ATOM 0 HB3 LEU A 60 14.685 -3.217 -5.740 1.00 0.00 H new ATOM 0 HG LEU A 60 11.862 -4.144 -6.333 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.558 -4.622 -3.902 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.753 -5.722 -4.630 1.00 0.00 H new ATOM 0 HD13 LEU A 60 13.296 -4.348 -3.638 1.00 0.00 H new ATOM 0 HD21 LEU A 60 11.300 -2.310 -4.745 1.00 0.00 H new ATOM 0 HD22 LEU A 60 13.035 -2.014 -4.480 1.00 0.00 H new ATOM 0 HD23 LEU A 60 12.316 -1.718 -6.080 1.00 0.00 H new ATOM 1010 N ASP A 61 16.158 -4.328 -8.247 1.00 0.00 N ATOM 1011 CA ASP A 61 17.547 -4.172 -8.760 1.00 0.00 C ATOM 1012 C ASP A 61 17.508 -3.610 -10.184 1.00 0.00 C ATOM 1013 O ASP A 61 18.459 -3.012 -10.645 1.00 0.00 O ATOM 1014 CB ASP A 61 18.244 -5.534 -8.771 1.00 0.00 C ATOM 1015 CG ASP A 61 19.684 -5.365 -9.258 1.00 0.00 C ATOM 1016 OD1 ASP A 61 20.484 -4.832 -8.507 1.00 0.00 O ATOM 1017 OD2 ASP A 61 19.963 -5.771 -10.375 1.00 0.00 O ATOM 0 H ASP A 61 15.927 -5.256 -7.892 1.00 0.00 H new ATOM 0 HA ASP A 61 18.096 -3.487 -8.114 1.00 0.00 H new ATOM 0 HB2 ASP A 61 18.235 -5.967 -7.771 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.707 -6.224 -9.422 1.00 0.00 H new ATOM 1022 N GLU A 62 16.414 -3.798 -10.887 1.00 0.00 N ATOM 1023 CA GLU A 62 16.312 -3.276 -12.290 1.00 0.00 C ATOM 1024 C GLU A 62 15.522 -1.975 -12.280 1.00 0.00 C ATOM 1025 O GLU A 62 14.707 -1.704 -13.139 1.00 0.00 O ATOM 1026 CB GLU A 62 15.601 -4.273 -13.154 1.00 0.00 C ATOM 1027 CG GLU A 62 16.529 -5.446 -13.471 1.00 0.00 C ATOM 1028 CD GLU A 62 15.783 -6.471 -14.327 1.00 0.00 C ATOM 1029 OE1 GLU A 62 14.567 -6.390 -14.388 1.00 0.00 O ATOM 1030 OE2 GLU A 62 16.440 -7.319 -14.908 1.00 0.00 O ATOM 0 H GLU A 62 15.587 -4.291 -10.550 1.00 0.00 H new ATOM 0 HA GLU A 62 17.313 -3.105 -12.685 1.00 0.00 H new ATOM 0 HB2 GLU A 62 14.706 -4.633 -12.647 1.00 0.00 H new ATOM 0 HB3 GLU A 62 15.274 -3.797 -14.079 1.00 0.00 H new ATOM 0 HG2 GLU A 62 17.414 -5.091 -13.999 1.00 0.00 H new ATOM 0 HG3 GLU A 62 16.874 -5.910 -12.547 1.00 0.00 H new ATOM 1037 N ASP A 63 15.782 -1.185 -11.315 1.00 0.00 N ATOM 1038 CA ASP A 63 15.093 0.132 -11.185 1.00 0.00 C ATOM 1039 C ASP A 63 15.052 0.827 -12.546 1.00 0.00 C ATOM 1040 O ASP A 63 14.101 1.500 -12.888 1.00 0.00 O ATOM 1041 CB ASP A 63 15.916 1.005 -10.230 1.00 0.00 C ATOM 1042 CG ASP A 63 17.309 1.236 -10.816 1.00 0.00 C ATOM 1043 OD1 ASP A 63 17.922 0.268 -11.233 1.00 0.00 O ATOM 1044 OD2 ASP A 63 17.738 2.378 -10.838 1.00 0.00 O ATOM 0 H ASP A 63 16.460 -1.384 -10.579 1.00 0.00 H new ATOM 0 HA ASP A 63 14.078 -0.015 -10.815 1.00 0.00 H new ATOM 0 HB2 ASP A 63 15.415 1.960 -10.071 1.00 0.00 H new ATOM 0 HB3 ASP A 63 15.996 0.521 -9.257 1.00 0.00 H new ATOM 1049 N GLY A 64 16.073 0.624 -13.331 1.00 0.00 N ATOM 1050 CA GLY A 64 16.132 1.220 -14.703 1.00 0.00 C ATOM 1051 C GLY A 64 15.874 2.736 -14.687 1.00 0.00 C ATOM 1052 O GLY A 64 16.043 3.393 -15.695 1.00 0.00 O ATOM 0 H GLY A 64 16.885 0.061 -13.079 1.00 0.00 H new ATOM 0 HA2 GLY A 64 17.111 1.024 -15.141 1.00 0.00 H new ATOM 0 HA3 GLY A 64 15.394 0.734 -15.341 1.00 0.00 H new ATOM 1056 N ASP A 65 15.472 3.307 -13.570 1.00 0.00 N ATOM 1057 CA ASP A 65 15.211 4.796 -13.524 1.00 0.00 C ATOM 1058 C ASP A 65 16.311 5.560 -12.737 1.00 0.00 C ATOM 1059 O ASP A 65 16.585 6.700 -13.057 1.00 0.00 O ATOM 1060 CB ASP A 65 13.856 5.032 -12.849 1.00 0.00 C ATOM 1061 CG ASP A 65 13.724 4.108 -11.636 1.00 0.00 C ATOM 1062 OD1 ASP A 65 14.446 4.317 -10.675 1.00 0.00 O ATOM 1063 OD2 ASP A 65 12.903 3.207 -11.690 1.00 0.00 O ATOM 0 H ASP A 65 15.313 2.814 -12.692 1.00 0.00 H new ATOM 0 HA ASP A 65 15.215 5.174 -14.546 1.00 0.00 H new ATOM 0 HB2 ASP A 65 13.769 6.073 -12.538 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.048 4.841 -13.555 1.00 0.00 H new ATOM 1068 N GLY A 66 16.945 4.990 -11.725 1.00 0.00 N ATOM 1069 CA GLY A 66 18.000 5.744 -10.968 1.00 0.00 C ATOM 1070 C GLY A 66 17.429 6.187 -9.618 1.00 0.00 C ATOM 1071 O GLY A 66 18.152 6.373 -8.659 1.00 0.00 O ATOM 0 H GLY A 66 16.775 4.040 -11.396 1.00 0.00 H new ATOM 0 HA2 GLY A 66 18.877 5.114 -10.817 1.00 0.00 H new ATOM 0 HA3 GLY A 66 18.326 6.612 -11.541 1.00 0.00 H new ATOM 1075 N GLU A 67 16.130 6.340 -9.530 1.00 0.00 N ATOM 1076 CA GLU A 67 15.506 6.751 -8.231 1.00 0.00 C ATOM 1077 C GLU A 67 14.113 6.125 -8.114 1.00 0.00 C ATOM 1078 O GLU A 67 13.314 6.215 -9.025 1.00 0.00 O ATOM 1079 CB GLU A 67 15.382 8.276 -8.180 1.00 0.00 C ATOM 1080 CG GLU A 67 16.750 8.917 -8.421 1.00 0.00 C ATOM 1081 CD GLU A 67 16.664 10.419 -8.146 1.00 0.00 C ATOM 1082 OE1 GLU A 67 16.879 10.807 -7.010 1.00 0.00 O ATOM 1083 OE2 GLU A 67 16.383 11.156 -9.077 1.00 0.00 O ATOM 0 H GLU A 67 15.475 6.199 -10.299 1.00 0.00 H new ATOM 0 HA GLU A 67 16.131 6.410 -7.406 1.00 0.00 H new ATOM 0 HB2 GLU A 67 14.673 8.617 -8.934 1.00 0.00 H new ATOM 0 HB3 GLU A 67 14.991 8.586 -7.211 1.00 0.00 H new ATOM 0 HG2 GLU A 67 17.497 8.460 -7.772 1.00 0.00 H new ATOM 0 HG3 GLU A 67 17.070 8.742 -9.448 1.00 0.00 H new ATOM 1090 N CYS A 68 13.805 5.495 -7.002 1.00 0.00 N ATOM 1091 CA CYS A 68 12.452 4.870 -6.834 1.00 0.00 C ATOM 1092 C CYS A 68 11.585 5.778 -5.958 1.00 0.00 C ATOM 1093 O CYS A 68 11.958 6.137 -4.859 1.00 0.00 O ATOM 1094 CB CYS A 68 12.599 3.499 -6.166 1.00 0.00 C ATOM 1095 SG CYS A 68 13.992 2.614 -6.908 1.00 0.00 S ATOM 0 H CYS A 68 14.432 5.387 -6.205 1.00 0.00 H new ATOM 0 HA CYS A 68 11.982 4.745 -7.810 1.00 0.00 H new ATOM 0 HB2 CYS A 68 12.760 3.620 -5.095 1.00 0.00 H new ATOM 0 HB3 CYS A 68 11.682 2.923 -6.288 1.00 0.00 H new ATOM 0 HG CYS A 68 13.874 1.341 -6.670 1.00 0.00 H new ATOM 1101 N ASP A 69 10.432 6.157 -6.439 1.00 0.00 N ATOM 1102 CA ASP A 69 9.544 7.049 -5.637 1.00 0.00 C ATOM 1103 C ASP A 69 8.748 6.215 -4.628 1.00 0.00 C ATOM 1104 O ASP A 69 8.929 5.019 -4.516 1.00 0.00 O ATOM 1105 CB ASP A 69 8.577 7.774 -6.578 1.00 0.00 C ATOM 1106 CG ASP A 69 7.947 8.966 -5.853 1.00 0.00 C ATOM 1107 OD1 ASP A 69 8.328 9.215 -4.721 1.00 0.00 O ATOM 1108 OD2 ASP A 69 7.094 9.609 -6.443 1.00 0.00 O ATOM 0 H ASP A 69 10.066 5.888 -7.352 1.00 0.00 H new ATOM 0 HA ASP A 69 10.150 7.778 -5.099 1.00 0.00 H new ATOM 0 HB2 ASP A 69 9.107 8.116 -7.467 1.00 0.00 H new ATOM 0 HB3 ASP A 69 7.799 7.088 -6.914 1.00 0.00 H new ATOM 1113 N PHE A 70 7.860 6.839 -3.901 1.00 0.00 N ATOM 1114 CA PHE A 70 7.043 6.082 -2.910 1.00 0.00 C ATOM 1115 C PHE A 70 5.973 5.283 -3.658 1.00 0.00 C ATOM 1116 O PHE A 70 5.570 4.221 -3.228 1.00 0.00 O ATOM 1117 CB PHE A 70 6.387 7.061 -1.932 1.00 0.00 C ATOM 1118 CG PHE A 70 5.763 6.305 -0.784 1.00 0.00 C ATOM 1119 CD1 PHE A 70 4.540 5.645 -0.960 1.00 0.00 C ATOM 1120 CD2 PHE A 70 6.405 6.269 0.460 1.00 0.00 C ATOM 1121 CE1 PHE A 70 3.960 4.949 0.108 1.00 0.00 C ATOM 1122 CE2 PHE A 70 5.825 5.573 1.527 1.00 0.00 C ATOM 1123 CZ PHE A 70 4.603 4.913 1.351 1.00 0.00 C ATOM 0 H PHE A 70 7.666 7.839 -3.951 1.00 0.00 H new ATOM 0 HA PHE A 70 7.677 5.398 -2.346 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.130 7.763 -1.554 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.627 7.648 -2.447 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.044 5.673 -1.919 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.348 6.778 0.596 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.017 4.440 -0.027 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.320 5.545 2.486 1.00 0.00 H new ATOM 0 HZ PHE A 70 4.156 4.376 2.175 1.00 0.00 H new ATOM 1133 N GLN A 71 5.519 5.771 -4.777 1.00 0.00 N ATOM 1134 CA GLN A 71 4.490 5.017 -5.547 1.00 0.00 C ATOM 1135 C GLN A 71 5.079 3.668 -5.971 1.00 0.00 C ATOM 1136 O GLN A 71 4.402 2.660 -5.980 1.00 0.00 O ATOM 1137 CB GLN A 71 4.095 5.818 -6.790 1.00 0.00 C ATOM 1138 CG GLN A 71 2.963 5.098 -7.526 1.00 0.00 C ATOM 1139 CD GLN A 71 2.524 5.934 -8.730 1.00 0.00 C ATOM 1140 OE1 GLN A 71 2.577 5.475 -9.854 1.00 0.00 O ATOM 1141 NE2 GLN A 71 2.091 7.150 -8.541 1.00 0.00 N ATOM 0 H GLN A 71 5.814 6.655 -5.191 1.00 0.00 H new ATOM 0 HA GLN A 71 3.607 4.856 -4.929 1.00 0.00 H new ATOM 0 HB2 GLN A 71 3.776 6.820 -6.503 1.00 0.00 H new ATOM 0 HB3 GLN A 71 4.955 5.934 -7.449 1.00 0.00 H new ATOM 0 HG2 GLN A 71 3.297 4.114 -7.855 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.120 4.940 -6.853 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.047 7.535 -7.597 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.797 7.716 -9.337 1.00 0.00 H new ATOM 1150 N GLU A 72 6.338 3.640 -6.314 1.00 0.00 N ATOM 1151 CA GLU A 72 6.971 2.354 -6.727 1.00 0.00 C ATOM 1152 C GLU A 72 7.170 1.454 -5.502 1.00 0.00 C ATOM 1153 O GLU A 72 7.206 0.246 -5.606 1.00 0.00 O ATOM 1154 CB GLU A 72 8.321 2.630 -7.392 1.00 0.00 C ATOM 1155 CG GLU A 72 8.181 3.803 -8.365 1.00 0.00 C ATOM 1156 CD GLU A 72 9.503 4.012 -9.106 1.00 0.00 C ATOM 1157 OE1 GLU A 72 10.397 3.203 -8.923 1.00 0.00 O ATOM 1158 OE2 GLU A 72 9.598 4.978 -9.845 1.00 0.00 O ATOM 0 H GLU A 72 6.956 4.451 -6.326 1.00 0.00 H new ATOM 0 HA GLU A 72 6.319 1.848 -7.439 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.071 2.859 -6.635 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.665 1.742 -7.923 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.380 3.605 -9.077 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.909 4.709 -7.823 1.00 0.00 H new ATOM 1165 N PHE A 73 7.260 2.041 -4.338 1.00 0.00 N ATOM 1166 CA PHE A 73 7.420 1.239 -3.086 1.00 0.00 C ATOM 1167 C PHE A 73 6.084 0.573 -2.737 1.00 0.00 C ATOM 1168 O PHE A 73 6.056 -0.585 -2.374 1.00 0.00 O ATOM 1169 CB PHE A 73 7.910 2.148 -1.946 1.00 0.00 C ATOM 1170 CG PHE A 73 7.661 1.503 -0.595 1.00 0.00 C ATOM 1171 CD1 PHE A 73 8.149 0.218 -0.330 1.00 0.00 C ATOM 1172 CD2 PHE A 73 6.945 2.196 0.393 1.00 0.00 C ATOM 1173 CE1 PHE A 73 7.922 -0.374 0.919 1.00 0.00 C ATOM 1174 CE2 PHE A 73 6.720 1.604 1.641 1.00 0.00 C ATOM 1175 CZ PHE A 73 7.208 0.319 1.904 1.00 0.00 C ATOM 0 H PHE A 73 7.229 3.051 -4.198 1.00 0.00 H new ATOM 0 HA PHE A 73 8.165 0.457 -3.234 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.975 2.349 -2.067 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.397 3.109 -1.995 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.701 -0.317 -1.089 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.567 3.187 0.190 1.00 0.00 H new ATOM 0 HE1 PHE A 73 8.298 -1.366 1.122 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.170 2.139 2.401 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.034 -0.138 2.867 1.00 0.00 H new ATOM 1185 N MET A 74 4.983 1.248 -2.856 1.00 0.00 N ATOM 1186 CA MET A 74 3.702 0.558 -2.535 1.00 0.00 C ATOM 1187 C MET A 74 3.529 -0.598 -3.533 1.00 0.00 C ATOM 1188 O MET A 74 3.244 -1.711 -3.139 1.00 0.00 O ATOM 1189 CB MET A 74 2.524 1.556 -2.611 1.00 0.00 C ATOM 1190 CG MET A 74 1.563 1.329 -1.437 1.00 0.00 C ATOM 1191 SD MET A 74 2.408 1.733 0.113 1.00 0.00 S ATOM 1192 CE MET A 74 1.498 0.589 1.180 1.00 0.00 C ATOM 0 H MET A 74 4.908 2.221 -3.153 1.00 0.00 H new ATOM 0 HA MET A 74 3.719 0.162 -1.520 1.00 0.00 H new ATOM 0 HB2 MET A 74 2.902 2.578 -2.589 1.00 0.00 H new ATOM 0 HB3 MET A 74 1.993 1.432 -3.555 1.00 0.00 H new ATOM 0 HG2 MET A 74 0.675 1.950 -1.553 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.227 0.292 -1.422 1.00 0.00 H new ATOM 0 HE1 MET A 74 2.018 0.488 2.133 1.00 0.00 H new ATOM 0 HE2 MET A 74 0.493 0.975 1.354 1.00 0.00 H new ATOM 0 HE3 MET A 74 1.434 -0.386 0.697 1.00 0.00 H new ATOM 1202 N ALA A 75 3.701 -0.375 -4.803 1.00 0.00 N ATOM 1203 CA ALA A 75 3.546 -1.501 -5.772 1.00 0.00 C ATOM 1204 C ALA A 75 4.409 -2.700 -5.354 1.00 0.00 C ATOM 1205 O ALA A 75 3.966 -3.829 -5.415 1.00 0.00 O ATOM 1206 CB ALA A 75 3.968 -1.033 -7.165 1.00 0.00 C ATOM 0 H ALA A 75 3.940 0.528 -5.213 1.00 0.00 H new ATOM 0 HA ALA A 75 2.501 -1.811 -5.783 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.856 -1.853 -7.874 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.340 -0.198 -7.474 1.00 0.00 H new ATOM 0 HB3 ALA A 75 5.010 -0.714 -7.141 1.00 0.00 H new ATOM 1212 N PHE A 76 5.628 -2.490 -4.932 1.00 0.00 N ATOM 1213 CA PHE A 76 6.464 -3.665 -4.528 1.00 0.00 C ATOM 1214 C PHE A 76 5.914 -4.262 -3.230 1.00 0.00 C ATOM 1215 O PHE A 76 5.986 -5.454 -3.006 1.00 0.00 O ATOM 1216 CB PHE A 76 7.928 -3.249 -4.309 1.00 0.00 C ATOM 1217 CG PHE A 76 8.572 -2.827 -5.620 1.00 0.00 C ATOM 1218 CD1 PHE A 76 8.617 -3.711 -6.711 1.00 0.00 C ATOM 1219 CD2 PHE A 76 9.128 -1.544 -5.743 1.00 0.00 C ATOM 1220 CE1 PHE A 76 9.211 -3.310 -7.914 1.00 0.00 C ATOM 1221 CE2 PHE A 76 9.723 -1.148 -6.947 1.00 0.00 C ATOM 1222 CZ PHE A 76 9.762 -2.030 -8.032 1.00 0.00 C ATOM 0 H PHE A 76 6.076 -1.577 -4.849 1.00 0.00 H new ATOM 0 HA PHE A 76 6.426 -4.404 -5.328 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.974 -2.427 -3.595 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.486 -4.079 -3.876 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.193 -4.700 -6.622 1.00 0.00 H new ATOM 0 HD2 PHE A 76 9.097 -0.861 -4.907 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.244 -3.990 -8.752 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.152 -0.161 -7.038 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.218 -1.722 -8.961 1.00 0.00 H new ATOM 1232 N VAL A 77 5.364 -3.448 -2.375 1.00 0.00 N ATOM 1233 CA VAL A 77 4.811 -3.977 -1.096 1.00 0.00 C ATOM 1234 C VAL A 77 3.583 -4.847 -1.391 1.00 0.00 C ATOM 1235 O VAL A 77 3.338 -5.834 -0.726 1.00 0.00 O ATOM 1236 CB VAL A 77 4.412 -2.804 -0.193 1.00 0.00 C ATOM 1237 CG1 VAL A 77 3.613 -3.318 1.010 1.00 0.00 C ATOM 1238 CG2 VAL A 77 5.674 -2.092 0.305 1.00 0.00 C ATOM 0 H VAL A 77 5.273 -2.440 -2.505 1.00 0.00 H new ATOM 0 HA VAL A 77 5.565 -4.581 -0.592 1.00 0.00 H new ATOM 0 HB VAL A 77 3.796 -2.108 -0.763 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.333 -2.479 1.647 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.713 -3.823 0.660 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.224 -4.018 1.580 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.392 -1.258 0.947 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.288 -2.793 0.870 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.241 -1.718 -0.547 1.00 0.00 H new ATOM 1248 N SER A 78 2.807 -4.488 -2.376 1.00 0.00 N ATOM 1249 CA SER A 78 1.595 -5.295 -2.699 1.00 0.00 C ATOM 1250 C SER A 78 2.006 -6.635 -3.319 1.00 0.00 C ATOM 1251 O SER A 78 1.599 -7.687 -2.868 1.00 0.00 O ATOM 1252 CB SER A 78 0.723 -4.525 -3.691 1.00 0.00 C ATOM 1253 OG SER A 78 1.225 -4.718 -5.007 1.00 0.00 O ATOM 0 H SER A 78 2.958 -3.673 -2.970 1.00 0.00 H new ATOM 0 HA SER A 78 1.036 -5.482 -1.782 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.309 -4.870 -3.629 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.720 -3.464 -3.443 1.00 0.00 H new ATOM 0 HG SER A 78 2.090 -4.265 -5.097 1.00 0.00 H new ATOM 1259 N MET A 79 2.788 -6.607 -4.362 1.00 0.00 N ATOM 1260 CA MET A 79 3.198 -7.879 -5.023 1.00 0.00 C ATOM 1261 C MET A 79 3.808 -8.841 -4.002 1.00 0.00 C ATOM 1262 O MET A 79 3.430 -9.992 -3.910 1.00 0.00 O ATOM 1263 CB MET A 79 4.236 -7.569 -6.105 1.00 0.00 C ATOM 1264 CG MET A 79 3.568 -6.807 -7.252 1.00 0.00 C ATOM 1265 SD MET A 79 4.726 -6.672 -8.643 1.00 0.00 S ATOM 1266 CE MET A 79 5.023 -4.887 -8.556 1.00 0.00 C ATOM 0 H MET A 79 3.162 -5.758 -4.786 1.00 0.00 H new ATOM 0 HA MET A 79 2.319 -8.347 -5.466 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.048 -6.976 -5.685 1.00 0.00 H new ATOM 0 HB3 MET A 79 4.676 -8.494 -6.477 1.00 0.00 H new ATOM 0 HG2 MET A 79 2.662 -7.324 -7.568 1.00 0.00 H new ATOM 0 HG3 MET A 79 3.268 -5.814 -6.917 1.00 0.00 H new ATOM 0 HE1 MET A 79 5.721 -4.596 -9.341 1.00 0.00 H new ATOM 0 HE2 MET A 79 4.082 -4.354 -8.691 1.00 0.00 H new ATOM 0 HE3 MET A 79 5.446 -4.635 -7.583 1.00 0.00 H new ATOM 1276 N VAL A 80 4.762 -8.378 -3.247 1.00 0.00 N ATOM 1277 CA VAL A 80 5.419 -9.265 -2.241 1.00 0.00 C ATOM 1278 C VAL A 80 4.380 -9.780 -1.237 1.00 0.00 C ATOM 1279 O VAL A 80 4.373 -10.942 -0.881 1.00 0.00 O ATOM 1280 CB VAL A 80 6.499 -8.473 -1.490 1.00 0.00 C ATOM 1281 CG1 VAL A 80 7.045 -9.311 -0.330 1.00 0.00 C ATOM 1282 CG2 VAL A 80 7.645 -8.133 -2.446 1.00 0.00 C ATOM 0 H VAL A 80 5.118 -7.423 -3.281 1.00 0.00 H new ATOM 0 HA VAL A 80 5.872 -10.112 -2.756 1.00 0.00 H new ATOM 0 HB VAL A 80 6.060 -7.554 -1.101 1.00 0.00 H new ATOM 0 HG11 VAL A 80 7.811 -8.744 0.199 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.234 -9.554 0.357 1.00 0.00 H new ATOM 0 HG13 VAL A 80 7.479 -10.232 -0.719 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.410 -7.571 -1.911 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.078 -9.054 -2.837 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.264 -7.532 -3.272 1.00 0.00 H new ATOM 1292 N THR A 81 3.510 -8.927 -0.772 1.00 0.00 N ATOM 1293 CA THR A 81 2.484 -9.370 0.212 1.00 0.00 C ATOM 1294 C THR A 81 1.486 -10.317 -0.464 1.00 0.00 C ATOM 1295 O THR A 81 1.070 -11.303 0.110 1.00 0.00 O ATOM 1296 CB THR A 81 1.745 -8.142 0.752 1.00 0.00 C ATOM 1297 OG1 THR A 81 1.461 -7.255 -0.320 1.00 0.00 O ATOM 1298 CG2 THR A 81 2.617 -7.429 1.789 1.00 0.00 C ATOM 0 H THR A 81 3.465 -7.942 -1.031 1.00 0.00 H new ATOM 0 HA THR A 81 2.971 -9.897 1.032 1.00 0.00 H new ATOM 0 HB THR A 81 0.814 -8.457 1.222 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.058 -6.480 -0.270 1.00 0.00 H new ATOM 0 HG21 THR A 81 2.088 -6.556 2.171 1.00 0.00 H new ATOM 0 HG22 THR A 81 2.834 -8.110 2.612 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.551 -7.113 1.324 1.00 0.00 H new ATOM 1306 N THR A 82 1.094 -10.025 -1.674 1.00 0.00 N ATOM 1307 CA THR A 82 0.118 -10.912 -2.371 1.00 0.00 C ATOM 1308 C THR A 82 0.675 -12.337 -2.436 1.00 0.00 C ATOM 1309 O THR A 82 0.011 -13.288 -2.075 1.00 0.00 O ATOM 1310 CB THR A 82 -0.128 -10.389 -3.790 1.00 0.00 C ATOM 1311 OG1 THR A 82 1.111 -10.021 -4.380 1.00 0.00 O ATOM 1312 CG2 THR A 82 -1.051 -9.169 -3.737 1.00 0.00 C ATOM 0 H THR A 82 1.405 -9.214 -2.209 1.00 0.00 H new ATOM 0 HA THR A 82 -0.823 -10.918 -1.821 1.00 0.00 H new ATOM 0 HB THR A 82 -0.598 -11.171 -4.387 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.830 -10.121 -3.721 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.224 -8.799 -4.748 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.002 -9.452 -3.286 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.585 -8.386 -3.139 1.00 0.00 H new ATOM 1320 N ALA A 83 1.885 -12.497 -2.899 1.00 0.00 N ATOM 1321 CA ALA A 83 2.470 -13.865 -2.990 1.00 0.00 C ATOM 1322 C ALA A 83 2.380 -14.551 -1.625 1.00 0.00 C ATOM 1323 O ALA A 83 2.260 -15.756 -1.532 1.00 0.00 O ATOM 1324 CB ALA A 83 3.936 -13.765 -3.418 1.00 0.00 C ATOM 0 H ALA A 83 2.492 -11.742 -3.217 1.00 0.00 H new ATOM 0 HA ALA A 83 1.917 -14.449 -3.725 1.00 0.00 H new ATOM 0 HB1 ALA A 83 4.365 -14.765 -3.485 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.999 -13.278 -4.391 1.00 0.00 H new ATOM 0 HB3 ALA A 83 4.490 -13.181 -2.683 1.00 0.00 H new ATOM 1481 N SER B 1 8.437 -5.487 14.057 1.00 0.00 N ATOM 1482 CA SER B 1 8.561 -4.003 14.224 1.00 0.00 C ATOM 1483 C SER B 1 7.163 -3.386 14.323 1.00 0.00 C ATOM 1484 O SER B 1 6.168 -4.036 14.072 1.00 0.00 O ATOM 1485 CB SER B 1 9.300 -3.410 13.023 1.00 0.00 C ATOM 1486 OG SER B 1 8.363 -3.111 11.996 1.00 0.00 O ATOM 0 H1 SER B 1 8.899 -5.966 14.856 1.00 0.00 H new ATOM 0 H2 SER B 1 7.431 -5.750 14.030 1.00 0.00 H new ATOM 0 H3 SER B 1 8.894 -5.776 13.169 1.00 0.00 H new ATOM 0 HA SER B 1 9.121 -3.785 15.133 1.00 0.00 H new ATOM 0 HB2 SER B 1 9.833 -2.507 13.319 1.00 0.00 H new ATOM 0 HB3 SER B 1 10.046 -4.115 12.656 1.00 0.00 H new ATOM 0 HG SER B 1 8.833 -2.729 11.225 1.00 0.00 H new ATOM 1492 N GLU B 2 7.079 -2.136 14.697 1.00 0.00 N ATOM 1493 CA GLU B 2 5.742 -1.487 14.823 1.00 0.00 C ATOM 1494 C GLU B 2 5.003 -1.562 13.486 1.00 0.00 C ATOM 1495 O GLU B 2 3.804 -1.753 13.441 1.00 0.00 O ATOM 1496 CB GLU B 2 5.924 -0.021 15.222 1.00 0.00 C ATOM 1497 CG GLU B 2 4.571 0.578 15.613 1.00 0.00 C ATOM 1498 CD GLU B 2 4.128 0.006 16.962 1.00 0.00 C ATOM 1499 OE1 GLU B 2 4.955 -0.591 17.630 1.00 0.00 O ATOM 1500 OE2 GLU B 2 2.969 0.176 17.302 1.00 0.00 O ATOM 0 H GLU B 2 7.876 -1.539 14.920 1.00 0.00 H new ATOM 0 HA GLU B 2 5.160 -2.005 15.586 1.00 0.00 H new ATOM 0 HB2 GLU B 2 6.621 0.055 16.056 1.00 0.00 H new ATOM 0 HB3 GLU B 2 6.356 0.541 14.394 1.00 0.00 H new ATOM 0 HG2 GLU B 2 4.646 1.664 15.674 1.00 0.00 H new ATOM 0 HG3 GLU B 2 3.827 0.352 14.849 1.00 0.00 H new ATOM 1507 N LEU B 3 5.706 -1.411 12.397 1.00 0.00 N ATOM 1508 CA LEU B 3 5.034 -1.474 11.069 1.00 0.00 C ATOM 1509 C LEU B 3 4.398 -2.851 10.896 1.00 0.00 C ATOM 1510 O LEU B 3 3.305 -2.981 10.381 1.00 0.00 O ATOM 1511 CB LEU B 3 6.068 -1.237 9.957 1.00 0.00 C ATOM 1512 CG LEU B 3 5.371 -1.129 8.569 1.00 0.00 C ATOM 1513 CD1 LEU B 3 6.074 -0.069 7.709 1.00 0.00 C ATOM 1514 CD2 LEU B 3 5.428 -2.480 7.833 1.00 0.00 C ATOM 0 H LEU B 3 6.712 -1.247 12.369 1.00 0.00 H new ATOM 0 HA LEU B 3 4.263 -0.705 11.010 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.626 -0.323 10.161 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.789 -2.054 9.944 1.00 0.00 H new ATOM 0 HG LEU B 3 4.331 -0.846 8.731 1.00 0.00 H new ATOM 0 HD11 LEU B 3 5.580 -0.000 6.740 1.00 0.00 H new ATOM 0 HD12 LEU B 3 6.025 0.897 8.211 1.00 0.00 H new ATOM 0 HD13 LEU B 3 7.117 -0.351 7.565 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.936 -2.388 6.864 1.00 0.00 H new ATOM 0 HD22 LEU B 3 6.468 -2.771 7.686 1.00 0.00 H new ATOM 0 HD23 LEU B 3 4.920 -3.240 8.427 1.00 0.00 H new ATOM 1526 N GLU B 4 5.073 -3.881 11.325 1.00 0.00 N ATOM 1527 CA GLU B 4 4.507 -5.249 11.187 1.00 0.00 C ATOM 1528 C GLU B 4 3.143 -5.302 11.875 1.00 0.00 C ATOM 1529 O GLU B 4 2.168 -5.765 11.322 1.00 0.00 O ATOM 1530 CB GLU B 4 5.453 -6.251 11.847 1.00 0.00 C ATOM 1531 CG GLU B 4 4.952 -7.672 11.598 1.00 0.00 C ATOM 1532 CD GLU B 4 5.958 -8.665 12.176 1.00 0.00 C ATOM 1533 OE1 GLU B 4 7.098 -8.273 12.371 1.00 0.00 O ATOM 1534 OE2 GLU B 4 5.574 -9.798 12.414 1.00 0.00 O ATOM 0 H GLU B 4 5.992 -3.833 11.765 1.00 0.00 H new ATOM 0 HA GLU B 4 4.391 -5.497 10.132 1.00 0.00 H new ATOM 0 HB2 GLU B 4 6.460 -6.134 11.446 1.00 0.00 H new ATOM 0 HB3 GLU B 4 5.513 -6.058 12.918 1.00 0.00 H new ATOM 0 HG2 GLU B 4 3.976 -7.813 12.062 1.00 0.00 H new ATOM 0 HG3 GLU B 4 4.825 -7.844 10.529 1.00 0.00 H new ATOM 1541 N LYS B 5 3.077 -4.810 13.082 1.00 0.00 N ATOM 1542 CA LYS B 5 1.789 -4.804 13.832 1.00 0.00 C ATOM 1543 C LYS B 5 0.681 -4.259 12.932 1.00 0.00 C ATOM 1544 O LYS B 5 -0.429 -4.755 12.909 1.00 0.00 O ATOM 1545 CB LYS B 5 1.924 -3.878 15.047 1.00 0.00 C ATOM 1546 CG LYS B 5 3.130 -4.293 15.902 1.00 0.00 C ATOM 1547 CD LYS B 5 2.857 -5.638 16.591 1.00 0.00 C ATOM 1548 CE LYS B 5 3.834 -5.827 17.754 1.00 0.00 C ATOM 1549 NZ LYS B 5 5.231 -5.674 17.259 1.00 0.00 N ATOM 0 H LYS B 5 3.868 -4.408 13.585 1.00 0.00 H new ATOM 0 HA LYS B 5 1.548 -5.818 14.150 1.00 0.00 H new ATOM 0 HB2 LYS B 5 2.043 -2.847 14.715 1.00 0.00 H new ATOM 0 HB3 LYS B 5 1.014 -3.918 15.646 1.00 0.00 H new ATOM 0 HG2 LYS B 5 4.019 -4.371 15.276 1.00 0.00 H new ATOM 0 HG3 LYS B 5 3.334 -3.528 16.651 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.831 -5.669 16.956 1.00 0.00 H new ATOM 0 HD3 LYS B 5 2.965 -6.453 15.876 1.00 0.00 H new ATOM 0 HE2 LYS B 5 3.632 -5.095 18.536 1.00 0.00 H new ATOM 0 HE3 LYS B 5 3.700 -6.813 18.199 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 5.891 -6.091 17.946 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 5.330 -6.160 16.345 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 5.448 -4.664 17.140 1.00 0.00 H new ATOM 1563 N ALA B 6 0.987 -3.223 12.202 1.00 0.00 N ATOM 1564 CA ALA B 6 -0.015 -2.593 11.300 1.00 0.00 C ATOM 1565 C ALA B 6 -0.168 -3.394 10.000 1.00 0.00 C ATOM 1566 O ALA B 6 -1.239 -3.441 9.429 1.00 0.00 O ATOM 1567 CB ALA B 6 0.443 -1.160 10.985 1.00 0.00 C ATOM 0 H ALA B 6 1.905 -2.779 12.193 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.985 -2.579 11.796 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.281 -0.684 10.324 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.519 -0.590 11.911 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.417 -1.188 10.496 1.00 0.00 H new ATOM 1573 N MET B 7 0.864 -4.027 9.519 1.00 0.00 N ATOM 1574 CA MET B 7 0.699 -4.804 8.257 1.00 0.00 C ATOM 1575 C MET B 7 -0.380 -5.872 8.481 1.00 0.00 C ATOM 1576 O MET B 7 -1.213 -6.115 7.631 1.00 0.00 O ATOM 1577 CB MET B 7 2.036 -5.459 7.863 1.00 0.00 C ATOM 1578 CG MET B 7 2.097 -5.651 6.340 1.00 0.00 C ATOM 1579 SD MET B 7 2.530 -4.074 5.549 1.00 0.00 S ATOM 1580 CE MET B 7 1.257 -4.071 4.257 1.00 0.00 C ATOM 0 H MET B 7 1.796 -4.042 9.933 1.00 0.00 H new ATOM 0 HA MET B 7 0.395 -4.143 7.446 1.00 0.00 H new ATOM 0 HB2 MET B 7 2.867 -4.836 8.193 1.00 0.00 H new ATOM 0 HB3 MET B 7 2.141 -6.421 8.364 1.00 0.00 H new ATOM 0 HG2 MET B 7 2.836 -6.412 6.088 1.00 0.00 H new ATOM 0 HG3 MET B 7 1.135 -6.005 5.968 1.00 0.00 H new ATOM 0 HE1 MET B 7 1.470 -3.280 3.538 1.00 0.00 H new ATOM 0 HE2 MET B 7 1.254 -5.034 3.747 1.00 0.00 H new ATOM 0 HE3 MET B 7 0.280 -3.897 4.709 1.00 0.00 H new ATOM 1590 N VAL B 8 -0.379 -6.498 9.628 1.00 0.00 N ATOM 1591 CA VAL B 8 -1.413 -7.534 9.919 1.00 0.00 C ATOM 1592 C VAL B 8 -2.771 -6.853 10.119 1.00 0.00 C ATOM 1593 O VAL B 8 -3.802 -7.379 9.750 1.00 0.00 O ATOM 1594 CB VAL B 8 -1.035 -8.292 11.196 1.00 0.00 C ATOM 1595 CG1 VAL B 8 -1.887 -9.558 11.305 1.00 0.00 C ATOM 1596 CG2 VAL B 8 0.445 -8.684 11.142 1.00 0.00 C ATOM 0 H VAL B 8 0.294 -6.336 10.377 1.00 0.00 H new ATOM 0 HA VAL B 8 -1.471 -8.233 9.085 1.00 0.00 H new ATOM 0 HB VAL B 8 -1.211 -7.653 12.061 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.620 -10.099 12.213 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.942 -9.285 11.342 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -1.707 -10.193 10.438 1.00 0.00 H new ATOM 0 HG21 VAL B 8 0.712 -9.223 12.051 1.00 0.00 H new ATOM 0 HG22 VAL B 8 0.621 -9.323 10.276 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.057 -7.785 11.060 1.00 0.00 H new ATOM 1606 N ALA B 9 -2.776 -5.681 10.698 1.00 0.00 N ATOM 1607 CA ALA B 9 -4.059 -4.952 10.922 1.00 0.00 C ATOM 1608 C ALA B 9 -4.736 -4.675 9.578 1.00 0.00 C ATOM 1609 O ALA B 9 -5.908 -4.934 9.389 1.00 0.00 O ATOM 1610 CB ALA B 9 -3.749 -3.616 11.600 1.00 0.00 C ATOM 0 H ALA B 9 -1.942 -5.195 11.027 1.00 0.00 H new ATOM 0 HA ALA B 9 -4.719 -5.555 11.545 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.677 -3.071 11.771 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -3.254 -3.798 12.554 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -3.094 -3.026 10.959 1.00 0.00 H new ATOM 1616 N LEU B 10 -3.999 -4.131 8.652 1.00 0.00 N ATOM 1617 CA LEU B 10 -4.569 -3.802 7.314 1.00 0.00 C ATOM 1618 C LEU B 10 -5.276 -5.027 6.738 1.00 0.00 C ATOM 1619 O LEU B 10 -6.433 -4.989 6.370 1.00 0.00 O ATOM 1620 CB LEU B 10 -3.397 -3.415 6.374 1.00 0.00 C ATOM 1621 CG LEU B 10 -3.180 -1.892 6.362 1.00 0.00 C ATOM 1622 CD1 LEU B 10 -2.683 -1.423 7.730 1.00 0.00 C ATOM 1623 CD2 LEU B 10 -2.134 -1.541 5.301 1.00 0.00 C ATOM 0 H LEU B 10 -3.013 -3.897 8.766 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.283 -2.984 7.405 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.484 -3.913 6.701 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -3.607 -3.764 5.363 1.00 0.00 H new ATOM 0 HG LEU B 10 -4.124 -1.398 6.134 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -2.532 -0.344 7.712 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -3.422 -1.673 8.491 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -1.740 -1.917 7.964 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -1.976 -0.463 5.288 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -1.195 -2.042 5.536 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -2.485 -1.868 4.322 1.00 0.00 H new ATOM 1635 N ILE B 11 -4.557 -6.106 6.638 1.00 0.00 N ATOM 1636 CA ILE B 11 -5.130 -7.350 6.064 1.00 0.00 C ATOM 1637 C ILE B 11 -6.388 -7.763 6.825 1.00 0.00 C ATOM 1638 O ILE B 11 -7.329 -8.268 6.244 1.00 0.00 O ATOM 1639 CB ILE B 11 -4.087 -8.467 6.157 1.00 0.00 C ATOM 1640 CG1 ILE B 11 -2.899 -8.127 5.252 1.00 0.00 C ATOM 1641 CG2 ILE B 11 -4.705 -9.794 5.708 1.00 0.00 C ATOM 1642 CD1 ILE B 11 -1.714 -9.027 5.605 1.00 0.00 C ATOM 0 H ILE B 11 -3.584 -6.179 6.934 1.00 0.00 H new ATOM 0 HA ILE B 11 -5.398 -7.171 5.023 1.00 0.00 H new ATOM 0 HB ILE B 11 -3.749 -8.560 7.189 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -3.174 -8.264 4.206 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -2.623 -7.080 5.375 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -3.958 -10.585 5.776 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -5.551 -10.037 6.351 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -5.047 -9.706 4.677 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -0.869 -8.785 4.961 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -1.434 -8.868 6.646 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -1.994 -10.070 5.460 1.00 0.00 H new ATOM 1654 N ASP B 12 -6.415 -7.593 8.119 1.00 0.00 N ATOM 1655 CA ASP B 12 -7.619 -8.028 8.877 1.00 0.00 C ATOM 1656 C ASP B 12 -8.810 -7.117 8.560 1.00 0.00 C ATOM 1657 O ASP B 12 -9.933 -7.573 8.489 1.00 0.00 O ATOM 1658 CB ASP B 12 -7.332 -8.019 10.379 1.00 0.00 C ATOM 1659 CG ASP B 12 -5.980 -8.684 10.646 1.00 0.00 C ATOM 1660 OD1 ASP B 12 -5.466 -9.320 9.741 1.00 0.00 O ATOM 1661 OD2 ASP B 12 -5.482 -8.546 11.751 1.00 0.00 O ATOM 0 H ASP B 12 -5.668 -7.178 8.676 1.00 0.00 H new ATOM 0 HA ASP B 12 -7.869 -9.045 8.574 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -7.325 -6.995 10.752 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -8.121 -8.548 10.914 1.00 0.00 H new ATOM 1666 N VAL B 13 -8.599 -5.837 8.370 1.00 0.00 N ATOM 1667 CA VAL B 13 -9.764 -4.955 8.064 1.00 0.00 C ATOM 1668 C VAL B 13 -10.256 -5.241 6.642 1.00 0.00 C ATOM 1669 O VAL B 13 -11.443 -5.217 6.378 1.00 0.00 O ATOM 1670 CB VAL B 13 -9.379 -3.482 8.220 1.00 0.00 C ATOM 1671 CG1 VAL B 13 -10.515 -2.593 7.703 1.00 0.00 C ATOM 1672 CG2 VAL B 13 -9.131 -3.180 9.700 1.00 0.00 C ATOM 0 H VAL B 13 -7.691 -5.374 8.412 1.00 0.00 H new ATOM 0 HA VAL B 13 -10.569 -5.165 8.768 1.00 0.00 H new ATOM 0 HB VAL B 13 -8.475 -3.281 7.646 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.237 -1.545 7.816 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -10.696 -2.809 6.650 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -11.421 -2.792 8.275 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -8.856 -2.132 9.816 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.038 -3.383 10.270 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.322 -3.810 10.069 1.00 0.00 H new ATOM 1682 N PHE B 14 -9.375 -5.533 5.728 1.00 0.00 N ATOM 1683 CA PHE B 14 -9.840 -5.838 4.347 1.00 0.00 C ATOM 1684 C PHE B 14 -10.719 -7.087 4.405 1.00 0.00 C ATOM 1685 O PHE B 14 -11.676 -7.227 3.669 1.00 0.00 O ATOM 1686 CB PHE B 14 -8.643 -6.099 3.430 1.00 0.00 C ATOM 1687 CG PHE B 14 -9.144 -6.406 2.037 1.00 0.00 C ATOM 1688 CD1 PHE B 14 -9.573 -7.701 1.716 1.00 0.00 C ATOM 1689 CD2 PHE B 14 -9.182 -5.397 1.067 1.00 0.00 C ATOM 1690 CE1 PHE B 14 -10.039 -7.985 0.426 1.00 0.00 C ATOM 1691 CE2 PHE B 14 -9.647 -5.681 -0.222 1.00 0.00 C ATOM 1692 CZ PHE B 14 -10.076 -6.975 -0.542 1.00 0.00 C ATOM 0 H PHE B 14 -8.366 -5.574 5.873 1.00 0.00 H new ATOM 0 HA PHE B 14 -10.401 -4.992 3.951 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -7.988 -5.228 3.410 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -8.053 -6.933 3.810 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.544 -8.480 2.463 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -8.852 -4.399 1.314 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -10.370 -8.983 0.178 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -9.675 -4.902 -0.970 1.00 0.00 H new ATOM 0 HZ PHE B 14 -10.436 -7.194 -1.537 1.00 0.00 H new ATOM 1702 N HIS B 15 -10.399 -7.994 5.287 1.00 0.00 N ATOM 1703 CA HIS B 15 -11.206 -9.238 5.413 1.00 0.00 C ATOM 1704 C HIS B 15 -12.524 -8.922 6.126 1.00 0.00 C ATOM 1705 O HIS B 15 -13.533 -9.563 5.906 1.00 0.00 O ATOM 1706 CB HIS B 15 -10.423 -10.271 6.225 1.00 0.00 C ATOM 1707 CG HIS B 15 -11.089 -11.615 6.108 1.00 0.00 C ATOM 1708 ND1 HIS B 15 -10.551 -12.643 5.351 1.00 0.00 N ATOM 1709 CD2 HIS B 15 -12.247 -12.116 6.650 1.00 0.00 C ATOM 1710 CE1 HIS B 15 -11.376 -13.700 5.456 1.00 0.00 C ATOM 1711 NE2 HIS B 15 -12.426 -13.433 6.237 1.00 0.00 N ATOM 0 H HIS B 15 -9.609 -7.925 5.928 1.00 0.00 H new ATOM 0 HA HIS B 15 -11.417 -9.637 4.421 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.396 -10.330 5.864 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.376 -9.967 7.271 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -12.917 -11.571 7.298 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -11.210 -14.649 4.968 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -13.194 -14.059 6.479 1.00 0.00 H new ATOM 1719 N GLN B 16 -12.512 -7.944 6.995 1.00 0.00 N ATOM 1720 CA GLN B 16 -13.750 -7.587 7.745 1.00 0.00 C ATOM 1721 C GLN B 16 -14.888 -7.294 6.768 1.00 0.00 C ATOM 1722 O GLN B 16 -16.008 -7.725 6.962 1.00 0.00 O ATOM 1723 CB GLN B 16 -13.486 -6.351 8.609 1.00 0.00 C ATOM 1724 CG GLN B 16 -14.756 -5.984 9.383 1.00 0.00 C ATOM 1725 CD GLN B 16 -14.399 -5.048 10.541 1.00 0.00 C ATOM 1726 OE1 GLN B 16 -13.658 -4.101 10.365 1.00 0.00 O ATOM 1727 NE2 GLN B 16 -14.896 -5.277 11.725 1.00 0.00 N ATOM 0 H GLN B 16 -11.694 -7.376 7.217 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.035 -8.424 8.382 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.669 -6.548 9.303 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.176 -5.515 7.981 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -15.472 -5.500 8.719 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -15.235 -6.886 9.765 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -15.518 -6.072 11.872 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -14.663 -4.661 12.504 1.00 0.00 H new ATOM 1736 N TYR B 17 -14.620 -6.562 5.721 1.00 0.00 N ATOM 1737 CA TYR B 17 -15.696 -6.243 4.741 1.00 0.00 C ATOM 1738 C TYR B 17 -16.043 -7.499 3.942 1.00 0.00 C ATOM 1739 O TYR B 17 -17.198 -7.831 3.760 1.00 0.00 O ATOM 1740 CB TYR B 17 -15.208 -5.147 3.786 1.00 0.00 C ATOM 1741 CG TYR B 17 -15.235 -3.808 4.491 1.00 0.00 C ATOM 1742 CD1 TYR B 17 -14.312 -3.537 5.508 1.00 0.00 C ATOM 1743 CD2 TYR B 17 -16.181 -2.840 4.129 1.00 0.00 C ATOM 1744 CE1 TYR B 17 -14.334 -2.299 6.163 1.00 0.00 C ATOM 1745 CE2 TYR B 17 -16.202 -1.602 4.783 1.00 0.00 C ATOM 1746 CZ TYR B 17 -15.279 -1.332 5.801 1.00 0.00 C ATOM 1747 OH TYR B 17 -15.301 -0.112 6.447 1.00 0.00 O ATOM 0 H TYR B 17 -13.703 -6.172 5.502 1.00 0.00 H new ATOM 0 HA TYR B 17 -16.581 -5.893 5.272 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -14.196 -5.370 3.447 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -15.841 -5.115 2.899 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -13.583 -4.283 5.788 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -16.894 -3.049 3.345 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -13.622 -2.091 6.948 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -16.930 -0.855 4.502 1.00 0.00 H new ATOM 0 HH TYR B 17 -16.017 0.443 6.074 1.00 0.00 H new ATOM 1757 N SER B 18 -15.050 -8.200 3.457 1.00 0.00 N ATOM 1758 CA SER B 18 -15.316 -9.437 2.660 1.00 0.00 C ATOM 1759 C SER B 18 -15.167 -10.675 3.549 1.00 0.00 C ATOM 1760 O SER B 18 -14.354 -11.538 3.280 1.00 0.00 O ATOM 1761 CB SER B 18 -14.312 -9.523 1.508 1.00 0.00 C ATOM 1762 OG SER B 18 -14.361 -10.826 0.940 1.00 0.00 O ATOM 0 H SER B 18 -14.064 -7.969 3.579 1.00 0.00 H new ATOM 0 HA SER B 18 -16.332 -9.396 2.266 1.00 0.00 H new ATOM 0 HB2 SER B 18 -14.545 -8.774 0.751 1.00 0.00 H new ATOM 0 HB3 SER B 18 -13.306 -9.309 1.870 1.00 0.00 H new ATOM 0 HG SER B 18 -13.982 -11.473 1.572 1.00 0.00 H new ATOM 1768 N GLY B 19 -15.960 -10.787 4.593 1.00 0.00 N ATOM 1769 CA GLY B 19 -15.891 -11.989 5.491 1.00 0.00 C ATOM 1770 C GLY B 19 -17.250 -12.689 5.438 1.00 0.00 C ATOM 1771 O GLY B 19 -17.395 -13.826 5.840 1.00 0.00 O ATOM 0 H GLY B 19 -16.656 -10.092 4.863 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -15.100 -12.665 5.165 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -15.654 -11.690 6.512 1.00 0.00 H new ATOM 1775 N ARG B 20 -18.236 -12.024 4.904 1.00 0.00 N ATOM 1776 CA ARG B 20 -19.585 -12.639 4.768 1.00 0.00 C ATOM 1777 C ARG B 20 -19.489 -13.848 3.841 1.00 0.00 C ATOM 1778 O ARG B 20 -20.225 -14.802 3.999 1.00 0.00 O ATOM 1779 CB ARG B 20 -20.560 -11.614 4.184 1.00 0.00 C ATOM 1780 CG ARG B 20 -21.989 -12.151 4.286 1.00 0.00 C ATOM 1781 CD ARG B 20 -22.963 -11.121 3.713 1.00 0.00 C ATOM 1782 NE ARG B 20 -24.284 -11.767 3.477 1.00 0.00 N ATOM 1783 CZ ARG B 20 -24.883 -12.396 4.450 1.00 0.00 C ATOM 1784 NH1 ARG B 20 -25.116 -11.782 5.578 1.00 0.00 N ATOM 1785 NH2 ARG B 20 -25.248 -13.640 4.297 1.00 0.00 N ATOM 0 H ARG B 20 -18.163 -11.069 4.552 1.00 0.00 H new ATOM 0 HA ARG B 20 -19.947 -12.956 5.746 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -20.476 -10.670 4.722 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -20.310 -11.411 3.143 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -22.075 -13.091 3.741 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -22.236 -12.362 5.326 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -23.073 -10.285 4.403 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -22.573 -10.715 2.780 1.00 0.00 H new ATOM 0 HE ARG B 20 -24.720 -11.718 2.556 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -24.830 -10.810 5.698 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -25.584 -12.274 6.339 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -25.065 -14.121 3.416 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -25.716 -14.131 5.058 1.00 0.00 H new ATOM 1799 N GLU B 21 -18.586 -13.853 2.897 1.00 0.00 N ATOM 1800 CA GLU B 21 -18.469 -15.052 2.012 1.00 0.00 C ATOM 1801 C GLU B 21 -17.019 -15.233 1.568 1.00 0.00 C ATOM 1802 O GLU B 21 -16.490 -16.326 1.594 1.00 0.00 O ATOM 1803 CB GLU B 21 -19.362 -14.875 0.783 1.00 0.00 C ATOM 1804 CG GLU B 21 -20.830 -14.873 1.214 1.00 0.00 C ATOM 1805 CD GLU B 21 -21.725 -14.991 -0.021 1.00 0.00 C ATOM 1806 OE1 GLU B 21 -21.257 -14.669 -1.101 1.00 0.00 O ATOM 1807 OE2 GLU B 21 -22.864 -15.400 0.134 1.00 0.00 O ATOM 0 H GLU B 21 -17.934 -13.094 2.701 1.00 0.00 H new ATOM 0 HA GLU B 21 -18.786 -15.935 2.567 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -19.120 -13.941 0.276 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -19.182 -15.680 0.071 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -21.021 -15.702 1.895 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -21.060 -13.956 1.756 1.00 0.00 H new ATOM 1814 N GLY B 22 -16.365 -14.180 1.160 1.00 0.00 N ATOM 1815 CA GLY B 22 -14.948 -14.314 0.715 1.00 0.00 C ATOM 1816 C GLY B 22 -14.834 -15.486 -0.261 1.00 0.00 C ATOM 1817 O GLY B 22 -13.750 -15.931 -0.583 1.00 0.00 O ATOM 0 H GLY B 22 -16.748 -13.236 1.115 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -14.617 -13.393 0.236 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -14.298 -14.477 1.575 1.00 0.00 H new ATOM 1821 N ASP B 23 -15.941 -15.992 -0.739 1.00 0.00 N ATOM 1822 CA ASP B 23 -15.879 -17.133 -1.697 1.00 0.00 C ATOM 1823 C ASP B 23 -14.871 -16.785 -2.792 1.00 0.00 C ATOM 1824 O ASP B 23 -13.931 -17.513 -3.040 1.00 0.00 O ATOM 1825 CB ASP B 23 -17.259 -17.361 -2.321 1.00 0.00 C ATOM 1826 CG ASP B 23 -18.167 -18.071 -1.313 1.00 0.00 C ATOM 1827 OD1 ASP B 23 -17.817 -18.096 -0.145 1.00 0.00 O ATOM 1828 OD2 ASP B 23 -19.197 -18.577 -1.728 1.00 0.00 O ATOM 0 H ASP B 23 -16.880 -15.666 -0.509 1.00 0.00 H new ATOM 0 HA ASP B 23 -15.574 -18.042 -1.179 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -17.699 -16.408 -2.614 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -17.165 -17.960 -3.227 1.00 0.00 H new ATOM 1833 N LYS B 24 -15.045 -15.656 -3.427 1.00 0.00 N ATOM 1834 CA LYS B 24 -14.082 -15.232 -4.483 1.00 0.00 C ATOM 1835 C LYS B 24 -12.996 -14.376 -3.822 1.00 0.00 C ATOM 1836 O LYS B 24 -13.043 -14.106 -2.639 1.00 0.00 O ATOM 1837 CB LYS B 24 -14.814 -14.407 -5.547 1.00 0.00 C ATOM 1838 CG LYS B 24 -16.097 -15.129 -5.967 1.00 0.00 C ATOM 1839 CD LYS B 24 -16.858 -14.271 -6.981 1.00 0.00 C ATOM 1840 CE LYS B 24 -18.277 -14.817 -7.147 1.00 0.00 C ATOM 1841 NZ LYS B 24 -19.014 -13.992 -8.147 1.00 0.00 N ATOM 0 H LYS B 24 -15.815 -15.008 -3.259 1.00 0.00 H new ATOM 0 HA LYS B 24 -13.636 -16.104 -4.961 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -15.053 -13.419 -5.154 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -14.169 -14.258 -6.413 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -15.855 -16.098 -6.404 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -16.722 -15.320 -5.094 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -16.893 -13.235 -6.644 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -16.340 -14.277 -7.940 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -18.242 -15.857 -7.472 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -18.799 -14.800 -6.190 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -19.979 -14.363 -8.260 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -19.059 -13.006 -7.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -18.519 -14.030 -9.061 1.00 0.00 H new ATOM 1855 N HIS B 25 -12.033 -13.933 -4.587 1.00 0.00 N ATOM 1856 CA HIS B 25 -10.942 -13.068 -4.038 1.00 0.00 C ATOM 1857 C HIS B 25 -10.841 -11.825 -4.923 1.00 0.00 C ATOM 1858 O HIS B 25 -9.769 -11.426 -5.333 1.00 0.00 O ATOM 1859 CB HIS B 25 -9.622 -13.842 -4.076 1.00 0.00 C ATOM 1860 CG HIS B 25 -9.232 -14.114 -5.505 1.00 0.00 C ATOM 1861 ND1 HIS B 25 -8.421 -13.253 -6.227 1.00 0.00 N ATOM 1862 CD2 HIS B 25 -9.535 -15.147 -6.357 1.00 0.00 C ATOM 1863 CE1 HIS B 25 -8.265 -13.778 -7.456 1.00 0.00 C ATOM 1864 NE2 HIS B 25 -8.924 -14.932 -7.589 1.00 0.00 N ATOM 0 H HIS B 25 -11.954 -14.136 -5.583 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.154 -12.781 -3.008 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -8.839 -13.269 -3.578 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -9.725 -14.781 -3.532 1.00 0.00 H new ATOM 0 HD1 HIS B 25 -8.016 -12.380 -5.888 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -10.153 -15.997 -6.109 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -7.678 -13.322 -8.240 1.00 0.00 H new ATOM 1872 N LYS B 26 -11.961 -11.215 -5.221 1.00 0.00 N ATOM 1873 CA LYS B 26 -11.963 -9.995 -6.083 1.00 0.00 C ATOM 1874 C LYS B 26 -12.866 -8.923 -5.466 1.00 0.00 C ATOM 1875 O LYS B 26 -13.812 -9.225 -4.765 1.00 0.00 O ATOM 1876 CB LYS B 26 -12.490 -10.357 -7.472 1.00 0.00 C ATOM 1877 CG LYS B 26 -11.635 -11.476 -8.070 1.00 0.00 C ATOM 1878 CD LYS B 26 -12.104 -11.772 -9.496 1.00 0.00 C ATOM 1879 CE LYS B 26 -11.138 -12.757 -10.156 1.00 0.00 C ATOM 1880 NZ LYS B 26 -9.805 -12.112 -10.317 1.00 0.00 N ATOM 0 H LYS B 26 -12.882 -11.514 -4.900 1.00 0.00 H new ATOM 0 HA LYS B 26 -10.946 -9.610 -6.161 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -13.530 -10.676 -7.406 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -12.466 -9.481 -8.121 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -10.585 -11.183 -8.075 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -11.712 -12.374 -7.457 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -13.111 -12.189 -9.480 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.150 -10.849 -10.074 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -11.047 -13.657 -9.548 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -11.524 -13.066 -11.127 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -9.286 -12.576 -11.090 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -9.932 -11.104 -10.541 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -9.265 -12.205 -9.433 1.00 0.00 H new ATOM 1894 N LEU B 27 -12.579 -7.672 -5.727 1.00 0.00 N ATOM 1895 CA LEU B 27 -13.408 -6.554 -5.172 1.00 0.00 C ATOM 1896 C LEU B 27 -13.847 -5.662 -6.332 1.00 0.00 C ATOM 1897 O LEU B 27 -13.109 -5.462 -7.275 1.00 0.00 O ATOM 1898 CB LEU B 27 -12.558 -5.739 -4.190 1.00 0.00 C ATOM 1899 CG LEU B 27 -13.450 -4.767 -3.392 1.00 0.00 C ATOM 1900 CD1 LEU B 27 -14.111 -5.490 -2.209 1.00 0.00 C ATOM 1901 CD2 LEU B 27 -12.594 -3.618 -2.853 1.00 0.00 C ATOM 0 H LEU B 27 -11.796 -7.373 -6.308 1.00 0.00 H new ATOM 0 HA LEU B 27 -14.281 -6.947 -4.651 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -12.036 -6.409 -3.507 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -11.796 -5.181 -4.734 1.00 0.00 H new ATOM 0 HG LEU B 27 -14.225 -4.383 -4.055 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -14.737 -4.788 -1.657 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -14.726 -6.310 -2.581 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -13.340 -5.886 -1.548 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -13.223 -2.930 -2.288 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -11.817 -4.018 -2.201 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -12.131 -3.087 -3.685 1.00 0.00 H new ATOM 1913 N LYS B 28 -15.046 -5.132 -6.287 1.00 0.00 N ATOM 1914 CA LYS B 28 -15.524 -4.264 -7.410 1.00 0.00 C ATOM 1915 C LYS B 28 -15.282 -2.788 -7.075 1.00 0.00 C ATOM 1916 O LYS B 28 -15.205 -2.405 -5.924 1.00 0.00 O ATOM 1917 CB LYS B 28 -17.020 -4.492 -7.630 1.00 0.00 C ATOM 1918 CG LYS B 28 -17.250 -5.905 -8.169 1.00 0.00 C ATOM 1919 CD LYS B 28 -18.731 -6.087 -8.506 1.00 0.00 C ATOM 1920 CE LYS B 28 -18.979 -7.524 -8.965 1.00 0.00 C ATOM 1921 NZ LYS B 28 -18.020 -7.870 -10.051 1.00 0.00 N ATOM 0 H LYS B 28 -15.712 -5.262 -5.525 1.00 0.00 H new ATOM 0 HA LYS B 28 -14.974 -4.521 -8.315 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -17.560 -4.357 -6.693 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -17.411 -3.756 -8.332 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -16.641 -6.070 -9.058 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -16.941 -6.643 -7.429 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -19.343 -5.863 -7.633 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -19.025 -5.388 -9.289 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -18.859 -8.211 -8.127 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -20.003 -7.632 -9.322 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -18.468 -8.539 -10.709 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -17.751 -7.007 -10.565 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -17.171 -8.306 -9.638 1.00 0.00 H new ATOM 1935 N LYS B 29 -15.181 -1.958 -8.076 1.00 0.00 N ATOM 1936 CA LYS B 29 -14.965 -0.504 -7.833 1.00 0.00 C ATOM 1937 C LYS B 29 -16.138 0.074 -7.028 1.00 0.00 C ATOM 1938 O LYS B 29 -15.965 0.934 -6.188 1.00 0.00 O ATOM 1939 CB LYS B 29 -14.841 0.227 -9.187 1.00 0.00 C ATOM 1940 CG LYS B 29 -16.162 0.216 -9.982 1.00 0.00 C ATOM 1941 CD LYS B 29 -16.538 -1.219 -10.386 1.00 0.00 C ATOM 1942 CE LYS B 29 -17.519 -1.182 -11.562 1.00 0.00 C ATOM 1943 NZ LYS B 29 -18.772 -0.496 -11.137 1.00 0.00 N ATOM 0 H LYS B 29 -15.239 -2.226 -9.058 1.00 0.00 H new ATOM 0 HA LYS B 29 -14.047 -0.364 -7.262 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -14.533 1.258 -9.014 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -14.058 -0.244 -9.781 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -16.959 0.651 -9.379 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -16.062 0.836 -10.873 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -15.643 -1.776 -10.664 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -16.988 -1.740 -9.540 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -17.072 -0.658 -12.407 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -17.741 -2.195 -11.897 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -19.520 -0.673 -11.838 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -19.071 -0.862 -10.211 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -18.600 0.527 -11.065 1.00 0.00 H new ATOM 1957 N SER B 30 -17.331 -0.381 -7.298 1.00 0.00 N ATOM 1958 CA SER B 30 -18.525 0.146 -6.578 1.00 0.00 C ATOM 1959 C SER B 30 -18.404 -0.103 -5.073 1.00 0.00 C ATOM 1960 O SER B 30 -18.724 0.752 -4.264 1.00 0.00 O ATOM 1961 CB SER B 30 -19.777 -0.557 -7.102 1.00 0.00 C ATOM 1962 OG SER B 30 -20.922 -0.035 -6.440 1.00 0.00 O ATOM 0 H SER B 30 -17.531 -1.101 -7.992 1.00 0.00 H new ATOM 0 HA SER B 30 -18.592 1.220 -6.751 1.00 0.00 H new ATOM 0 HB2 SER B 30 -19.867 -0.410 -8.178 1.00 0.00 H new ATOM 0 HB3 SER B 30 -19.703 -1.631 -6.932 1.00 0.00 H new ATOM 0 HG SER B 30 -21.726 -0.483 -6.775 1.00 0.00 H new ATOM 1968 N GLU B 31 -17.943 -1.262 -4.678 1.00 0.00 N ATOM 1969 CA GLU B 31 -17.820 -1.535 -3.217 1.00 0.00 C ATOM 1970 C GLU B 31 -16.552 -0.861 -2.698 1.00 0.00 C ATOM 1971 O GLU B 31 -16.497 -0.380 -1.584 1.00 0.00 O ATOM 1972 CB GLU B 31 -17.759 -3.043 -2.960 1.00 0.00 C ATOM 1973 CG GLU B 31 -17.698 -3.302 -1.452 1.00 0.00 C ATOM 1974 CD GLU B 31 -17.888 -4.795 -1.181 1.00 0.00 C ATOM 1975 OE1 GLU B 31 -17.655 -5.577 -2.089 1.00 0.00 O ATOM 1976 OE2 GLU B 31 -18.262 -5.133 -0.070 1.00 0.00 O ATOM 0 H GLU B 31 -17.651 -2.020 -5.294 1.00 0.00 H new ATOM 0 HA GLU B 31 -18.690 -1.137 -2.696 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -18.634 -3.531 -3.389 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -16.884 -3.471 -3.449 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -16.740 -2.969 -1.054 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -18.472 -2.728 -0.942 1.00 0.00 H new ATOM 1983 N LEU B 32 -15.535 -0.809 -3.518 1.00 0.00 N ATOM 1984 CA LEU B 32 -14.269 -0.151 -3.099 1.00 0.00 C ATOM 1985 C LEU B 32 -14.559 1.330 -2.841 1.00 0.00 C ATOM 1986 O LEU B 32 -14.129 1.888 -1.852 1.00 0.00 O ATOM 1987 CB LEU B 32 -13.219 -0.310 -4.214 1.00 0.00 C ATOM 1988 CG LEU B 32 -11.796 -0.232 -3.638 1.00 0.00 C ATOM 1989 CD1 LEU B 32 -10.793 -0.602 -4.735 1.00 0.00 C ATOM 1990 CD2 LEU B 32 -11.503 1.191 -3.130 1.00 0.00 C ATOM 0 H LEU B 32 -15.530 -1.196 -4.462 1.00 0.00 H new ATOM 0 HA LEU B 32 -13.879 -0.609 -2.190 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -13.360 -1.266 -4.719 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -13.356 0.470 -4.963 1.00 0.00 H new ATOM 0 HG LEU B 32 -11.708 -0.926 -2.802 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -9.780 -0.549 -4.335 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -10.993 -1.615 -5.084 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -10.891 0.095 -5.568 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -10.492 1.232 -2.725 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -11.592 1.897 -3.955 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -12.217 1.453 -2.350 1.00 0.00 H new ATOM 2002 N LYS B 33 -15.272 1.986 -3.721 1.00 0.00 N ATOM 2003 CA LYS B 33 -15.549 3.430 -3.498 1.00 0.00 C ATOM 2004 C LYS B 33 -16.130 3.608 -2.101 1.00 0.00 C ATOM 2005 O LYS B 33 -15.612 4.349 -1.290 1.00 0.00 O ATOM 2006 CB LYS B 33 -16.547 3.936 -4.543 1.00 0.00 C ATOM 2007 CG LYS B 33 -16.794 5.432 -4.331 1.00 0.00 C ATOM 2008 CD LYS B 33 -17.497 6.018 -5.558 1.00 0.00 C ATOM 2009 CE LYS B 33 -18.806 5.266 -5.812 1.00 0.00 C ATOM 2010 NZ LYS B 33 -19.506 5.032 -4.518 1.00 0.00 N ATOM 0 H LYS B 33 -15.668 1.588 -4.572 1.00 0.00 H new ATOM 0 HA LYS B 33 -14.625 4.001 -3.590 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -16.160 3.759 -5.547 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -17.485 3.387 -4.462 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -17.405 5.587 -3.441 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -15.848 5.946 -4.162 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -17.700 7.077 -5.401 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -16.848 5.943 -6.431 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -19.444 5.841 -6.483 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -18.602 4.315 -6.304 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -20.524 4.908 -4.691 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -19.125 4.176 -4.067 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -19.359 5.849 -3.891 1.00 0.00 H new ATOM 2024 N GLU B 34 -17.213 2.933 -1.815 1.00 0.00 N ATOM 2025 CA GLU B 34 -17.831 3.071 -0.463 1.00 0.00 C ATOM 2026 C GLU B 34 -16.733 2.926 0.598 1.00 0.00 C ATOM 2027 O GLU B 34 -16.757 3.583 1.619 1.00 0.00 O ATOM 2028 CB GLU B 34 -18.892 1.987 -0.263 1.00 0.00 C ATOM 2029 CG GLU B 34 -19.945 2.094 -1.368 1.00 0.00 C ATOM 2030 CD GLU B 34 -20.800 3.341 -1.140 1.00 0.00 C ATOM 2031 OE1 GLU B 34 -21.680 3.286 -0.297 1.00 0.00 O ATOM 2032 OE2 GLU B 34 -20.560 4.331 -1.812 1.00 0.00 O ATOM 0 H GLU B 34 -17.693 2.298 -2.453 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.307 4.047 -0.372 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -18.428 1.001 -0.282 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.362 2.099 0.714 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -19.460 2.146 -2.343 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -20.575 1.204 -1.372 1.00 0.00 H new ATOM 2039 N LEU B 35 -15.762 2.087 0.359 1.00 0.00 N ATOM 2040 CA LEU B 35 -14.661 1.928 1.350 1.00 0.00 C ATOM 2041 C LEU B 35 -13.849 3.233 1.393 1.00 0.00 C ATOM 2042 O LEU B 35 -13.490 3.704 2.450 1.00 0.00 O ATOM 2043 CB LEU B 35 -13.763 0.730 0.943 1.00 0.00 C ATOM 2044 CG LEU B 35 -13.908 -0.430 1.946 1.00 0.00 C ATOM 2045 CD1 LEU B 35 -13.384 -1.723 1.316 1.00 0.00 C ATOM 2046 CD2 LEU B 35 -13.098 -0.126 3.214 1.00 0.00 C ATOM 0 H LEU B 35 -15.684 1.507 -0.476 1.00 0.00 H new ATOM 0 HA LEU B 35 -15.066 1.726 2.341 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.035 0.389 -0.056 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -12.722 1.049 0.898 1.00 0.00 H new ATOM 0 HG LEU B 35 -14.961 -0.546 2.204 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -13.488 -2.542 2.027 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -13.958 -1.948 0.417 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -12.333 -1.600 1.054 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -13.204 -0.950 3.920 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -12.047 -0.005 2.954 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -13.467 0.793 3.670 1.00 0.00 H new ATOM 2058 N ILE B 36 -13.574 3.833 0.267 1.00 0.00 N ATOM 2059 CA ILE B 36 -12.806 5.114 0.272 1.00 0.00 C ATOM 2060 C ILE B 36 -13.512 6.123 1.182 1.00 0.00 C ATOM 2061 O ILE B 36 -12.883 6.933 1.834 1.00 0.00 O ATOM 2062 CB ILE B 36 -12.759 5.679 -1.156 1.00 0.00 C ATOM 2063 CG1 ILE B 36 -12.140 4.641 -2.122 1.00 0.00 C ATOM 2064 CG2 ILE B 36 -11.937 6.975 -1.170 1.00 0.00 C ATOM 2065 CD1 ILE B 36 -10.603 4.689 -2.086 1.00 0.00 C ATOM 0 H ILE B 36 -13.847 3.494 -0.655 1.00 0.00 H new ATOM 0 HA ILE B 36 -11.794 4.933 0.635 1.00 0.00 H new ATOM 0 HB ILE B 36 -13.774 5.897 -1.488 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -12.481 3.642 -1.852 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -12.488 4.833 -3.137 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -11.905 7.374 -2.184 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -12.399 7.706 -0.506 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -10.923 6.766 -0.830 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -10.200 3.948 -2.776 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -10.263 5.682 -2.381 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -10.256 4.472 -1.076 1.00 0.00 H new ATOM 2077 N ASN B 37 -14.816 6.097 1.207 1.00 0.00 N ATOM 2078 CA ASN B 37 -15.574 7.070 2.046 1.00 0.00 C ATOM 2079 C ASN B 37 -15.311 6.830 3.536 1.00 0.00 C ATOM 2080 O ASN B 37 -15.310 7.753 4.325 1.00 0.00 O ATOM 2081 CB ASN B 37 -17.071 6.909 1.772 1.00 0.00 C ATOM 2082 CG ASN B 37 -17.401 7.469 0.387 1.00 0.00 C ATOM 2083 OD1 ASN B 37 -17.109 6.850 -0.617 1.00 0.00 O ATOM 2084 ND2 ASN B 37 -18.002 8.623 0.290 1.00 0.00 N ATOM 0 H ASN B 37 -15.393 5.441 0.680 1.00 0.00 H new ATOM 0 HA ASN B 37 -15.245 8.078 1.791 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -17.350 5.857 1.826 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -17.649 7.432 2.534 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -18.227 9.005 -0.629 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -18.247 9.143 1.133 1.00 0.00 H new ATOM 2091 N ASN B 38 -15.113 5.595 3.931 1.00 0.00 N ATOM 2092 CA ASN B 38 -14.877 5.282 5.380 1.00 0.00 C ATOM 2093 C ASN B 38 -13.443 4.792 5.599 1.00 0.00 C ATOM 2094 O ASN B 38 -13.010 4.613 6.720 1.00 0.00 O ATOM 2095 CB ASN B 38 -15.845 4.176 5.808 1.00 0.00 C ATOM 2096 CG ASN B 38 -17.264 4.742 5.890 1.00 0.00 C ATOM 2097 OD1 ASN B 38 -18.013 4.407 6.787 1.00 0.00 O ATOM 2098 ND2 ASN B 38 -17.669 5.591 4.986 1.00 0.00 N ATOM 0 H ASN B 38 -15.104 4.785 3.311 1.00 0.00 H new ATOM 0 HA ASN B 38 -15.036 6.186 5.968 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -15.811 3.353 5.094 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -15.547 3.772 6.775 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -18.614 5.973 5.032 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -17.041 5.873 4.233 1.00 0.00 H new ATOM 2105 N GLU B 39 -12.703 4.554 4.549 1.00 0.00 N ATOM 2106 CA GLU B 39 -11.304 4.054 4.721 1.00 0.00 C ATOM 2107 C GLU B 39 -10.317 5.225 4.754 1.00 0.00 C ATOM 2108 O GLU B 39 -9.299 5.166 5.416 1.00 0.00 O ATOM 2109 CB GLU B 39 -10.953 3.137 3.547 1.00 0.00 C ATOM 2110 CG GLU B 39 -9.663 2.376 3.857 1.00 0.00 C ATOM 2111 CD GLU B 39 -9.958 1.261 4.861 1.00 0.00 C ATOM 2112 OE1 GLU B 39 -9.957 1.544 6.048 1.00 0.00 O ATOM 2113 OE2 GLU B 39 -10.179 0.142 4.427 1.00 0.00 O ATOM 0 H GLU B 39 -13.003 4.683 3.583 1.00 0.00 H new ATOM 0 HA GLU B 39 -11.236 3.508 5.662 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.767 2.435 3.365 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -10.830 3.725 2.637 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -9.247 1.955 2.941 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -8.915 3.057 4.263 1.00 0.00 H new ATOM 2120 N LEU B 40 -10.613 6.290 4.048 1.00 0.00 N ATOM 2121 CA LEU B 40 -9.701 7.481 4.032 1.00 0.00 C ATOM 2122 C LEU B 40 -10.494 8.738 4.392 1.00 0.00 C ATOM 2123 O LEU B 40 -10.276 9.801 3.845 1.00 0.00 O ATOM 2124 CB LEU B 40 -9.105 7.645 2.632 1.00 0.00 C ATOM 2125 CG LEU B 40 -8.386 6.356 2.216 1.00 0.00 C ATOM 2126 CD1 LEU B 40 -7.953 6.472 0.752 1.00 0.00 C ATOM 2127 CD2 LEU B 40 -7.149 6.131 3.102 1.00 0.00 C ATOM 0 H LEU B 40 -11.453 6.387 3.478 1.00 0.00 H new ATOM 0 HA LEU B 40 -8.901 7.334 4.758 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -9.894 7.879 1.917 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -8.406 8.481 2.621 1.00 0.00 H new ATOM 0 HG LEU B 40 -9.064 5.511 2.335 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -7.441 5.558 0.450 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -8.831 6.620 0.124 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -7.278 7.320 0.638 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -6.646 5.213 2.798 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -6.465 6.973 2.993 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -7.458 6.047 4.144 1.00 0.00 H new ATOM 2139 N SER B 41 -11.423 8.620 5.301 1.00 0.00 N ATOM 2140 CA SER B 41 -12.245 9.799 5.691 1.00 0.00 C ATOM 2141 C SER B 41 -11.402 10.786 6.503 1.00 0.00 C ATOM 2142 O SER B 41 -11.655 11.974 6.502 1.00 0.00 O ATOM 2143 CB SER B 41 -13.427 9.329 6.539 1.00 0.00 C ATOM 2144 OG SER B 41 -12.958 8.943 7.824 1.00 0.00 O ATOM 0 H SER B 41 -11.648 7.755 5.792 1.00 0.00 H new ATOM 0 HA SER B 41 -12.605 10.296 4.790 1.00 0.00 H new ATOM 0 HB2 SER B 41 -14.163 10.128 6.632 1.00 0.00 H new ATOM 0 HB3 SER B 41 -13.927 8.490 6.054 1.00 0.00 H new ATOM 0 HG SER B 41 -13.713 8.643 8.371 1.00 0.00 H new ATOM 2150 N HIS B 42 -10.408 10.310 7.201 1.00 0.00 N ATOM 2151 CA HIS B 42 -9.564 11.232 8.012 1.00 0.00 C ATOM 2152 C HIS B 42 -8.640 12.035 7.094 1.00 0.00 C ATOM 2153 O HIS B 42 -8.578 13.246 7.168 1.00 0.00 O ATOM 2154 CB HIS B 42 -8.725 10.419 8.996 1.00 0.00 C ATOM 2155 CG HIS B 42 -7.854 11.346 9.799 1.00 0.00 C ATOM 2156 ND1 HIS B 42 -6.471 11.313 9.722 1.00 0.00 N ATOM 2157 CD2 HIS B 42 -8.156 12.338 10.698 1.00 0.00 C ATOM 2158 CE1 HIS B 42 -5.996 12.259 10.553 1.00 0.00 C ATOM 2159 NE2 HIS B 42 -6.982 12.913 11.173 1.00 0.00 N ATOM 0 H HIS B 42 -10.144 9.326 7.245 1.00 0.00 H new ATOM 0 HA HIS B 42 -10.208 11.919 8.561 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -9.375 9.848 9.659 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -8.109 9.700 8.457 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -9.154 12.628 10.992 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -4.946 12.464 10.701 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -6.893 13.671 11.849 1.00 0.00 H new ATOM 2167 N PHE B 43 -7.920 11.373 6.230 1.00 0.00 N ATOM 2168 CA PHE B 43 -7.003 12.107 5.313 1.00 0.00 C ATOM 2169 C PHE B 43 -7.826 13.027 4.411 1.00 0.00 C ATOM 2170 O PHE B 43 -7.320 13.976 3.847 1.00 0.00 O ATOM 2171 CB PHE B 43 -6.224 11.105 4.459 1.00 0.00 C ATOM 2172 CG PHE B 43 -5.301 10.302 5.345 1.00 0.00 C ATOM 2173 CD1 PHE B 43 -5.756 9.118 5.937 1.00 0.00 C ATOM 2174 CD2 PHE B 43 -3.991 10.740 5.574 1.00 0.00 C ATOM 2175 CE1 PHE B 43 -4.903 8.373 6.758 1.00 0.00 C ATOM 2176 CE2 PHE B 43 -3.137 9.994 6.395 1.00 0.00 C ATOM 2177 CZ PHE B 43 -3.593 8.811 6.986 1.00 0.00 C ATOM 0 H PHE B 43 -7.927 10.359 6.120 1.00 0.00 H new ATOM 0 HA PHE B 43 -6.300 12.703 5.895 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -6.914 10.441 3.937 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -5.649 11.630 3.697 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -6.766 8.780 5.760 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -3.639 11.653 5.117 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -5.255 7.460 7.216 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -2.127 10.332 6.572 1.00 0.00 H new ATOM 0 HZ PHE B 43 -2.934 8.235 7.619 1.00 0.00 H new ATOM 2187 N LEU B 44 -9.092 12.744 4.266 1.00 0.00 N ATOM 2188 CA LEU B 44 -9.959 13.587 3.394 1.00 0.00 C ATOM 2189 C LEU B 44 -9.733 15.068 3.725 1.00 0.00 C ATOM 2190 O LEU B 44 -9.588 15.897 2.849 1.00 0.00 O ATOM 2191 CB LEU B 44 -11.432 13.204 3.639 1.00 0.00 C ATOM 2192 CG LEU B 44 -12.288 13.461 2.382 1.00 0.00 C ATOM 2193 CD1 LEU B 44 -12.097 14.906 1.906 1.00 0.00 C ATOM 2194 CD2 LEU B 44 -11.903 12.483 1.248 1.00 0.00 C ATOM 0 H LEU B 44 -9.565 11.961 4.717 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.711 13.422 2.345 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -11.496 12.152 3.918 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.827 13.780 4.476 1.00 0.00 H new ATOM 0 HG LEU B 44 -13.335 13.300 2.640 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -12.705 15.080 1.018 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -12.403 15.593 2.695 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -11.047 15.074 1.666 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -12.519 12.682 0.371 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -10.852 12.619 0.992 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -12.066 11.458 1.581 1.00 0.00 H new ATOM 2206 N GLU B 45 -9.708 15.408 4.983 1.00 0.00 N ATOM 2207 CA GLU B 45 -9.501 16.833 5.365 1.00 0.00 C ATOM 2208 C GLU B 45 -8.136 17.317 4.866 1.00 0.00 C ATOM 2209 O GLU B 45 -7.981 18.450 4.457 1.00 0.00 O ATOM 2210 CB GLU B 45 -9.562 16.963 6.888 1.00 0.00 C ATOM 2211 CG GLU B 45 -9.638 18.442 7.274 1.00 0.00 C ATOM 2212 CD GLU B 45 -9.776 18.566 8.792 1.00 0.00 C ATOM 2213 OE1 GLU B 45 -10.135 17.582 9.417 1.00 0.00 O ATOM 2214 OE2 GLU B 45 -9.521 19.644 9.304 1.00 0.00 O ATOM 0 H GLU B 45 -9.822 14.761 5.763 1.00 0.00 H new ATOM 0 HA GLU B 45 -10.283 17.443 4.911 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -10.431 16.431 7.274 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -8.682 16.504 7.338 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.743 18.964 6.936 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -10.488 18.914 6.781 1.00 0.00 H new ATOM 2221 N GLU B 46 -7.142 16.472 4.912 1.00 0.00 N ATOM 2222 CA GLU B 46 -5.779 16.885 4.456 1.00 0.00 C ATOM 2223 C GLU B 46 -5.610 16.620 2.955 1.00 0.00 C ATOM 2224 O GLU B 46 -4.764 15.849 2.549 1.00 0.00 O ATOM 2225 CB GLU B 46 -4.729 16.087 5.231 1.00 0.00 C ATOM 2226 CG GLU B 46 -4.757 16.505 6.703 1.00 0.00 C ATOM 2227 CD GLU B 46 -4.210 17.927 6.842 1.00 0.00 C ATOM 2228 OE1 GLU B 46 -3.492 18.353 5.953 1.00 0.00 O ATOM 2229 OE2 GLU B 46 -4.519 18.565 7.835 1.00 0.00 O ATOM 0 H GLU B 46 -7.213 15.511 5.246 1.00 0.00 H new ATOM 0 HA GLU B 46 -5.653 17.952 4.640 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -4.928 15.019 5.141 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -3.739 16.263 4.810 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -5.776 16.457 7.086 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -4.160 15.815 7.299 1.00 0.00 H new ATOM 2236 N ILE B 47 -6.401 17.264 2.129 1.00 0.00 N ATOM 2237 CA ILE B 47 -6.288 17.071 0.644 1.00 0.00 C ATOM 2238 C ILE B 47 -6.077 18.432 -0.022 1.00 0.00 C ATOM 2239 O ILE B 47 -6.927 19.298 0.040 1.00 0.00 O ATOM 2240 CB ILE B 47 -7.580 16.448 0.105 1.00 0.00 C ATOM 2241 CG1 ILE B 47 -7.848 15.098 0.806 1.00 0.00 C ATOM 2242 CG2 ILE B 47 -7.464 16.251 -1.411 1.00 0.00 C ATOM 2243 CD1 ILE B 47 -7.035 13.956 0.167 1.00 0.00 C ATOM 0 H ILE B 47 -7.126 17.920 2.421 1.00 0.00 H new ATOM 0 HA ILE B 47 -5.447 16.412 0.427 1.00 0.00 H new ATOM 0 HB ILE B 47 -8.416 17.116 0.311 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -7.594 15.179 1.863 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -8.911 14.864 0.751 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -8.384 15.808 -1.792 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -7.300 17.215 -1.892 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -6.625 15.590 -1.629 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -7.249 13.022 0.686 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -7.309 13.858 -0.884 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -5.971 14.179 0.245 1.00 0.00 H new ATOM 2255 N LYS B 48 -4.950 18.633 -0.657 1.00 0.00 N ATOM 2256 CA LYS B 48 -4.687 19.945 -1.324 1.00 0.00 C ATOM 2257 C LYS B 48 -5.071 19.859 -2.804 1.00 0.00 C ATOM 2258 O LYS B 48 -5.877 20.627 -3.291 1.00 0.00 O ATOM 2259 CB LYS B 48 -3.199 20.286 -1.207 1.00 0.00 C ATOM 2260 CG LYS B 48 -2.867 20.632 0.246 1.00 0.00 C ATOM 2261 CD LYS B 48 -1.347 20.715 0.422 1.00 0.00 C ATOM 2262 CE LYS B 48 -0.757 21.704 -0.590 1.00 0.00 C ATOM 2263 NZ LYS B 48 0.582 22.157 -0.116 1.00 0.00 N ATOM 0 H LYS B 48 -4.201 17.946 -0.743 1.00 0.00 H new ATOM 0 HA LYS B 48 -5.281 20.720 -0.840 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -2.594 19.442 -1.538 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -2.956 21.127 -1.857 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -3.327 21.582 0.518 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -3.279 19.876 0.914 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -1.107 21.033 1.437 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -0.902 19.730 0.283 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -0.668 21.231 -1.568 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -1.422 22.560 -0.709 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 0.984 22.828 -0.801 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 0.484 22.623 0.808 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 1.214 21.336 -0.024 1.00 0.00 H new ATOM 2277 N GLU B 49 -4.494 18.934 -3.526 1.00 0.00 N ATOM 2278 CA GLU B 49 -4.820 18.805 -4.977 1.00 0.00 C ATOM 2279 C GLU B 49 -6.134 18.031 -5.138 1.00 0.00 C ATOM 2280 O GLU B 49 -6.188 16.836 -4.925 1.00 0.00 O ATOM 2281 CB GLU B 49 -3.674 18.065 -5.688 1.00 0.00 C ATOM 2282 CG GLU B 49 -3.651 18.434 -7.176 1.00 0.00 C ATOM 2283 CD GLU B 49 -3.209 19.890 -7.339 1.00 0.00 C ATOM 2284 OE1 GLU B 49 -2.013 20.131 -7.324 1.00 0.00 O ATOM 2285 OE2 GLU B 49 -4.074 20.740 -7.476 1.00 0.00 O ATOM 0 H GLU B 49 -3.812 18.263 -3.174 1.00 0.00 H new ATOM 0 HA GLU B 49 -4.937 19.793 -5.422 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -2.721 18.325 -5.226 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -3.800 16.988 -5.574 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -2.970 17.775 -7.714 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -4.641 18.293 -7.611 1.00 0.00 H new ATOM 2292 N GLN B 50 -7.194 18.697 -5.508 1.00 0.00 N ATOM 2293 CA GLN B 50 -8.499 17.993 -5.677 1.00 0.00 C ATOM 2294 C GLN B 50 -8.566 17.319 -7.053 1.00 0.00 C ATOM 2295 O GLN B 50 -9.343 16.410 -7.269 1.00 0.00 O ATOM 2296 CB GLN B 50 -9.638 19.009 -5.558 1.00 0.00 C ATOM 2297 CG GLN B 50 -10.981 18.288 -5.685 1.00 0.00 C ATOM 2298 CD GLN B 50 -12.112 19.238 -5.285 1.00 0.00 C ATOM 2299 OE1 GLN B 50 -13.221 18.810 -5.035 1.00 0.00 O ATOM 2300 NE2 GLN B 50 -11.876 20.519 -5.212 1.00 0.00 N ATOM 0 H GLN B 50 -7.214 19.698 -5.701 1.00 0.00 H new ATOM 0 HA GLN B 50 -8.594 17.231 -4.904 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -9.580 19.526 -4.600 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -9.546 19.767 -6.335 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -11.126 17.945 -6.709 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -10.992 17.404 -5.048 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -10.945 20.879 -5.422 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -12.623 21.161 -4.945 1.00 0.00 H new ATOM 2309 N GLU B 51 -7.774 17.765 -7.990 1.00 0.00 N ATOM 2310 CA GLU B 51 -7.817 17.154 -9.353 1.00 0.00 C ATOM 2311 C GLU B 51 -7.199 15.751 -9.340 1.00 0.00 C ATOM 2312 O GLU B 51 -7.532 14.922 -10.163 1.00 0.00 O ATOM 2313 CB GLU B 51 -7.084 18.045 -10.358 1.00 0.00 C ATOM 2314 CG GLU B 51 -7.886 19.328 -10.585 1.00 0.00 C ATOM 2315 CD GLU B 51 -9.111 19.020 -11.447 1.00 0.00 C ATOM 2316 OE1 GLU B 51 -8.929 18.726 -12.618 1.00 0.00 O ATOM 2317 OE2 GLU B 51 -10.211 19.083 -10.923 1.00 0.00 O ATOM 0 H GLU B 51 -7.101 18.523 -7.873 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.861 17.067 -9.655 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -6.088 18.287 -9.986 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -6.952 17.515 -11.301 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -8.198 19.748 -9.629 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -7.263 20.077 -11.074 1.00 0.00 H new ATOM 2324 N VAL B 52 -6.341 15.449 -8.408 1.00 0.00 N ATOM 2325 CA VAL B 52 -5.773 14.071 -8.365 1.00 0.00 C ATOM 2326 C VAL B 52 -6.845 13.136 -7.808 1.00 0.00 C ATOM 2327 O VAL B 52 -7.125 12.098 -8.374 1.00 0.00 O ATOM 2328 CB VAL B 52 -4.543 14.037 -7.456 1.00 0.00 C ATOM 2329 CG1 VAL B 52 -4.080 12.588 -7.277 1.00 0.00 C ATOM 2330 CG2 VAL B 52 -3.415 14.854 -8.091 1.00 0.00 C ATOM 0 H VAL B 52 -6.011 16.085 -7.683 1.00 0.00 H new ATOM 0 HA VAL B 52 -5.473 13.759 -9.365 1.00 0.00 H new ATOM 0 HB VAL B 52 -4.799 14.461 -6.485 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -3.204 12.563 -6.629 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -4.881 12.003 -6.825 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -3.825 12.165 -8.249 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -2.539 14.830 -7.443 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -3.160 14.429 -9.062 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -3.742 15.886 -8.221 1.00 0.00 H new ATOM 2340 N VAL B 53 -7.462 13.489 -6.717 1.00 0.00 N ATOM 2341 CA VAL B 53 -8.521 12.607 -6.158 1.00 0.00 C ATOM 2342 C VAL B 53 -9.671 12.524 -7.162 1.00 0.00 C ATOM 2343 O VAL B 53 -10.335 11.515 -7.284 1.00 0.00 O ATOM 2344 CB VAL B 53 -9.031 13.191 -4.840 1.00 0.00 C ATOM 2345 CG1 VAL B 53 -10.202 12.352 -4.327 1.00 0.00 C ATOM 2346 CG2 VAL B 53 -7.903 13.174 -3.807 1.00 0.00 C ATOM 0 H VAL B 53 -7.281 14.344 -6.191 1.00 0.00 H new ATOM 0 HA VAL B 53 -8.117 11.612 -5.974 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.363 14.216 -5.002 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -10.565 12.769 -3.388 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -11.006 12.362 -5.063 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -9.871 11.326 -4.165 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -8.265 13.590 -2.867 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -7.572 12.148 -3.646 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -7.067 13.772 -4.171 1.00 0.00 H new ATOM 2356 N ASP B 54 -9.911 13.585 -7.881 1.00 0.00 N ATOM 2357 CA ASP B 54 -11.016 13.576 -8.878 1.00 0.00 C ATOM 2358 C ASP B 54 -10.770 12.471 -9.907 1.00 0.00 C ATOM 2359 O ASP B 54 -11.660 11.716 -10.245 1.00 0.00 O ATOM 2360 CB ASP B 54 -11.074 14.927 -9.593 1.00 0.00 C ATOM 2361 CG ASP B 54 -12.171 14.895 -10.658 1.00 0.00 C ATOM 2362 OD1 ASP B 54 -11.878 14.487 -11.770 1.00 0.00 O ATOM 2363 OD2 ASP B 54 -13.286 15.279 -10.345 1.00 0.00 O ATOM 0 H ASP B 54 -9.388 14.459 -7.821 1.00 0.00 H new ATOM 0 HA ASP B 54 -11.960 13.394 -8.365 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -11.273 15.722 -8.875 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -10.111 15.148 -10.054 1.00 0.00 H new ATOM 2368 N LYS B 55 -9.571 12.378 -10.422 1.00 0.00 N ATOM 2369 CA LYS B 55 -9.283 11.331 -11.443 1.00 0.00 C ATOM 2370 C LYS B 55 -9.369 9.945 -10.803 1.00 0.00 C ATOM 2371 O LYS B 55 -9.690 8.976 -11.463 1.00 0.00 O ATOM 2372 CB LYS B 55 -7.893 11.548 -12.045 1.00 0.00 C ATOM 2373 CG LYS B 55 -7.682 10.589 -13.221 1.00 0.00 C ATOM 2374 CD LYS B 55 -6.493 11.063 -14.062 1.00 0.00 C ATOM 2375 CE LYS B 55 -5.247 11.170 -13.179 1.00 0.00 C ATOM 2376 NZ LYS B 55 -4.034 11.248 -14.040 1.00 0.00 N ATOM 0 H LYS B 55 -8.783 12.979 -10.180 1.00 0.00 H new ATOM 0 HA LYS B 55 -10.023 11.401 -12.240 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -7.789 12.579 -12.382 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -7.128 11.382 -11.286 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -7.500 9.579 -12.852 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -8.581 10.547 -13.835 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -6.312 10.365 -14.880 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -6.716 12.030 -14.512 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -5.313 12.054 -12.544 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -5.182 10.306 -12.517 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -3.187 11.321 -13.441 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -3.970 10.392 -14.628 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -4.097 12.085 -14.653 1.00 0.00 H new ATOM 2390 N VAL B 56 -9.134 9.830 -9.525 1.00 0.00 N ATOM 2391 CA VAL B 56 -9.261 8.498 -8.874 1.00 0.00 C ATOM 2392 C VAL B 56 -10.731 8.084 -8.946 1.00 0.00 C ATOM 2393 O VAL B 56 -11.069 7.041 -9.469 1.00 0.00 O ATOM 2394 CB VAL B 56 -8.805 8.600 -7.412 1.00 0.00 C ATOM 2395 CG1 VAL B 56 -9.246 7.356 -6.633 1.00 0.00 C ATOM 2396 CG2 VAL B 56 -7.278 8.708 -7.376 1.00 0.00 C ATOM 0 H VAL B 56 -8.862 10.595 -8.908 1.00 0.00 H new ATOM 0 HA VAL B 56 -8.640 7.757 -9.376 1.00 0.00 H new ATOM 0 HB VAL B 56 -9.255 9.481 -6.953 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -8.917 7.440 -5.597 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -10.333 7.274 -6.663 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -8.803 6.468 -7.084 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -6.943 8.781 -6.341 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -6.840 7.823 -7.838 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -6.963 9.597 -7.923 1.00 0.00 H new ATOM 2406 N MET B 57 -11.610 8.900 -8.432 1.00 0.00 N ATOM 2407 CA MET B 57 -13.057 8.556 -8.480 1.00 0.00 C ATOM 2408 C MET B 57 -13.449 8.213 -9.918 1.00 0.00 C ATOM 2409 O MET B 57 -14.351 7.433 -10.151 1.00 0.00 O ATOM 2410 CB MET B 57 -13.888 9.744 -7.991 1.00 0.00 C ATOM 2411 CG MET B 57 -13.549 10.042 -6.530 1.00 0.00 C ATOM 2412 SD MET B 57 -14.133 8.683 -5.487 1.00 0.00 S ATOM 2413 CE MET B 57 -13.196 9.117 -4.002 1.00 0.00 C ATOM 0 H MET B 57 -11.388 9.788 -7.982 1.00 0.00 H new ATOM 0 HA MET B 57 -13.246 7.698 -7.835 1.00 0.00 H new ATOM 0 HB2 MET B 57 -13.686 10.620 -8.607 1.00 0.00 H new ATOM 0 HB3 MET B 57 -14.951 9.523 -8.090 1.00 0.00 H new ATOM 0 HG2 MET B 57 -12.473 10.168 -6.413 1.00 0.00 H new ATOM 0 HG3 MET B 57 -14.014 10.978 -6.221 1.00 0.00 H new ATOM 0 HE1 MET B 57 -13.631 8.615 -3.138 1.00 0.00 H new ATOM 0 HE2 MET B 57 -12.159 8.802 -4.121 1.00 0.00 H new ATOM 0 HE3 MET B 57 -13.232 10.196 -3.851 1.00 0.00 H new ATOM 2423 N GLU B 58 -12.760 8.759 -10.891 1.00 0.00 N ATOM 2424 CA GLU B 58 -13.075 8.426 -12.312 1.00 0.00 C ATOM 2425 C GLU B 58 -12.298 7.169 -12.707 1.00 0.00 C ATOM 2426 O GLU B 58 -12.781 6.347 -13.457 1.00 0.00 O ATOM 2427 CB GLU B 58 -12.708 9.596 -13.229 1.00 0.00 C ATOM 2428 CG GLU B 58 -13.386 9.413 -14.588 1.00 0.00 C ATOM 2429 CD GLU B 58 -12.951 10.537 -15.530 1.00 0.00 C ATOM 2430 OE1 GLU B 58 -11.756 10.757 -15.644 1.00 0.00 O ATOM 2431 OE2 GLU B 58 -13.819 11.158 -16.121 1.00 0.00 O ATOM 0 H GLU B 58 -11.994 9.420 -10.761 1.00 0.00 H new ATOM 0 HA GLU B 58 -14.144 8.242 -12.417 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -13.022 10.537 -12.778 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -11.626 9.648 -13.355 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -13.119 8.445 -15.012 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -14.470 9.422 -14.470 1.00 0.00 H new ATOM 2438 N THR B 59 -11.111 6.995 -12.193 1.00 0.00 N ATOM 2439 CA THR B 59 -10.337 5.768 -12.535 1.00 0.00 C ATOM 2440 C THR B 59 -11.056 4.568 -11.922 1.00 0.00 C ATOM 2441 O THR B 59 -11.280 3.575 -12.586 1.00 0.00 O ATOM 2442 CB THR B 59 -8.910 5.871 -11.990 1.00 0.00 C ATOM 2443 OG1 THR B 59 -8.391 7.165 -12.268 1.00 0.00 O ATOM 2444 CG2 THR B 59 -8.028 4.814 -12.655 1.00 0.00 C ATOM 0 H THR B 59 -10.647 7.643 -11.557 1.00 0.00 H new ATOM 0 HA THR B 59 -10.273 5.653 -13.617 1.00 0.00 H new ATOM 0 HB THR B 59 -8.921 5.705 -10.913 1.00 0.00 H new ATOM 0 HG1 THR B 59 -8.702 7.796 -11.586 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.013 4.890 -12.265 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.426 3.822 -12.442 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.016 4.976 -13.733 1.00 0.00 H new ATOM 2452 N LEU B 60 -11.460 4.646 -10.688 1.00 0.00 N ATOM 2453 CA LEU B 60 -12.205 3.505 -10.092 1.00 0.00 C ATOM 2454 C LEU B 60 -13.495 3.303 -10.886 1.00 0.00 C ATOM 2455 O LEU B 60 -13.751 2.237 -11.409 1.00 0.00 O ATOM 2456 CB LEU B 60 -12.557 3.828 -8.633 1.00 0.00 C ATOM 2457 CG LEU B 60 -11.301 3.720 -7.742 1.00 0.00 C ATOM 2458 CD1 LEU B 60 -11.486 4.571 -6.481 1.00 0.00 C ATOM 2459 CD2 LEU B 60 -11.071 2.261 -7.322 1.00 0.00 C ATOM 0 H LEU B 60 -11.309 5.443 -10.070 1.00 0.00 H new ATOM 0 HA LEU B 60 -11.594 2.603 -10.124 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.973 4.833 -8.566 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -13.324 3.141 -8.276 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.442 4.076 -8.311 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -10.597 4.492 -5.855 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -11.639 5.612 -6.764 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -12.354 4.215 -5.926 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -10.182 2.199 -6.694 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -11.936 1.903 -6.763 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -10.932 1.644 -8.210 1.00 0.00 H new ATOM 2471 N ASP B 61 -14.308 4.319 -10.986 1.00 0.00 N ATOM 2472 CA ASP B 61 -15.577 4.181 -11.752 1.00 0.00 C ATOM 2473 C ASP B 61 -15.273 3.654 -13.157 1.00 0.00 C ATOM 2474 O ASP B 61 -16.121 3.070 -13.803 1.00 0.00 O ATOM 2475 CB ASP B 61 -16.263 5.544 -11.858 1.00 0.00 C ATOM 2476 CG ASP B 61 -17.587 5.392 -12.608 1.00 0.00 C ATOM 2477 OD1 ASP B 61 -18.511 4.842 -12.032 1.00 0.00 O ATOM 2478 OD2 ASP B 61 -17.654 5.826 -13.746 1.00 0.00 O ATOM 0 H ASP B 61 -14.148 5.237 -10.571 1.00 0.00 H new ATOM 0 HA ASP B 61 -16.235 3.482 -11.236 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -16.441 5.952 -10.863 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -15.616 6.249 -12.380 1.00 0.00 H new ATOM 2483 N GLU B 62 -14.069 3.855 -13.639 1.00 0.00 N ATOM 2484 CA GLU B 62 -13.708 3.364 -15.007 1.00 0.00 C ATOM 2485 C GLU B 62 -12.931 2.064 -14.888 1.00 0.00 C ATOM 2486 O GLU B 62 -11.969 1.815 -15.587 1.00 0.00 O ATOM 2487 CB GLU B 62 -12.847 4.385 -15.700 1.00 0.00 C ATOM 2488 CG GLU B 62 -13.703 5.570 -16.157 1.00 0.00 C ATOM 2489 CD GLU B 62 -12.813 6.613 -16.834 1.00 0.00 C ATOM 2490 OE1 GLU B 62 -11.607 6.531 -16.669 1.00 0.00 O ATOM 2491 OE2 GLU B 62 -13.352 7.477 -17.505 1.00 0.00 O ATOM 0 H GLU B 62 -13.320 4.339 -13.143 1.00 0.00 H new ATOM 0 HA GLU B 62 -14.620 3.201 -15.582 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -12.064 4.731 -15.025 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -12.351 3.932 -16.558 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -14.473 5.230 -16.849 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -14.215 6.013 -15.303 1.00 0.00 H new ATOM 2498 N ASP B 63 -13.365 1.250 -14.009 1.00 0.00 N ATOM 2499 CA ASP B 63 -12.711 -0.074 -13.781 1.00 0.00 C ATOM 2500 C ASP B 63 -12.414 -0.730 -15.132 1.00 0.00 C ATOM 2501 O ASP B 63 -11.414 -1.397 -15.309 1.00 0.00 O ATOM 2502 CB ASP B 63 -13.690 -0.964 -13.019 1.00 0.00 C ATOM 2503 CG ASP B 63 -14.950 -1.176 -13.862 1.00 0.00 C ATOM 2504 OD1 ASP B 63 -15.477 -0.195 -14.362 1.00 0.00 O ATOM 2505 OD2 ASP B 63 -15.366 -2.315 -13.994 1.00 0.00 O ATOM 0 H ASP B 63 -14.170 1.433 -13.409 1.00 0.00 H new ATOM 0 HA ASP B 63 -11.785 0.057 -13.220 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -13.225 -1.924 -12.793 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -13.950 -0.504 -12.066 1.00 0.00 H new ATOM 2510 N GLY B 64 -13.270 -0.502 -16.087 1.00 0.00 N ATOM 2511 CA GLY B 64 -13.073 -1.061 -17.457 1.00 0.00 C ATOM 2512 C GLY B 64 -12.820 -2.581 -17.435 1.00 0.00 C ATOM 2513 O GLY B 64 -12.796 -3.211 -18.474 1.00 0.00 O ATOM 0 H GLY B 64 -14.115 0.059 -15.976 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -13.954 -0.850 -18.064 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.230 -0.561 -17.934 1.00 0.00 H new ATOM 2517 N ASP B 65 -12.631 -3.181 -16.280 1.00 0.00 N ATOM 2518 CA ASP B 65 -12.379 -4.669 -16.225 1.00 0.00 C ATOM 2519 C ASP B 65 -13.606 -5.451 -15.675 1.00 0.00 C ATOM 2520 O ASP B 65 -13.812 -6.582 -16.069 1.00 0.00 O ATOM 2521 CB ASP B 65 -11.174 -4.927 -15.314 1.00 0.00 C ATOM 2522 CG ASP B 65 -11.270 -4.035 -14.075 1.00 0.00 C ATOM 2523 OD1 ASP B 65 -12.158 -4.267 -13.271 1.00 0.00 O ATOM 2524 OD2 ASP B 65 -10.455 -3.136 -13.952 1.00 0.00 O ATOM 0 H ASP B 65 -12.639 -2.711 -15.375 1.00 0.00 H new ATOM 0 HA ASP B 65 -12.190 -5.019 -17.240 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -11.146 -5.976 -15.019 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -10.248 -4.722 -15.851 1.00 0.00 H new ATOM 2529 N GLY B 66 -14.416 -4.906 -14.785 1.00 0.00 N ATOM 2530 CA GLY B 66 -15.592 -5.674 -14.258 1.00 0.00 C ATOM 2531 C GLY B 66 -15.282 -6.152 -12.835 1.00 0.00 C ATOM 2532 O GLY B 66 -16.170 -6.361 -12.032 1.00 0.00 O ATOM 0 H GLY B 66 -14.310 -3.965 -14.405 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -16.482 -5.045 -14.258 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -15.804 -6.527 -14.903 1.00 0.00 H new ATOM 2536 N GLU B 67 -14.022 -6.312 -12.510 1.00 0.00 N ATOM 2537 CA GLU B 67 -13.650 -6.758 -11.129 1.00 0.00 C ATOM 2538 C GLU B 67 -12.304 -6.139 -10.739 1.00 0.00 C ATOM 2539 O GLU B 67 -11.349 -6.209 -11.487 1.00 0.00 O ATOM 2540 CB GLU B 67 -13.534 -8.285 -11.094 1.00 0.00 C ATOM 2541 CG GLU B 67 -14.833 -8.915 -11.601 1.00 0.00 C ATOM 2542 CD GLU B 67 -14.796 -10.424 -11.353 1.00 0.00 C ATOM 2543 OE1 GLU B 67 -15.218 -10.840 -10.287 1.00 0.00 O ATOM 2544 OE2 GLU B 67 -14.345 -11.138 -12.234 1.00 0.00 O ATOM 0 H GLU B 67 -13.236 -6.153 -13.140 1.00 0.00 H new ATOM 0 HA GLU B 67 -14.419 -6.436 -10.427 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -12.696 -8.610 -11.711 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -13.329 -8.620 -10.077 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -15.688 -8.472 -11.091 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -14.957 -8.713 -12.665 1.00 0.00 H new ATOM 2551 N CYS B 68 -12.209 -5.538 -9.574 1.00 0.00 N ATOM 2552 CA CYS B 68 -10.912 -4.922 -9.141 1.00 0.00 C ATOM 2553 C CYS B 68 -10.221 -5.854 -8.143 1.00 0.00 C ATOM 2554 O CYS B 68 -10.792 -6.240 -7.142 1.00 0.00 O ATOM 2555 CB CYS B 68 -11.183 -3.568 -8.477 1.00 0.00 C ATOM 2556 SG CYS B 68 -12.415 -2.660 -9.443 1.00 0.00 S ATOM 0 H CYS B 68 -12.974 -5.448 -8.905 1.00 0.00 H new ATOM 0 HA CYS B 68 -10.269 -4.774 -10.009 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -11.541 -3.715 -7.458 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -10.260 -2.992 -8.411 1.00 0.00 H new ATOM 0 HG CYS B 68 -12.208 -1.383 -9.319 1.00 0.00 H new ATOM 2562 N ASP B 69 -8.998 -6.225 -8.410 1.00 0.00 N ATOM 2563 CA ASP B 69 -8.273 -7.138 -7.480 1.00 0.00 C ATOM 2564 C ASP B 69 -7.680 -6.333 -6.320 1.00 0.00 C ATOM 2565 O ASP B 69 -7.881 -5.139 -6.213 1.00 0.00 O ATOM 2566 CB ASP B 69 -7.146 -7.843 -8.243 1.00 0.00 C ATOM 2567 CG ASP B 69 -6.660 -9.054 -7.444 1.00 0.00 C ATOM 2568 OD1 ASP B 69 -7.244 -9.330 -6.409 1.00 0.00 O ATOM 2569 OD2 ASP B 69 -5.712 -9.684 -7.881 1.00 0.00 O ATOM 0 H ASP B 69 -8.469 -5.935 -9.233 1.00 0.00 H new ATOM 0 HA ASP B 69 -8.968 -7.878 -7.083 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -7.501 -8.161 -9.223 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -6.320 -7.152 -8.412 1.00 0.00 H new ATOM 2574 N PHE B 70 -6.942 -6.977 -5.457 1.00 0.00 N ATOM 2575 CA PHE B 70 -6.325 -6.247 -4.312 1.00 0.00 C ATOM 2576 C PHE B 70 -5.135 -5.433 -4.827 1.00 0.00 C ATOM 2577 O PHE B 70 -4.821 -4.383 -4.303 1.00 0.00 O ATOM 2578 CB PHE B 70 -5.860 -7.253 -3.255 1.00 0.00 C ATOM 2579 CG PHE B 70 -5.462 -6.527 -1.991 1.00 0.00 C ATOM 2580 CD1 PHE B 70 -4.229 -5.867 -1.920 1.00 0.00 C ATOM 2581 CD2 PHE B 70 -6.323 -6.521 -0.888 1.00 0.00 C ATOM 2582 CE1 PHE B 70 -3.858 -5.200 -0.746 1.00 0.00 C ATOM 2583 CE2 PHE B 70 -5.954 -5.854 0.285 1.00 0.00 C ATOM 2584 CZ PHE B 70 -4.721 -5.193 0.357 1.00 0.00 C ATOM 0 H PHE B 70 -6.740 -7.976 -5.495 1.00 0.00 H new ATOM 0 HA PHE B 70 -7.054 -5.575 -3.860 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -6.659 -7.963 -3.040 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -5.016 -7.828 -3.635 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.564 -5.872 -2.771 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -7.273 -7.032 -0.942 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.907 -4.691 -0.691 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -6.620 -5.849 1.135 1.00 0.00 H new ATOM 0 HZ PHE B 70 -4.436 -4.678 1.263 1.00 0.00 H new ATOM 2594 N GLN B 71 -4.481 -5.894 -5.855 1.00 0.00 N ATOM 2595 CA GLN B 71 -3.328 -5.123 -6.400 1.00 0.00 C ATOM 2596 C GLN B 71 -3.831 -3.763 -6.893 1.00 0.00 C ATOM 2597 O GLN B 71 -3.165 -2.757 -6.750 1.00 0.00 O ATOM 2598 CB GLN B 71 -2.707 -5.894 -7.568 1.00 0.00 C ATOM 2599 CG GLN B 71 -1.459 -5.160 -8.062 1.00 0.00 C ATOM 2600 CD GLN B 71 -0.803 -5.966 -9.185 1.00 0.00 C ATOM 2601 OE1 GLN B 71 -0.646 -5.479 -10.287 1.00 0.00 O ATOM 2602 NE2 GLN B 71 -0.410 -7.188 -8.950 1.00 0.00 N ATOM 0 H GLN B 71 -4.692 -6.766 -6.340 1.00 0.00 H new ATOM 0 HA GLN B 71 -2.576 -4.980 -5.624 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -2.446 -6.904 -7.252 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -3.429 -5.990 -8.379 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -1.727 -4.167 -8.422 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -0.756 -5.022 -7.240 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.542 -7.597 -8.025 1.00 0.00 H new ATOM 0 HE22 GLN B 71 0.029 -7.734 -9.691 1.00 0.00 H new ATOM 2611 N GLU B 72 -5.004 -3.722 -7.463 1.00 0.00 N ATOM 2612 CA GLU B 72 -5.552 -2.425 -7.954 1.00 0.00 C ATOM 2613 C GLU B 72 -5.976 -1.556 -6.764 1.00 0.00 C ATOM 2614 O GLU B 72 -5.994 -0.345 -6.843 1.00 0.00 O ATOM 2615 CB GLU B 72 -6.754 -2.680 -8.865 1.00 0.00 C ATOM 2616 CG GLU B 72 -6.433 -3.828 -9.824 1.00 0.00 C ATOM 2617 CD GLU B 72 -7.593 -4.015 -10.803 1.00 0.00 C ATOM 2618 OE1 GLU B 72 -8.507 -3.208 -10.769 1.00 0.00 O ATOM 2619 OE2 GLU B 72 -7.548 -4.962 -11.571 1.00 0.00 O ATOM 0 H GLU B 72 -5.607 -4.531 -7.610 1.00 0.00 H new ATOM 0 HA GLU B 72 -4.780 -1.903 -8.520 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -7.631 -2.926 -8.267 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -6.995 -1.778 -9.428 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.514 -3.614 -10.369 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -6.264 -4.748 -9.264 1.00 0.00 H new ATOM 2626 N PHE B 73 -6.280 -2.171 -5.653 1.00 0.00 N ATOM 2627 CA PHE B 73 -6.671 -1.400 -4.433 1.00 0.00 C ATOM 2628 C PHE B 73 -5.425 -0.747 -3.824 1.00 0.00 C ATOM 2629 O PHE B 73 -5.467 0.401 -3.433 1.00 0.00 O ATOM 2630 CB PHE B 73 -7.363 -2.336 -3.427 1.00 0.00 C ATOM 2631 CG PHE B 73 -7.371 -1.727 -2.037 1.00 0.00 C ATOM 2632 CD1 PHE B 73 -7.902 -0.447 -1.835 1.00 0.00 C ATOM 2633 CD2 PHE B 73 -6.850 -2.446 -0.951 1.00 0.00 C ATOM 2634 CE1 PHE B 73 -7.912 0.112 -0.551 1.00 0.00 C ATOM 2635 CE2 PHE B 73 -6.862 -1.887 0.331 1.00 0.00 C ATOM 2636 CZ PHE B 73 -7.393 -0.607 0.531 1.00 0.00 C ATOM 0 H PHE B 73 -6.275 -3.184 -5.535 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.376 -0.612 -4.699 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -8.386 -2.530 -3.749 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -6.848 -3.297 -3.405 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -8.304 0.109 -2.669 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -6.439 -3.433 -1.105 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -8.321 1.099 -0.396 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -6.462 -2.442 1.166 1.00 0.00 H new ATOM 0 HZ PHE B 73 -7.402 -0.175 1.521 1.00 0.00 H new ATOM 2646 N MET B 74 -4.320 -1.422 -3.754 1.00 0.00 N ATOM 2647 CA MET B 74 -3.122 -0.744 -3.183 1.00 0.00 C ATOM 2648 C MET B 74 -2.769 0.436 -4.102 1.00 0.00 C ATOM 2649 O MET B 74 -2.564 1.538 -3.633 1.00 0.00 O ATOM 2650 CB MET B 74 -1.949 -1.743 -3.064 1.00 0.00 C ATOM 2651 CG MET B 74 -1.223 -1.549 -1.726 1.00 0.00 C ATOM 2652 SD MET B 74 -2.341 -1.989 -0.371 1.00 0.00 S ATOM 2653 CE MET B 74 -1.647 -0.875 0.875 1.00 0.00 C ATOM 0 H MET B 74 -4.189 -2.387 -4.057 1.00 0.00 H new ATOM 0 HA MET B 74 -3.327 -0.374 -2.179 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.322 -2.764 -3.139 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.252 -1.597 -3.889 1.00 0.00 H new ATOM 0 HG2 MET B 74 -0.328 -2.170 -1.691 1.00 0.00 H new ATOM 0 HG3 MET B 74 -0.897 -0.514 -1.623 1.00 0.00 H new ATOM 0 HE1 MET B 74 -2.379 -0.713 1.666 1.00 0.00 H new ATOM 0 HE2 MET B 74 -0.747 -1.319 1.299 1.00 0.00 H new ATOM 0 HE3 MET B 74 -1.396 0.079 0.411 1.00 0.00 H new ATOM 2663 N ALA B 75 -2.701 0.246 -5.387 1.00 0.00 N ATOM 2664 CA ALA B 75 -2.371 1.395 -6.281 1.00 0.00 C ATOM 2665 C ALA B 75 -3.299 2.586 -6.001 1.00 0.00 C ATOM 2666 O ALA B 75 -2.854 3.715 -5.950 1.00 0.00 O ATOM 2667 CB ALA B 75 -2.526 0.964 -7.740 1.00 0.00 C ATOM 0 H ALA B 75 -2.857 -0.645 -5.857 1.00 0.00 H new ATOM 0 HA ALA B 75 -1.343 1.701 -6.089 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -2.285 1.802 -8.394 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -1.850 0.135 -7.948 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -3.554 0.648 -7.919 1.00 0.00 H new ATOM 2673 N PHE B 76 -4.574 2.369 -5.818 1.00 0.00 N ATOM 2674 CA PHE B 76 -5.474 3.535 -5.547 1.00 0.00 C ATOM 2675 C PHE B 76 -5.175 4.098 -4.155 1.00 0.00 C ATOM 2676 O PHE B 76 -5.290 5.284 -3.918 1.00 0.00 O ATOM 2677 CB PHE B 76 -6.952 3.118 -5.615 1.00 0.00 C ATOM 2678 CG PHE B 76 -7.340 2.731 -7.033 1.00 0.00 C ATOM 2679 CD1 PHE B 76 -7.183 3.643 -8.091 1.00 0.00 C ATOM 2680 CD2 PHE B 76 -7.861 1.454 -7.290 1.00 0.00 C ATOM 2681 CE1 PHE B 76 -7.542 3.274 -9.393 1.00 0.00 C ATOM 2682 CE2 PHE B 76 -8.220 1.090 -8.593 1.00 0.00 C ATOM 2683 CZ PHE B 76 -8.059 1.998 -9.644 1.00 0.00 C ATOM 0 H PHE B 76 -5.027 1.456 -5.843 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.290 4.294 -6.308 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.129 2.278 -4.943 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.582 3.939 -5.272 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -6.785 4.629 -7.900 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.985 0.750 -6.480 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -7.420 3.975 -10.205 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -8.622 0.106 -8.787 1.00 0.00 H new ATOM 0 HZ PHE B 76 -8.334 1.715 -10.649 1.00 0.00 H new ATOM 2693 N VAL B 77 -4.793 3.261 -3.234 1.00 0.00 N ATOM 2694 CA VAL B 77 -4.488 3.757 -1.861 1.00 0.00 C ATOM 2695 C VAL B 77 -3.228 4.630 -1.901 1.00 0.00 C ATOM 2696 O VAL B 77 -3.113 5.599 -1.177 1.00 0.00 O ATOM 2697 CB VAL B 77 -4.261 2.560 -0.929 1.00 0.00 C ATOM 2698 CG1 VAL B 77 -3.700 3.041 0.414 1.00 0.00 C ATOM 2699 CG2 VAL B 77 -5.593 1.839 -0.693 1.00 0.00 C ATOM 0 H VAL B 77 -4.678 2.257 -3.370 1.00 0.00 H new ATOM 0 HA VAL B 77 -5.324 4.351 -1.491 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.548 1.877 -1.392 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -3.542 2.185 1.070 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -2.752 3.553 0.250 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -4.407 3.728 0.879 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -5.434 0.988 -0.031 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -6.303 2.527 -0.235 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -5.991 1.488 -1.645 1.00 0.00 H new ATOM 2709 N SER B 78 -2.282 4.294 -2.732 1.00 0.00 N ATOM 2710 CA SER B 78 -1.033 5.106 -2.804 1.00 0.00 C ATOM 2711 C SER B 78 -1.324 6.462 -3.456 1.00 0.00 C ATOM 2712 O SER B 78 -1.009 7.501 -2.911 1.00 0.00 O ATOM 2713 CB SER B 78 0.011 4.358 -3.636 1.00 0.00 C ATOM 2714 OG SER B 78 -0.239 4.585 -5.017 1.00 0.00 O ATOM 0 H SER B 78 -2.318 3.494 -3.364 1.00 0.00 H new ATOM 0 HA SER B 78 -0.655 5.269 -1.795 1.00 0.00 H new ATOM 0 HB2 SER B 78 1.013 4.699 -3.375 1.00 0.00 H new ATOM 0 HB3 SER B 78 -0.030 3.291 -3.418 1.00 0.00 H new ATOM 0 HG SER B 78 -1.071 4.137 -5.277 1.00 0.00 H new ATOM 2720 N MET B 79 -1.898 6.462 -4.626 1.00 0.00 N ATOM 2721 CA MET B 79 -2.180 7.751 -5.320 1.00 0.00 C ATOM 2722 C MET B 79 -2.971 8.689 -4.406 1.00 0.00 C ATOM 2723 O MET B 79 -2.619 9.836 -4.216 1.00 0.00 O ATOM 2724 CB MET B 79 -2.998 7.471 -6.583 1.00 0.00 C ATOM 2725 CG MET B 79 -2.127 6.737 -7.606 1.00 0.00 C ATOM 2726 SD MET B 79 -3.006 6.640 -9.190 1.00 0.00 S ATOM 2727 CE MET B 79 -3.311 4.854 -9.205 1.00 0.00 C ATOM 0 H MET B 79 -2.185 5.625 -5.133 1.00 0.00 H new ATOM 0 HA MET B 79 -1.235 8.227 -5.581 1.00 0.00 H new ATOM 0 HB2 MET B 79 -3.872 6.869 -6.336 1.00 0.00 H new ATOM 0 HB3 MET B 79 -3.364 8.406 -7.006 1.00 0.00 H new ATOM 0 HG2 MET B 79 -1.180 7.260 -7.735 1.00 0.00 H new ATOM 0 HG3 MET B 79 -1.891 5.735 -7.247 1.00 0.00 H new ATOM 0 HE1 MET B 79 -3.850 4.585 -10.113 1.00 0.00 H new ATOM 0 HE2 MET B 79 -2.360 4.322 -9.177 1.00 0.00 H new ATOM 0 HE3 MET B 79 -3.906 4.579 -8.334 1.00 0.00 H new ATOM 2737 N VAL B 80 -4.049 8.210 -3.854 1.00 0.00 N ATOM 2738 CA VAL B 80 -4.882 9.073 -2.965 1.00 0.00 C ATOM 2739 C VAL B 80 -4.050 9.559 -1.773 1.00 0.00 C ATOM 2740 O VAL B 80 -4.111 10.712 -1.393 1.00 0.00 O ATOM 2741 CB VAL B 80 -6.081 8.265 -2.449 1.00 0.00 C ATOM 2742 CG1 VAL B 80 -6.835 9.076 -1.390 1.00 0.00 C ATOM 2743 CG2 VAL B 80 -7.029 7.953 -3.609 1.00 0.00 C ATOM 0 H VAL B 80 -4.392 7.257 -3.979 1.00 0.00 H new ATOM 0 HA VAL B 80 -5.232 9.935 -3.533 1.00 0.00 H new ATOM 0 HB VAL B 80 -5.720 7.335 -2.009 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -7.685 8.499 -1.027 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.166 9.300 -0.559 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -7.191 10.008 -1.830 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -7.879 7.379 -3.240 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -7.384 8.885 -4.050 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -6.500 7.372 -4.365 1.00 0.00 H new ATOM 2753 N THR B 81 -3.279 8.693 -1.175 1.00 0.00 N ATOM 2754 CA THR B 81 -2.455 9.108 -0.007 1.00 0.00 C ATOM 2755 C THR B 81 -1.351 10.069 -0.462 1.00 0.00 C ATOM 2756 O THR B 81 -1.050 11.039 0.204 1.00 0.00 O ATOM 2757 CB THR B 81 -1.827 7.865 0.629 1.00 0.00 C ATOM 2758 OG1 THR B 81 -1.347 7.004 -0.393 1.00 0.00 O ATOM 2759 CG2 THR B 81 -2.875 7.128 1.467 1.00 0.00 C ATOM 0 H THR B 81 -3.185 7.714 -1.446 1.00 0.00 H new ATOM 0 HA THR B 81 -3.086 9.616 0.722 1.00 0.00 H new ATOM 0 HB THR B 81 -1.000 8.167 1.272 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.915 6.207 -0.442 1.00 0.00 H new ATOM 0 HG21 THR B 81 -2.424 6.244 1.918 1.00 0.00 H new ATOM 0 HG22 THR B 81 -3.243 7.788 2.252 1.00 0.00 H new ATOM 0 HG23 THR B 81 -3.705 6.826 0.828 1.00 0.00 H new ATOM 2767 N THR B 82 -0.739 9.807 -1.585 1.00 0.00 N ATOM 2768 CA THR B 82 0.347 10.708 -2.066 1.00 0.00 C ATOM 2769 C THR B 82 -0.191 12.136 -2.198 1.00 0.00 C ATOM 2770 O THR B 82 0.393 13.076 -1.695 1.00 0.00 O ATOM 2771 CB THR B 82 0.854 10.220 -3.427 1.00 0.00 C ATOM 2772 OG1 THR B 82 -0.253 9.871 -4.246 1.00 0.00 O ATOM 2773 CG2 THR B 82 1.753 8.996 -3.234 1.00 0.00 C ATOM 0 H THR B 82 -0.943 9.011 -2.189 1.00 0.00 H new ATOM 0 HA THR B 82 1.169 10.698 -1.350 1.00 0.00 H new ATOM 0 HB THR B 82 1.426 11.015 -3.906 1.00 0.00 H new ATOM 0 HG1 THR B 82 -1.085 10.135 -3.801 1.00 0.00 H new ATOM 0 HG21 THR B 82 2.112 8.652 -4.204 1.00 0.00 H new ATOM 0 HG22 THR B 82 2.603 9.264 -2.607 1.00 0.00 H new ATOM 0 HG23 THR B 82 1.185 8.199 -2.754 1.00 0.00 H new ATOM 2781 N ALA B 83 -1.294 12.311 -2.873 1.00 0.00 N ATOM 2782 CA ALA B 83 -1.854 13.682 -3.036 1.00 0.00 C ATOM 2783 C ALA B 83 -2.021 14.333 -1.661 1.00 0.00 C ATOM 2784 O ALA B 83 -1.923 15.535 -1.517 1.00 0.00 O ATOM 2785 CB ALA B 83 -3.215 13.597 -3.732 1.00 0.00 C ATOM 0 H ALA B 83 -1.830 11.566 -3.318 1.00 0.00 H new ATOM 0 HA ALA B 83 -1.174 14.283 -3.640 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -3.626 14.600 -3.852 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -3.094 13.135 -4.712 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -3.895 12.996 -3.129 1.00 0.00 H new