USER MOD reduce.3.24.130724 H: found=0, std=0, add=1375, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1375 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 61 TYR OH : rot -145:sc= 2.21 USER MOD Set 1.2: A 83 LYS NZ :NH3+ -141:sc= 2.29 (180deg=-0.862) USER MOD Set 2.1: A 46 THR OG1 : rot 180:sc= 0.937 USER MOD Set 2.2: A 49 HIS : no HE2:sc= -3.4 K(o=-2.5,f=-16!) USER MOD Set 3.1: A 38 LYS NZ :NH3+ -138:sc= 1.17 (180deg=0) USER MOD Set 3.2: A 43 THR OG1 : rot 180:sc= 0.995 USER MOD Set 4.1: A 31 ASN : amide:sc= 0.669 K(o=1.7,f=-11!) USER MOD Set 4.2: A 104 LYS NZ :NH3+ -160:sc= 1.06 (180deg=-0.595) USER MOD Set 5.1: A 12 MET CE :methyl -153:sc= -0.315 (180deg=-1.2) USER MOD Set 5.2: A 15 THR OG1 : rot 74:sc= 0.889 USER MOD Single : A 1 MET CE :methyl -159:sc= -0.309 (180deg=-1.02) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 GLN :FLIP amide:sc= -0.0187 F(o=-1.4!,f=-0.019) USER MOD Single : A 10 HIS : no HD1:sc= -0.0368 X(o=-0.037,f=-0.49) USER MOD Single : A 13 GLN : amide:sc= -0.43 X(o=-0.43,f=-0.68) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 8:sc= 1 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.00456 USER MOD Single : A 23 SER OG : rot -6:sc= 0.145! USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -66:sc= 1.27 USER MOD Single : A 42 LYS NZ :NH3+ 167:sc= 1.06 (180deg=0.746) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 30:sc= -0.288 USER MOD Single : A 52 GLN : amide:sc= -1.8 K(o=-1.8,f=-2.4) USER MOD Single : A 54 GLN : amide:sc= -0.0141 K(o=-0.014,f=-0.57) USER MOD Single : A 55 LYS NZ :NH3+ -163:sc= 1.63 (180deg=1.01) USER MOD Single : A 60 LYS NZ :NH3+ -167:sc= 1.22 (180deg=1.03) USER MOD Single : A 69 SER OG : rot 180:sc= 0.0285 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 167:sc= 0 (180deg=-0.201) USER MOD Single : A 77 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -165:sc= -0.0486 (180deg=-0.316) USER MOD Single : A 88 ASN : amide:sc= 0.411 K(o=0.41,f=-8.1!) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 172:sc= -2.22! (180deg=-2.41!) USER MOD Single : A 95 GLN :FLIP amide:sc= 0 F(o=-0.91,f=0) USER MOD Single : A 97 MET CE :methyl 162:sc= -0.385 (180deg=-1.16) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN :FLIP amide:sc= -0.772 F(o=-1.9!,f=-0.77) USER MOD Single : A 108 HIS : +bothHN:sc= 1.33 K(o=1.3,f=-8.7!) USER MOD Single : A 118 THR OG1 : rot 6:sc= 0.672 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 HIS : +bothHN:sc= -0.264 K(o=-0.26,f=-8.5!) USER MOD Single : A 127 THR OG1 : rot 180:sc= -0.391 USER MOD Single : A 129 ASN : amide:sc= -0.111 K(o=-0.11,f=-1.6!) USER MOD Single : A 132 TYR OH : rot -118:sc= 0.717 USER MOD Single : A 138 HIS :FLIP no HD1:sc= -0.224 F(o=-1.3,f=-0.22) USER MOD Single : A 140 LYS NZ :NH3+ 157:sc= -0.178 (180deg=-0.674) USER MOD Single : A 142 LYS NZ :NH3+ -161:sc= 1.04 (180deg=-0.393!) USER MOD Single : A 143 ASN : amide:sc= 0.845 K(o=0.84,f=-2.9!) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 155 GLN : amide:sc= -0.263 K(o=-0.26,f=-2.8!) USER MOD Single : A 160 LYS NZ :NH3+ -170:sc= -0.0288 (180deg=-0.161) USER MOD Single : A 163 HIS : no HE2:sc= 0.0222 K(o=0.022,f=-6.9!) USER MOD Single : A 164 HIS : no HE2:sc= -0.579 K(o=-0.58,f=-1.7) USER MOD Single : A 165 HIS : no HD1:sc= -0.203 X(o=-0.2,f=-0.2) USER MOD Single : A 166 HIS : no HD1:sc=-0.00538 X(o=-0.0054,f=0) USER MOD Single : A 167 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 168 HIS : no HD1:sc= -0.161 X(o=-0.16,f=-0.012) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.202 7.950 17.678 1.00 0.00 N ATOM 2 CA MET A 1 14.814 7.181 16.474 1.00 0.00 C ATOM 3 C MET A 1 13.423 7.575 15.999 1.00 0.00 C ATOM 4 O MET A 1 12.431 7.324 16.684 1.00 0.00 O ATOM 5 CB MET A 1 14.839 5.679 16.769 1.00 0.00 C ATOM 6 CG MET A 1 16.231 5.071 16.799 1.00 0.00 C ATOM 7 SD MET A 1 17.030 5.077 15.180 1.00 0.00 S ATOM 8 CE MET A 1 15.870 4.101 14.220 1.00 0.00 C ATOM 0 H1 MET A 1 16.154 7.663 17.982 1.00 0.00 H new ATOM 0 H2 MET A 1 15.201 8.966 17.456 1.00 0.00 H new ATOM 0 H3 MET A 1 14.523 7.762 18.443 1.00 0.00 H new ATOM 0 HA MET A 1 15.534 7.411 15.688 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.357 5.501 17.730 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.246 5.162 16.014 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.849 5.624 17.507 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.167 4.046 17.164 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.372 3.702 13.339 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.496 3.278 14.829 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.036 4.730 13.909 1.00 0.00 H new ATOM 20 N PRO A 2 13.329 8.205 14.823 1.00 0.00 N ATOM 21 CA PRO A 2 12.051 8.518 14.198 1.00 0.00 C ATOM 22 C PRO A 2 11.493 7.289 13.499 1.00 0.00 C ATOM 23 O PRO A 2 11.816 7.031 12.338 1.00 0.00 O ATOM 24 CB PRO A 2 12.393 9.617 13.176 1.00 0.00 C ATOM 25 CG PRO A 2 13.867 9.861 13.302 1.00 0.00 C ATOM 26 CD PRO A 2 14.447 8.663 14.001 1.00 0.00 C ATOM 0 HA PRO A 2 11.295 8.837 14.915 1.00 0.00 H new ATOM 0 HB2 PRO A 2 12.136 9.302 12.165 1.00 0.00 H new ATOM 0 HB3 PRO A 2 11.829 10.527 13.380 1.00 0.00 H new ATOM 0 HG2 PRO A 2 14.322 9.994 12.321 1.00 0.00 H new ATOM 0 HG3 PRO A 2 14.061 10.771 13.869 1.00 0.00 H new ATOM 0 HD2 PRO A 2 14.771 7.899 13.295 1.00 0.00 H new ATOM 0 HD3 PRO A 2 15.314 8.927 14.606 1.00 0.00 H new ATOM 34 N VAL A 3 10.678 6.522 14.226 1.00 0.00 N ATOM 35 CA VAL A 3 10.203 5.213 13.771 1.00 0.00 C ATOM 36 C VAL A 3 11.356 4.205 13.787 1.00 0.00 C ATOM 37 O VAL A 3 12.484 4.528 13.411 1.00 0.00 O ATOM 38 CB VAL A 3 9.573 5.277 12.354 1.00 0.00 C ATOM 39 CG1 VAL A 3 9.057 3.914 11.915 1.00 0.00 C ATOM 40 CG2 VAL A 3 8.455 6.310 12.312 1.00 0.00 C ATOM 0 H VAL A 3 10.329 6.790 15.146 1.00 0.00 H new ATOM 0 HA VAL A 3 9.422 4.891 14.460 1.00 0.00 H new ATOM 0 HB VAL A 3 10.354 5.579 11.656 1.00 0.00 H new ATOM 0 HG11 VAL A 3 8.622 3.993 10.919 1.00 0.00 H new ATOM 0 HG12 VAL A 3 9.882 3.202 11.895 1.00 0.00 H new ATOM 0 HG13 VAL A 3 8.297 3.569 12.616 1.00 0.00 H new ATOM 0 HG21 VAL A 3 8.025 6.341 11.311 1.00 0.00 H new ATOM 0 HG22 VAL A 3 7.682 6.039 13.031 1.00 0.00 H new ATOM 0 HG23 VAL A 3 8.857 7.291 12.565 1.00 0.00 H new ATOM 50 N ARG A 4 11.085 2.985 14.231 1.00 0.00 N ATOM 51 CA ARG A 4 12.116 1.954 14.289 1.00 0.00 C ATOM 52 C ARG A 4 12.311 1.300 12.926 1.00 0.00 C ATOM 53 O ARG A 4 12.340 0.071 12.796 1.00 0.00 O ATOM 54 CB ARG A 4 11.791 0.906 15.355 1.00 0.00 C ATOM 55 CG ARG A 4 12.030 1.402 16.771 1.00 0.00 C ATOM 56 CD ARG A 4 11.985 0.274 17.791 1.00 0.00 C ATOM 57 NE ARG A 4 10.640 -0.267 17.970 1.00 0.00 N ATOM 58 CZ ARG A 4 9.920 -0.092 19.077 1.00 0.00 C ATOM 59 NH1 ARG A 4 10.398 0.639 20.078 1.00 0.00 N ATOM 60 NH2 ARG A 4 8.723 -0.648 19.182 1.00 0.00 N ATOM 0 H ARG A 4 10.166 2.685 14.555 1.00 0.00 H new ATOM 0 HA ARG A 4 13.052 2.436 14.570 1.00 0.00 H new ATOM 0 HB2 ARG A 4 10.749 0.604 15.253 1.00 0.00 H new ATOM 0 HB3 ARG A 4 12.398 0.018 15.180 1.00 0.00 H new ATOM 0 HG2 ARG A 4 13.000 1.897 16.822 1.00 0.00 H new ATOM 0 HG3 ARG A 4 11.277 2.149 17.024 1.00 0.00 H new ATOM 0 HD2 ARG A 4 12.655 -0.525 17.474 1.00 0.00 H new ATOM 0 HD3 ARG A 4 12.356 0.640 18.748 1.00 0.00 H new ATOM 0 HE ARG A 4 10.231 -0.807 17.208 1.00 0.00 H new ATOM 0 HH11 ARG A 4 11.320 1.069 20.001 1.00 0.00 H new ATOM 0 HH12 ARG A 4 9.843 0.770 20.924 1.00 0.00 H new ATOM 0 HH21 ARG A 4 8.353 -1.210 18.416 1.00 0.00 H new ATOM 0 HH22 ARG A 4 8.171 -0.514 20.029 1.00 0.00 H new ATOM 74 N ALA A 5 12.450 2.143 11.913 1.00 0.00 N ATOM 75 CA ALA A 5 12.761 1.699 10.571 1.00 0.00 C ATOM 76 C ALA A 5 14.270 1.553 10.421 1.00 0.00 C ATOM 77 O ALA A 5 15.006 1.698 11.399 1.00 0.00 O ATOM 78 CB ALA A 5 12.208 2.685 9.552 1.00 0.00 C ATOM 0 H ALA A 5 12.349 3.154 12.003 1.00 0.00 H new ATOM 0 HA ALA A 5 12.296 0.730 10.391 1.00 0.00 H new ATOM 0 HB1 ALA A 5 12.448 2.341 8.546 1.00 0.00 H new ATOM 0 HB2 ALA A 5 11.126 2.755 9.663 1.00 0.00 H new ATOM 0 HB3 ALA A 5 12.654 3.666 9.716 1.00 0.00 H new ATOM 84 N GLN A 6 14.726 1.263 9.203 1.00 0.00 N ATOM 85 CA GLN A 6 16.153 1.080 8.938 1.00 0.00 C ATOM 86 C GLN A 6 16.720 -0.064 9.776 1.00 0.00 C ATOM 87 O GLN A 6 17.895 -0.046 10.145 1.00 0.00 O ATOM 88 CB GLN A 6 16.936 2.368 9.233 1.00 0.00 C ATOM 89 CG GLN A 6 16.636 3.514 8.281 1.00 0.00 C ATOM 90 CD GLN A 6 17.426 4.766 8.620 1.00 0.00 C ATOM 91 OE1 GLN A 6 16.967 5.617 9.381 1.00 0.00 O ATOM 92 NE2 GLN A 6 18.623 4.884 8.062 1.00 0.00 N ATOM 0 H GLN A 6 14.128 1.150 8.384 1.00 0.00 H new ATOM 0 HA GLN A 6 16.261 0.834 7.882 1.00 0.00 H new ATOM 0 HB2 GLN A 6 16.714 2.689 10.251 1.00 0.00 H new ATOM 0 HB3 GLN A 6 18.003 2.148 9.193 1.00 0.00 H new ATOM 0 HG2 GLN A 6 16.867 3.206 7.261 1.00 0.00 H new ATOM 0 HG3 GLN A 6 15.570 3.740 8.312 1.00 0.00 H new ATOM 0 HE21 GLN A 6 18.968 4.156 7.436 1.00 0.00 H new ATOM 0 HE22 GLN A 6 19.199 5.703 8.259 1.00 0.00 H new ATOM 101 N ARG A 7 15.880 -1.060 10.065 1.00 0.00 N ATOM 102 CA ARG A 7 16.292 -2.209 10.874 1.00 0.00 C ATOM 103 C ARG A 7 17.533 -2.853 10.268 1.00 0.00 C ATOM 104 O ARG A 7 18.512 -3.127 10.963 1.00 0.00 O ATOM 105 CB ARG A 7 15.159 -3.233 10.961 1.00 0.00 C ATOM 106 CG ARG A 7 14.887 -3.733 12.372 1.00 0.00 C ATOM 107 CD ARG A 7 14.267 -2.646 13.241 1.00 0.00 C ATOM 108 NE ARG A 7 13.986 -3.121 14.596 1.00 0.00 N ATOM 109 CZ ARG A 7 12.832 -2.924 15.235 1.00 0.00 C ATOM 110 NH1 ARG A 7 11.838 -2.264 14.648 1.00 0.00 N ATOM 111 NH2 ARG A 7 12.672 -3.380 16.472 1.00 0.00 N ATOM 0 H ARG A 7 14.910 -1.094 9.751 1.00 0.00 H new ATOM 0 HA ARG A 7 16.526 -1.863 11.881 1.00 0.00 H new ATOM 0 HB2 ARG A 7 14.248 -2.787 10.562 1.00 0.00 H new ATOM 0 HB3 ARG A 7 15.402 -4.084 10.325 1.00 0.00 H new ATOM 0 HG2 ARG A 7 14.219 -4.593 12.332 1.00 0.00 H new ATOM 0 HG3 ARG A 7 15.818 -4.074 12.824 1.00 0.00 H new ATOM 0 HD2 ARG A 7 14.942 -1.791 13.289 1.00 0.00 H new ATOM 0 HD3 ARG A 7 13.343 -2.297 12.780 1.00 0.00 H new ATOM 0 HE ARG A 7 14.720 -3.636 15.083 1.00 0.00 H new ATOM 0 HH11 ARG A 7 11.954 -1.903 13.701 1.00 0.00 H new ATOM 0 HH12 ARG A 7 10.959 -2.118 15.145 1.00 0.00 H new ATOM 0 HH21 ARG A 7 13.432 -3.881 16.933 1.00 0.00 H new ATOM 0 HH22 ARG A 7 11.790 -3.229 16.961 1.00 0.00 H new ATOM 125 N ILE A 8 17.480 -3.081 8.965 1.00 0.00 N ATOM 126 CA ILE A 8 18.637 -3.541 8.222 1.00 0.00 C ATOM 127 C ILE A 8 19.163 -2.393 7.364 1.00 0.00 C ATOM 128 O ILE A 8 18.414 -1.801 6.586 1.00 0.00 O ATOM 129 CB ILE A 8 18.292 -4.754 7.328 1.00 0.00 C ATOM 130 CG1 ILE A 8 17.694 -5.887 8.174 1.00 0.00 C ATOM 131 CG2 ILE A 8 19.532 -5.237 6.585 1.00 0.00 C ATOM 132 CD1 ILE A 8 17.266 -7.093 7.364 1.00 0.00 C ATOM 0 H ILE A 8 16.641 -2.953 8.399 1.00 0.00 H new ATOM 0 HA ILE A 8 19.401 -3.862 8.931 1.00 0.00 H new ATOM 0 HB ILE A 8 17.550 -4.444 6.592 1.00 0.00 H new ATOM 0 HG12 ILE A 8 18.429 -6.201 8.916 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.833 -5.504 8.721 1.00 0.00 H new ATOM 0 HG21 ILE A 8 19.272 -6.091 5.960 1.00 0.00 H new ATOM 0 HG22 ILE A 8 19.917 -4.433 5.958 1.00 0.00 H new ATOM 0 HG23 ILE A 8 20.295 -5.533 7.305 1.00 0.00 H new ATOM 0 HD11 ILE A 8 16.854 -7.851 8.030 1.00 0.00 H new ATOM 0 HD12 ILE A 8 16.508 -6.795 6.640 1.00 0.00 H new ATOM 0 HD13 ILE A 8 18.128 -7.503 6.838 1.00 0.00 H new ATOM 144 N GLN A 9 20.439 -2.067 7.532 1.00 0.00 N ATOM 145 CA GLN A 9 21.040 -0.925 6.847 1.00 0.00 C ATOM 146 C GLN A 9 21.114 -1.149 5.341 1.00 0.00 C ATOM 147 O GLN A 9 20.929 -0.221 4.553 1.00 0.00 O ATOM 148 CB GLN A 9 22.448 -0.668 7.382 1.00 0.00 C ATOM 149 CG GLN A 9 22.513 -0.410 8.881 1.00 0.00 C ATOM 150 CD GLN A 9 23.936 -0.231 9.374 1.00 0.00 C ATOM 151 OE1 GLN A 9 24.874 -0.878 8.703 1.00 0.00 O flip ATOM 152 NE2 GLN A 9 24.190 0.478 10.349 1.00 0.00 N flip ATOM 0 H GLN A 9 21.081 -2.578 8.138 1.00 0.00 H new ATOM 0 HA GLN A 9 20.405 -0.060 7.039 1.00 0.00 H new ATOM 0 HB2 GLN A 9 23.076 -1.527 7.146 1.00 0.00 H new ATOM 0 HB3 GLN A 9 22.871 0.190 6.859 1.00 0.00 H new ATOM 0 HG2 GLN A 9 21.934 0.482 9.119 1.00 0.00 H new ATOM 0 HG3 GLN A 9 22.049 -1.242 9.411 1.00 0.00 H new ATOM 0 HE21 GLN A 9 23.437 0.960 10.839 1.00 0.00 H new ATOM 0 HE22 GLN A 9 25.154 0.583 10.666 1.00 0.00 H new ATOM 161 N HIS A 10 21.393 -2.381 4.947 1.00 0.00 N ATOM 162 CA HIS A 10 21.584 -2.703 3.545 1.00 0.00 C ATOM 163 C HIS A 10 21.254 -4.168 3.299 1.00 0.00 C ATOM 164 O HIS A 10 21.710 -5.042 4.035 1.00 0.00 O ATOM 165 CB HIS A 10 23.033 -2.403 3.140 1.00 0.00 C ATOM 166 CG HIS A 10 23.313 -2.565 1.678 1.00 0.00 C ATOM 167 ND1 HIS A 10 23.964 -3.658 1.157 1.00 0.00 N ATOM 168 CD2 HIS A 10 23.049 -1.754 0.629 1.00 0.00 C ATOM 169 CE1 HIS A 10 24.087 -3.513 -0.148 1.00 0.00 C ATOM 170 NE2 HIS A 10 23.541 -2.365 -0.496 1.00 0.00 N ATOM 0 H HIS A 10 21.492 -3.174 5.580 1.00 0.00 H new ATOM 0 HA HIS A 10 20.916 -2.091 2.939 1.00 0.00 H new ATOM 0 HB2 HIS A 10 23.275 -1.381 3.433 1.00 0.00 H new ATOM 0 HB3 HIS A 10 23.698 -3.061 3.700 1.00 0.00 H new ATOM 0 HD2 HIS A 10 22.544 -0.800 0.669 1.00 0.00 H new ATOM 0 HE1 HIS A 10 24.556 -4.217 -0.819 1.00 0.00 H new ATOM 0 HE2 HIS A 10 23.492 -1.993 -1.444 1.00 0.00 H new ATOM 179 N VAL A 11 20.458 -4.430 2.278 1.00 0.00 N ATOM 180 CA VAL A 11 20.067 -5.793 1.954 1.00 0.00 C ATOM 181 C VAL A 11 21.120 -6.465 1.079 1.00 0.00 C ATOM 182 O VAL A 11 22.154 -5.876 0.764 1.00 0.00 O ATOM 183 CB VAL A 11 18.695 -5.848 1.248 1.00 0.00 C ATOM 184 CG1 VAL A 11 17.611 -5.251 2.136 1.00 0.00 C ATOM 185 CG2 VAL A 11 18.750 -5.142 -0.095 1.00 0.00 C ATOM 0 H VAL A 11 20.069 -3.719 1.659 1.00 0.00 H new ATOM 0 HA VAL A 11 19.984 -6.331 2.898 1.00 0.00 H new ATOM 0 HB VAL A 11 18.445 -6.893 1.066 1.00 0.00 H new ATOM 0 HG11 VAL A 11 16.652 -5.299 1.621 1.00 0.00 H new ATOM 0 HG12 VAL A 11 17.552 -5.815 3.067 1.00 0.00 H new ATOM 0 HG13 VAL A 11 17.853 -4.211 2.356 1.00 0.00 H new ATOM 0 HG21 VAL A 11 17.772 -5.194 -0.574 1.00 0.00 H new ATOM 0 HG22 VAL A 11 19.026 -4.098 0.054 1.00 0.00 H new ATOM 0 HG23 VAL A 11 19.491 -5.626 -0.731 1.00 0.00 H new ATOM 195 N MET A 12 20.851 -7.694 0.690 1.00 0.00 N ATOM 196 CA MET A 12 21.781 -8.460 -0.123 1.00 0.00 C ATOM 197 C MET A 12 21.342 -8.427 -1.580 1.00 0.00 C ATOM 198 O MET A 12 20.209 -8.042 -1.879 1.00 0.00 O ATOM 199 CB MET A 12 21.826 -9.904 0.377 1.00 0.00 C ATOM 200 CG MET A 12 22.175 -10.026 1.853 1.00 0.00 C ATOM 201 SD MET A 12 21.825 -11.664 2.518 1.00 0.00 S ATOM 202 CE MET A 12 20.050 -11.748 2.281 1.00 0.00 C ATOM 0 H MET A 12 19.991 -8.189 0.924 1.00 0.00 H new ATOM 0 HA MET A 12 22.776 -8.022 -0.045 1.00 0.00 H new ATOM 0 HB2 MET A 12 20.857 -10.371 0.201 1.00 0.00 H new ATOM 0 HB3 MET A 12 22.558 -10.460 -0.208 1.00 0.00 H new ATOM 0 HG2 MET A 12 23.232 -9.800 1.992 1.00 0.00 H new ATOM 0 HG3 MET A 12 21.613 -9.282 2.418 1.00 0.00 H new ATOM 0 HE1 MET A 12 19.615 -12.418 3.023 1.00 0.00 H new ATOM 0 HE2 MET A 12 19.620 -10.753 2.395 1.00 0.00 H new ATOM 0 HE3 MET A 12 19.834 -12.124 1.281 1.00 0.00 H new ATOM 212 N GLN A 13 22.227 -8.827 -2.481 1.00 0.00 N ATOM 213 CA GLN A 13 21.875 -8.918 -3.889 1.00 0.00 C ATOM 214 C GLN A 13 20.830 -10.009 -4.072 1.00 0.00 C ATOM 215 O GLN A 13 21.118 -11.190 -3.864 1.00 0.00 O ATOM 216 CB GLN A 13 23.106 -9.206 -4.756 1.00 0.00 C ATOM 217 CG GLN A 13 24.073 -8.034 -4.887 1.00 0.00 C ATOM 218 CD GLN A 13 24.885 -7.772 -3.631 1.00 0.00 C ATOM 219 OE1 GLN A 13 24.488 -6.993 -2.762 1.00 0.00 O ATOM 220 NE2 GLN A 13 26.033 -8.419 -3.526 1.00 0.00 N ATOM 0 H GLN A 13 23.188 -9.092 -2.264 1.00 0.00 H new ATOM 0 HA GLN A 13 21.467 -7.960 -4.210 1.00 0.00 H new ATOM 0 HB2 GLN A 13 23.641 -10.057 -4.335 1.00 0.00 H new ATOM 0 HB3 GLN A 13 22.773 -9.500 -5.752 1.00 0.00 H new ATOM 0 HG2 GLN A 13 24.754 -8.227 -5.716 1.00 0.00 H new ATOM 0 HG3 GLN A 13 23.510 -7.136 -5.139 1.00 0.00 H new ATOM 0 HE21 GLN A 13 26.329 -9.056 -4.266 1.00 0.00 H new ATOM 0 HE22 GLN A 13 26.623 -8.281 -2.705 1.00 0.00 H new ATOM 229 N ASP A 14 19.619 -9.592 -4.433 1.00 0.00 N ATOM 230 CA ASP A 14 18.468 -10.489 -4.537 1.00 0.00 C ATOM 231 C ASP A 14 18.104 -11.057 -3.167 1.00 0.00 C ATOM 232 O ASP A 14 18.532 -12.147 -2.787 1.00 0.00 O ATOM 233 CB ASP A 14 18.713 -11.619 -5.546 1.00 0.00 C ATOM 234 CG ASP A 14 17.528 -12.562 -5.668 1.00 0.00 C ATOM 235 OD1 ASP A 14 16.493 -12.159 -6.243 1.00 0.00 O ATOM 236 OD2 ASP A 14 17.634 -13.721 -5.206 1.00 0.00 O ATOM 0 H ASP A 14 19.406 -8.621 -4.662 1.00 0.00 H new ATOM 0 HA ASP A 14 17.627 -9.901 -4.906 1.00 0.00 H new ATOM 0 HB2 ASP A 14 18.931 -11.188 -6.523 1.00 0.00 H new ATOM 0 HB3 ASP A 14 19.594 -12.186 -5.244 1.00 0.00 H new ATOM 241 N THR A 15 17.348 -10.279 -2.414 1.00 0.00 N ATOM 242 CA THR A 15 16.872 -10.699 -1.108 1.00 0.00 C ATOM 243 C THR A 15 15.358 -10.814 -1.136 1.00 0.00 C ATOM 244 O THR A 15 14.672 -9.849 -1.430 1.00 0.00 O ATOM 245 CB THR A 15 17.274 -9.689 -0.013 1.00 0.00 C ATOM 246 OG1 THR A 15 18.683 -9.450 -0.059 1.00 0.00 O ATOM 247 CG2 THR A 15 16.885 -10.197 1.369 1.00 0.00 C ATOM 0 H THR A 15 17.048 -9.343 -2.688 1.00 0.00 H new ATOM 0 HA THR A 15 17.326 -11.663 -0.877 1.00 0.00 H new ATOM 0 HB THR A 15 16.741 -8.757 -0.201 1.00 0.00 H new ATOM 0 HG1 THR A 15 18.895 -8.895 -0.838 1.00 0.00 H new ATOM 0 HG21 THR A 15 17.180 -9.466 2.122 1.00 0.00 H new ATOM 0 HG22 THR A 15 15.806 -10.346 1.411 1.00 0.00 H new ATOM 0 HG23 THR A 15 17.390 -11.143 1.564 1.00 0.00 H new ATOM 255 N ILE A 16 14.829 -11.984 -0.861 1.00 0.00 N ATOM 256 CA ILE A 16 13.391 -12.151 -0.867 1.00 0.00 C ATOM 257 C ILE A 16 12.841 -12.036 0.543 1.00 0.00 C ATOM 258 O ILE A 16 13.032 -12.921 1.380 1.00 0.00 O ATOM 259 CB ILE A 16 12.981 -13.484 -1.515 1.00 0.00 C ATOM 260 CG1 ILE A 16 13.561 -13.537 -2.932 1.00 0.00 C ATOM 261 CG2 ILE A 16 11.463 -13.625 -1.537 1.00 0.00 C ATOM 262 CD1 ILE A 16 13.126 -14.733 -3.736 1.00 0.00 C ATOM 0 H ILE A 16 15.362 -12.824 -0.633 1.00 0.00 H new ATOM 0 HA ILE A 16 12.961 -11.353 -1.472 1.00 0.00 H new ATOM 0 HB ILE A 16 13.375 -14.316 -0.932 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.271 -12.631 -3.465 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.649 -13.534 -2.867 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.192 -14.574 -1.999 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.080 -13.596 -0.517 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.030 -12.806 -2.111 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.582 -14.692 -4.725 1.00 0.00 H new ATOM 0 HD12 ILE A 16 13.440 -15.646 -3.229 1.00 0.00 H new ATOM 0 HD13 ILE A 16 12.041 -14.729 -3.836 1.00 0.00 H new ATOM 274 N ILE A 17 12.180 -10.920 0.801 1.00 0.00 N ATOM 275 CA ILE A 17 11.682 -10.617 2.127 1.00 0.00 C ATOM 276 C ILE A 17 10.189 -10.897 2.218 1.00 0.00 C ATOM 277 O ILE A 17 9.369 -10.116 1.733 1.00 0.00 O ATOM 278 CB ILE A 17 11.958 -9.144 2.510 1.00 0.00 C ATOM 279 CG1 ILE A 17 13.457 -8.839 2.387 1.00 0.00 C ATOM 280 CG2 ILE A 17 11.467 -8.863 3.925 1.00 0.00 C ATOM 281 CD1 ILE A 17 13.815 -7.393 2.660 1.00 0.00 C ATOM 0 H ILE A 17 11.976 -10.206 0.102 1.00 0.00 H new ATOM 0 HA ILE A 17 12.211 -11.262 2.828 1.00 0.00 H new ATOM 0 HB ILE A 17 11.414 -8.494 1.824 1.00 0.00 H new ATOM 0 HG12 ILE A 17 14.005 -9.476 3.081 1.00 0.00 H new ATOM 0 HG13 ILE A 17 13.790 -9.102 1.383 1.00 0.00 H new ATOM 0 HG21 ILE A 17 11.668 -7.823 4.180 1.00 0.00 H new ATOM 0 HG22 ILE A 17 10.395 -9.050 3.982 1.00 0.00 H new ATOM 0 HG23 ILE A 17 11.986 -9.516 4.627 1.00 0.00 H new ATOM 0 HD11 ILE A 17 14.891 -7.258 2.553 1.00 0.00 H new ATOM 0 HD12 ILE A 17 13.296 -6.749 1.949 1.00 0.00 H new ATOM 0 HD13 ILE A 17 13.515 -7.129 3.674 1.00 0.00 H new ATOM 293 N ASN A 18 9.854 -12.032 2.808 1.00 0.00 N ATOM 294 CA ASN A 18 8.468 -12.391 3.055 1.00 0.00 C ATOM 295 C ASN A 18 8.024 -11.814 4.387 1.00 0.00 C ATOM 296 O ASN A 18 8.415 -12.306 5.446 1.00 0.00 O ATOM 297 CB ASN A 18 8.291 -13.913 3.073 1.00 0.00 C ATOM 298 CG ASN A 18 8.624 -14.563 1.745 1.00 0.00 C ATOM 299 OD1 ASN A 18 7.762 -14.729 0.886 1.00 0.00 O ATOM 300 ND2 ASN A 18 9.883 -14.943 1.570 1.00 0.00 N ATOM 0 H ASN A 18 10.530 -12.726 3.127 1.00 0.00 H new ATOM 0 HA ASN A 18 7.857 -11.982 2.250 1.00 0.00 H new ATOM 0 HB2 ASN A 18 8.927 -14.338 3.849 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.261 -14.150 3.340 1.00 0.00 H new ATOM 0 HD21 ASN A 18 10.164 -15.391 0.698 1.00 0.00 H new ATOM 0 HD22 ASN A 18 10.570 -14.787 2.308 1.00 0.00 H new ATOM 307 N PHE A 19 7.234 -10.760 4.337 1.00 0.00 N ATOM 308 CA PHE A 19 6.772 -10.112 5.551 1.00 0.00 C ATOM 309 C PHE A 19 5.280 -10.339 5.736 1.00 0.00 C ATOM 310 O PHE A 19 4.594 -10.798 4.818 1.00 0.00 O ATOM 311 CB PHE A 19 7.089 -8.609 5.530 1.00 0.00 C ATOM 312 CG PHE A 19 6.446 -7.850 4.400 1.00 0.00 C ATOM 313 CD1 PHE A 19 7.076 -7.747 3.170 1.00 0.00 C ATOM 314 CD2 PHE A 19 5.218 -7.231 4.574 1.00 0.00 C ATOM 315 CE1 PHE A 19 6.491 -7.043 2.135 1.00 0.00 C ATOM 316 CE2 PHE A 19 4.631 -6.526 3.542 1.00 0.00 C ATOM 317 CZ PHE A 19 5.268 -6.432 2.321 1.00 0.00 C ATOM 0 H PHE A 19 6.899 -10.334 3.473 1.00 0.00 H new ATOM 0 HA PHE A 19 7.301 -10.555 6.395 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.768 -8.170 6.475 1.00 0.00 H new ATOM 0 HB3 PHE A 19 8.170 -8.479 5.469 1.00 0.00 H new ATOM 0 HD1 PHE A 19 8.034 -8.222 3.019 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.715 -7.301 5.527 1.00 0.00 H new ATOM 0 HE1 PHE A 19 6.991 -6.971 1.180 1.00 0.00 H new ATOM 0 HE2 PHE A 19 3.674 -6.048 3.690 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.810 -5.881 1.513 1.00 0.00 H new ATOM 327 N TYR A 20 4.787 -10.039 6.925 1.00 0.00 N ATOM 328 CA TYR A 20 3.371 -10.161 7.209 1.00 0.00 C ATOM 329 C TYR A 20 2.948 -9.145 8.256 1.00 0.00 C ATOM 330 O TYR A 20 3.500 -9.123 9.359 1.00 0.00 O ATOM 331 CB TYR A 20 3.026 -11.572 7.685 1.00 0.00 C ATOM 332 CG TYR A 20 1.538 -11.799 7.785 1.00 0.00 C ATOM 333 CD1 TYR A 20 0.756 -11.803 6.641 1.00 0.00 C ATOM 334 CD2 TYR A 20 0.914 -11.994 9.009 1.00 0.00 C ATOM 335 CE1 TYR A 20 -0.606 -11.992 6.707 1.00 0.00 C ATOM 336 CE2 TYR A 20 -0.453 -12.189 9.086 1.00 0.00 C ATOM 337 CZ TYR A 20 -1.209 -12.187 7.932 1.00 0.00 C ATOM 338 OH TYR A 20 -2.574 -12.361 8.013 1.00 0.00 O ATOM 0 H TYR A 20 5.349 -9.709 7.710 1.00 0.00 H new ATOM 0 HA TYR A 20 2.828 -9.966 6.284 1.00 0.00 H new ATOM 0 HB2 TYR A 20 3.456 -12.300 6.997 1.00 0.00 H new ATOM 0 HB3 TYR A 20 3.483 -11.746 8.659 1.00 0.00 H new ATOM 0 HD1 TYR A 20 1.224 -11.655 5.679 1.00 0.00 H new ATOM 0 HD2 TYR A 20 1.504 -11.993 9.914 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -1.199 -11.988 5.804 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -0.926 -12.342 10.045 1.00 0.00 H new ATOM 0 HH TYR A 20 -2.833 -12.487 8.950 1.00 0.00 H new ATOM 348 N SER A 21 1.971 -8.313 7.896 1.00 0.00 N ATOM 349 CA SER A 21 1.430 -7.259 8.762 1.00 0.00 C ATOM 350 C SER A 21 2.522 -6.296 9.243 1.00 0.00 C ATOM 351 O SER A 21 3.684 -6.402 8.849 1.00 0.00 O ATOM 352 CB SER A 21 0.631 -7.844 9.946 1.00 0.00 C ATOM 353 OG SER A 21 1.418 -8.675 10.782 1.00 0.00 O ATOM 0 H SER A 21 1.524 -8.351 6.980 1.00 0.00 H new ATOM 0 HA SER A 21 0.734 -6.679 8.156 1.00 0.00 H new ATOM 0 HB2 SER A 21 0.218 -7.028 10.538 1.00 0.00 H new ATOM 0 HB3 SER A 21 -0.212 -8.418 9.561 1.00 0.00 H new ATOM 0 HG SER A 21 2.358 -8.613 10.513 1.00 0.00 H new ATOM 359 N THR A 22 2.140 -5.351 10.088 1.00 0.00 N ATOM 360 CA THR A 22 3.041 -4.289 10.497 1.00 0.00 C ATOM 361 C THR A 22 3.997 -4.735 11.602 1.00 0.00 C ATOM 362 O THR A 22 5.120 -4.237 11.690 1.00 0.00 O ATOM 363 CB THR A 22 2.237 -3.060 10.956 1.00 0.00 C ATOM 364 OG1 THR A 22 1.297 -3.448 11.969 1.00 0.00 O ATOM 365 CG2 THR A 22 1.494 -2.446 9.778 1.00 0.00 C ATOM 0 H THR A 22 1.210 -5.299 10.504 1.00 0.00 H new ATOM 0 HA THR A 22 3.647 -4.026 9.630 1.00 0.00 H new ATOM 0 HB THR A 22 2.926 -2.320 11.363 1.00 0.00 H new ATOM 0 HG1 THR A 22 0.788 -2.663 12.261 1.00 0.00 H new ATOM 0 HG21 THR A 22 0.929 -1.577 10.117 1.00 0.00 H new ATOM 0 HG22 THR A 22 2.210 -2.138 9.016 1.00 0.00 H new ATOM 0 HG23 THR A 22 0.809 -3.182 9.356 1.00 0.00 H new ATOM 373 N SER A 23 3.553 -5.707 12.404 1.00 0.00 N ATOM 374 CA SER A 23 4.308 -6.227 13.555 1.00 0.00 C ATOM 375 C SER A 23 4.795 -5.102 14.481 1.00 0.00 C ATOM 376 O SER A 23 4.080 -4.703 15.405 1.00 0.00 O ATOM 377 CB SER A 23 5.471 -7.136 13.110 1.00 0.00 C ATOM 378 OG SER A 23 6.357 -6.479 12.216 1.00 0.00 O ATOM 0 H SER A 23 2.650 -6.162 12.274 1.00 0.00 H new ATOM 0 HA SER A 23 3.618 -6.840 14.134 1.00 0.00 H new ATOM 0 HB2 SER A 23 6.025 -7.469 13.988 1.00 0.00 H new ATOM 0 HB3 SER A 23 5.069 -8.028 12.629 1.00 0.00 H new ATOM 0 HG SER A 23 5.991 -5.601 11.979 1.00 0.00 H new ATOM 384 N ASP A 24 5.998 -4.593 14.233 1.00 0.00 N ATOM 385 CA ASP A 24 6.527 -3.478 15.010 1.00 0.00 C ATOM 386 C ASP A 24 6.527 -2.202 14.173 1.00 0.00 C ATOM 387 O ASP A 24 5.514 -1.508 14.103 1.00 0.00 O ATOM 388 CB ASP A 24 7.939 -3.785 15.529 1.00 0.00 C ATOM 389 CG ASP A 24 8.495 -2.673 16.401 1.00 0.00 C ATOM 390 OD1 ASP A 24 7.803 -2.264 17.356 1.00 0.00 O ATOM 391 OD2 ASP A 24 9.627 -2.207 16.137 1.00 0.00 O ATOM 0 H ASP A 24 6.623 -4.934 13.502 1.00 0.00 H new ATOM 0 HA ASP A 24 5.880 -3.329 15.874 1.00 0.00 H new ATOM 0 HB2 ASP A 24 7.918 -4.713 16.100 1.00 0.00 H new ATOM 0 HB3 ASP A 24 8.606 -3.946 14.682 1.00 0.00 H new ATOM 396 N ASP A 25 7.650 -1.922 13.515 1.00 0.00 N ATOM 397 CA ASP A 25 7.793 -0.710 12.699 1.00 0.00 C ATOM 398 C ASP A 25 8.372 -1.046 11.328 1.00 0.00 C ATOM 399 O ASP A 25 8.613 -0.162 10.508 1.00 0.00 O ATOM 400 CB ASP A 25 8.715 0.308 13.388 1.00 0.00 C ATOM 401 CG ASP A 25 8.025 1.169 14.433 1.00 0.00 C ATOM 402 OD1 ASP A 25 6.935 0.805 14.908 1.00 0.00 O ATOM 403 OD2 ASP A 25 8.587 2.226 14.800 1.00 0.00 O ATOM 0 H ASP A 25 8.478 -2.517 13.529 1.00 0.00 H new ATOM 0 HA ASP A 25 6.799 -0.278 12.580 1.00 0.00 H new ATOM 0 HB2 ASP A 25 9.538 -0.227 13.861 1.00 0.00 H new ATOM 0 HB3 ASP A 25 9.151 0.958 12.629 1.00 0.00 H new ATOM 408 N TYR A 26 8.634 -2.324 11.095 1.00 0.00 N ATOM 409 CA TYR A 26 9.259 -2.754 9.851 1.00 0.00 C ATOM 410 C TYR A 26 8.222 -3.333 8.889 1.00 0.00 C ATOM 411 O TYR A 26 8.484 -3.504 7.702 1.00 0.00 O ATOM 412 CB TYR A 26 10.342 -3.792 10.152 1.00 0.00 C ATOM 413 CG TYR A 26 11.370 -3.953 9.054 1.00 0.00 C ATOM 414 CD1 TYR A 26 12.313 -2.960 8.818 1.00 0.00 C ATOM 415 CD2 TYR A 26 11.404 -5.092 8.263 1.00 0.00 C ATOM 416 CE1 TYR A 26 13.258 -3.097 7.824 1.00 0.00 C ATOM 417 CE2 TYR A 26 12.350 -5.240 7.265 1.00 0.00 C ATOM 418 CZ TYR A 26 13.273 -4.238 7.050 1.00 0.00 C ATOM 419 OH TYR A 26 14.222 -4.380 6.062 1.00 0.00 O ATOM 0 H TYR A 26 8.425 -3.079 11.748 1.00 0.00 H new ATOM 0 HA TYR A 26 9.714 -1.887 9.372 1.00 0.00 H new ATOM 0 HB2 TYR A 26 10.852 -3.511 11.073 1.00 0.00 H new ATOM 0 HB3 TYR A 26 9.866 -4.756 10.332 1.00 0.00 H new ATOM 0 HD1 TYR A 26 12.305 -2.066 9.424 1.00 0.00 H new ATOM 0 HD2 TYR A 26 10.680 -5.876 8.429 1.00 0.00 H new ATOM 0 HE1 TYR A 26 13.983 -2.315 7.652 1.00 0.00 H new ATOM 0 HE2 TYR A 26 12.366 -6.134 6.659 1.00 0.00 H new ATOM 0 HH TYR A 26 14.097 -5.240 5.609 1.00 0.00 H new ATOM 429 N GLY A 27 7.040 -3.613 9.417 1.00 0.00 N ATOM 430 CA GLY A 27 6.005 -4.265 8.638 1.00 0.00 C ATOM 431 C GLY A 27 5.044 -3.289 7.990 1.00 0.00 C ATOM 432 O GLY A 27 4.105 -3.694 7.306 1.00 0.00 O ATOM 0 H GLY A 27 6.777 -3.399 10.379 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.471 -4.875 7.864 1.00 0.00 H new ATOM 0 HA3 GLY A 27 5.445 -4.942 9.283 1.00 0.00 H new ATOM 436 N ASP A 28 5.276 -1.998 8.213 1.00 0.00 N ATOM 437 CA ASP A 28 4.366 -0.938 7.751 1.00 0.00 C ATOM 438 C ASP A 28 4.226 -0.888 6.227 1.00 0.00 C ATOM 439 O ASP A 28 3.507 -0.043 5.686 1.00 0.00 O ATOM 440 CB ASP A 28 4.824 0.413 8.292 1.00 0.00 C ATOM 441 CG ASP A 28 4.619 0.521 9.790 1.00 0.00 C ATOM 442 OD1 ASP A 28 3.450 0.540 10.232 1.00 0.00 O ATOM 443 OD2 ASP A 28 5.618 0.586 10.528 1.00 0.00 O ATOM 0 H ASP A 28 6.093 -1.652 8.716 1.00 0.00 H new ATOM 0 HA ASP A 28 3.376 -1.175 8.142 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.879 0.559 8.058 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.274 1.210 7.792 1.00 0.00 H new ATOM 448 N PHE A 29 4.907 -1.793 5.534 1.00 0.00 N ATOM 449 CA PHE A 29 4.715 -1.967 4.099 1.00 0.00 C ATOM 450 C PHE A 29 3.278 -2.402 3.806 1.00 0.00 C ATOM 451 O PHE A 29 2.717 -2.065 2.758 1.00 0.00 O ATOM 452 CB PHE A 29 5.677 -3.021 3.542 1.00 0.00 C ATOM 453 CG PHE A 29 7.116 -2.598 3.506 1.00 0.00 C ATOM 454 CD1 PHE A 29 7.941 -2.789 4.603 1.00 0.00 C ATOM 455 CD2 PHE A 29 7.647 -2.027 2.364 1.00 0.00 C ATOM 456 CE1 PHE A 29 9.269 -2.411 4.558 1.00 0.00 C ATOM 457 CE2 PHE A 29 8.974 -1.649 2.313 1.00 0.00 C ATOM 458 CZ PHE A 29 9.787 -1.840 3.412 1.00 0.00 C ATOM 0 H PHE A 29 5.599 -2.420 5.944 1.00 0.00 H new ATOM 0 HA PHE A 29 4.917 -1.010 3.618 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.593 -3.925 4.145 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.363 -3.282 2.531 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.542 -3.237 5.501 1.00 0.00 H new ATOM 0 HD2 PHE A 29 7.016 -1.875 1.501 1.00 0.00 H new ATOM 0 HE1 PHE A 29 9.903 -2.562 5.419 1.00 0.00 H new ATOM 0 HE2 PHE A 29 9.375 -1.204 1.414 1.00 0.00 H new ATOM 0 HZ PHE A 29 10.825 -1.544 3.376 1.00 0.00 H new ATOM 468 N SER A 30 2.691 -3.141 4.749 1.00 0.00 N ATOM 469 CA SER A 30 1.344 -3.688 4.598 1.00 0.00 C ATOM 470 C SER A 30 0.295 -2.596 4.363 1.00 0.00 C ATOM 471 O SER A 30 0.454 -1.449 4.784 1.00 0.00 O ATOM 472 CB SER A 30 0.975 -4.506 5.835 1.00 0.00 C ATOM 473 OG SER A 30 1.806 -5.645 5.954 1.00 0.00 O ATOM 0 H SER A 30 3.136 -3.376 5.636 1.00 0.00 H new ATOM 0 HA SER A 30 1.349 -4.329 3.716 1.00 0.00 H new ATOM 0 HB2 SER A 30 1.070 -3.887 6.727 1.00 0.00 H new ATOM 0 HB3 SER A 30 -0.068 -4.817 5.773 1.00 0.00 H new ATOM 0 HG SER A 30 1.631 -6.257 5.209 1.00 0.00 H new ATOM 479 N ASN A 31 -0.786 -2.966 3.691 1.00 0.00 N ATOM 480 CA ASN A 31 -1.859 -2.030 3.372 1.00 0.00 C ATOM 481 C ASN A 31 -2.724 -1.766 4.595 1.00 0.00 C ATOM 482 O ASN A 31 -3.470 -0.786 4.647 1.00 0.00 O ATOM 483 CB ASN A 31 -2.713 -2.566 2.220 1.00 0.00 C ATOM 484 CG ASN A 31 -1.947 -2.610 0.913 1.00 0.00 C ATOM 485 OD1 ASN A 31 -1.057 -1.786 0.676 1.00 0.00 O ATOM 486 ND2 ASN A 31 -2.279 -3.570 0.065 1.00 0.00 N ATOM 0 H ASN A 31 -0.945 -3.915 3.353 1.00 0.00 H new ATOM 0 HA ASN A 31 -1.408 -1.088 3.061 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -3.066 -3.567 2.467 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -3.596 -1.938 2.101 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -1.793 -3.652 -0.828 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -3.021 -4.228 0.304 1.00 0.00 H new ATOM 493 N PHE A 32 -2.597 -2.635 5.587 1.00 0.00 N ATOM 494 CA PHE A 32 -3.333 -2.493 6.834 1.00 0.00 C ATOM 495 C PHE A 32 -2.561 -1.586 7.799 1.00 0.00 C ATOM 496 O PHE A 32 -2.945 -1.423 8.956 1.00 0.00 O ATOM 497 CB PHE A 32 -3.578 -3.877 7.453 1.00 0.00 C ATOM 498 CG PHE A 32 -4.609 -3.886 8.547 1.00 0.00 C ATOM 499 CD1 PHE A 32 -5.936 -3.608 8.266 1.00 0.00 C ATOM 500 CD2 PHE A 32 -4.248 -4.168 9.857 1.00 0.00 C ATOM 501 CE1 PHE A 32 -6.886 -3.611 9.269 1.00 0.00 C ATOM 502 CE2 PHE A 32 -5.194 -4.172 10.866 1.00 0.00 C ATOM 503 CZ PHE A 32 -6.516 -3.893 10.570 1.00 0.00 C ATOM 0 H PHE A 32 -1.987 -3.451 5.551 1.00 0.00 H new ATOM 0 HA PHE A 32 -4.299 -2.030 6.634 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -3.892 -4.564 6.667 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -2.637 -4.257 7.852 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -6.232 -3.386 7.251 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -3.217 -4.387 10.091 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -7.918 -3.393 9.036 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -4.901 -4.392 11.882 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.258 -3.896 11.355 1.00 0.00 H new ATOM 513 N ALA A 33 -1.466 -0.998 7.311 1.00 0.00 N ATOM 514 CA ALA A 33 -0.675 -0.065 8.107 1.00 0.00 C ATOM 515 C ALA A 33 -1.525 1.122 8.557 1.00 0.00 C ATOM 516 O ALA A 33 -2.413 1.570 7.827 1.00 0.00 O ATOM 517 CB ALA A 33 0.534 0.411 7.316 1.00 0.00 C ATOM 0 H ALA A 33 -1.109 -1.153 6.368 1.00 0.00 H new ATOM 0 HA ALA A 33 -0.324 -0.586 8.998 1.00 0.00 H new ATOM 0 HB1 ALA A 33 1.115 1.106 7.922 1.00 0.00 H new ATOM 0 HB2 ALA A 33 1.155 -0.445 7.050 1.00 0.00 H new ATOM 0 HB3 ALA A 33 0.200 0.913 6.408 1.00 0.00 H new ATOM 523 N ALA A 34 -1.236 1.634 9.747 1.00 0.00 N ATOM 524 CA ALA A 34 -2.055 2.675 10.362 1.00 0.00 C ATOM 525 C ALA A 34 -1.556 4.071 10.002 1.00 0.00 C ATOM 526 O ALA A 34 -1.854 5.045 10.694 1.00 0.00 O ATOM 527 CB ALA A 34 -2.069 2.498 11.875 1.00 0.00 C ATOM 0 H ALA A 34 -0.436 1.344 10.309 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.069 2.576 9.974 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.682 3.278 12.327 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.484 1.521 12.123 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.051 2.568 12.259 1.00 0.00 H new ATOM 533 N TRP A 35 -0.806 4.171 8.916 1.00 0.00 N ATOM 534 CA TRP A 35 -0.270 5.454 8.486 1.00 0.00 C ATOM 535 C TRP A 35 -1.235 6.159 7.545 1.00 0.00 C ATOM 536 O TRP A 35 -1.637 5.602 6.524 1.00 0.00 O ATOM 537 CB TRP A 35 1.085 5.273 7.806 1.00 0.00 C ATOM 538 CG TRP A 35 2.117 4.699 8.719 1.00 0.00 C ATOM 539 CD1 TRP A 35 2.284 3.385 9.025 1.00 0.00 C ATOM 540 CD2 TRP A 35 3.118 5.413 9.448 1.00 0.00 C ATOM 541 NE1 TRP A 35 3.321 3.236 9.904 1.00 0.00 N ATOM 542 CE2 TRP A 35 3.855 4.463 10.177 1.00 0.00 C ATOM 543 CE3 TRP A 35 3.464 6.760 9.558 1.00 0.00 C ATOM 544 CZ2 TRP A 35 4.916 4.817 11.000 1.00 0.00 C ATOM 545 CZ3 TRP A 35 4.519 7.110 10.376 1.00 0.00 C ATOM 546 CH2 TRP A 35 5.235 6.143 11.087 1.00 0.00 C ATOM 0 H TRP A 35 -0.555 3.384 8.318 1.00 0.00 H new ATOM 0 HA TRP A 35 -0.137 6.073 9.373 1.00 0.00 H new ATOM 0 HB2 TRP A 35 0.968 4.620 6.941 1.00 0.00 H new ATOM 0 HB3 TRP A 35 1.431 6.237 7.434 1.00 0.00 H new ATOM 0 HD1 TRP A 35 1.685 2.577 8.631 1.00 0.00 H new ATOM 0 HE1 TRP A 35 3.644 2.350 10.293 1.00 0.00 H new ATOM 0 HE3 TRP A 35 2.916 7.515 9.013 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 5.469 4.071 11.552 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 4.796 8.150 10.468 1.00 0.00 H new ATOM 0 HH2 TRP A 35 6.056 6.450 11.718 1.00 0.00 H new ATOM 557 N PRO A 36 -1.613 7.400 7.883 1.00 0.00 N ATOM 558 CA PRO A 36 -2.530 8.193 7.066 1.00 0.00 C ATOM 559 C PRO A 36 -1.916 8.568 5.722 1.00 0.00 C ATOM 560 O PRO A 36 -0.794 9.084 5.657 1.00 0.00 O ATOM 561 CB PRO A 36 -2.786 9.443 7.914 1.00 0.00 C ATOM 562 CG PRO A 36 -1.616 9.536 8.831 1.00 0.00 C ATOM 563 CD PRO A 36 -1.177 8.122 9.090 1.00 0.00 C ATOM 0 HA PRO A 36 -3.440 7.645 6.823 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -2.869 10.333 7.290 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -3.718 9.357 8.472 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -0.812 10.117 8.380 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -1.888 10.036 9.760 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -0.098 8.056 9.229 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -1.640 7.716 9.990 1.00 0.00 H new ATOM 571 N ILE A 37 -2.646 8.291 4.655 1.00 0.00 N ATOM 572 CA ILE A 37 -2.189 8.597 3.311 1.00 0.00 C ATOM 573 C ILE A 37 -2.886 9.839 2.769 1.00 0.00 C ATOM 574 O ILE A 37 -4.091 10.021 2.955 1.00 0.00 O ATOM 575 CB ILE A 37 -2.406 7.409 2.348 1.00 0.00 C ATOM 576 CG1 ILE A 37 -3.827 6.847 2.469 1.00 0.00 C ATOM 577 CG2 ILE A 37 -1.383 6.321 2.628 1.00 0.00 C ATOM 578 CD1 ILE A 37 -4.168 5.839 1.390 1.00 0.00 C ATOM 0 H ILE A 37 -3.565 7.851 4.695 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.118 8.790 3.374 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.276 7.770 1.328 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -3.942 6.376 3.445 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -4.540 7.670 2.426 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.543 5.487 1.945 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.379 6.720 2.485 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.492 5.974 3.656 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -5.187 5.482 1.535 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -4.085 6.312 0.411 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -3.477 4.998 1.447 1.00 0.00 H new ATOM 590 N LYS A 38 -2.121 10.697 2.111 1.00 0.00 N ATOM 591 CA LYS A 38 -2.656 11.938 1.577 1.00 0.00 C ATOM 592 C LYS A 38 -2.927 11.791 0.086 1.00 0.00 C ATOM 593 O LYS A 38 -2.008 11.848 -0.729 1.00 0.00 O ATOM 594 CB LYS A 38 -1.679 13.089 1.821 1.00 0.00 C ATOM 595 CG LYS A 38 -2.297 14.467 1.656 1.00 0.00 C ATOM 596 CD LYS A 38 -3.223 14.797 2.816 1.00 0.00 C ATOM 597 CE LYS A 38 -3.829 16.185 2.677 1.00 0.00 C ATOM 598 NZ LYS A 38 -4.570 16.591 3.900 1.00 0.00 N ATOM 0 H LYS A 38 -1.126 10.555 1.934 1.00 0.00 H new ATOM 0 HA LYS A 38 -3.593 12.162 2.088 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -1.274 13.001 2.829 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.840 12.993 1.132 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.508 15.217 1.592 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.853 14.509 0.720 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.020 14.056 2.867 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -2.669 14.734 3.753 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -3.039 16.908 2.475 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -4.504 16.203 1.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -5.458 17.058 3.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -4.783 15.749 4.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -3.988 17.250 4.456 1.00 0.00 H new ATOM 612 N VAL A 39 -4.186 11.586 -0.265 1.00 0.00 N ATOM 613 CA VAL A 39 -4.562 11.402 -1.657 1.00 0.00 C ATOM 614 C VAL A 39 -5.463 12.539 -2.120 1.00 0.00 C ATOM 615 O VAL A 39 -6.478 12.821 -1.480 1.00 0.00 O ATOM 616 CB VAL A 39 -5.289 10.059 -1.877 1.00 0.00 C ATOM 617 CG1 VAL A 39 -5.576 9.842 -3.354 1.00 0.00 C ATOM 618 CG2 VAL A 39 -4.476 8.902 -1.314 1.00 0.00 C ATOM 0 H VAL A 39 -4.964 11.543 0.394 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.642 11.399 -2.242 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.239 10.097 -1.343 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -6.089 8.890 -3.489 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.207 10.650 -3.725 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.638 9.831 -3.909 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.010 7.967 -1.482 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.508 8.861 -1.812 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.328 9.048 -0.244 1.00 0.00 H new ATOM 628 N ASP A 40 -5.053 13.204 -3.210 1.00 0.00 N ATOM 629 CA ASP A 40 -5.812 14.295 -3.836 1.00 0.00 C ATOM 630 C ASP A 40 -5.697 15.556 -3.004 1.00 0.00 C ATOM 631 O ASP A 40 -5.157 16.575 -3.426 1.00 0.00 O ATOM 632 CB ASP A 40 -7.287 13.903 -4.003 1.00 0.00 C ATOM 633 CG ASP A 40 -8.141 15.015 -4.577 1.00 0.00 C ATOM 634 OD1 ASP A 40 -8.180 15.163 -5.814 1.00 0.00 O ATOM 635 OD2 ASP A 40 -8.798 15.731 -3.789 1.00 0.00 O ATOM 0 H ASP A 40 -4.175 12.997 -3.686 1.00 0.00 H new ATOM 0 HA ASP A 40 -5.392 14.484 -4.824 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -7.353 13.031 -4.654 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -7.690 13.608 -3.034 1.00 0.00 H new ATOM 640 N GLY A 41 -6.202 15.434 -1.814 1.00 0.00 N ATOM 641 CA GLY A 41 -6.169 16.495 -0.835 1.00 0.00 C ATOM 642 C GLY A 41 -6.893 16.063 0.416 1.00 0.00 C ATOM 643 O GLY A 41 -7.447 16.879 1.148 1.00 0.00 O ATOM 0 H GLY A 41 -6.658 14.583 -1.484 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -5.136 16.751 -0.598 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -6.634 17.392 -1.243 1.00 0.00 H new ATOM 647 N LYS A 42 -6.882 14.760 0.656 1.00 0.00 N ATOM 648 CA LYS A 42 -7.658 14.165 1.727 1.00 0.00 C ATOM 649 C LYS A 42 -6.796 13.161 2.469 1.00 0.00 C ATOM 650 O LYS A 42 -5.983 12.463 1.861 1.00 0.00 O ATOM 651 CB LYS A 42 -8.903 13.490 1.142 1.00 0.00 C ATOM 652 CG LYS A 42 -9.824 14.466 0.425 1.00 0.00 C ATOM 653 CD LYS A 42 -10.664 13.786 -0.641 1.00 0.00 C ATOM 654 CE LYS A 42 -11.542 14.786 -1.383 1.00 0.00 C ATOM 655 NZ LYS A 42 -10.759 15.941 -1.911 1.00 0.00 N ATOM 0 H LYS A 42 -6.336 14.090 0.114 1.00 0.00 H new ATOM 0 HA LYS A 42 -7.981 14.934 2.429 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -8.594 12.711 0.445 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -9.455 13.000 1.944 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -10.481 14.944 1.152 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -9.228 15.255 -0.033 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -10.011 13.277 -1.350 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -11.290 13.022 -0.180 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -12.045 14.283 -2.209 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -12.319 15.152 -0.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -11.342 16.476 -2.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -10.483 16.562 -1.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -9.905 15.591 -2.391 1.00 0.00 H new ATOM 669 N THR A 43 -6.954 13.109 3.776 1.00 0.00 N ATOM 670 CA THR A 43 -6.127 12.256 4.602 1.00 0.00 C ATOM 671 C THR A 43 -6.882 10.994 5.001 1.00 0.00 C ATOM 672 O THR A 43 -7.791 11.036 5.828 1.00 0.00 O ATOM 673 CB THR A 43 -5.662 13.014 5.856 1.00 0.00 C ATOM 674 OG1 THR A 43 -5.154 14.299 5.468 1.00 0.00 O ATOM 675 CG2 THR A 43 -4.579 12.241 6.593 1.00 0.00 C ATOM 0 H THR A 43 -7.650 13.650 4.289 1.00 0.00 H new ATOM 0 HA THR A 43 -5.251 11.965 4.022 1.00 0.00 H new ATOM 0 HB THR A 43 -6.513 13.132 6.527 1.00 0.00 H new ATOM 0 HG1 THR A 43 -4.858 14.788 6.264 1.00 0.00 H new ATOM 0 HG21 THR A 43 -4.269 12.801 7.476 1.00 0.00 H new ATOM 0 HG22 THR A 43 -4.969 11.270 6.898 1.00 0.00 H new ATOM 0 HG23 THR A 43 -3.722 12.098 5.935 1.00 0.00 H new ATOM 683 N TRP A 44 -6.510 9.880 4.389 1.00 0.00 N ATOM 684 CA TRP A 44 -7.146 8.605 4.670 1.00 0.00 C ATOM 685 C TRP A 44 -6.363 7.871 5.751 1.00 0.00 C ATOM 686 O TRP A 44 -5.168 7.626 5.590 1.00 0.00 O ATOM 687 CB TRP A 44 -7.224 7.758 3.398 1.00 0.00 C ATOM 688 CG TRP A 44 -7.826 8.491 2.238 1.00 0.00 C ATOM 689 CD1 TRP A 44 -7.164 9.249 1.315 1.00 0.00 C ATOM 690 CD2 TRP A 44 -9.211 8.541 1.878 1.00 0.00 C ATOM 691 NE1 TRP A 44 -8.051 9.769 0.407 1.00 0.00 N ATOM 692 CE2 TRP A 44 -9.314 9.346 0.728 1.00 0.00 C ATOM 693 CE3 TRP A 44 -10.374 7.983 2.416 1.00 0.00 C ATOM 694 CZ2 TRP A 44 -10.531 9.606 0.108 1.00 0.00 C ATOM 695 CZ3 TRP A 44 -11.583 8.241 1.796 1.00 0.00 C ATOM 696 CH2 TRP A 44 -11.653 9.046 0.653 1.00 0.00 C ATOM 0 H TRP A 44 -5.767 9.835 3.691 1.00 0.00 H new ATOM 0 HA TRP A 44 -8.161 8.782 5.025 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -6.222 7.425 3.129 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -7.813 6.864 3.600 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.097 9.415 1.302 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -7.810 10.372 -0.379 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -10.329 7.362 3.299 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -10.588 10.228 -0.773 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -12.489 7.814 2.201 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -12.613 9.228 0.192 1.00 0.00 H new ATOM 707 N PRO A 45 -7.028 7.528 6.867 1.00 0.00 N ATOM 708 CA PRO A 45 -6.391 6.906 8.038 1.00 0.00 C ATOM 709 C PRO A 45 -5.483 5.719 7.697 1.00 0.00 C ATOM 710 O PRO A 45 -4.446 5.532 8.331 1.00 0.00 O ATOM 711 CB PRO A 45 -7.575 6.440 8.901 1.00 0.00 C ATOM 712 CG PRO A 45 -8.804 6.670 8.081 1.00 0.00 C ATOM 713 CD PRO A 45 -8.462 7.745 7.093 1.00 0.00 C ATOM 0 HA PRO A 45 -5.729 7.616 8.534 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -7.474 5.387 9.165 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.620 7.000 9.835 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -9.106 5.756 7.570 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -9.640 6.974 8.711 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -9.037 7.647 6.172 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -8.664 8.740 7.490 1.00 0.00 H new ATOM 721 N THR A 46 -5.871 4.926 6.700 1.00 0.00 N ATOM 722 CA THR A 46 -5.091 3.755 6.298 1.00 0.00 C ATOM 723 C THR A 46 -5.253 3.520 4.802 1.00 0.00 C ATOM 724 O THR A 46 -6.162 4.079 4.178 1.00 0.00 O ATOM 725 CB THR A 46 -5.510 2.457 7.044 1.00 0.00 C ATOM 726 OG1 THR A 46 -6.848 2.084 6.690 1.00 0.00 O ATOM 727 CG2 THR A 46 -5.418 2.612 8.555 1.00 0.00 C ATOM 0 H THR A 46 -6.721 5.072 6.155 1.00 0.00 H new ATOM 0 HA THR A 46 -4.055 3.970 6.558 1.00 0.00 H new ATOM 0 HB THR A 46 -4.814 1.676 6.737 1.00 0.00 H new ATOM 0 HG1 THR A 46 -7.096 1.265 7.167 1.00 0.00 H new ATOM 0 HG21 THR A 46 -5.720 1.681 9.035 1.00 0.00 H new ATOM 0 HG22 THR A 46 -4.391 2.848 8.835 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.077 3.418 8.879 1.00 0.00 H new ATOM 735 N SER A 47 -4.396 2.678 4.237 1.00 0.00 N ATOM 736 CA SER A 47 -4.457 2.359 2.817 1.00 0.00 C ATOM 737 C SER A 47 -5.775 1.657 2.479 1.00 0.00 C ATOM 738 O SER A 47 -6.384 1.933 1.444 1.00 0.00 O ATOM 739 CB SER A 47 -3.265 1.479 2.426 1.00 0.00 C ATOM 740 OG SER A 47 -3.201 1.275 1.026 1.00 0.00 O ATOM 0 H SER A 47 -3.649 2.203 4.743 1.00 0.00 H new ATOM 0 HA SER A 47 -4.410 3.287 2.248 1.00 0.00 H new ATOM 0 HB2 SER A 47 -2.341 1.945 2.768 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.343 0.516 2.931 1.00 0.00 H new ATOM 0 HG SER A 47 -2.428 0.711 0.813 1.00 0.00 H new ATOM 746 N GLU A 48 -6.213 0.762 3.368 1.00 0.00 N ATOM 747 CA GLU A 48 -7.478 0.048 3.192 1.00 0.00 C ATOM 748 C GLU A 48 -8.659 1.008 3.063 1.00 0.00 C ATOM 749 O GLU A 48 -9.568 0.773 2.275 1.00 0.00 O ATOM 750 CB GLU A 48 -7.715 -0.915 4.361 1.00 0.00 C ATOM 751 CG GLU A 48 -6.955 -2.229 4.240 1.00 0.00 C ATOM 752 CD GLU A 48 -7.637 -3.219 3.309 1.00 0.00 C ATOM 753 OE1 GLU A 48 -8.070 -2.817 2.210 1.00 0.00 O ATOM 754 OE2 GLU A 48 -7.745 -4.407 3.677 1.00 0.00 O ATOM 0 H GLU A 48 -5.708 0.515 4.219 1.00 0.00 H new ATOM 0 HA GLU A 48 -7.404 -0.519 2.264 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -7.425 -0.423 5.289 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -8.781 -1.128 4.433 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -5.947 -2.029 3.875 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -6.853 -2.677 5.228 1.00 0.00 H new ATOM 761 N HIS A 49 -8.632 2.102 3.821 1.00 0.00 N ATOM 762 CA HIS A 49 -9.735 3.064 3.803 1.00 0.00 C ATOM 763 C HIS A 49 -9.926 3.661 2.417 1.00 0.00 C ATOM 764 O HIS A 49 -11.050 3.775 1.936 1.00 0.00 O ATOM 765 CB HIS A 49 -9.509 4.184 4.822 1.00 0.00 C ATOM 766 CG HIS A 49 -9.949 3.831 6.209 1.00 0.00 C ATOM 767 ND1 HIS A 49 -9.103 3.303 7.159 1.00 0.00 N ATOM 768 CD2 HIS A 49 -11.154 3.947 6.811 1.00 0.00 C ATOM 769 CE1 HIS A 49 -9.767 3.111 8.280 1.00 0.00 C ATOM 770 NE2 HIS A 49 -11.013 3.493 8.098 1.00 0.00 N ATOM 0 H HIS A 49 -7.867 2.344 4.450 1.00 0.00 H new ATOM 0 HA HIS A 49 -10.639 2.520 4.075 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -8.449 4.439 4.840 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -10.046 5.075 4.495 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -8.115 3.093 7.016 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -12.060 4.327 6.362 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -9.358 2.708 9.195 1.00 0.00 H new ATOM 779 N TYR A 50 -8.826 4.025 1.774 1.00 0.00 N ATOM 780 CA TYR A 50 -8.891 4.608 0.442 1.00 0.00 C ATOM 781 C TYR A 50 -9.348 3.571 -0.578 1.00 0.00 C ATOM 782 O TYR A 50 -10.124 3.875 -1.484 1.00 0.00 O ATOM 783 CB TYR A 50 -7.529 5.180 0.037 1.00 0.00 C ATOM 784 CG TYR A 50 -7.528 5.786 -1.347 1.00 0.00 C ATOM 785 CD1 TYR A 50 -8.159 6.997 -1.590 1.00 0.00 C ATOM 786 CD2 TYR A 50 -6.915 5.141 -2.411 1.00 0.00 C ATOM 787 CE1 TYR A 50 -8.177 7.550 -2.853 1.00 0.00 C ATOM 788 CE2 TYR A 50 -6.930 5.686 -3.679 1.00 0.00 C ATOM 789 CZ TYR A 50 -7.562 6.890 -3.894 1.00 0.00 C ATOM 790 OH TYR A 50 -7.585 7.433 -5.156 1.00 0.00 O ATOM 0 H TYR A 50 -7.883 3.928 2.150 1.00 0.00 H new ATOM 0 HA TYR A 50 -9.618 5.419 0.463 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -7.231 5.940 0.760 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -6.781 4.388 0.081 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -8.644 7.515 -0.776 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.418 4.197 -2.245 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -8.670 8.495 -3.025 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.449 5.171 -4.497 1.00 0.00 H new ATOM 0 HH TYR A 50 -7.618 8.410 -5.091 1.00 0.00 H new ATOM 800 N PHE A 51 -8.872 2.344 -0.414 1.00 0.00 N ATOM 801 CA PHE A 51 -9.216 1.267 -1.329 1.00 0.00 C ATOM 802 C PHE A 51 -10.716 0.990 -1.293 1.00 0.00 C ATOM 803 O PHE A 51 -11.358 0.873 -2.337 1.00 0.00 O ATOM 804 CB PHE A 51 -8.428 0.000 -0.979 1.00 0.00 C ATOM 805 CG PHE A 51 -8.670 -1.150 -1.917 1.00 0.00 C ATOM 806 CD1 PHE A 51 -8.295 -1.067 -3.249 1.00 0.00 C ATOM 807 CD2 PHE A 51 -9.270 -2.315 -1.466 1.00 0.00 C ATOM 808 CE1 PHE A 51 -8.515 -2.124 -4.112 1.00 0.00 C ATOM 809 CE2 PHE A 51 -9.492 -3.375 -2.325 1.00 0.00 C ATOM 810 CZ PHE A 51 -9.114 -3.279 -3.650 1.00 0.00 C ATOM 0 H PHE A 51 -8.247 2.071 0.344 1.00 0.00 H new ATOM 0 HA PHE A 51 -8.949 1.574 -2.340 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -7.364 0.236 -0.977 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -8.688 -0.309 0.033 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -7.826 -0.166 -3.616 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -9.568 -2.396 -0.431 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -8.218 -2.046 -5.148 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.960 -4.277 -1.960 1.00 0.00 H new ATOM 0 HZ PHE A 51 -9.287 -4.106 -4.323 1.00 0.00 H new ATOM 820 N GLN A 52 -11.277 0.914 -0.090 1.00 0.00 N ATOM 821 CA GLN A 52 -12.696 0.628 0.059 1.00 0.00 C ATOM 822 C GLN A 52 -13.538 1.810 -0.412 1.00 0.00 C ATOM 823 O GLN A 52 -14.622 1.628 -0.964 1.00 0.00 O ATOM 824 CB GLN A 52 -13.036 0.289 1.513 1.00 0.00 C ATOM 825 CG GLN A 52 -12.124 -0.757 2.139 1.00 0.00 C ATOM 826 CD GLN A 52 -11.968 -2.009 1.296 1.00 0.00 C ATOM 827 OE1 GLN A 52 -12.872 -2.405 0.557 1.00 0.00 O ATOM 828 NE2 GLN A 52 -10.812 -2.639 1.396 1.00 0.00 N ATOM 0 H GLN A 52 -10.774 1.046 0.788 1.00 0.00 H new ATOM 0 HA GLN A 52 -12.928 -0.237 -0.562 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -12.987 1.201 2.108 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -14.065 -0.067 1.560 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -11.141 -0.317 2.306 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -12.520 -1.034 3.116 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -10.088 -2.280 2.019 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -10.643 -3.484 0.851 1.00 0.00 H new ATOM 837 N ALA A 53 -13.028 3.021 -0.205 1.00 0.00 N ATOM 838 CA ALA A 53 -13.745 4.233 -0.591 1.00 0.00 C ATOM 839 C ALA A 53 -13.883 4.340 -2.106 1.00 0.00 C ATOM 840 O ALA A 53 -14.956 4.662 -2.619 1.00 0.00 O ATOM 841 CB ALA A 53 -13.040 5.465 -0.044 1.00 0.00 C ATOM 0 H ALA A 53 -12.120 3.189 0.228 1.00 0.00 H new ATOM 0 HA ALA A 53 -14.746 4.175 -0.163 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.588 6.359 -0.341 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -13.000 5.408 1.044 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -12.026 5.511 -0.442 1.00 0.00 H new ATOM 847 N GLN A 54 -12.797 4.066 -2.817 1.00 0.00 N ATOM 848 CA GLN A 54 -12.794 4.151 -4.273 1.00 0.00 C ATOM 849 C GLN A 54 -13.383 2.895 -4.902 1.00 0.00 C ATOM 850 O GLN A 54 -13.662 2.865 -6.100 1.00 0.00 O ATOM 851 CB GLN A 54 -11.377 4.397 -4.796 1.00 0.00 C ATOM 852 CG GLN A 54 -11.137 5.829 -5.252 1.00 0.00 C ATOM 853 CD GLN A 54 -11.409 6.858 -4.167 1.00 0.00 C ATOM 854 OE1 GLN A 54 -11.225 6.599 -2.981 1.00 0.00 O ATOM 855 NE2 GLN A 54 -11.854 8.036 -4.572 1.00 0.00 N ATOM 0 H GLN A 54 -11.906 3.783 -2.409 1.00 0.00 H new ATOM 0 HA GLN A 54 -13.422 4.995 -4.558 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -10.661 4.149 -4.012 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -11.184 3.722 -5.629 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -10.104 5.928 -5.587 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -11.773 6.041 -6.112 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -11.994 8.214 -5.567 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -12.057 8.767 -3.890 1.00 0.00 H new ATOM 864 N LYS A 55 -13.562 1.861 -4.089 1.00 0.00 N ATOM 865 CA LYS A 55 -14.209 0.634 -4.536 1.00 0.00 C ATOM 866 C LYS A 55 -15.677 0.890 -4.876 1.00 0.00 C ATOM 867 O LYS A 55 -16.258 0.216 -5.731 1.00 0.00 O ATOM 868 CB LYS A 55 -14.082 -0.445 -3.451 1.00 0.00 C ATOM 869 CG LYS A 55 -14.873 -1.716 -3.722 1.00 0.00 C ATOM 870 CD LYS A 55 -14.530 -2.802 -2.715 1.00 0.00 C ATOM 871 CE LYS A 55 -15.452 -4.005 -2.843 1.00 0.00 C ATOM 872 NZ LYS A 55 -16.833 -3.698 -2.376 1.00 0.00 N ATOM 0 H LYS A 55 -13.267 1.848 -3.113 1.00 0.00 H new ATOM 0 HA LYS A 55 -13.713 0.283 -5.441 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -13.030 -0.705 -3.338 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -14.410 -0.025 -2.500 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -15.940 -1.500 -3.678 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -14.661 -2.071 -4.730 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -13.497 -3.119 -2.860 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -14.600 -2.397 -1.706 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -15.484 -4.329 -3.883 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -15.049 -4.835 -2.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -17.347 -4.586 -2.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -16.787 -3.149 -1.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -17.330 -3.145 -3.103 1.00 0.00 H new ATOM 886 N PHE A 56 -16.266 1.878 -4.218 1.00 0.00 N ATOM 887 CA PHE A 56 -17.668 2.202 -4.428 1.00 0.00 C ATOM 888 C PHE A 56 -17.823 3.539 -5.135 1.00 0.00 C ATOM 889 O PHE A 56 -16.876 4.317 -5.241 1.00 0.00 O ATOM 890 CB PHE A 56 -18.412 2.246 -3.094 1.00 0.00 C ATOM 891 CG PHE A 56 -18.410 0.937 -2.363 1.00 0.00 C ATOM 892 CD1 PHE A 56 -19.283 -0.073 -2.725 1.00 0.00 C ATOM 893 CD2 PHE A 56 -17.535 0.717 -1.313 1.00 0.00 C ATOM 894 CE1 PHE A 56 -19.284 -1.278 -2.055 1.00 0.00 C ATOM 895 CE2 PHE A 56 -17.532 -0.486 -0.639 1.00 0.00 C ATOM 896 CZ PHE A 56 -18.409 -1.484 -1.010 1.00 0.00 C ATOM 0 H PHE A 56 -15.794 2.469 -3.534 1.00 0.00 H new ATOM 0 HA PHE A 56 -18.095 1.421 -5.057 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -17.959 3.008 -2.460 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -19.443 2.552 -3.272 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -19.972 0.084 -3.542 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -16.847 1.496 -1.019 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -19.969 -2.059 -2.349 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -16.844 -0.647 0.178 1.00 0.00 H new ATOM 0 HZ PHE A 56 -18.410 -2.426 -0.482 1.00 0.00 H new ATOM 906 N LEU A 57 -19.027 3.793 -5.617 1.00 0.00 N ATOM 907 CA LEU A 57 -19.352 5.067 -6.239 1.00 0.00 C ATOM 908 C LEU A 57 -20.536 5.696 -5.517 1.00 0.00 C ATOM 909 O LEU A 57 -21.014 6.771 -5.886 1.00 0.00 O ATOM 910 CB LEU A 57 -19.661 4.895 -7.738 1.00 0.00 C ATOM 911 CG LEU A 57 -20.899 4.053 -8.088 1.00 0.00 C ATOM 912 CD1 LEU A 57 -21.288 4.274 -9.540 1.00 0.00 C ATOM 913 CD2 LEU A 57 -20.647 2.569 -7.848 1.00 0.00 C ATOM 0 H LEU A 57 -19.801 3.130 -5.590 1.00 0.00 H new ATOM 0 HA LEU A 57 -18.487 5.725 -6.157 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -19.786 5.885 -8.177 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -18.793 4.441 -8.216 1.00 0.00 H new ATOM 0 HG LEU A 57 -21.713 4.373 -7.438 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -22.166 3.673 -9.777 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -21.516 5.328 -9.699 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -20.461 3.980 -10.187 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -21.542 2.002 -8.105 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -19.815 2.236 -8.469 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -20.404 2.406 -6.798 1.00 0.00 H new ATOM 925 N ASP A 58 -20.985 5.018 -4.470 1.00 0.00 N ATOM 926 CA ASP A 58 -22.133 5.459 -3.692 1.00 0.00 C ATOM 927 C ASP A 58 -21.751 6.612 -2.780 1.00 0.00 C ATOM 928 O ASP A 58 -20.678 6.605 -2.169 1.00 0.00 O ATOM 929 CB ASP A 58 -22.686 4.308 -2.848 1.00 0.00 C ATOM 930 CG ASP A 58 -23.085 3.108 -3.682 1.00 0.00 C ATOM 931 OD1 ASP A 58 -22.199 2.297 -4.010 1.00 0.00 O ATOM 932 OD2 ASP A 58 -24.284 2.978 -4.011 1.00 0.00 O ATOM 0 H ASP A 58 -20.565 4.150 -4.137 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.901 5.794 -4.390 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -21.935 4.004 -2.119 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -23.552 4.659 -2.286 1.00 0.00 H new ATOM 937 N GLU A 59 -22.630 7.598 -2.691 1.00 0.00 N ATOM 938 CA GLU A 59 -22.423 8.746 -1.819 1.00 0.00 C ATOM 939 C GLU A 59 -22.369 8.307 -0.359 1.00 0.00 C ATOM 940 O GLU A 59 -21.380 8.546 0.336 1.00 0.00 O ATOM 941 CB GLU A 59 -23.558 9.755 -2.013 1.00 0.00 C ATOM 942 CG GLU A 59 -23.486 10.958 -1.087 1.00 0.00 C ATOM 943 CD GLU A 59 -24.766 11.765 -1.095 1.00 0.00 C ATOM 944 OE1 GLU A 59 -24.996 12.510 -2.068 1.00 0.00 O ATOM 945 OE2 GLU A 59 -25.555 11.647 -0.132 1.00 0.00 O ATOM 0 H GLU A 59 -23.503 7.626 -3.218 1.00 0.00 H new ATOM 0 HA GLU A 59 -21.473 9.213 -2.078 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -23.546 10.104 -3.046 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -24.510 9.248 -1.859 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -23.278 10.620 -0.072 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -22.655 11.596 -1.387 1.00 0.00 H new ATOM 952 N LYS A 60 -23.426 7.630 0.076 1.00 0.00 N ATOM 953 CA LYS A 60 -23.601 7.263 1.481 1.00 0.00 C ATOM 954 C LYS A 60 -22.451 6.405 1.994 1.00 0.00 C ATOM 955 O LYS A 60 -21.894 6.667 3.059 1.00 0.00 O ATOM 956 CB LYS A 60 -24.919 6.505 1.666 1.00 0.00 C ATOM 957 CG LYS A 60 -26.145 7.287 1.228 1.00 0.00 C ATOM 958 CD LYS A 60 -26.303 8.570 2.022 1.00 0.00 C ATOM 959 CE LYS A 60 -27.526 9.352 1.580 1.00 0.00 C ATOM 960 NZ LYS A 60 -27.428 9.777 0.159 1.00 0.00 N ATOM 0 H LYS A 60 -24.185 7.320 -0.531 1.00 0.00 H new ATOM 0 HA LYS A 60 -23.617 8.188 2.058 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -24.873 5.574 1.102 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -25.028 6.236 2.717 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -26.067 7.523 0.167 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -27.035 6.670 1.353 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -26.385 8.334 3.083 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -25.412 9.186 1.900 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -28.417 8.739 1.715 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -27.644 10.230 2.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -28.163 10.485 -0.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -26.490 10.192 -0.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -27.562 8.952 -0.460 1.00 0.00 H new ATOM 974 N TYR A 61 -22.092 5.387 1.229 1.00 0.00 N ATOM 975 CA TYR A 61 -21.114 4.412 1.683 1.00 0.00 C ATOM 976 C TYR A 61 -19.710 5.005 1.688 1.00 0.00 C ATOM 977 O TYR A 61 -18.936 4.784 2.617 1.00 0.00 O ATOM 978 CB TYR A 61 -21.163 3.171 0.802 1.00 0.00 C ATOM 979 CG TYR A 61 -20.994 1.884 1.575 1.00 0.00 C ATOM 980 CD1 TYR A 61 -21.726 1.649 2.733 1.00 0.00 C ATOM 981 CD2 TYR A 61 -20.117 0.904 1.145 1.00 0.00 C ATOM 982 CE1 TYR A 61 -21.587 0.469 3.436 1.00 0.00 C ATOM 983 CE2 TYR A 61 -19.975 -0.282 1.840 1.00 0.00 C ATOM 984 CZ TYR A 61 -20.712 -0.494 2.984 1.00 0.00 C ATOM 985 OH TYR A 61 -20.585 -1.681 3.664 1.00 0.00 O ATOM 0 H TYR A 61 -22.462 5.215 0.294 1.00 0.00 H new ATOM 0 HA TYR A 61 -21.363 4.130 2.706 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -22.116 3.147 0.273 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -20.380 3.239 0.047 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -22.414 2.401 3.088 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -19.534 1.069 0.251 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -22.161 0.302 4.335 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -19.290 -1.039 1.488 1.00 0.00 H new ATOM 0 HH TYR A 61 -19.655 -1.987 3.616 1.00 0.00 H new ATOM 995 N ARG A 62 -19.395 5.771 0.652 1.00 0.00 N ATOM 996 CA ARG A 62 -18.091 6.418 0.542 1.00 0.00 C ATOM 997 C ARG A 62 -17.924 7.472 1.637 1.00 0.00 C ATOM 998 O ARG A 62 -16.816 7.721 2.115 1.00 0.00 O ATOM 999 CB ARG A 62 -17.948 7.029 -0.854 1.00 0.00 C ATOM 1000 CG ARG A 62 -16.679 7.829 -1.083 1.00 0.00 C ATOM 1001 CD ARG A 62 -16.511 8.157 -2.558 1.00 0.00 C ATOM 1002 NE ARG A 62 -17.782 8.540 -3.181 1.00 0.00 N ATOM 1003 CZ ARG A 62 -17.883 9.180 -4.348 1.00 0.00 C ATOM 1004 NH1 ARG A 62 -16.794 9.559 -5.005 1.00 0.00 N ATOM 1005 NH2 ARG A 62 -19.079 9.438 -4.864 1.00 0.00 N ATOM 0 H ARG A 62 -20.025 5.961 -0.127 1.00 0.00 H new ATOM 0 HA ARG A 62 -17.301 5.680 0.680 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -17.990 6.226 -1.590 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -18.805 7.677 -1.039 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -16.714 8.750 -0.502 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -15.817 7.262 -0.731 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -15.793 8.969 -2.670 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -16.098 7.292 -3.077 1.00 0.00 H new ATOM 0 HE ARG A 62 -18.644 8.302 -2.691 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -15.871 9.362 -4.619 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -16.880 10.048 -5.896 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -19.922 9.147 -4.369 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -19.155 9.927 -5.756 1.00 0.00 H new ATOM 1019 N GLU A 63 -19.039 8.076 2.036 1.00 0.00 N ATOM 1020 CA GLU A 63 -19.057 9.016 3.150 1.00 0.00 C ATOM 1021 C GLU A 63 -18.653 8.305 4.442 1.00 0.00 C ATOM 1022 O GLU A 63 -17.795 8.786 5.186 1.00 0.00 O ATOM 1023 CB GLU A 63 -20.460 9.623 3.288 1.00 0.00 C ATOM 1024 CG GLU A 63 -20.607 10.629 4.421 1.00 0.00 C ATOM 1025 CD GLU A 63 -19.765 11.872 4.221 1.00 0.00 C ATOM 1026 OE1 GLU A 63 -20.063 12.662 3.305 1.00 0.00 O ATOM 1027 OE2 GLU A 63 -18.808 12.082 4.999 1.00 0.00 O ATOM 0 H GLU A 63 -19.949 7.929 1.599 1.00 0.00 H new ATOM 0 HA GLU A 63 -18.343 9.817 2.959 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -20.724 10.111 2.350 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -21.177 8.816 3.441 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -21.655 10.917 4.510 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -20.326 10.154 5.361 1.00 0.00 H new ATOM 1034 N GLU A 64 -19.256 7.142 4.680 1.00 0.00 N ATOM 1035 CA GLU A 64 -18.977 6.354 5.878 1.00 0.00 C ATOM 1036 C GLU A 64 -17.515 5.923 5.933 1.00 0.00 C ATOM 1037 O GLU A 64 -16.824 6.161 6.924 1.00 0.00 O ATOM 1038 CB GLU A 64 -19.876 5.117 5.921 1.00 0.00 C ATOM 1039 CG GLU A 64 -21.353 5.435 6.049 1.00 0.00 C ATOM 1040 CD GLU A 64 -21.700 6.097 7.367 1.00 0.00 C ATOM 1041 OE1 GLU A 64 -21.896 5.371 8.365 1.00 0.00 O ATOM 1042 OE2 GLU A 64 -21.794 7.339 7.413 1.00 0.00 O ATOM 0 H GLU A 64 -19.945 6.723 4.055 1.00 0.00 H new ATOM 0 HA GLU A 64 -19.183 6.985 6.743 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -19.717 4.533 5.014 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -19.575 4.490 6.761 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -21.651 6.089 5.230 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -21.928 4.515 5.948 1.00 0.00 H new ATOM 1049 N ILE A 65 -17.047 5.304 4.854 1.00 0.00 N ATOM 1050 CA ILE A 65 -15.698 4.746 4.805 1.00 0.00 C ATOM 1051 C ILE A 65 -14.630 5.835 4.941 1.00 0.00 C ATOM 1052 O ILE A 65 -13.528 5.581 5.434 1.00 0.00 O ATOM 1053 CB ILE A 65 -15.475 3.953 3.497 1.00 0.00 C ATOM 1054 CG1 ILE A 65 -16.533 2.853 3.363 1.00 0.00 C ATOM 1055 CG2 ILE A 65 -14.072 3.352 3.458 1.00 0.00 C ATOM 1056 CD1 ILE A 65 -16.443 2.073 2.069 1.00 0.00 C ATOM 0 H ILE A 65 -17.585 5.175 3.997 1.00 0.00 H new ATOM 0 HA ILE A 65 -15.602 4.067 5.652 1.00 0.00 H new ATOM 0 HB ILE A 65 -15.571 4.640 2.656 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -16.434 2.162 4.200 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -17.523 3.303 3.437 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -13.939 2.799 2.528 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -13.332 4.151 3.514 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.942 2.677 4.304 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.224 1.313 2.047 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.573 2.751 1.226 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -15.467 1.593 2.001 1.00 0.00 H new ATOM 1068 N ARG A 66 -14.962 7.050 4.520 1.00 0.00 N ATOM 1069 CA ARG A 66 -14.024 8.162 4.602 1.00 0.00 C ATOM 1070 C ARG A 66 -13.858 8.644 6.041 1.00 0.00 C ATOM 1071 O ARG A 66 -12.772 9.067 6.443 1.00 0.00 O ATOM 1072 CB ARG A 66 -14.487 9.325 3.716 1.00 0.00 C ATOM 1073 CG ARG A 66 -13.592 10.552 3.807 1.00 0.00 C ATOM 1074 CD ARG A 66 -14.102 11.690 2.940 1.00 0.00 C ATOM 1075 NE ARG A 66 -15.465 12.086 3.295 1.00 0.00 N ATOM 1076 CZ ARG A 66 -16.074 13.168 2.813 1.00 0.00 C ATOM 1077 NH1 ARG A 66 -15.420 14.018 2.030 1.00 0.00 N ATOM 1078 NH2 ARG A 66 -17.330 13.420 3.143 1.00 0.00 N ATOM 0 H ARG A 66 -15.869 7.289 4.120 1.00 0.00 H new ATOM 0 HA ARG A 66 -13.058 7.803 4.246 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -14.525 8.989 2.680 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -15.502 9.604 3.998 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.534 10.883 4.844 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -12.580 10.287 3.500 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -13.438 12.548 3.042 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -14.074 11.388 1.893 1.00 0.00 H new ATOM 0 HE ARG A 66 -15.980 11.498 3.951 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -14.443 13.845 1.793 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -15.895 14.844 1.665 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -17.831 12.786 3.766 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -17.798 14.248 2.775 1.00 0.00 H new ATOM 1092 N ARG A 67 -14.928 8.578 6.820 1.00 0.00 N ATOM 1093 CA ARG A 67 -14.911 9.141 8.165 1.00 0.00 C ATOM 1094 C ARG A 67 -14.674 8.084 9.238 1.00 0.00 C ATOM 1095 O ARG A 67 -14.343 8.422 10.376 1.00 0.00 O ATOM 1096 CB ARG A 67 -16.209 9.890 8.450 1.00 0.00 C ATOM 1097 CG ARG A 67 -16.410 11.107 7.563 1.00 0.00 C ATOM 1098 CD ARG A 67 -17.562 11.961 8.055 1.00 0.00 C ATOM 1099 NE ARG A 67 -17.334 12.448 9.414 1.00 0.00 N ATOM 1100 CZ ARG A 67 -18.240 13.107 10.136 1.00 0.00 C ATOM 1101 NH1 ARG A 67 -19.444 13.360 9.638 1.00 0.00 N ATOM 1102 NH2 ARG A 67 -17.935 13.508 11.361 1.00 0.00 N ATOM 0 H ARG A 67 -15.811 8.145 6.549 1.00 0.00 H new ATOM 0 HA ARG A 67 -14.074 9.838 8.203 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -17.050 9.209 8.316 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -16.217 10.205 9.494 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -15.496 11.701 7.544 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -16.603 10.786 6.539 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -17.699 12.808 7.383 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -18.484 11.380 8.027 1.00 0.00 H new ATOM 0 HE ARG A 67 -16.423 12.272 9.837 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -19.682 13.049 8.696 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -20.131 13.865 10.197 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -17.011 13.312 11.747 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -18.624 14.013 11.919 1.00 0.00 H new ATOM 1116 N VAL A 68 -14.853 6.816 8.894 1.00 0.00 N ATOM 1117 CA VAL A 68 -14.609 5.741 9.845 1.00 0.00 C ATOM 1118 C VAL A 68 -13.109 5.614 10.120 1.00 0.00 C ATOM 1119 O VAL A 68 -12.302 5.544 9.196 1.00 0.00 O ATOM 1120 CB VAL A 68 -15.186 4.385 9.352 1.00 0.00 C ATOM 1121 CG1 VAL A 68 -14.512 3.912 8.073 1.00 0.00 C ATOM 1122 CG2 VAL A 68 -15.079 3.325 10.439 1.00 0.00 C ATOM 0 H VAL A 68 -15.163 6.509 7.972 1.00 0.00 H new ATOM 0 HA VAL A 68 -15.126 5.995 10.771 1.00 0.00 H new ATOM 0 HB VAL A 68 -16.240 4.546 9.125 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -14.945 2.961 7.764 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -14.663 4.652 7.287 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -13.444 3.783 8.250 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -15.489 2.384 10.071 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -14.032 3.184 10.708 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -15.639 3.646 11.317 1.00 0.00 H new ATOM 1132 N SER A 69 -12.735 5.621 11.386 1.00 0.00 N ATOM 1133 CA SER A 69 -11.335 5.510 11.761 1.00 0.00 C ATOM 1134 C SER A 69 -10.903 4.048 11.829 1.00 0.00 C ATOM 1135 O SER A 69 -9.775 3.706 11.467 1.00 0.00 O ATOM 1136 CB SER A 69 -11.107 6.211 13.099 1.00 0.00 C ATOM 1137 OG SER A 69 -12.114 5.860 14.036 1.00 0.00 O ATOM 0 H SER A 69 -13.379 5.702 12.172 1.00 0.00 H new ATOM 0 HA SER A 69 -10.725 5.996 11.000 1.00 0.00 H new ATOM 0 HB2 SER A 69 -10.128 5.940 13.493 1.00 0.00 H new ATOM 0 HB3 SER A 69 -11.103 7.291 12.952 1.00 0.00 H new ATOM 0 HG SER A 69 -11.945 6.320 14.885 1.00 0.00 H new ATOM 1143 N SER A 70 -11.817 3.195 12.270 1.00 0.00 N ATOM 1144 CA SER A 70 -11.556 1.770 12.420 1.00 0.00 C ATOM 1145 C SER A 70 -11.136 1.130 11.092 1.00 0.00 C ATOM 1146 O SER A 70 -11.908 1.103 10.129 1.00 0.00 O ATOM 1147 CB SER A 70 -12.807 1.092 12.969 1.00 0.00 C ATOM 1148 OG SER A 70 -13.267 1.760 14.132 1.00 0.00 O ATOM 0 H SER A 70 -12.762 3.472 12.534 1.00 0.00 H new ATOM 0 HA SER A 70 -10.728 1.637 13.116 1.00 0.00 H new ATOM 0 HB2 SER A 70 -13.589 1.091 12.210 1.00 0.00 H new ATOM 0 HB3 SER A 70 -12.589 0.050 13.204 1.00 0.00 H new ATOM 0 HG SER A 70 -14.071 1.313 14.470 1.00 0.00 H new ATOM 1154 N PRO A 71 -9.894 0.618 11.026 1.00 0.00 N ATOM 1155 CA PRO A 71 -9.349 0.002 9.816 1.00 0.00 C ATOM 1156 C PRO A 71 -9.975 -1.355 9.519 1.00 0.00 C ATOM 1157 O PRO A 71 -10.339 -1.640 8.377 1.00 0.00 O ATOM 1158 CB PRO A 71 -7.851 -0.158 10.122 1.00 0.00 C ATOM 1159 CG PRO A 71 -7.610 0.607 11.383 1.00 0.00 C ATOM 1160 CD PRO A 71 -8.916 0.615 12.121 1.00 0.00 C ATOM 0 HA PRO A 71 -9.552 0.610 8.935 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -7.587 -1.208 10.245 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -7.241 0.230 9.306 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -6.828 0.138 11.980 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -7.279 1.623 11.166 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -9.026 -0.260 12.762 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -9.017 1.493 12.759 1.00 0.00 H new ATOM 1168 N MET A 72 -10.116 -2.174 10.554 1.00 0.00 N ATOM 1169 CA MET A 72 -10.643 -3.525 10.402 1.00 0.00 C ATOM 1170 C MET A 72 -12.083 -3.481 9.909 1.00 0.00 C ATOM 1171 O MET A 72 -12.470 -4.239 9.020 1.00 0.00 O ATOM 1172 CB MET A 72 -10.563 -4.275 11.734 1.00 0.00 C ATOM 1173 CG MET A 72 -11.002 -5.728 11.657 1.00 0.00 C ATOM 1174 SD MET A 72 -10.001 -6.703 10.517 1.00 0.00 S ATOM 1175 CE MET A 72 -10.660 -8.344 10.802 1.00 0.00 C ATOM 0 H MET A 72 -9.871 -1.925 11.512 1.00 0.00 H new ATOM 0 HA MET A 72 -10.039 -4.053 9.664 1.00 0.00 H new ATOM 0 HB2 MET A 72 -9.537 -4.236 12.099 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.182 -3.758 12.467 1.00 0.00 H new ATOM 0 HG2 MET A 72 -10.948 -6.172 12.651 1.00 0.00 H new ATOM 0 HG3 MET A 72 -12.045 -5.771 11.345 1.00 0.00 H new ATOM 0 HE1 MET A 72 -10.313 -9.017 10.018 1.00 0.00 H new ATOM 0 HE2 MET A 72 -10.319 -8.710 11.771 1.00 0.00 H new ATOM 0 HE3 MET A 72 -11.749 -8.306 10.791 1.00 0.00 H new ATOM 1185 N VAL A 73 -12.864 -2.575 10.482 1.00 0.00 N ATOM 1186 CA VAL A 73 -14.260 -2.407 10.100 1.00 0.00 C ATOM 1187 C VAL A 73 -14.375 -1.908 8.660 1.00 0.00 C ATOM 1188 O VAL A 73 -15.218 -2.380 7.896 1.00 0.00 O ATOM 1189 CB VAL A 73 -14.988 -1.430 11.049 1.00 0.00 C ATOM 1190 CG1 VAL A 73 -16.444 -1.254 10.643 1.00 0.00 C ATOM 1191 CG2 VAL A 73 -14.891 -1.915 12.488 1.00 0.00 C ATOM 0 H VAL A 73 -12.552 -1.941 11.218 1.00 0.00 H new ATOM 0 HA VAL A 73 -14.737 -3.384 10.176 1.00 0.00 H new ATOM 0 HB VAL A 73 -14.498 -0.459 10.974 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -16.932 -0.561 11.329 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -16.494 -0.857 9.629 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -16.951 -2.218 10.680 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.409 -1.215 13.144 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -15.351 -2.899 12.572 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -13.843 -1.978 12.781 1.00 0.00 H new ATOM 1201 N ALA A 74 -13.502 -0.971 8.291 1.00 0.00 N ATOM 1202 CA ALA A 74 -13.508 -0.397 6.948 1.00 0.00 C ATOM 1203 C ALA A 74 -13.311 -1.469 5.888 1.00 0.00 C ATOM 1204 O ALA A 74 -14.007 -1.488 4.881 1.00 0.00 O ATOM 1205 CB ALA A 74 -12.431 0.666 6.817 1.00 0.00 C ATOM 0 H ALA A 74 -12.781 -0.593 8.906 1.00 0.00 H new ATOM 0 HA ALA A 74 -14.483 0.064 6.791 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -12.451 1.082 5.810 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -12.613 1.460 7.541 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.455 0.220 7.006 1.00 0.00 H new ATOM 1211 N ALA A 75 -12.362 -2.363 6.124 1.00 0.00 N ATOM 1212 CA ALA A 75 -12.083 -3.440 5.186 1.00 0.00 C ATOM 1213 C ALA A 75 -13.170 -4.508 5.242 1.00 0.00 C ATOM 1214 O ALA A 75 -13.530 -5.099 4.220 1.00 0.00 O ATOM 1215 CB ALA A 75 -10.721 -4.052 5.480 1.00 0.00 C ATOM 0 H ALA A 75 -11.773 -2.364 6.956 1.00 0.00 H new ATOM 0 HA ALA A 75 -12.072 -3.023 4.179 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -10.523 -4.857 4.772 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -9.950 -3.287 5.385 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -10.713 -4.451 6.494 1.00 0.00 H new ATOM 1221 N ARG A 76 -13.704 -4.731 6.439 1.00 0.00 N ATOM 1222 CA ARG A 76 -14.705 -5.769 6.660 1.00 0.00 C ATOM 1223 C ARG A 76 -15.995 -5.460 5.906 1.00 0.00 C ATOM 1224 O ARG A 76 -16.568 -6.336 5.258 1.00 0.00 O ATOM 1225 CB ARG A 76 -14.994 -5.915 8.154 1.00 0.00 C ATOM 1226 CG ARG A 76 -15.031 -7.359 8.619 1.00 0.00 C ATOM 1227 CD ARG A 76 -13.693 -8.044 8.387 1.00 0.00 C ATOM 1228 NE ARG A 76 -13.711 -9.446 8.799 1.00 0.00 N ATOM 1229 CZ ARG A 76 -12.889 -10.376 8.310 1.00 0.00 C ATOM 1230 NH1 ARG A 76 -11.970 -10.054 7.407 1.00 0.00 N ATOM 1231 NH2 ARG A 76 -12.976 -11.630 8.727 1.00 0.00 N ATOM 0 H ARG A 76 -13.458 -4.203 7.276 1.00 0.00 H new ATOM 0 HA ARG A 76 -14.305 -6.709 6.279 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.232 -5.378 8.719 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -15.950 -5.443 8.380 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -15.283 -7.397 9.679 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -15.815 -7.896 8.085 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -13.433 -7.981 7.330 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -12.916 -7.515 8.938 1.00 0.00 H new ATOM 0 HE ARG A 76 -14.393 -9.730 9.502 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -11.889 -9.090 7.083 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -11.345 -10.770 7.038 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -13.674 -11.888 9.425 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -12.345 -12.338 8.350 1.00 0.00 H new ATOM 1245 N MET A 77 -16.453 -4.218 5.997 1.00 0.00 N ATOM 1246 CA MET A 77 -17.662 -3.803 5.291 1.00 0.00 C ATOM 1247 C MET A 77 -17.305 -3.183 3.942 1.00 0.00 C ATOM 1248 O MET A 77 -18.182 -2.803 3.167 1.00 0.00 O ATOM 1249 CB MET A 77 -18.481 -2.811 6.129 1.00 0.00 C ATOM 1250 CG MET A 77 -17.865 -1.423 6.245 1.00 0.00 C ATOM 1251 SD MET A 77 -18.929 -0.276 7.144 1.00 0.00 S ATOM 1252 CE MET A 77 -18.008 1.250 6.975 1.00 0.00 C ATOM 0 H MET A 77 -16.010 -3.483 6.549 1.00 0.00 H new ATOM 0 HA MET A 77 -18.272 -4.690 5.122 1.00 0.00 H new ATOM 0 HB2 MET A 77 -19.475 -2.718 5.691 1.00 0.00 H new ATOM 0 HB3 MET A 77 -18.611 -3.222 7.130 1.00 0.00 H new ATOM 0 HG2 MET A 77 -16.903 -1.496 6.752 1.00 0.00 H new ATOM 0 HG3 MET A 77 -17.671 -1.029 5.247 1.00 0.00 H new ATOM 0 HE1 MET A 77 -18.541 2.055 7.481 1.00 0.00 H new ATOM 0 HE2 MET A 77 -17.021 1.131 7.422 1.00 0.00 H new ATOM 0 HE3 MET A 77 -17.900 1.495 5.918 1.00 0.00 H new ATOM 1262 N GLY A 78 -16.013 -3.090 3.670 1.00 0.00 N ATOM 1263 CA GLY A 78 -15.553 -2.486 2.436 1.00 0.00 C ATOM 1264 C GLY A 78 -15.584 -3.455 1.277 1.00 0.00 C ATOM 1265 O GLY A 78 -16.156 -3.164 0.226 1.00 0.00 O ATOM 0 H GLY A 78 -15.271 -3.424 4.285 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -16.176 -1.623 2.202 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -14.536 -2.117 2.571 1.00 0.00 H new ATOM 1269 N ARG A 79 -14.992 -4.627 1.464 1.00 0.00 N ATOM 1270 CA ARG A 79 -14.976 -5.641 0.416 1.00 0.00 C ATOM 1271 C ARG A 79 -16.280 -6.441 0.416 1.00 0.00 C ATOM 1272 O ARG A 79 -16.335 -7.576 -0.059 1.00 0.00 O ATOM 1273 CB ARG A 79 -13.745 -6.549 0.552 1.00 0.00 C ATOM 1274 CG ARG A 79 -12.465 -5.874 0.067 1.00 0.00 C ATOM 1275 CD ARG A 79 -11.267 -6.821 0.029 1.00 0.00 C ATOM 1276 NE ARG A 79 -10.681 -7.047 1.352 1.00 0.00 N ATOM 1277 CZ ARG A 79 -9.758 -6.250 1.906 1.00 0.00 C ATOM 1278 NH1 ARG A 79 -9.286 -5.203 1.239 1.00 0.00 N ATOM 1279 NH2 ARG A 79 -9.282 -6.514 3.114 1.00 0.00 N ATOM 0 H ARG A 79 -14.519 -4.899 2.326 1.00 0.00 H new ATOM 0 HA ARG A 79 -14.902 -5.140 -0.549 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -13.626 -6.840 1.596 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -13.908 -7.464 -0.017 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -12.631 -5.467 -0.931 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -12.235 -5.032 0.720 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -11.578 -7.776 -0.394 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -10.506 -6.411 -0.635 1.00 0.00 H new ATOM 0 HE ARG A 79 -10.994 -7.860 1.883 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -9.626 -5.002 0.299 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -8.583 -4.600 1.667 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -9.618 -7.328 3.628 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -8.579 -5.903 3.530 1.00 0.00 H new ATOM 1293 N ASP A 80 -17.332 -5.806 0.923 1.00 0.00 N ATOM 1294 CA ASP A 80 -18.679 -6.363 0.906 1.00 0.00 C ATOM 1295 C ASP A 80 -19.263 -6.306 -0.506 1.00 0.00 C ATOM 1296 O ASP A 80 -18.812 -5.512 -1.339 1.00 0.00 O ATOM 1297 CB ASP A 80 -19.567 -5.582 1.885 1.00 0.00 C ATOM 1298 CG ASP A 80 -21.043 -5.884 1.718 1.00 0.00 C ATOM 1299 OD1 ASP A 80 -21.426 -7.066 1.830 1.00 0.00 O ATOM 1300 OD2 ASP A 80 -21.819 -4.946 1.439 1.00 0.00 O ATOM 0 H ASP A 80 -17.273 -4.886 1.359 1.00 0.00 H new ATOM 0 HA ASP A 80 -18.638 -7.408 1.215 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -19.267 -5.818 2.906 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -19.402 -4.514 1.743 1.00 0.00 H new ATOM 1305 N ARG A 81 -20.250 -7.157 -0.776 1.00 0.00 N ATOM 1306 CA ARG A 81 -20.899 -7.186 -2.080 1.00 0.00 C ATOM 1307 C ARG A 81 -22.406 -6.965 -1.978 1.00 0.00 C ATOM 1308 O ARG A 81 -23.124 -7.112 -2.970 1.00 0.00 O ATOM 1309 CB ARG A 81 -20.608 -8.500 -2.799 1.00 0.00 C ATOM 1310 CG ARG A 81 -19.354 -8.449 -3.652 1.00 0.00 C ATOM 1311 CD ARG A 81 -19.091 -9.779 -4.331 1.00 0.00 C ATOM 1312 NE ARG A 81 -18.641 -10.795 -3.385 1.00 0.00 N ATOM 1313 CZ ARG A 81 -18.716 -12.104 -3.609 1.00 0.00 C ATOM 1314 NH1 ARG A 81 -19.314 -12.564 -4.702 1.00 0.00 N ATOM 1315 NH2 ARG A 81 -18.209 -12.954 -2.726 1.00 0.00 N ATOM 0 H ARG A 81 -20.616 -7.835 -0.108 1.00 0.00 H new ATOM 0 HA ARG A 81 -20.484 -6.362 -2.660 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -20.506 -9.296 -2.061 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -21.459 -8.758 -3.430 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -19.457 -7.668 -4.406 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -18.500 -8.181 -3.030 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -20.001 -10.121 -4.825 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -18.337 -9.647 -5.107 1.00 0.00 H new ATOM 0 HE ARG A 81 -18.245 -10.482 -2.498 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -19.719 -11.913 -5.375 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -19.369 -13.569 -4.869 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -17.763 -12.603 -1.878 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -18.265 -13.958 -2.895 1.00 0.00 H new ATOM 1329 N SER A 82 -22.888 -6.606 -0.789 1.00 0.00 N ATOM 1330 CA SER A 82 -24.277 -6.184 -0.641 1.00 0.00 C ATOM 1331 C SER A 82 -24.462 -4.844 -1.342 1.00 0.00 C ATOM 1332 O SER A 82 -25.545 -4.517 -1.827 1.00 0.00 O ATOM 1333 CB SER A 82 -24.674 -6.059 0.835 1.00 0.00 C ATOM 1334 OG SER A 82 -24.729 -7.322 1.476 1.00 0.00 O ATOM 0 H SER A 82 -22.345 -6.599 0.074 1.00 0.00 H new ATOM 0 HA SER A 82 -24.920 -6.940 -1.092 1.00 0.00 H new ATOM 0 HB2 SER A 82 -23.957 -5.421 1.351 1.00 0.00 H new ATOM 0 HB3 SER A 82 -25.646 -5.571 0.910 1.00 0.00 H new ATOM 0 HG SER A 82 -24.983 -7.202 2.415 1.00 0.00 H new ATOM 1340 N LYS A 83 -23.377 -4.082 -1.405 1.00 0.00 N ATOM 1341 CA LYS A 83 -23.378 -2.798 -2.085 1.00 0.00 C ATOM 1342 C LYS A 83 -22.884 -2.996 -3.518 1.00 0.00 C ATOM 1343 O LYS A 83 -22.149 -3.949 -3.790 1.00 0.00 O ATOM 1344 CB LYS A 83 -22.479 -1.793 -1.350 1.00 0.00 C ATOM 1345 CG LYS A 83 -22.481 -1.927 0.169 1.00 0.00 C ATOM 1346 CD LYS A 83 -23.886 -1.899 0.753 1.00 0.00 C ATOM 1347 CE LYS A 83 -23.865 -1.932 2.276 1.00 0.00 C ATOM 1348 NZ LYS A 83 -22.964 -2.990 2.813 1.00 0.00 N ATOM 0 H LYS A 83 -22.481 -4.336 -0.990 1.00 0.00 H new ATOM 0 HA LYS A 83 -24.392 -2.398 -2.095 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -21.457 -1.910 -1.710 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -22.796 -0.784 -1.612 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -21.993 -2.860 0.449 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -21.894 -1.118 0.603 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -24.402 -1.000 0.416 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -24.453 -2.752 0.378 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -23.544 -0.961 2.653 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -24.877 -2.099 2.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -23.404 -3.430 3.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -22.805 -3.713 2.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -22.054 -2.566 3.085 1.00 0.00 H new ATOM 1362 N PRO A 84 -23.280 -2.113 -4.453 1.00 0.00 N ATOM 1363 CA PRO A 84 -22.907 -2.241 -5.866 1.00 0.00 C ATOM 1364 C PRO A 84 -21.427 -1.959 -6.115 1.00 0.00 C ATOM 1365 O PRO A 84 -20.702 -1.518 -5.223 1.00 0.00 O ATOM 1366 CB PRO A 84 -23.779 -1.194 -6.563 1.00 0.00 C ATOM 1367 CG PRO A 84 -24.065 -0.178 -5.517 1.00 0.00 C ATOM 1368 CD PRO A 84 -24.115 -0.923 -4.210 1.00 0.00 C ATOM 0 HA PRO A 84 -23.061 -3.256 -6.232 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -23.261 -0.751 -7.413 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -24.699 -1.637 -6.946 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -23.291 0.590 -5.498 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -25.011 0.327 -5.713 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -23.724 -0.320 -3.390 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -25.136 -1.198 -3.945 1.00 0.00 H new ATOM 1376 N LEU A 85 -20.979 -2.218 -7.336 1.00 0.00 N ATOM 1377 CA LEU A 85 -19.583 -2.026 -7.691 1.00 0.00 C ATOM 1378 C LEU A 85 -19.442 -1.150 -8.929 1.00 0.00 C ATOM 1379 O LEU A 85 -20.429 -0.796 -9.580 1.00 0.00 O ATOM 1380 CB LEU A 85 -18.902 -3.375 -7.936 1.00 0.00 C ATOM 1381 CG LEU A 85 -18.777 -4.283 -6.710 1.00 0.00 C ATOM 1382 CD1 LEU A 85 -18.150 -5.612 -7.095 1.00 0.00 C ATOM 1383 CD2 LEU A 85 -17.951 -3.604 -5.630 1.00 0.00 C ATOM 0 H LEU A 85 -21.565 -2.562 -8.097 1.00 0.00 H new ATOM 0 HA LEU A 85 -19.097 -1.523 -6.855 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -19.459 -3.909 -8.706 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -17.904 -3.191 -8.334 1.00 0.00 H new ATOM 0 HG LEU A 85 -19.776 -4.472 -6.317 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -18.069 -6.245 -6.212 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -18.774 -6.106 -7.840 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -17.157 -5.439 -7.510 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -17.871 -4.262 -4.765 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -16.954 -3.389 -6.015 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -18.434 -2.673 -5.334 1.00 0.00 H new ATOM 1395 N ARG A 86 -18.204 -0.809 -9.247 1.00 0.00 N ATOM 1396 CA ARG A 86 -17.898 -0.015 -10.427 1.00 0.00 C ATOM 1397 C ARG A 86 -17.796 -0.918 -11.652 1.00 0.00 C ATOM 1398 O ARG A 86 -17.465 -2.095 -11.531 1.00 0.00 O ATOM 1399 CB ARG A 86 -16.580 0.732 -10.218 1.00 0.00 C ATOM 1400 CG ARG A 86 -16.618 1.719 -9.063 1.00 0.00 C ATOM 1401 CD ARG A 86 -15.228 2.217 -8.700 1.00 0.00 C ATOM 1402 NE ARG A 86 -14.547 2.860 -9.826 1.00 0.00 N ATOM 1403 CZ ARG A 86 -13.697 3.879 -9.698 1.00 0.00 C ATOM 1404 NH1 ARG A 86 -13.417 4.372 -8.497 1.00 0.00 N ATOM 1405 NH2 ARG A 86 -13.113 4.396 -10.773 1.00 0.00 N ATOM 0 H ARG A 86 -17.386 -1.073 -8.698 1.00 0.00 H new ATOM 0 HA ARG A 86 -18.698 0.708 -10.588 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -15.785 0.007 -10.040 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -16.325 1.266 -11.133 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -17.250 2.566 -9.330 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -17.072 1.244 -8.194 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -15.304 2.925 -7.874 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -14.627 1.379 -8.347 1.00 0.00 H new ATOM 0 HE ARG A 86 -14.734 2.507 -10.764 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -13.853 3.971 -7.667 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -12.766 5.152 -8.405 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -13.315 4.013 -11.697 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -12.463 5.176 -10.675 1.00 0.00 H new ATOM 1419 N LYS A 87 -18.075 -0.372 -12.824 1.00 0.00 N ATOM 1420 CA LYS A 87 -17.984 -1.142 -14.059 1.00 0.00 C ATOM 1421 C LYS A 87 -16.527 -1.251 -14.492 1.00 0.00 C ATOM 1422 O LYS A 87 -16.113 -2.231 -15.115 1.00 0.00 O ATOM 1423 CB LYS A 87 -18.820 -0.491 -15.163 1.00 0.00 C ATOM 1424 CG LYS A 87 -18.869 -1.306 -16.444 1.00 0.00 C ATOM 1425 CD LYS A 87 -19.671 -0.605 -17.522 1.00 0.00 C ATOM 1426 CE LYS A 87 -19.693 -1.413 -18.806 1.00 0.00 C ATOM 1427 NZ LYS A 87 -18.327 -1.632 -19.354 1.00 0.00 N ATOM 0 H LYS A 87 -18.366 0.598 -12.949 1.00 0.00 H new ATOM 0 HA LYS A 87 -18.378 -2.142 -13.879 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -19.836 -0.341 -14.798 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -18.411 0.495 -15.384 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -17.855 -1.483 -16.802 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -19.310 -2.282 -16.238 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -20.691 -0.445 -17.173 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -19.242 0.378 -17.716 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -20.167 -2.377 -18.619 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -20.302 -0.897 -19.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -18.396 -1.956 -20.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -17.792 -0.741 -19.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -17.836 -2.352 -18.786 1.00 0.00 H new ATOM 1441 N ASN A 88 -15.749 -0.239 -14.135 1.00 0.00 N ATOM 1442 CA ASN A 88 -14.320 -0.230 -14.415 1.00 0.00 C ATOM 1443 C ASN A 88 -13.542 -0.810 -13.245 1.00 0.00 C ATOM 1444 O ASN A 88 -12.318 -0.693 -13.183 1.00 0.00 O ATOM 1445 CB ASN A 88 -13.834 1.191 -14.727 1.00 0.00 C ATOM 1446 CG ASN A 88 -14.236 2.219 -13.677 1.00 0.00 C ATOM 1447 OD1 ASN A 88 -14.331 1.921 -12.484 1.00 0.00 O ATOM 1448 ND2 ASN A 88 -14.484 3.444 -14.115 1.00 0.00 N ATOM 0 H ASN A 88 -16.086 0.591 -13.648 1.00 0.00 H new ATOM 0 HA ASN A 88 -14.144 -0.853 -15.292 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -12.748 1.183 -14.817 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -14.232 1.498 -15.694 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -14.763 4.174 -13.459 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -14.396 3.658 -15.108 1.00 0.00 H new ATOM 1455 N TRP A 89 -14.262 -1.463 -12.333 1.00 0.00 N ATOM 1456 CA TRP A 89 -13.651 -2.062 -11.153 1.00 0.00 C ATOM 1457 C TRP A 89 -12.577 -3.068 -11.558 1.00 0.00 C ATOM 1458 O TRP A 89 -11.593 -3.261 -10.851 1.00 0.00 O ATOM 1459 CB TRP A 89 -14.721 -2.732 -10.282 1.00 0.00 C ATOM 1460 CG TRP A 89 -14.175 -3.375 -9.043 1.00 0.00 C ATOM 1461 CD1 TRP A 89 -14.345 -4.672 -8.653 1.00 0.00 C ATOM 1462 CD2 TRP A 89 -13.361 -2.755 -8.039 1.00 0.00 C ATOM 1463 NE1 TRP A 89 -13.692 -4.896 -7.466 1.00 0.00 N ATOM 1464 CE2 TRP A 89 -13.079 -3.736 -7.069 1.00 0.00 C ATOM 1465 CE3 TRP A 89 -12.844 -1.468 -7.865 1.00 0.00 C ATOM 1466 CZ2 TRP A 89 -12.303 -3.467 -5.945 1.00 0.00 C ATOM 1467 CZ3 TRP A 89 -12.073 -1.204 -6.750 1.00 0.00 C ATOM 1468 CH2 TRP A 89 -11.809 -2.199 -5.803 1.00 0.00 C ATOM 0 H TRP A 89 -15.272 -1.589 -12.392 1.00 0.00 H new ATOM 0 HA TRP A 89 -13.176 -1.274 -10.569 1.00 0.00 H new ATOM 0 HB2 TRP A 89 -15.463 -1.987 -9.997 1.00 0.00 H new ATOM 0 HB3 TRP A 89 -15.238 -3.487 -10.874 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -14.910 -5.413 -9.198 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -13.667 -5.782 -6.961 1.00 0.00 H new ATOM 0 HE3 TRP A 89 -13.044 -0.693 -8.590 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -12.098 -4.232 -5.211 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 -11.667 -0.213 -6.607 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -11.202 -1.961 -4.942 1.00 0.00 H new ATOM 1479 N GLU A 90 -12.758 -3.681 -12.716 1.00 0.00 N ATOM 1480 CA GLU A 90 -11.794 -4.642 -13.232 1.00 0.00 C ATOM 1481 C GLU A 90 -10.448 -3.979 -13.519 1.00 0.00 C ATOM 1482 O GLU A 90 -9.398 -4.558 -13.257 1.00 0.00 O ATOM 1483 CB GLU A 90 -12.339 -5.306 -14.499 1.00 0.00 C ATOM 1484 CG GLU A 90 -13.625 -6.077 -14.264 1.00 0.00 C ATOM 1485 CD GLU A 90 -13.474 -7.129 -13.185 1.00 0.00 C ATOM 1486 OE1 GLU A 90 -12.897 -8.197 -13.469 1.00 0.00 O ATOM 1487 OE2 GLU A 90 -13.915 -6.881 -12.041 1.00 0.00 O ATOM 0 H GLU A 90 -13.566 -3.530 -13.319 1.00 0.00 H new ATOM 0 HA GLU A 90 -11.636 -5.404 -12.469 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -12.515 -4.541 -15.255 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -11.585 -5.983 -14.900 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -14.417 -5.382 -13.983 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -13.935 -6.555 -15.193 1.00 0.00 H new ATOM 1494 N SER A 91 -10.486 -2.749 -14.017 1.00 0.00 N ATOM 1495 CA SER A 91 -9.272 -2.064 -14.440 1.00 0.00 C ATOM 1496 C SER A 91 -8.648 -1.255 -13.300 1.00 0.00 C ATOM 1497 O SER A 91 -7.453 -0.952 -13.322 1.00 0.00 O ATOM 1498 CB SER A 91 -9.591 -1.146 -15.627 1.00 0.00 C ATOM 1499 OG SER A 91 -8.440 -0.454 -16.083 1.00 0.00 O ATOM 0 H SER A 91 -11.342 -2.207 -14.137 1.00 0.00 H new ATOM 0 HA SER A 91 -8.544 -2.818 -14.740 1.00 0.00 H new ATOM 0 HB2 SER A 91 -10.006 -1.738 -16.443 1.00 0.00 H new ATOM 0 HB3 SER A 91 -10.356 -0.426 -15.334 1.00 0.00 H new ATOM 0 HG SER A 91 -8.682 0.119 -16.840 1.00 0.00 H new ATOM 1505 N VAL A 92 -9.440 -0.926 -12.286 1.00 0.00 N ATOM 1506 CA VAL A 92 -8.983 0.010 -11.266 1.00 0.00 C ATOM 1507 C VAL A 92 -8.531 -0.675 -9.976 1.00 0.00 C ATOM 1508 O VAL A 92 -8.003 -0.005 -9.095 1.00 0.00 O ATOM 1509 CB VAL A 92 -10.052 1.073 -10.931 1.00 0.00 C ATOM 1510 CG1 VAL A 92 -10.392 1.898 -12.164 1.00 0.00 C ATOM 1511 CG2 VAL A 92 -11.297 0.431 -10.345 1.00 0.00 C ATOM 0 H VAL A 92 -10.385 -1.286 -12.149 1.00 0.00 H new ATOM 0 HA VAL A 92 -8.115 0.501 -11.707 1.00 0.00 H new ATOM 0 HB VAL A 92 -9.639 1.743 -10.177 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -11.147 2.641 -11.908 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -9.495 2.401 -12.524 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -10.778 1.243 -12.945 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -12.032 1.203 -10.119 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -11.718 -0.271 -11.065 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -11.036 -0.101 -9.430 1.00 0.00 H new ATOM 1521 N LYS A 93 -8.710 -1.995 -9.864 1.00 0.00 N ATOM 1522 CA LYS A 93 -8.295 -2.716 -8.649 1.00 0.00 C ATOM 1523 C LYS A 93 -6.837 -2.415 -8.313 1.00 0.00 C ATOM 1524 O LYS A 93 -6.526 -1.782 -7.302 1.00 0.00 O ATOM 1525 CB LYS A 93 -8.451 -4.236 -8.806 1.00 0.00 C ATOM 1526 CG LYS A 93 -9.883 -4.720 -8.943 1.00 0.00 C ATOM 1527 CD LYS A 93 -9.957 -6.238 -8.871 1.00 0.00 C ATOM 1528 CE LYS A 93 -11.348 -6.752 -9.204 1.00 0.00 C ATOM 1529 NZ LYS A 93 -11.683 -6.536 -10.634 1.00 0.00 N ATOM 0 H LYS A 93 -9.132 -2.581 -10.585 1.00 0.00 H new ATOM 0 HA LYS A 93 -8.945 -2.372 -7.845 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.889 -4.556 -9.684 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -7.999 -4.724 -7.943 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -10.494 -4.285 -8.152 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -10.297 -4.377 -9.891 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -9.234 -6.670 -9.563 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -9.677 -6.568 -7.871 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -11.409 -7.815 -8.972 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -12.083 -6.247 -8.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -12.578 -7.017 -10.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -11.782 -5.517 -10.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -10.924 -6.923 -11.231 1.00 0.00 H new ATOM 1543 N GLU A 94 -5.953 -2.841 -9.195 1.00 0.00 N ATOM 1544 CA GLU A 94 -4.522 -2.724 -8.967 1.00 0.00 C ATOM 1545 C GLU A 94 -4.007 -1.365 -9.434 1.00 0.00 C ATOM 1546 O GLU A 94 -2.844 -1.012 -9.229 1.00 0.00 O ATOM 1547 CB GLU A 94 -3.808 -3.878 -9.673 1.00 0.00 C ATOM 1548 CG GLU A 94 -4.310 -5.232 -9.192 1.00 0.00 C ATOM 1549 CD GLU A 94 -3.794 -6.400 -9.999 1.00 0.00 C ATOM 1550 OE1 GLU A 94 -4.457 -6.782 -10.982 1.00 0.00 O ATOM 1551 OE2 GLU A 94 -2.746 -6.967 -9.634 1.00 0.00 O ATOM 0 H GLU A 94 -6.202 -3.275 -10.084 1.00 0.00 H new ATOM 0 HA GLU A 94 -4.314 -2.788 -7.899 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -3.960 -3.795 -10.749 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -2.735 -3.804 -9.496 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -4.019 -5.367 -8.150 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -5.400 -5.236 -9.222 1.00 0.00 H new ATOM 1558 N GLN A 95 -4.896 -0.595 -10.043 1.00 0.00 N ATOM 1559 CA GLN A 95 -4.580 0.764 -10.449 1.00 0.00 C ATOM 1560 C GLN A 95 -4.708 1.697 -9.248 1.00 0.00 C ATOM 1561 O GLN A 95 -3.821 2.507 -8.976 1.00 0.00 O ATOM 1562 CB GLN A 95 -5.520 1.209 -11.569 1.00 0.00 C ATOM 1563 CG GLN A 95 -5.194 2.576 -12.143 1.00 0.00 C ATOM 1564 CD GLN A 95 -6.177 3.010 -13.215 1.00 0.00 C ATOM 1565 OE1 GLN A 95 -6.743 2.051 -13.934 1.00 0.00 O flip ATOM 1566 NE2 GLN A 95 -6.429 4.202 -13.393 1.00 0.00 N flip ATOM 0 H GLN A 95 -5.846 -0.891 -10.267 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.556 0.801 -10.822 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -5.487 0.472 -12.371 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -6.542 1.220 -11.189 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -5.191 3.312 -11.339 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -4.188 2.559 -12.563 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -5.973 4.911 -12.819 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -7.094 4.480 -14.114 1.00 0.00 H new ATOM 1575 N VAL A 96 -5.816 1.557 -8.526 1.00 0.00 N ATOM 1576 CA VAL A 96 -6.047 2.324 -7.309 1.00 0.00 C ATOM 1577 C VAL A 96 -5.040 1.929 -6.234 1.00 0.00 C ATOM 1578 O VAL A 96 -4.541 2.777 -5.495 1.00 0.00 O ATOM 1579 CB VAL A 96 -7.493 2.124 -6.785 1.00 0.00 C ATOM 1580 CG1 VAL A 96 -7.670 2.726 -5.400 1.00 0.00 C ATOM 1581 CG2 VAL A 96 -8.500 2.735 -7.750 1.00 0.00 C ATOM 0 H VAL A 96 -6.571 0.915 -8.766 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.916 3.379 -7.548 1.00 0.00 H new ATOM 0 HB VAL A 96 -7.672 1.051 -6.715 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.694 2.568 -5.063 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.981 2.247 -4.704 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -7.461 3.795 -5.439 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -9.509 2.585 -7.366 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -8.305 3.803 -7.851 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -8.408 2.255 -8.724 1.00 0.00 H new ATOM 1591 N MET A 97 -4.725 0.639 -6.167 1.00 0.00 N ATOM 1592 CA MET A 97 -3.737 0.143 -5.216 1.00 0.00 C ATOM 1593 C MET A 97 -2.366 0.759 -5.478 1.00 0.00 C ATOM 1594 O MET A 97 -1.689 1.172 -4.543 1.00 0.00 O ATOM 1595 CB MET A 97 -3.654 -1.381 -5.266 1.00 0.00 C ATOM 1596 CG MET A 97 -4.843 -2.080 -4.624 1.00 0.00 C ATOM 1597 SD MET A 97 -4.532 -2.613 -2.925 1.00 0.00 S ATOM 1598 CE MET A 97 -4.516 -1.051 -2.053 1.00 0.00 C ATOM 0 H MET A 97 -5.139 -0.081 -6.759 1.00 0.00 H new ATOM 0 HA MET A 97 -4.058 0.439 -4.217 1.00 0.00 H new ATOM 0 HB2 MET A 97 -3.576 -1.698 -6.306 1.00 0.00 H new ATOM 0 HB3 MET A 97 -2.741 -1.703 -4.765 1.00 0.00 H new ATOM 0 HG2 MET A 97 -5.700 -1.406 -4.634 1.00 0.00 H new ATOM 0 HG3 MET A 97 -5.113 -2.948 -5.226 1.00 0.00 H new ATOM 0 HE1 MET A 97 -4.656 -1.228 -0.987 1.00 0.00 H new ATOM 0 HE2 MET A 97 -3.560 -0.553 -2.216 1.00 0.00 H new ATOM 0 HE3 MET A 97 -5.323 -0.419 -2.424 1.00 0.00 H new ATOM 1608 N ARG A 98 -1.964 0.832 -6.751 1.00 0.00 N ATOM 1609 CA ARG A 98 -0.709 1.494 -7.114 1.00 0.00 C ATOM 1610 C ARG A 98 -0.704 2.936 -6.607 1.00 0.00 C ATOM 1611 O ARG A 98 0.280 3.407 -6.031 1.00 0.00 O ATOM 1612 CB ARG A 98 -0.504 1.495 -8.634 1.00 0.00 C ATOM 1613 CG ARG A 98 0.728 2.277 -9.068 1.00 0.00 C ATOM 1614 CD ARG A 98 0.698 2.619 -10.549 1.00 0.00 C ATOM 1615 NE ARG A 98 0.927 1.452 -11.403 1.00 0.00 N ATOM 1616 CZ ARG A 98 0.458 1.342 -12.646 1.00 0.00 C ATOM 1617 NH1 ARG A 98 -0.352 2.270 -13.139 1.00 0.00 N ATOM 1618 NH2 ARG A 98 0.785 0.298 -13.397 1.00 0.00 N ATOM 0 H ARG A 98 -2.484 0.445 -7.539 1.00 0.00 H new ATOM 0 HA ARG A 98 0.105 0.938 -6.649 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -0.416 0.466 -8.984 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -1.385 1.921 -9.114 1.00 0.00 H new ATOM 0 HG2 ARG A 98 0.797 3.196 -8.486 1.00 0.00 H new ATOM 0 HG3 ARG A 98 1.622 1.694 -8.849 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -0.267 3.061 -10.796 1.00 0.00 H new ATOM 0 HD3 ARG A 98 1.457 3.373 -10.759 1.00 0.00 H new ATOM 0 HE ARG A 98 1.476 0.680 -11.026 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -0.618 3.071 -12.566 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -0.709 2.182 -14.091 1.00 0.00 H new ATOM 0 HH21 ARG A 98 1.399 -0.426 -13.024 1.00 0.00 H new ATOM 0 HH22 ARG A 98 0.423 0.220 -14.347 1.00 0.00 H new ATOM 1632 N LYS A 99 -1.823 3.615 -6.819 1.00 0.00 N ATOM 1633 CA LYS A 99 -1.984 5.003 -6.410 1.00 0.00 C ATOM 1634 C LYS A 99 -1.876 5.131 -4.890 1.00 0.00 C ATOM 1635 O LYS A 99 -1.214 6.037 -4.376 1.00 0.00 O ATOM 1636 CB LYS A 99 -3.343 5.515 -6.894 1.00 0.00 C ATOM 1637 CG LYS A 99 -3.586 6.996 -6.662 1.00 0.00 C ATOM 1638 CD LYS A 99 -4.999 7.376 -7.066 1.00 0.00 C ATOM 1639 CE LYS A 99 -5.280 8.852 -6.847 1.00 0.00 C ATOM 1640 NZ LYS A 99 -4.583 9.717 -7.834 1.00 0.00 N ATOM 0 H LYS A 99 -2.643 3.220 -7.279 1.00 0.00 H new ATOM 0 HA LYS A 99 -1.191 5.604 -6.855 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -3.434 5.309 -7.961 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.128 4.950 -6.392 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.426 7.236 -5.611 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -2.868 7.582 -7.236 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -5.153 7.130 -8.117 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.711 6.783 -6.492 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.354 9.027 -6.910 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.970 9.132 -5.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -4.807 10.714 -7.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -3.556 9.572 -7.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -4.897 9.471 -8.794 1.00 0.00 H new ATOM 1654 N ALA A 100 -2.521 4.207 -4.183 1.00 0.00 N ATOM 1655 CA ALA A 100 -2.503 4.191 -2.725 1.00 0.00 C ATOM 1656 C ALA A 100 -1.116 3.843 -2.196 1.00 0.00 C ATOM 1657 O ALA A 100 -0.671 4.392 -1.188 1.00 0.00 O ATOM 1658 CB ALA A 100 -3.537 3.207 -2.197 1.00 0.00 C ATOM 0 H ALA A 100 -3.067 3.454 -4.602 1.00 0.00 H new ATOM 0 HA ALA A 100 -2.755 5.191 -2.371 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -3.514 3.204 -1.107 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -4.529 3.504 -2.538 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -3.310 2.207 -2.567 1.00 0.00 H new ATOM 1664 N LEU A 101 -0.436 2.928 -2.878 1.00 0.00 N ATOM 1665 CA LEU A 101 0.921 2.551 -2.505 1.00 0.00 C ATOM 1666 C LEU A 101 1.862 3.737 -2.642 1.00 0.00 C ATOM 1667 O LEU A 101 2.690 3.985 -1.765 1.00 0.00 O ATOM 1668 CB LEU A 101 1.422 1.385 -3.363 1.00 0.00 C ATOM 1669 CG LEU A 101 0.763 0.037 -3.071 1.00 0.00 C ATOM 1670 CD1 LEU A 101 1.305 -1.032 -4.004 1.00 0.00 C ATOM 1671 CD2 LEU A 101 0.988 -0.358 -1.621 1.00 0.00 C ATOM 0 H LEU A 101 -0.803 2.434 -3.692 1.00 0.00 H new ATOM 0 HA LEU A 101 0.904 2.232 -1.463 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.261 1.631 -4.413 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.498 1.285 -3.220 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.309 0.131 -3.242 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.825 -1.985 -3.783 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.098 -0.753 -5.037 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.382 -1.126 -3.863 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.513 -1.320 -1.428 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.058 -0.436 -1.427 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.555 0.398 -0.966 1.00 0.00 H new ATOM 1683 N ARG A 102 1.723 4.475 -3.738 1.00 0.00 N ATOM 1684 CA ARG A 102 2.528 5.667 -3.943 1.00 0.00 C ATOM 1685 C ARG A 102 2.227 6.691 -2.861 1.00 0.00 C ATOM 1686 O ARG A 102 3.135 7.299 -2.305 1.00 0.00 O ATOM 1687 CB ARG A 102 2.288 6.275 -5.328 1.00 0.00 C ATOM 1688 CG ARG A 102 3.133 7.513 -5.587 1.00 0.00 C ATOM 1689 CD ARG A 102 2.986 8.022 -7.010 1.00 0.00 C ATOM 1690 NE ARG A 102 3.790 9.221 -7.232 1.00 0.00 N ATOM 1691 CZ ARG A 102 3.985 9.785 -8.419 1.00 0.00 C ATOM 1692 NH1 ARG A 102 3.459 9.248 -9.517 1.00 0.00 N ATOM 1693 NH2 ARG A 102 4.722 10.882 -8.505 1.00 0.00 N ATOM 0 H ARG A 102 1.066 4.269 -4.490 1.00 0.00 H new ATOM 0 HA ARG A 102 3.577 5.378 -3.884 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.506 5.527 -6.090 1.00 0.00 H new ATOM 0 HB3 ARG A 102 1.234 6.534 -5.428 1.00 0.00 H new ATOM 0 HG2 ARG A 102 2.844 8.300 -4.890 1.00 0.00 H new ATOM 0 HG3 ARG A 102 4.180 7.283 -5.392 1.00 0.00 H new ATOM 0 HD2 ARG A 102 3.290 7.244 -7.710 1.00 0.00 H new ATOM 0 HD3 ARG A 102 1.938 8.242 -7.213 1.00 0.00 H new ATOM 0 HE ARG A 102 4.231 9.655 -6.421 1.00 0.00 H new ATOM 0 HH11 ARG A 102 2.901 8.397 -9.451 1.00 0.00 H new ATOM 0 HH12 ARG A 102 3.614 9.688 -10.424 1.00 0.00 H new ATOM 0 HH21 ARG A 102 5.134 11.287 -7.664 1.00 0.00 H new ATOM 0 HH22 ARG A 102 4.877 11.322 -9.412 1.00 0.00 H new ATOM 1707 N ALA A 103 0.950 6.859 -2.544 1.00 0.00 N ATOM 1708 CA ALA A 103 0.547 7.778 -1.494 1.00 0.00 C ATOM 1709 C ALA A 103 1.187 7.390 -0.167 1.00 0.00 C ATOM 1710 O ALA A 103 1.727 8.240 0.542 1.00 0.00 O ATOM 1711 CB ALA A 103 -0.966 7.808 -1.366 1.00 0.00 C ATOM 0 H ALA A 103 0.179 6.371 -2.999 1.00 0.00 H new ATOM 0 HA ALA A 103 0.891 8.777 -1.762 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.251 8.502 -0.575 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.405 8.134 -2.309 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.330 6.810 -1.122 1.00 0.00 H new ATOM 1717 N LYS A 104 1.145 6.098 0.141 1.00 0.00 N ATOM 1718 CA LYS A 104 1.696 5.570 1.384 1.00 0.00 C ATOM 1719 C LYS A 104 3.172 5.935 1.536 1.00 0.00 C ATOM 1720 O LYS A 104 3.563 6.606 2.494 1.00 0.00 O ATOM 1721 CB LYS A 104 1.541 4.044 1.416 1.00 0.00 C ATOM 1722 CG LYS A 104 1.896 3.415 2.756 1.00 0.00 C ATOM 1723 CD LYS A 104 2.001 1.896 2.662 1.00 0.00 C ATOM 1724 CE LYS A 104 0.718 1.261 2.141 1.00 0.00 C ATOM 1725 NZ LYS A 104 0.810 -0.225 2.107 1.00 0.00 N ATOM 0 H LYS A 104 0.729 5.389 -0.463 1.00 0.00 H new ATOM 0 HA LYS A 104 1.145 6.016 2.212 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.511 3.788 1.167 1.00 0.00 H new ATOM 0 HB3 LYS A 104 2.173 3.608 0.642 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.843 3.823 3.109 1.00 0.00 H new ATOM 0 HG3 LYS A 104 1.139 3.682 3.494 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.829 1.631 2.004 1.00 0.00 H new ATOM 0 HD3 LYS A 104 2.233 1.488 3.646 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -0.118 1.559 2.774 1.00 0.00 H new ATOM 0 HE3 LYS A 104 0.508 1.635 1.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 0.093 -0.602 1.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.757 -0.507 1.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 0.645 -0.605 3.061 1.00 0.00 H new ATOM 1739 N PHE A 105 3.976 5.510 0.571 1.00 0.00 N ATOM 1740 CA PHE A 105 5.422 5.653 0.667 1.00 0.00 C ATOM 1741 C PHE A 105 5.898 7.056 0.308 1.00 0.00 C ATOM 1742 O PHE A 105 6.754 7.610 0.986 1.00 0.00 O ATOM 1743 CB PHE A 105 6.118 4.621 -0.222 1.00 0.00 C ATOM 1744 CG PHE A 105 5.959 3.213 0.273 1.00 0.00 C ATOM 1745 CD1 PHE A 105 6.857 2.685 1.185 1.00 0.00 C ATOM 1746 CD2 PHE A 105 4.911 2.422 -0.165 1.00 0.00 C ATOM 1747 CE1 PHE A 105 6.713 1.395 1.651 1.00 0.00 C ATOM 1748 CE2 PHE A 105 4.761 1.130 0.300 1.00 0.00 C ATOM 1749 CZ PHE A 105 5.663 0.615 1.208 1.00 0.00 C ATOM 0 H PHE A 105 3.652 5.064 -0.287 1.00 0.00 H new ATOM 0 HA PHE A 105 5.689 5.479 1.709 1.00 0.00 H new ATOM 0 HB2 PHE A 105 5.716 4.692 -1.233 1.00 0.00 H new ATOM 0 HB3 PHE A 105 7.180 4.860 -0.283 1.00 0.00 H new ATOM 0 HD1 PHE A 105 7.680 3.290 1.536 1.00 0.00 H new ATOM 0 HD2 PHE A 105 4.203 2.819 -0.878 1.00 0.00 H new ATOM 0 HE1 PHE A 105 7.421 0.995 2.362 1.00 0.00 H new ATOM 0 HE2 PHE A 105 3.938 0.523 -0.047 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.548 -0.396 1.571 1.00 0.00 H new ATOM 1759 N GLU A 106 5.346 7.644 -0.742 1.00 0.00 N ATOM 1760 CA GLU A 106 5.864 8.911 -1.243 1.00 0.00 C ATOM 1761 C GLU A 106 5.464 10.080 -0.335 1.00 0.00 C ATOM 1762 O GLU A 106 6.126 11.120 -0.325 1.00 0.00 O ATOM 1763 CB GLU A 106 5.404 9.148 -2.685 1.00 0.00 C ATOM 1764 CG GLU A 106 6.152 10.263 -3.396 1.00 0.00 C ATOM 1765 CD GLU A 106 5.839 10.332 -4.877 1.00 0.00 C ATOM 1766 OE1 GLU A 106 4.783 10.884 -5.248 1.00 0.00 O ATOM 1767 OE2 GLU A 106 6.649 9.824 -5.679 1.00 0.00 O ATOM 0 H GLU A 106 4.550 7.272 -1.259 1.00 0.00 H new ATOM 0 HA GLU A 106 6.952 8.854 -1.237 1.00 0.00 H new ATOM 0 HB2 GLU A 106 5.525 8.224 -3.251 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.340 9.382 -2.682 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.900 11.216 -2.932 1.00 0.00 H new ATOM 0 HG3 GLU A 106 7.224 10.117 -3.263 1.00 0.00 H new ATOM 1774 N GLN A 107 4.396 9.906 0.441 1.00 0.00 N ATOM 1775 CA GLN A 107 3.988 10.934 1.399 1.00 0.00 C ATOM 1776 C GLN A 107 4.776 10.811 2.698 1.00 0.00 C ATOM 1777 O GLN A 107 5.136 11.815 3.313 1.00 0.00 O ATOM 1778 CB GLN A 107 2.489 10.857 1.695 1.00 0.00 C ATOM 1779 CG GLN A 107 1.676 11.962 1.038 1.00 0.00 C ATOM 1780 CD GLN A 107 1.717 11.925 -0.478 1.00 0.00 C ATOM 1781 OE1 GLN A 107 1.803 10.733 -1.047 1.00 0.00 O flip ATOM 1782 NE2 GLN A 107 1.657 12.964 -1.134 1.00 0.00 N flip ATOM 0 H GLN A 107 3.804 9.075 0.427 1.00 0.00 H new ATOM 0 HA GLN A 107 4.202 11.902 0.945 1.00 0.00 H new ATOM 0 HB2 GLN A 107 2.111 9.892 1.359 1.00 0.00 H new ATOM 0 HB3 GLN A 107 2.338 10.900 2.774 1.00 0.00 H new ATOM 0 HG2 GLN A 107 0.640 11.884 1.367 1.00 0.00 H new ATOM 0 HG3 GLN A 107 2.048 12.928 1.380 1.00 0.00 H new ATOM 0 HE21 GLN A 107 1.591 13.864 -0.659 1.00 0.00 H new ATOM 0 HE22 GLN A 107 1.673 12.925 -2.153 1.00 0.00 H new ATOM 1791 N HIS A 108 5.043 9.581 3.118 1.00 0.00 N ATOM 1792 CA HIS A 108 5.789 9.354 4.346 1.00 0.00 C ATOM 1793 C HIS A 108 7.249 9.079 4.045 1.00 0.00 C ATOM 1794 O HIS A 108 7.602 7.988 3.605 1.00 0.00 O ATOM 1795 CB HIS A 108 5.197 8.192 5.146 1.00 0.00 C ATOM 1796 CG HIS A 108 3.906 8.525 5.820 1.00 0.00 C ATOM 1797 ND1 HIS A 108 3.834 8.992 7.113 1.00 0.00 N ATOM 1798 CD2 HIS A 108 2.629 8.459 5.373 1.00 0.00 C ATOM 1799 CE1 HIS A 108 2.570 9.201 7.435 1.00 0.00 C ATOM 1800 NE2 HIS A 108 1.819 8.885 6.395 1.00 0.00 N ATOM 0 H HIS A 108 4.756 8.732 2.630 1.00 0.00 H new ATOM 0 HA HIS A 108 5.716 10.261 4.947 1.00 0.00 H new ATOM 0 HB2 HIS A 108 5.040 7.345 4.478 1.00 0.00 H new ATOM 0 HB3 HIS A 108 5.919 7.875 5.899 1.00 0.00 H new ATOM 0 HD1 HIS A 108 4.633 9.152 7.727 1.00 0.00 H new ATOM 0 HD2 HIS A 108 2.308 8.132 4.395 1.00 0.00 H new ATOM 0 HE1 HIS A 108 2.212 9.567 8.386 1.00 0.00 H new ATOM 0 HE2 HIS A 108 0.802 8.948 6.358 1.00 0.00 H new ATOM 1809 N ALA A 109 8.094 10.073 4.293 1.00 0.00 N ATOM 1810 CA ALA A 109 9.529 9.941 4.068 1.00 0.00 C ATOM 1811 C ALA A 109 10.096 8.776 4.875 1.00 0.00 C ATOM 1812 O ALA A 109 11.067 8.140 4.464 1.00 0.00 O ATOM 1813 CB ALA A 109 10.245 11.234 4.425 1.00 0.00 C ATOM 0 H ALA A 109 7.808 10.984 4.652 1.00 0.00 H new ATOM 0 HA ALA A 109 9.692 9.736 3.010 1.00 0.00 H new ATOM 0 HB1 ALA A 109 11.315 11.118 4.251 1.00 0.00 H new ATOM 0 HB2 ALA A 109 9.863 12.045 3.805 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.072 11.468 5.475 1.00 0.00 H new ATOM 1819 N GLU A 110 9.470 8.507 6.018 1.00 0.00 N ATOM 1820 CA GLU A 110 9.837 7.379 6.865 1.00 0.00 C ATOM 1821 C GLU A 110 9.765 6.081 6.066 1.00 0.00 C ATOM 1822 O GLU A 110 10.721 5.305 6.009 1.00 0.00 O ATOM 1823 CB GLU A 110 8.892 7.267 8.074 1.00 0.00 C ATOM 1824 CG GLU A 110 8.535 8.592 8.738 1.00 0.00 C ATOM 1825 CD GLU A 110 7.372 9.303 8.063 1.00 0.00 C ATOM 1826 OE1 GLU A 110 7.610 10.086 7.123 1.00 0.00 O ATOM 1827 OE2 GLU A 110 6.208 9.079 8.465 1.00 0.00 O ATOM 0 H GLU A 110 8.696 9.064 6.381 1.00 0.00 H new ATOM 0 HA GLU A 110 10.854 7.546 7.220 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.972 6.779 7.753 1.00 0.00 H new ATOM 0 HB3 GLU A 110 9.354 6.618 8.818 1.00 0.00 H new ATOM 0 HG2 GLU A 110 8.286 8.412 9.784 1.00 0.00 H new ATOM 0 HG3 GLU A 110 9.408 9.244 8.726 1.00 0.00 H new ATOM 1834 N LEU A 111 8.624 5.874 5.426 1.00 0.00 N ATOM 1835 CA LEU A 111 8.366 4.647 4.690 1.00 0.00 C ATOM 1836 C LEU A 111 9.063 4.682 3.337 1.00 0.00 C ATOM 1837 O LEU A 111 9.483 3.650 2.818 1.00 0.00 O ATOM 1838 CB LEU A 111 6.858 4.449 4.507 1.00 0.00 C ATOM 1839 CG LEU A 111 6.025 4.578 5.788 1.00 0.00 C ATOM 1840 CD1 LEU A 111 4.557 4.317 5.504 1.00 0.00 C ATOM 1841 CD2 LEU A 111 6.535 3.629 6.864 1.00 0.00 C ATOM 0 H LEU A 111 7.857 6.546 5.402 1.00 0.00 H new ATOM 0 HA LEU A 111 8.763 3.808 5.261 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.497 5.179 3.782 1.00 0.00 H new ATOM 0 HB3 LEU A 111 6.686 3.462 4.078 1.00 0.00 H new ATOM 0 HG LEU A 111 6.128 5.599 6.155 1.00 0.00 H new ATOM 0 HD11 LEU A 111 3.985 4.414 6.427 1.00 0.00 H new ATOM 0 HD12 LEU A 111 4.193 5.040 4.774 1.00 0.00 H new ATOM 0 HD13 LEU A 111 4.437 3.309 5.107 1.00 0.00 H new ATOM 0 HD21 LEU A 111 5.929 3.739 7.763 1.00 0.00 H new ATOM 0 HD22 LEU A 111 6.469 2.602 6.505 1.00 0.00 H new ATOM 0 HD23 LEU A 111 7.573 3.866 7.096 1.00 0.00 H new ATOM 1853 N ARG A 112 9.190 5.881 2.777 1.00 0.00 N ATOM 1854 CA ARG A 112 9.858 6.059 1.494 1.00 0.00 C ATOM 1855 C ARG A 112 11.320 5.648 1.603 1.00 0.00 C ATOM 1856 O ARG A 112 11.849 4.955 0.734 1.00 0.00 O ATOM 1857 CB ARG A 112 9.755 7.519 1.041 1.00 0.00 C ATOM 1858 CG ARG A 112 9.824 7.697 -0.467 1.00 0.00 C ATOM 1859 CD ARG A 112 9.639 9.153 -0.867 1.00 0.00 C ATOM 1860 NE ARG A 112 9.313 9.299 -2.286 1.00 0.00 N ATOM 1861 CZ ARG A 112 9.808 10.254 -3.081 1.00 0.00 C ATOM 1862 NH1 ARG A 112 10.677 11.138 -2.612 1.00 0.00 N ATOM 1863 NH2 ARG A 112 9.417 10.336 -4.346 1.00 0.00 N ATOM 0 H ARG A 112 8.839 6.744 3.192 1.00 0.00 H new ATOM 0 HA ARG A 112 9.368 5.426 0.754 1.00 0.00 H new ATOM 0 HB2 ARG A 112 8.817 7.938 1.405 1.00 0.00 H new ATOM 0 HB3 ARG A 112 10.560 8.091 1.503 1.00 0.00 H new ATOM 0 HG2 ARG A 112 10.786 7.338 -0.833 1.00 0.00 H new ATOM 0 HG3 ARG A 112 9.055 7.088 -0.942 1.00 0.00 H new ATOM 0 HD2 ARG A 112 8.844 9.595 -0.266 1.00 0.00 H new ATOM 0 HD3 ARG A 112 10.551 9.707 -0.647 1.00 0.00 H new ATOM 0 HE ARG A 112 8.665 8.627 -2.697 1.00 0.00 H new ATOM 0 HH11 ARG A 112 10.974 11.094 -1.637 1.00 0.00 H new ATOM 0 HH12 ARG A 112 11.049 11.863 -3.226 1.00 0.00 H new ATOM 0 HH21 ARG A 112 8.738 9.670 -4.714 1.00 0.00 H new ATOM 0 HH22 ARG A 112 9.796 11.065 -4.951 1.00 0.00 H new ATOM 1877 N ALA A 113 11.962 6.069 2.688 1.00 0.00 N ATOM 1878 CA ALA A 113 13.349 5.712 2.941 1.00 0.00 C ATOM 1879 C ALA A 113 13.469 4.225 3.240 1.00 0.00 C ATOM 1880 O ALA A 113 14.441 3.584 2.852 1.00 0.00 O ATOM 1881 CB ALA A 113 13.907 6.534 4.093 1.00 0.00 C ATOM 0 H ALA A 113 11.541 6.659 3.406 1.00 0.00 H new ATOM 0 HA ALA A 113 13.932 5.932 2.046 1.00 0.00 H new ATOM 0 HB1 ALA A 113 14.946 6.255 4.270 1.00 0.00 H new ATOM 0 HB2 ALA A 113 13.854 7.594 3.843 1.00 0.00 H new ATOM 0 HB3 ALA A 113 13.322 6.343 4.993 1.00 0.00 H new ATOM 1887 N LEU A 114 12.467 3.682 3.923 1.00 0.00 N ATOM 1888 CA LEU A 114 12.440 2.263 4.250 1.00 0.00 C ATOM 1889 C LEU A 114 12.340 1.425 2.977 1.00 0.00 C ATOM 1890 O LEU A 114 13.039 0.422 2.825 1.00 0.00 O ATOM 1891 CB LEU A 114 11.263 1.966 5.185 1.00 0.00 C ATOM 1892 CG LEU A 114 11.203 0.540 5.738 1.00 0.00 C ATOM 1893 CD1 LEU A 114 12.475 0.207 6.501 1.00 0.00 C ATOM 1894 CD2 LEU A 114 9.986 0.373 6.636 1.00 0.00 C ATOM 0 H LEU A 114 11.660 4.206 4.262 1.00 0.00 H new ATOM 0 HA LEU A 114 13.367 1.999 4.759 1.00 0.00 H new ATOM 0 HB2 LEU A 114 11.304 2.661 6.024 1.00 0.00 H new ATOM 0 HB3 LEU A 114 10.336 2.168 4.649 1.00 0.00 H new ATOM 0 HG LEU A 114 11.116 -0.151 4.900 1.00 0.00 H new ATOM 0 HD11 LEU A 114 12.412 -0.811 6.886 1.00 0.00 H new ATOM 0 HD12 LEU A 114 13.332 0.290 5.833 1.00 0.00 H new ATOM 0 HD13 LEU A 114 12.594 0.903 7.332 1.00 0.00 H new ATOM 0 HD21 LEU A 114 9.956 -0.646 7.022 1.00 0.00 H new ATOM 0 HD22 LEU A 114 10.049 1.075 7.468 1.00 0.00 H new ATOM 0 HD23 LEU A 114 9.081 0.570 6.062 1.00 0.00 H new ATOM 1906 N LEU A 115 11.490 1.861 2.057 1.00 0.00 N ATOM 1907 CA LEU A 115 11.319 1.183 0.777 1.00 0.00 C ATOM 1908 C LEU A 115 12.621 1.200 -0.022 1.00 0.00 C ATOM 1909 O LEU A 115 13.007 0.202 -0.637 1.00 0.00 O ATOM 1910 CB LEU A 115 10.202 1.855 -0.026 1.00 0.00 C ATOM 1911 CG LEU A 115 9.896 1.224 -1.386 1.00 0.00 C ATOM 1912 CD1 LEU A 115 9.425 -0.211 -1.219 1.00 0.00 C ATOM 1913 CD2 LEU A 115 8.854 2.046 -2.129 1.00 0.00 C ATOM 0 H LEU A 115 10.904 2.687 2.174 1.00 0.00 H new ATOM 0 HA LEU A 115 11.047 0.145 0.970 1.00 0.00 H new ATOM 0 HB2 LEU A 115 9.291 1.845 0.573 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.469 2.900 -0.182 1.00 0.00 H new ATOM 0 HG LEU A 115 10.813 1.214 -1.975 1.00 0.00 H new ATOM 0 HD11 LEU A 115 9.213 -0.641 -2.198 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.203 -0.795 -0.728 1.00 0.00 H new ATOM 0 HD13 LEU A 115 8.520 -0.229 -0.611 1.00 0.00 H new ATOM 0 HD21 LEU A 115 8.647 1.584 -3.094 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.936 2.087 -1.542 1.00 0.00 H new ATOM 0 HD23 LEU A 115 9.231 3.057 -2.284 1.00 0.00 H new ATOM 1925 N LEU A 116 13.306 2.334 0.006 1.00 0.00 N ATOM 1926 CA LEU A 116 14.564 2.482 -0.715 1.00 0.00 C ATOM 1927 C LEU A 116 15.709 1.803 0.037 1.00 0.00 C ATOM 1928 O LEU A 116 16.784 1.582 -0.520 1.00 0.00 O ATOM 1929 CB LEU A 116 14.873 3.964 -0.950 1.00 0.00 C ATOM 1930 CG LEU A 116 13.844 4.709 -1.807 1.00 0.00 C ATOM 1931 CD1 LEU A 116 14.249 6.162 -1.997 1.00 0.00 C ATOM 1932 CD2 LEU A 116 13.672 4.022 -3.153 1.00 0.00 C ATOM 0 H LEU A 116 13.013 3.165 0.520 1.00 0.00 H new ATOM 0 HA LEU A 116 14.462 1.992 -1.683 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.948 4.462 0.017 1.00 0.00 H new ATOM 0 HB3 LEU A 116 15.849 4.045 -1.428 1.00 0.00 H new ATOM 0 HG LEU A 116 12.888 4.688 -1.284 1.00 0.00 H new ATOM 0 HD11 LEU A 116 13.504 6.671 -2.608 1.00 0.00 H new ATOM 0 HD12 LEU A 116 14.316 6.651 -1.025 1.00 0.00 H new ATOM 0 HD13 LEU A 116 15.218 6.208 -2.494 1.00 0.00 H new ATOM 0 HD21 LEU A 116 12.938 4.565 -3.748 1.00 0.00 H new ATOM 0 HD22 LEU A 116 14.626 4.008 -3.679 1.00 0.00 H new ATOM 0 HD23 LEU A 116 13.329 2.999 -2.998 1.00 0.00 H new ATOM 1944 N ALA A 117 15.468 1.467 1.297 1.00 0.00 N ATOM 1945 CA ALA A 117 16.452 0.753 2.099 1.00 0.00 C ATOM 1946 C ALA A 117 16.412 -0.739 1.791 1.00 0.00 C ATOM 1947 O ALA A 117 17.441 -1.412 1.802 1.00 0.00 O ATOM 1948 CB ALA A 117 16.217 0.997 3.584 1.00 0.00 C ATOM 0 H ALA A 117 14.598 1.678 1.786 1.00 0.00 H new ATOM 0 HA ALA A 117 17.441 1.133 1.842 1.00 0.00 H new ATOM 0 HB1 ALA A 117 16.963 0.454 4.164 1.00 0.00 H new ATOM 0 HB2 ALA A 117 16.298 2.063 3.795 1.00 0.00 H new ATOM 0 HB3 ALA A 117 15.221 0.648 3.857 1.00 0.00 H new ATOM 1954 N THR A 118 15.216 -1.250 1.508 1.00 0.00 N ATOM 1955 CA THR A 118 15.053 -2.652 1.150 1.00 0.00 C ATOM 1956 C THR A 118 15.529 -2.917 -0.277 1.00 0.00 C ATOM 1957 O THR A 118 15.652 -4.059 -0.695 1.00 0.00 O ATOM 1958 CB THR A 118 13.589 -3.114 1.306 1.00 0.00 C ATOM 1959 OG1 THR A 118 12.700 -2.195 0.655 1.00 0.00 O ATOM 1960 CG2 THR A 118 13.213 -3.234 2.776 1.00 0.00 C ATOM 0 H THR A 118 14.349 -0.713 1.520 1.00 0.00 H new ATOM 0 HA THR A 118 15.670 -3.228 1.840 1.00 0.00 H new ATOM 0 HB THR A 118 13.496 -4.094 0.838 1.00 0.00 H new ATOM 0 HG1 THR A 118 13.222 -1.519 0.174 1.00 0.00 H new ATOM 0 HG21 THR A 118 12.177 -3.561 2.861 1.00 0.00 H new ATOM 0 HG22 THR A 118 13.864 -3.962 3.260 1.00 0.00 H new ATOM 0 HG23 THR A 118 13.329 -2.265 3.261 1.00 0.00 H new ATOM 1968 N ALA A 119 15.767 -1.849 -1.026 1.00 0.00 N ATOM 1969 CA ALA A 119 16.330 -1.948 -2.370 1.00 0.00 C ATOM 1970 C ALA A 119 17.677 -2.676 -2.362 1.00 0.00 C ATOM 1971 O ALA A 119 18.530 -2.376 -1.528 1.00 0.00 O ATOM 1972 CB ALA A 119 16.515 -0.553 -2.951 1.00 0.00 C ATOM 0 H ALA A 119 15.577 -0.894 -0.723 1.00 0.00 H new ATOM 0 HA ALA A 119 15.635 -2.522 -2.983 1.00 0.00 H new ATOM 0 HB1 ALA A 119 16.935 -0.629 -3.954 1.00 0.00 H new ATOM 0 HB2 ALA A 119 15.550 -0.048 -2.999 1.00 0.00 H new ATOM 0 HB3 ALA A 119 17.192 0.019 -2.316 1.00 0.00 H new ATOM 1978 N PRO A 120 17.912 -3.628 -3.295 1.00 0.00 N ATOM 1979 CA PRO A 120 16.946 -4.116 -4.273 1.00 0.00 C ATOM 1980 C PRO A 120 16.416 -5.522 -3.948 1.00 0.00 C ATOM 1981 O PRO A 120 16.733 -6.491 -4.641 1.00 0.00 O ATOM 1982 CB PRO A 120 17.813 -4.163 -5.532 1.00 0.00 C ATOM 1983 CG PRO A 120 19.211 -4.442 -5.042 1.00 0.00 C ATOM 1984 CD PRO A 120 19.204 -4.268 -3.536 1.00 0.00 C ATOM 0 HA PRO A 120 16.050 -3.498 -4.332 1.00 0.00 H new ATOM 0 HB2 PRO A 120 17.473 -4.941 -6.215 1.00 0.00 H new ATOM 0 HB3 PRO A 120 17.768 -3.220 -6.076 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.518 -5.453 -5.311 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.924 -3.759 -5.504 1.00 0.00 H new ATOM 0 HD2 PRO A 120 19.286 -5.223 -3.017 1.00 0.00 H new ATOM 0 HD3 PRO A 120 20.033 -3.648 -3.196 1.00 0.00 H new ATOM 1992 N ALA A 121 15.627 -5.633 -2.892 1.00 0.00 N ATOM 1993 CA ALA A 121 15.070 -6.918 -2.484 1.00 0.00 C ATOM 1994 C ALA A 121 13.731 -7.204 -3.169 1.00 0.00 C ATOM 1995 O ALA A 121 13.048 -6.286 -3.628 1.00 0.00 O ATOM 1996 CB ALA A 121 14.904 -6.953 -0.971 1.00 0.00 C ATOM 0 H ALA A 121 15.356 -4.849 -2.299 1.00 0.00 H new ATOM 0 HA ALA A 121 15.768 -7.696 -2.793 1.00 0.00 H new ATOM 0 HB1 ALA A 121 14.488 -7.915 -0.673 1.00 0.00 H new ATOM 0 HB2 ALA A 121 15.875 -6.815 -0.495 1.00 0.00 H new ATOM 0 HB3 ALA A 121 14.230 -6.154 -0.660 1.00 0.00 H new ATOM 2002 N LYS A 122 13.361 -8.484 -3.229 1.00 0.00 N ATOM 2003 CA LYS A 122 12.085 -8.896 -3.785 1.00 0.00 C ATOM 2004 C LYS A 122 11.029 -8.880 -2.677 1.00 0.00 C ATOM 2005 O LYS A 122 11.032 -9.741 -1.793 1.00 0.00 O ATOM 2006 CB LYS A 122 12.219 -10.300 -4.386 1.00 0.00 C ATOM 2007 CG LYS A 122 11.099 -10.685 -5.342 1.00 0.00 C ATOM 2008 CD LYS A 122 11.254 -12.118 -5.835 1.00 0.00 C ATOM 2009 CE LYS A 122 12.620 -12.360 -6.473 1.00 0.00 C ATOM 2010 NZ LYS A 122 12.798 -11.612 -7.746 1.00 0.00 N ATOM 0 H LYS A 122 13.938 -9.255 -2.894 1.00 0.00 H new ATOM 0 HA LYS A 122 11.780 -8.209 -4.575 1.00 0.00 H new ATOM 0 HB2 LYS A 122 13.170 -10.366 -4.915 1.00 0.00 H new ATOM 0 HB3 LYS A 122 12.254 -11.027 -3.575 1.00 0.00 H new ATOM 0 HG2 LYS A 122 10.137 -10.573 -4.841 1.00 0.00 H new ATOM 0 HG3 LYS A 122 11.096 -10.004 -6.193 1.00 0.00 H new ATOM 0 HD2 LYS A 122 11.117 -12.805 -5.000 1.00 0.00 H new ATOM 0 HD3 LYS A 122 10.471 -12.338 -6.561 1.00 0.00 H new ATOM 0 HE2 LYS A 122 13.401 -12.067 -5.772 1.00 0.00 H new ATOM 0 HE3 LYS A 122 12.745 -13.426 -6.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 13.741 -11.811 -8.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 12.071 -11.909 -8.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 12.707 -10.592 -7.565 1.00 0.00 H new ATOM 2024 N LEU A 123 10.156 -7.885 -2.715 1.00 0.00 N ATOM 2025 CA LEU A 123 9.181 -7.667 -1.648 1.00 0.00 C ATOM 2026 C LEU A 123 7.974 -8.592 -1.807 1.00 0.00 C ATOM 2027 O LEU A 123 7.267 -8.538 -2.818 1.00 0.00 O ATOM 2028 CB LEU A 123 8.722 -6.203 -1.661 1.00 0.00 C ATOM 2029 CG LEU A 123 9.852 -5.167 -1.746 1.00 0.00 C ATOM 2030 CD1 LEU A 123 9.280 -3.764 -1.814 1.00 0.00 C ATOM 2031 CD2 LEU A 123 10.803 -5.291 -0.562 1.00 0.00 C ATOM 0 H LEU A 123 10.100 -7.209 -3.477 1.00 0.00 H new ATOM 0 HA LEU A 123 9.658 -7.893 -0.694 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.051 -6.056 -2.507 1.00 0.00 H new ATOM 0 HB3 LEU A 123 8.142 -6.012 -0.758 1.00 0.00 H new ATOM 0 HG LEU A 123 10.418 -5.362 -2.657 1.00 0.00 H new ATOM 0 HD11 LEU A 123 10.094 -3.042 -1.874 1.00 0.00 H new ATOM 0 HD12 LEU A 123 8.647 -3.671 -2.697 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.687 -3.569 -0.920 1.00 0.00 H new ATOM 0 HD21 LEU A 123 11.593 -4.545 -0.650 1.00 0.00 H new ATOM 0 HD22 LEU A 123 10.253 -5.130 0.365 1.00 0.00 H new ATOM 0 HD23 LEU A 123 11.245 -6.287 -0.553 1.00 0.00 H new ATOM 2043 N VAL A 124 7.744 -9.442 -0.810 1.00 0.00 N ATOM 2044 CA VAL A 124 6.628 -10.383 -0.843 1.00 0.00 C ATOM 2045 C VAL A 124 5.892 -10.404 0.498 1.00 0.00 C ATOM 2046 O VAL A 124 6.496 -10.639 1.543 1.00 0.00 O ATOM 2047 CB VAL A 124 7.100 -11.822 -1.167 1.00 0.00 C ATOM 2048 CG1 VAL A 124 5.911 -12.767 -1.271 1.00 0.00 C ATOM 2049 CG2 VAL A 124 7.923 -11.859 -2.444 1.00 0.00 C ATOM 0 H VAL A 124 8.317 -9.499 0.032 1.00 0.00 H new ATOM 0 HA VAL A 124 5.956 -10.042 -1.631 1.00 0.00 H new ATOM 0 HB VAL A 124 7.737 -12.155 -0.348 1.00 0.00 H new ATOM 0 HG11 VAL A 124 6.264 -13.773 -1.499 1.00 0.00 H new ATOM 0 HG12 VAL A 124 5.371 -12.778 -0.324 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.245 -12.428 -2.064 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.239 -12.883 -2.644 1.00 0.00 H new ATOM 0 HG22 VAL A 124 7.320 -11.497 -3.276 1.00 0.00 H new ATOM 0 HG23 VAL A 124 8.801 -11.224 -2.329 1.00 0.00 H new ATOM 2059 N GLU A 125 4.592 -10.142 0.470 1.00 0.00 N ATOM 2060 CA GLU A 125 3.768 -10.296 1.660 1.00 0.00 C ATOM 2061 C GLU A 125 3.043 -11.634 1.596 1.00 0.00 C ATOM 2062 O GLU A 125 2.529 -12.017 0.543 1.00 0.00 O ATOM 2063 CB GLU A 125 2.751 -9.153 1.794 1.00 0.00 C ATOM 2064 CG GLU A 125 1.928 -9.230 3.075 1.00 0.00 C ATOM 2065 CD GLU A 125 0.875 -8.143 3.176 1.00 0.00 C ATOM 2066 OE1 GLU A 125 -0.220 -8.318 2.607 1.00 0.00 O ATOM 2067 OE2 GLU A 125 1.134 -7.113 3.835 1.00 0.00 O ATOM 0 H GLU A 125 4.089 -9.824 -0.358 1.00 0.00 H new ATOM 0 HA GLU A 125 4.417 -10.264 2.535 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.279 -8.200 1.766 1.00 0.00 H new ATOM 0 HB3 GLU A 125 2.079 -9.171 0.936 1.00 0.00 H new ATOM 0 HG2 GLU A 125 1.442 -10.204 3.128 1.00 0.00 H new ATOM 0 HG3 GLU A 125 2.596 -9.160 3.933 1.00 0.00 H new ATOM 2074 N HIS A 126 3.000 -12.341 2.714 1.00 0.00 N ATOM 2075 CA HIS A 126 2.377 -13.652 2.757 1.00 0.00 C ATOM 2076 C HIS A 126 0.971 -13.513 3.321 1.00 0.00 C ATOM 2077 O HIS A 126 0.721 -13.806 4.488 1.00 0.00 O ATOM 2078 CB HIS A 126 3.240 -14.611 3.600 1.00 0.00 C ATOM 2079 CG HIS A 126 2.623 -15.956 3.871 1.00 0.00 C ATOM 2080 ND1 HIS A 126 2.494 -16.941 2.922 1.00 0.00 N ATOM 2081 CD2 HIS A 126 2.103 -16.469 5.011 1.00 0.00 C ATOM 2082 CE1 HIS A 126 1.923 -17.998 3.462 1.00 0.00 C ATOM 2083 NE2 HIS A 126 1.671 -17.741 4.730 1.00 0.00 N ATOM 0 H HIS A 126 3.389 -12.028 3.603 1.00 0.00 H new ATOM 0 HA HIS A 126 2.304 -14.072 1.754 1.00 0.00 H new ATOM 0 HB2 HIS A 126 4.192 -14.762 3.090 1.00 0.00 H new ATOM 0 HB3 HIS A 126 3.462 -14.132 4.554 1.00 0.00 H new ATOM 0 HD1 HIS A 126 2.794 -16.865 1.950 1.00 0.00 H new ATOM 0 HD2 HIS A 126 2.040 -15.969 5.966 1.00 0.00 H new ATOM 0 HE1 HIS A 126 1.698 -18.922 2.950 1.00 0.00 H new ATOM 0 HE2 HIS A 126 1.229 -18.380 5.391 1.00 0.00 H new ATOM 2092 N THR A 127 0.056 -13.047 2.492 1.00 0.00 N ATOM 2093 CA THR A 127 -1.279 -12.751 2.956 1.00 0.00 C ATOM 2094 C THR A 127 -2.256 -13.870 2.610 1.00 0.00 C ATOM 2095 O THR A 127 -2.809 -13.944 1.514 1.00 0.00 O ATOM 2096 CB THR A 127 -1.791 -11.386 2.428 1.00 0.00 C ATOM 2097 OG1 THR A 127 -3.142 -11.160 2.854 1.00 0.00 O ATOM 2098 CG2 THR A 127 -1.710 -11.300 0.912 1.00 0.00 C ATOM 0 H THR A 127 0.215 -12.867 1.501 1.00 0.00 H new ATOM 0 HA THR A 127 -1.222 -12.680 4.042 1.00 0.00 H new ATOM 0 HB THR A 127 -1.144 -10.614 2.845 1.00 0.00 H new ATOM 0 HG1 THR A 127 -3.451 -10.294 2.515 1.00 0.00 H new ATOM 0 HG21 THR A 127 -2.078 -10.328 0.583 1.00 0.00 H new ATOM 0 HG22 THR A 127 -0.674 -11.422 0.595 1.00 0.00 H new ATOM 0 HG23 THR A 127 -2.320 -12.088 0.470 1.00 0.00 H new ATOM 2106 N GLU A 128 -2.447 -14.759 3.568 1.00 0.00 N ATOM 2107 CA GLU A 128 -3.496 -15.759 3.480 1.00 0.00 C ATOM 2108 C GLU A 128 -4.810 -15.140 3.951 1.00 0.00 C ATOM 2109 O GLU A 128 -5.796 -15.832 4.216 1.00 0.00 O ATOM 2110 CB GLU A 128 -3.118 -17.000 4.295 1.00 0.00 C ATOM 2111 CG GLU A 128 -2.353 -16.686 5.570 1.00 0.00 C ATOM 2112 CD GLU A 128 -1.785 -17.925 6.231 1.00 0.00 C ATOM 2113 OE1 GLU A 128 -2.491 -18.548 7.046 1.00 0.00 O ATOM 2114 OE2 GLU A 128 -0.622 -18.281 5.940 1.00 0.00 O ATOM 0 H GLU A 128 -1.887 -14.809 4.419 1.00 0.00 H new ATOM 0 HA GLU A 128 -3.621 -16.085 2.447 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -4.026 -17.545 4.552 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -2.514 -17.661 3.674 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -1.540 -15.997 5.341 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -3.015 -16.177 6.270 1.00 0.00 H new ATOM 2121 N ASN A 129 -4.794 -13.812 4.039 1.00 0.00 N ATOM 2122 CA ASN A 129 -5.975 -13.023 4.338 1.00 0.00 C ATOM 2123 C ASN A 129 -6.770 -12.819 3.054 1.00 0.00 C ATOM 2124 O ASN A 129 -7.964 -13.109 2.990 1.00 0.00 O ATOM 2125 CB ASN A 129 -5.560 -11.659 4.908 1.00 0.00 C ATOM 2126 CG ASN A 129 -6.707 -10.893 5.547 1.00 0.00 C ATOM 2127 OD1 ASN A 129 -7.878 -11.109 5.236 1.00 0.00 O ATOM 2128 ND2 ASN A 129 -6.370 -9.963 6.428 1.00 0.00 N ATOM 0 H ASN A 129 -3.951 -13.254 3.903 1.00 0.00 H new ATOM 0 HA ASN A 129 -6.587 -13.544 5.075 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -4.775 -11.808 5.650 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -5.132 -11.055 4.108 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -7.092 -9.397 6.874 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -5.388 -9.813 6.661 1.00 0.00 H new ATOM 2135 N ASP A 130 -6.080 -12.343 2.026 1.00 0.00 N ATOM 2136 CA ASP A 130 -6.698 -12.092 0.732 1.00 0.00 C ATOM 2137 C ASP A 130 -5.709 -12.413 -0.384 1.00 0.00 C ATOM 2138 O ASP A 130 -4.724 -11.695 -0.580 1.00 0.00 O ATOM 2139 CB ASP A 130 -7.150 -10.632 0.635 1.00 0.00 C ATOM 2140 CG ASP A 130 -8.028 -10.371 -0.571 1.00 0.00 C ATOM 2141 OD1 ASP A 130 -7.490 -10.049 -1.650 1.00 0.00 O ATOM 2142 OD2 ASP A 130 -9.269 -10.480 -0.442 1.00 0.00 O ATOM 0 H ASP A 130 -5.085 -12.122 2.065 1.00 0.00 H new ATOM 0 HA ASP A 130 -7.573 -12.734 0.626 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -7.694 -10.364 1.540 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -6.273 -9.987 0.587 1.00 0.00 H new ATOM 2147 N ALA A 131 -5.957 -13.503 -1.099 1.00 0.00 N ATOM 2148 CA ALA A 131 -5.050 -13.941 -2.153 1.00 0.00 C ATOM 2149 C ALA A 131 -5.239 -13.116 -3.420 1.00 0.00 C ATOM 2150 O ALA A 131 -5.999 -13.492 -4.315 1.00 0.00 O ATOM 2151 CB ALA A 131 -5.237 -15.420 -2.460 1.00 0.00 C ATOM 0 H ALA A 131 -6.775 -14.098 -0.969 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.033 -13.789 -1.790 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -4.547 -15.718 -3.250 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.036 -16.006 -1.563 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -6.262 -15.597 -2.787 1.00 0.00 H new ATOM 2157 N TYR A 132 -4.553 -11.986 -3.476 1.00 0.00 N ATOM 2158 CA TYR A 132 -4.582 -11.117 -4.644 1.00 0.00 C ATOM 2159 C TYR A 132 -3.500 -10.051 -4.517 1.00 0.00 C ATOM 2160 O TYR A 132 -2.976 -9.558 -5.513 1.00 0.00 O ATOM 2161 CB TYR A 132 -5.962 -10.461 -4.805 1.00 0.00 C ATOM 2162 CG TYR A 132 -6.188 -9.834 -6.168 1.00 0.00 C ATOM 2163 CD1 TYR A 132 -6.681 -10.589 -7.227 1.00 0.00 C ATOM 2164 CD2 TYR A 132 -5.908 -8.495 -6.397 1.00 0.00 C ATOM 2165 CE1 TYR A 132 -6.884 -10.024 -8.474 1.00 0.00 C ATOM 2166 CE2 TYR A 132 -6.111 -7.923 -7.640 1.00 0.00 C ATOM 2167 CZ TYR A 132 -6.597 -8.690 -8.675 1.00 0.00 C ATOM 2168 OH TYR A 132 -6.794 -8.123 -9.918 1.00 0.00 O ATOM 0 H TYR A 132 -3.962 -11.645 -2.717 1.00 0.00 H new ATOM 0 HA TYR A 132 -4.390 -11.719 -5.532 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -6.733 -11.211 -4.628 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.081 -9.695 -4.039 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -6.909 -11.633 -7.074 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -5.525 -7.888 -5.590 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -7.265 -10.625 -9.286 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -5.889 -6.878 -7.798 1.00 0.00 H new ATOM 0 HH TYR A 132 -5.938 -7.801 -10.270 1.00 0.00 H new ATOM 2178 N TRP A 133 -3.164 -9.702 -3.284 1.00 0.00 N ATOM 2179 CA TRP A 133 -2.135 -8.705 -3.035 1.00 0.00 C ATOM 2180 C TRP A 133 -0.908 -9.350 -2.402 1.00 0.00 C ATOM 2181 O TRP A 133 -0.693 -9.250 -1.199 1.00 0.00 O ATOM 2182 CB TRP A 133 -2.677 -7.598 -2.127 1.00 0.00 C ATOM 2183 CG TRP A 133 -4.015 -7.076 -2.556 1.00 0.00 C ATOM 2184 CD1 TRP A 133 -5.198 -7.207 -1.886 1.00 0.00 C ATOM 2185 CD2 TRP A 133 -4.313 -6.363 -3.759 1.00 0.00 C ATOM 2186 NE1 TRP A 133 -6.211 -6.607 -2.593 1.00 0.00 N ATOM 2187 CE2 TRP A 133 -5.692 -6.082 -3.746 1.00 0.00 C ATOM 2188 CE3 TRP A 133 -3.545 -5.928 -4.842 1.00 0.00 C ATOM 2189 CZ2 TRP A 133 -6.320 -5.388 -4.776 1.00 0.00 C ATOM 2190 CZ3 TRP A 133 -4.169 -5.242 -5.864 1.00 0.00 C ATOM 2191 CH2 TRP A 133 -5.544 -4.977 -5.825 1.00 0.00 C ATOM 0 H TRP A 133 -3.588 -10.093 -2.443 1.00 0.00 H new ATOM 0 HA TRP A 133 -1.843 -8.266 -3.989 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -2.754 -7.979 -1.109 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -1.964 -6.774 -2.106 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -5.319 -7.710 -0.938 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -7.189 -6.560 -2.306 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -2.484 -6.125 -4.879 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -7.380 -5.182 -4.748 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -3.587 -4.904 -6.709 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -6.001 -4.437 -6.641 1.00 0.00 H new ATOM 2202 N GLY A 134 -0.116 -10.024 -3.221 1.00 0.00 N ATOM 2203 CA GLY A 134 1.058 -10.711 -2.722 1.00 0.00 C ATOM 2204 C GLY A 134 0.907 -12.211 -2.834 1.00 0.00 C ATOM 2205 O GLY A 134 0.373 -12.711 -3.823 1.00 0.00 O ATOM 0 H GLY A 134 -0.265 -10.108 -4.226 1.00 0.00 H new ATOM 0 HA2 GLY A 134 1.936 -10.389 -3.282 1.00 0.00 H new ATOM 0 HA3 GLY A 134 1.227 -10.437 -1.681 1.00 0.00 H new ATOM 2209 N ASP A 135 1.368 -12.937 -1.832 1.00 0.00 N ATOM 2210 CA ASP A 135 1.194 -14.382 -1.812 1.00 0.00 C ATOM 2211 C ASP A 135 -0.148 -14.741 -1.196 1.00 0.00 C ATOM 2212 O ASP A 135 -0.503 -14.236 -0.135 1.00 0.00 O ATOM 2213 CB ASP A 135 2.321 -15.067 -1.037 1.00 0.00 C ATOM 2214 CG ASP A 135 1.998 -16.516 -0.728 1.00 0.00 C ATOM 2215 OD1 ASP A 135 1.362 -17.187 -1.568 1.00 0.00 O ATOM 2216 OD2 ASP A 135 2.348 -16.983 0.372 1.00 0.00 O ATOM 0 H ASP A 135 1.863 -12.555 -1.026 1.00 0.00 H new ATOM 0 HA ASP A 135 1.225 -14.736 -2.842 1.00 0.00 H new ATOM 0 HB2 ASP A 135 3.243 -15.017 -1.617 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.500 -14.529 -0.106 1.00 0.00 H new ATOM 2221 N GLY A 136 -0.873 -15.634 -1.856 1.00 0.00 N ATOM 2222 CA GLY A 136 -2.180 -16.035 -1.381 1.00 0.00 C ATOM 2223 C GLY A 136 -2.115 -17.137 -0.343 1.00 0.00 C ATOM 2224 O GLY A 136 -2.996 -17.991 -0.278 1.00 0.00 O ATOM 0 H GLY A 136 -0.575 -16.090 -2.718 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -2.688 -15.170 -0.954 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -2.781 -16.373 -2.226 1.00 0.00 H new ATOM 2228 N GLY A 137 -1.057 -17.132 0.449 1.00 0.00 N ATOM 2229 CA GLY A 137 -0.940 -18.065 1.549 1.00 0.00 C ATOM 2230 C GLY A 137 -0.460 -19.448 1.141 1.00 0.00 C ATOM 2231 O GLY A 137 -0.549 -20.383 1.936 1.00 0.00 O ATOM 0 H GLY A 137 -0.269 -16.492 0.349 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -0.250 -17.656 2.287 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.910 -18.158 2.037 1.00 0.00 H new ATOM 2235 N HIS A 138 0.056 -19.595 -0.076 1.00 0.00 N ATOM 2236 CA HIS A 138 0.546 -20.903 -0.523 1.00 0.00 C ATOM 2237 C HIS A 138 1.624 -20.793 -1.610 1.00 0.00 C ATOM 2238 O HIS A 138 1.974 -21.789 -2.242 1.00 0.00 O ATOM 2239 CB HIS A 138 -0.612 -21.798 -1.005 1.00 0.00 C ATOM 2240 CG HIS A 138 -1.490 -21.179 -2.049 1.00 0.00 C ATOM 2241 ND1 HIS A 138 -2.754 -20.696 -1.968 1.00 0.00 N flip ATOM 2242 CD2 HIS A 138 -1.094 -20.988 -3.352 1.00 0.00 C flip ATOM 2243 CE1 HIS A 138 -3.091 -20.225 -3.212 1.00 0.00 C flip ATOM 2244 NE2 HIS A 138 -2.068 -20.409 -4.024 1.00 0.00 N flip ATOM 0 H HIS A 138 0.147 -18.844 -0.761 1.00 0.00 H new ATOM 0 HA HIS A 138 1.011 -21.368 0.346 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -0.196 -22.724 -1.402 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -1.227 -22.067 -0.146 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -0.134 -21.269 -3.761 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -4.037 -19.778 -3.481 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -2.036 -20.146 -5.009 1.00 0.00 H new ATOM 2253 N GLY A 139 2.147 -19.594 -1.825 1.00 0.00 N ATOM 2254 CA GLY A 139 3.275 -19.419 -2.723 1.00 0.00 C ATOM 2255 C GLY A 139 2.894 -18.948 -4.108 1.00 0.00 C ATOM 2256 O GLY A 139 3.753 -18.853 -4.986 1.00 0.00 O ATOM 0 H GLY A 139 1.810 -18.734 -1.392 1.00 0.00 H new ATOM 0 HA2 GLY A 139 3.967 -18.700 -2.284 1.00 0.00 H new ATOM 0 HA3 GLY A 139 3.809 -20.365 -2.807 1.00 0.00 H new ATOM 2260 N LYS A 140 1.623 -18.646 -4.317 1.00 0.00 N ATOM 2261 CA LYS A 140 1.187 -18.106 -5.598 1.00 0.00 C ATOM 2262 C LYS A 140 -0.225 -17.551 -5.510 1.00 0.00 C ATOM 2263 O LYS A 140 -1.201 -18.284 -5.612 1.00 0.00 O ATOM 2264 CB LYS A 140 1.253 -19.157 -6.712 1.00 0.00 C ATOM 2265 CG LYS A 140 1.002 -18.567 -8.093 1.00 0.00 C ATOM 2266 CD LYS A 140 1.068 -19.622 -9.185 1.00 0.00 C ATOM 2267 CE LYS A 140 1.060 -18.983 -10.565 1.00 0.00 C ATOM 2268 NZ LYS A 140 2.236 -18.096 -10.768 1.00 0.00 N ATOM 0 H LYS A 140 0.881 -18.763 -3.626 1.00 0.00 H new ATOM 0 HA LYS A 140 1.874 -17.297 -5.844 1.00 0.00 H new ATOM 0 HB2 LYS A 140 2.233 -19.634 -6.698 1.00 0.00 H new ATOM 0 HB3 LYS A 140 0.516 -19.936 -6.515 1.00 0.00 H new ATOM 0 HG2 LYS A 140 0.023 -18.089 -8.110 1.00 0.00 H new ATOM 0 HG3 LYS A 140 1.740 -17.790 -8.295 1.00 0.00 H new ATOM 0 HD2 LYS A 140 1.971 -20.220 -9.063 1.00 0.00 H new ATOM 0 HD3 LYS A 140 0.221 -20.301 -9.090 1.00 0.00 H new ATOM 0 HE2 LYS A 140 1.057 -19.763 -11.327 1.00 0.00 H new ATOM 0 HE3 LYS A 140 0.144 -18.407 -10.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 2.420 -17.992 -11.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 2.042 -17.162 -10.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 3.069 -18.513 -10.306 1.00 0.00 H new ATOM 2282 N GLY A 141 -0.320 -16.257 -5.326 1.00 0.00 N ATOM 2283 CA GLY A 141 -1.610 -15.600 -5.379 1.00 0.00 C ATOM 2284 C GLY A 141 -1.623 -14.494 -6.414 1.00 0.00 C ATOM 2285 O GLY A 141 -2.340 -14.590 -7.413 1.00 0.00 O ATOM 0 H GLY A 141 0.470 -15.640 -5.140 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -2.383 -16.331 -5.615 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -1.851 -15.187 -4.399 1.00 0.00 H new ATOM 2289 N LYS A 142 -0.821 -13.465 -6.183 1.00 0.00 N ATOM 2290 CA LYS A 142 -0.645 -12.380 -7.140 1.00 0.00 C ATOM 2291 C LYS A 142 0.376 -11.395 -6.586 1.00 0.00 C ATOM 2292 O LYS A 142 0.026 -10.394 -5.961 1.00 0.00 O ATOM 2293 CB LYS A 142 -1.971 -11.673 -7.435 1.00 0.00 C ATOM 2294 CG LYS A 142 -2.053 -11.067 -8.826 1.00 0.00 C ATOM 2295 CD LYS A 142 -3.426 -10.469 -9.078 1.00 0.00 C ATOM 2296 CE LYS A 142 -3.667 -10.175 -10.552 1.00 0.00 C ATOM 2297 NZ LYS A 142 -2.710 -9.177 -11.094 1.00 0.00 N ATOM 0 H LYS A 142 -0.274 -13.358 -5.329 1.00 0.00 H new ATOM 0 HA LYS A 142 -0.285 -12.794 -8.082 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -2.786 -12.386 -7.312 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -2.123 -10.885 -6.697 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -1.291 -10.296 -8.936 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -1.843 -11.832 -9.573 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -4.191 -11.157 -8.717 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -3.529 -9.548 -8.505 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -3.585 -11.100 -11.122 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -4.685 -9.808 -10.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -3.092 -8.771 -11.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -2.567 -8.419 -10.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -1.801 -9.641 -11.293 1.00 0.00 H new ATOM 2311 N ASN A 143 1.646 -11.712 -6.806 1.00 0.00 N ATOM 2312 CA ASN A 143 2.776 -10.953 -6.250 1.00 0.00 C ATOM 2313 C ASN A 143 2.863 -9.532 -6.831 1.00 0.00 C ATOM 2314 O ASN A 143 3.792 -8.784 -6.526 1.00 0.00 O ATOM 2315 CB ASN A 143 4.081 -11.721 -6.523 1.00 0.00 C ATOM 2316 CG ASN A 143 5.167 -11.504 -5.470 1.00 0.00 C ATOM 2317 OD1 ASN A 143 5.901 -12.430 -5.135 1.00 0.00 O ATOM 2318 ND2 ASN A 143 5.303 -10.283 -4.969 1.00 0.00 N ATOM 0 H ASN A 143 1.930 -12.507 -7.378 1.00 0.00 H new ATOM 0 HA ASN A 143 2.619 -10.848 -5.176 1.00 0.00 H new ATOM 0 HB2 ASN A 143 3.857 -12.786 -6.584 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.469 -11.421 -7.496 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.034 -10.091 -4.284 1.00 0.00 H new ATOM 0 HD22 ASN A 143 4.676 -9.536 -5.269 1.00 0.00 H new ATOM 2325 N ARG A 144 1.881 -9.152 -7.642 1.00 0.00 N ATOM 2326 CA ARG A 144 1.906 -7.868 -8.338 1.00 0.00 C ATOM 2327 C ARG A 144 1.900 -6.696 -7.359 1.00 0.00 C ATOM 2328 O ARG A 144 2.367 -5.610 -7.689 1.00 0.00 O ATOM 2329 CB ARG A 144 0.730 -7.763 -9.312 1.00 0.00 C ATOM 2330 CG ARG A 144 0.675 -6.447 -10.079 1.00 0.00 C ATOM 2331 CD ARG A 144 -0.325 -6.524 -11.217 1.00 0.00 C ATOM 2332 NE ARG A 144 -0.567 -5.230 -11.847 1.00 0.00 N ATOM 2333 CZ ARG A 144 -0.992 -5.091 -13.102 1.00 0.00 C ATOM 2334 NH1 ARG A 144 -1.125 -6.160 -13.881 1.00 0.00 N ATOM 2335 NH2 ARG A 144 -1.269 -3.885 -13.581 1.00 0.00 N ATOM 0 H ARG A 144 1.054 -9.717 -7.835 1.00 0.00 H new ATOM 0 HA ARG A 144 2.836 -7.817 -8.905 1.00 0.00 H new ATOM 0 HB2 ARG A 144 0.788 -8.585 -10.025 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -0.200 -7.887 -8.757 1.00 0.00 H new ATOM 0 HG2 ARG A 144 0.400 -5.638 -9.402 1.00 0.00 H new ATOM 0 HG3 ARG A 144 1.663 -6.210 -10.473 1.00 0.00 H new ATOM 0 HD2 ARG A 144 0.039 -7.226 -11.967 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -1.267 -6.921 -10.840 1.00 0.00 H new ATOM 0 HE ARG A 144 -0.402 -4.387 -11.297 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -0.902 -7.087 -13.518 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -1.450 -6.054 -14.842 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -1.157 -3.063 -12.988 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -1.594 -3.780 -14.542 1.00 0.00 H new ATOM 2349 N LEU A 145 1.392 -6.918 -6.149 1.00 0.00 N ATOM 2350 CA LEU A 145 1.433 -5.888 -5.113 1.00 0.00 C ATOM 2351 C LEU A 145 2.880 -5.482 -4.842 1.00 0.00 C ATOM 2352 O LEU A 145 3.221 -4.299 -4.865 1.00 0.00 O ATOM 2353 CB LEU A 145 0.787 -6.384 -3.817 1.00 0.00 C ATOM 2354 CG LEU A 145 0.691 -5.333 -2.707 1.00 0.00 C ATOM 2355 CD1 LEU A 145 -0.350 -4.280 -3.056 1.00 0.00 C ATOM 2356 CD2 LEU A 145 0.374 -5.982 -1.369 1.00 0.00 C ATOM 0 H LEU A 145 0.951 -7.792 -5.863 1.00 0.00 H new ATOM 0 HA LEU A 145 0.870 -5.025 -5.470 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -0.216 -6.747 -4.043 1.00 0.00 H new ATOM 0 HB3 LEU A 145 1.358 -7.235 -3.445 1.00 0.00 H new ATOM 0 HG LEU A 145 1.660 -4.842 -2.620 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -0.404 -3.542 -2.256 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -0.070 -3.786 -3.987 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -1.323 -4.756 -3.176 1.00 0.00 H new ATOM 0 HD21 LEU A 145 0.311 -5.214 -0.598 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -0.579 -6.507 -1.436 1.00 0.00 H new ATOM 0 HD23 LEU A 145 1.162 -6.690 -1.112 1.00 0.00 H new ATOM 2368 N GLY A 146 3.730 -6.478 -4.610 1.00 0.00 N ATOM 2369 CA GLY A 146 5.141 -6.227 -4.415 1.00 0.00 C ATOM 2370 C GLY A 146 5.802 -5.707 -5.674 1.00 0.00 C ATOM 2371 O GLY A 146 6.780 -4.969 -5.607 1.00 0.00 O ATOM 0 H GLY A 146 3.461 -7.460 -4.554 1.00 0.00 H new ATOM 0 HA2 GLY A 146 5.273 -5.504 -3.610 1.00 0.00 H new ATOM 0 HA3 GLY A 146 5.633 -7.147 -4.100 1.00 0.00 H new ATOM 2375 N TYR A 147 5.263 -6.089 -6.827 1.00 0.00 N ATOM 2376 CA TYR A 147 5.783 -5.613 -8.101 1.00 0.00 C ATOM 2377 C TYR A 147 5.495 -4.123 -8.268 1.00 0.00 C ATOM 2378 O TYR A 147 6.326 -3.375 -8.784 1.00 0.00 O ATOM 2379 CB TYR A 147 5.183 -6.400 -9.269 1.00 0.00 C ATOM 2380 CG TYR A 147 5.726 -5.973 -10.612 1.00 0.00 C ATOM 2381 CD1 TYR A 147 6.985 -6.383 -11.027 1.00 0.00 C ATOM 2382 CD2 TYR A 147 4.992 -5.146 -11.455 1.00 0.00 C ATOM 2383 CE1 TYR A 147 7.500 -5.982 -12.243 1.00 0.00 C ATOM 2384 CE2 TYR A 147 5.499 -4.744 -12.676 1.00 0.00 C ATOM 2385 CZ TYR A 147 6.753 -5.163 -13.064 1.00 0.00 C ATOM 2386 OH TYR A 147 7.267 -4.755 -14.274 1.00 0.00 O ATOM 0 H TYR A 147 4.469 -6.725 -6.904 1.00 0.00 H new ATOM 0 HA TYR A 147 6.862 -5.768 -8.104 1.00 0.00 H new ATOM 0 HB2 TYR A 147 5.382 -7.462 -9.124 1.00 0.00 H new ATOM 0 HB3 TYR A 147 4.100 -6.275 -9.265 1.00 0.00 H new ATOM 0 HD1 TYR A 147 7.572 -7.026 -10.388 1.00 0.00 H new ATOM 0 HD2 TYR A 147 4.011 -4.813 -11.151 1.00 0.00 H new ATOM 0 HE1 TYR A 147 8.483 -6.308 -12.550 1.00 0.00 H new ATOM 0 HE2 TYR A 147 4.916 -4.105 -13.322 1.00 0.00 H new ATOM 0 HH TYR A 147 6.615 -4.184 -14.731 1.00 0.00 H new ATOM 2396 N LEU A 148 4.315 -3.700 -7.828 1.00 0.00 N ATOM 2397 CA LEU A 148 3.965 -2.286 -7.821 1.00 0.00 C ATOM 2398 C LEU A 148 4.935 -1.527 -6.926 1.00 0.00 C ATOM 2399 O LEU A 148 5.338 -0.406 -7.234 1.00 0.00 O ATOM 2400 CB LEU A 148 2.530 -2.083 -7.325 1.00 0.00 C ATOM 2401 CG LEU A 148 1.433 -2.707 -8.194 1.00 0.00 C ATOM 2402 CD1 LEU A 148 0.074 -2.544 -7.534 1.00 0.00 C ATOM 2403 CD2 LEU A 148 1.422 -2.080 -9.578 1.00 0.00 C ATOM 0 H LEU A 148 3.585 -4.317 -7.472 1.00 0.00 H new ATOM 0 HA LEU A 148 4.032 -1.904 -8.840 1.00 0.00 H new ATOM 0 HB2 LEU A 148 2.451 -2.496 -6.319 1.00 0.00 H new ATOM 0 HB3 LEU A 148 2.340 -1.013 -7.246 1.00 0.00 H new ATOM 0 HG LEU A 148 1.646 -3.771 -8.298 1.00 0.00 H new ATOM 0 HD11 LEU A 148 -0.693 -2.993 -8.165 1.00 0.00 H new ATOM 0 HD12 LEU A 148 0.080 -3.038 -6.562 1.00 0.00 H new ATOM 0 HD13 LEU A 148 -0.141 -1.484 -7.400 1.00 0.00 H new ATOM 0 HD21 LEU A 148 0.636 -2.538 -10.178 1.00 0.00 H new ATOM 0 HD22 LEU A 148 1.236 -1.010 -9.491 1.00 0.00 H new ATOM 0 HD23 LEU A 148 2.387 -2.242 -10.059 1.00 0.00 H new ATOM 2415 N LEU A 149 5.316 -2.166 -5.823 1.00 0.00 N ATOM 2416 CA LEU A 149 6.299 -1.606 -4.908 1.00 0.00 C ATOM 2417 C LEU A 149 7.658 -1.491 -5.589 1.00 0.00 C ATOM 2418 O LEU A 149 8.382 -0.525 -5.376 1.00 0.00 O ATOM 2419 CB LEU A 149 6.415 -2.469 -3.648 1.00 0.00 C ATOM 2420 CG LEU A 149 5.147 -2.554 -2.797 1.00 0.00 C ATOM 2421 CD1 LEU A 149 5.364 -3.470 -1.602 1.00 0.00 C ATOM 2422 CD2 LEU A 149 4.719 -1.166 -2.340 1.00 0.00 C ATOM 0 H LEU A 149 4.955 -3.078 -5.543 1.00 0.00 H new ATOM 0 HA LEU A 149 5.966 -0.609 -4.619 1.00 0.00 H new ATOM 0 HB2 LEU A 149 6.703 -3.478 -3.943 1.00 0.00 H new ATOM 0 HB3 LEU A 149 7.222 -2.075 -3.030 1.00 0.00 H new ATOM 0 HG LEU A 149 4.349 -2.976 -3.408 1.00 0.00 H new ATOM 0 HD11 LEU A 149 4.451 -3.517 -1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 149 5.622 -4.470 -1.952 1.00 0.00 H new ATOM 0 HD13 LEU A 149 6.176 -3.080 -0.988 1.00 0.00 H new ATOM 0 HD21 LEU A 149 3.815 -1.244 -1.736 1.00 0.00 H new ATOM 0 HD22 LEU A 149 5.515 -0.717 -1.746 1.00 0.00 H new ATOM 0 HD23 LEU A 149 4.520 -0.541 -3.211 1.00 0.00 H new ATOM 2434 N MET A 150 7.995 -2.478 -6.414 1.00 0.00 N ATOM 2435 CA MET A 150 9.240 -2.449 -7.177 1.00 0.00 C ATOM 2436 C MET A 150 9.237 -1.271 -8.142 1.00 0.00 C ATOM 2437 O MET A 150 10.169 -0.468 -8.161 1.00 0.00 O ATOM 2438 CB MET A 150 9.435 -3.740 -7.976 1.00 0.00 C ATOM 2439 CG MET A 150 9.430 -5.007 -7.140 1.00 0.00 C ATOM 2440 SD MET A 150 9.574 -6.491 -8.154 1.00 0.00 S ATOM 2441 CE MET A 150 9.246 -7.764 -6.940 1.00 0.00 C ATOM 0 H MET A 150 7.424 -3.308 -6.572 1.00 0.00 H new ATOM 0 HA MET A 150 10.058 -2.348 -6.464 1.00 0.00 H new ATOM 0 HB2 MET A 150 8.646 -3.811 -8.725 1.00 0.00 H new ATOM 0 HB3 MET A 150 10.381 -3.679 -8.514 1.00 0.00 H new ATOM 0 HG2 MET A 150 10.255 -4.974 -6.428 1.00 0.00 H new ATOM 0 HG3 MET A 150 8.509 -5.054 -6.559 1.00 0.00 H new ATOM 0 HE1 MET A 150 9.299 -8.743 -7.416 1.00 0.00 H new ATOM 0 HE2 MET A 150 9.988 -7.707 -6.143 1.00 0.00 H new ATOM 0 HE3 MET A 150 8.251 -7.618 -6.520 1.00 0.00 H new ATOM 2451 N GLU A 151 8.169 -1.176 -8.926 1.00 0.00 N ATOM 2452 CA GLU A 151 8.026 -0.128 -9.929 1.00 0.00 C ATOM 2453 C GLU A 151 8.082 1.252 -9.272 1.00 0.00 C ATOM 2454 O GLU A 151 8.758 2.164 -9.759 1.00 0.00 O ATOM 2455 CB GLU A 151 6.695 -0.305 -10.667 1.00 0.00 C ATOM 2456 CG GLU A 151 6.628 0.415 -12.003 1.00 0.00 C ATOM 2457 CD GLU A 151 7.563 -0.193 -13.030 1.00 0.00 C ATOM 2458 OE1 GLU A 151 7.160 -1.165 -13.705 1.00 0.00 O ATOM 2459 OE2 GLU A 151 8.701 0.298 -13.169 1.00 0.00 O ATOM 0 H GLU A 151 7.380 -1.821 -8.884 1.00 0.00 H new ATOM 0 HA GLU A 151 8.848 -0.204 -10.641 1.00 0.00 H new ATOM 0 HB2 GLU A 151 6.521 -1.369 -10.830 1.00 0.00 H new ATOM 0 HB3 GLU A 151 5.888 0.057 -10.030 1.00 0.00 H new ATOM 0 HG2 GLU A 151 5.606 0.382 -12.380 1.00 0.00 H new ATOM 0 HG3 GLU A 151 6.881 1.465 -11.861 1.00 0.00 H new ATOM 2466 N LEU A 152 7.373 1.386 -8.158 1.00 0.00 N ATOM 2467 CA LEU A 152 7.344 2.630 -7.402 1.00 0.00 C ATOM 2468 C LEU A 152 8.706 2.925 -6.782 1.00 0.00 C ATOM 2469 O LEU A 152 9.156 4.069 -6.764 1.00 0.00 O ATOM 2470 CB LEU A 152 6.283 2.549 -6.303 1.00 0.00 C ATOM 2471 CG LEU A 152 6.155 3.797 -5.430 1.00 0.00 C ATOM 2472 CD1 LEU A 152 5.641 4.972 -6.248 1.00 0.00 C ATOM 2473 CD2 LEU A 152 5.245 3.524 -4.243 1.00 0.00 C ATOM 0 H LEU A 152 6.806 0.640 -7.756 1.00 0.00 H new ATOM 0 HA LEU A 152 7.095 3.439 -8.089 1.00 0.00 H new ATOM 0 HB2 LEU A 152 5.317 2.349 -6.767 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.511 1.698 -5.661 1.00 0.00 H new ATOM 0 HG LEU A 152 7.143 4.056 -5.050 1.00 0.00 H new ATOM 0 HD11 LEU A 152 5.557 5.851 -5.609 1.00 0.00 H new ATOM 0 HD12 LEU A 152 6.336 5.180 -7.062 1.00 0.00 H new ATOM 0 HD13 LEU A 152 4.662 4.728 -6.660 1.00 0.00 H new ATOM 0 HD21 LEU A 152 5.165 4.423 -3.632 1.00 0.00 H new ATOM 0 HD22 LEU A 152 4.256 3.239 -4.601 1.00 0.00 H new ATOM 0 HD23 LEU A 152 5.661 2.714 -3.644 1.00 0.00 H new ATOM 2485 N ARG A 153 9.353 1.882 -6.277 1.00 0.00 N ATOM 2486 CA ARG A 153 10.661 2.004 -5.641 1.00 0.00 C ATOM 2487 C ARG A 153 11.671 2.615 -6.610 1.00 0.00 C ATOM 2488 O ARG A 153 12.455 3.487 -6.236 1.00 0.00 O ATOM 2489 CB ARG A 153 11.140 0.628 -5.184 1.00 0.00 C ATOM 2490 CG ARG A 153 12.350 0.649 -4.268 1.00 0.00 C ATOM 2491 CD ARG A 153 12.934 -0.749 -4.106 1.00 0.00 C ATOM 2492 NE ARG A 153 14.081 -0.973 -4.994 1.00 0.00 N ATOM 2493 CZ ARG A 153 14.012 -1.117 -6.322 1.00 0.00 C ATOM 2494 NH1 ARG A 153 12.842 -1.180 -6.941 1.00 0.00 N ATOM 2495 NH2 ARG A 153 15.127 -1.212 -7.031 1.00 0.00 N ATOM 0 H ARG A 153 8.988 0.930 -6.296 1.00 0.00 H new ATOM 0 HA ARG A 153 10.572 2.660 -4.775 1.00 0.00 H new ATOM 0 HB2 ARG A 153 10.321 0.126 -4.670 1.00 0.00 H new ATOM 0 HB3 ARG A 153 11.378 0.031 -6.064 1.00 0.00 H new ATOM 0 HG2 ARG A 153 13.107 1.319 -4.675 1.00 0.00 H new ATOM 0 HG3 ARG A 153 12.066 1.044 -3.293 1.00 0.00 H new ATOM 0 HD2 ARG A 153 13.243 -0.895 -3.071 1.00 0.00 H new ATOM 0 HD3 ARG A 153 12.163 -1.490 -4.316 1.00 0.00 H new ATOM 0 HE ARG A 153 15.005 -1.023 -4.564 1.00 0.00 H new ATOM 0 HH11 ARG A 153 11.977 -1.119 -6.404 1.00 0.00 H new ATOM 0 HH12 ARG A 153 12.806 -1.290 -7.954 1.00 0.00 H new ATOM 0 HH21 ARG A 153 16.033 -1.175 -6.564 1.00 0.00 H new ATOM 0 HH22 ARG A 153 15.079 -1.322 -8.044 1.00 0.00 H new ATOM 2509 N GLU A 154 11.639 2.144 -7.856 1.00 0.00 N ATOM 2510 CA GLU A 154 12.479 2.698 -8.915 1.00 0.00 C ATOM 2511 C GLU A 154 12.217 4.195 -9.070 1.00 0.00 C ATOM 2512 O GLU A 154 13.148 4.997 -9.133 1.00 0.00 O ATOM 2513 CB GLU A 154 12.201 1.980 -10.241 1.00 0.00 C ATOM 2514 CG GLU A 154 13.368 1.151 -10.766 1.00 0.00 C ATOM 2515 CD GLU A 154 13.789 0.046 -9.820 1.00 0.00 C ATOM 2516 OE1 GLU A 154 12.982 -0.877 -9.572 1.00 0.00 O ATOM 2517 OE2 GLU A 154 14.933 0.085 -9.329 1.00 0.00 O ATOM 0 H GLU A 154 11.038 1.377 -8.157 1.00 0.00 H new ATOM 0 HA GLU A 154 13.524 2.549 -8.643 1.00 0.00 H new ATOM 0 HB2 GLU A 154 11.337 1.328 -10.113 1.00 0.00 H new ATOM 0 HB3 GLU A 154 11.932 2.722 -10.992 1.00 0.00 H new ATOM 0 HG2 GLU A 154 13.092 0.713 -11.725 1.00 0.00 H new ATOM 0 HG3 GLU A 154 14.219 1.808 -10.948 1.00 0.00 H new ATOM 2524 N GLN A 155 10.938 4.558 -9.103 1.00 0.00 N ATOM 2525 CA GLN A 155 10.528 5.950 -9.259 1.00 0.00 C ATOM 2526 C GLN A 155 11.051 6.795 -8.100 1.00 0.00 C ATOM 2527 O GLN A 155 11.707 7.813 -8.316 1.00 0.00 O ATOM 2528 CB GLN A 155 8.995 6.031 -9.345 1.00 0.00 C ATOM 2529 CG GLN A 155 8.438 7.380 -9.804 1.00 0.00 C ATOM 2530 CD GLN A 155 8.351 8.420 -8.697 1.00 0.00 C ATOM 2531 OE1 GLN A 155 9.268 9.210 -8.494 1.00 0.00 O ATOM 2532 NE2 GLN A 155 7.243 8.420 -7.973 1.00 0.00 N ATOM 0 H GLN A 155 10.162 3.901 -9.023 1.00 0.00 H new ATOM 0 HA GLN A 155 10.953 6.346 -10.181 1.00 0.00 H new ATOM 0 HB2 GLN A 155 8.644 5.259 -10.030 1.00 0.00 H new ATOM 0 HB3 GLN A 155 8.579 5.799 -8.364 1.00 0.00 H new ATOM 0 HG2 GLN A 155 9.067 7.768 -10.605 1.00 0.00 H new ATOM 0 HG3 GLN A 155 7.444 7.227 -10.225 1.00 0.00 H new ATOM 0 HE21 GLN A 155 6.503 7.747 -8.173 1.00 0.00 H new ATOM 0 HE22 GLN A 155 7.129 9.093 -7.215 1.00 0.00 H new ATOM 2541 N LEU A 156 10.793 6.343 -6.875 1.00 0.00 N ATOM 2542 CA LEU A 156 11.150 7.108 -5.685 1.00 0.00 C ATOM 2543 C LEU A 156 12.662 7.282 -5.583 1.00 0.00 C ATOM 2544 O LEU A 156 13.147 8.287 -5.057 1.00 0.00 O ATOM 2545 CB LEU A 156 10.609 6.426 -4.421 1.00 0.00 C ATOM 2546 CG LEU A 156 9.110 6.099 -4.441 1.00 0.00 C ATOM 2547 CD1 LEU A 156 8.628 5.682 -3.063 1.00 0.00 C ATOM 2548 CD2 LEU A 156 8.304 7.286 -4.937 1.00 0.00 C ATOM 0 H LEU A 156 10.338 5.451 -6.681 1.00 0.00 H new ATOM 0 HA LEU A 156 10.695 8.095 -5.771 1.00 0.00 H new ATOM 0 HB2 LEU A 156 11.163 5.501 -4.262 1.00 0.00 H new ATOM 0 HB3 LEU A 156 10.812 7.070 -3.566 1.00 0.00 H new ATOM 0 HG LEU A 156 8.961 5.266 -5.128 1.00 0.00 H new ATOM 0 HD11 LEU A 156 7.563 5.455 -3.103 1.00 0.00 H new ATOM 0 HD12 LEU A 156 9.175 4.797 -2.739 1.00 0.00 H new ATOM 0 HD13 LEU A 156 8.800 6.494 -2.356 1.00 0.00 H new ATOM 0 HD21 LEU A 156 7.245 7.030 -4.942 1.00 0.00 H new ATOM 0 HD22 LEU A 156 8.468 8.138 -4.278 1.00 0.00 H new ATOM 0 HD23 LEU A 156 8.620 7.543 -5.948 1.00 0.00 H new ATOM 2560 N ALA A 157 13.397 6.299 -6.092 1.00 0.00 N ATOM 2561 CA ALA A 157 14.848 6.378 -6.139 1.00 0.00 C ATOM 2562 C ALA A 157 15.287 7.437 -7.137 1.00 0.00 C ATOM 2563 O ALA A 157 16.114 8.287 -6.821 1.00 0.00 O ATOM 2564 CB ALA A 157 15.445 5.024 -6.499 1.00 0.00 C ATOM 0 H ALA A 157 13.009 5.438 -6.478 1.00 0.00 H new ATOM 0 HA ALA A 157 15.212 6.661 -5.151 1.00 0.00 H new ATOM 0 HB1 ALA A 157 16.532 5.102 -6.530 1.00 0.00 H new ATOM 0 HB2 ALA A 157 15.155 4.288 -5.749 1.00 0.00 H new ATOM 0 HB3 ALA A 157 15.076 4.712 -7.476 1.00 0.00 H new ATOM 2570 N ILE A 158 14.708 7.395 -8.334 1.00 0.00 N ATOM 2571 CA ILE A 158 15.035 8.354 -9.387 1.00 0.00 C ATOM 2572 C ILE A 158 14.640 9.775 -8.983 1.00 0.00 C ATOM 2573 O ILE A 158 15.369 10.726 -9.254 1.00 0.00 O ATOM 2574 CB ILE A 158 14.345 7.980 -10.721 1.00 0.00 C ATOM 2575 CG1 ILE A 158 14.835 6.612 -11.207 1.00 0.00 C ATOM 2576 CG2 ILE A 158 14.604 9.043 -11.783 1.00 0.00 C ATOM 2577 CD1 ILE A 158 14.143 6.127 -12.464 1.00 0.00 C ATOM 0 H ILE A 158 14.007 6.704 -8.600 1.00 0.00 H new ATOM 0 HA ILE A 158 16.115 8.318 -9.530 1.00 0.00 H new ATOM 0 HB ILE A 158 13.270 7.927 -10.547 1.00 0.00 H new ATOM 0 HG12 ILE A 158 15.908 6.665 -11.391 1.00 0.00 H new ATOM 0 HG13 ILE A 158 14.684 5.879 -10.414 1.00 0.00 H new ATOM 0 HG21 ILE A 158 14.109 8.758 -12.711 1.00 0.00 H new ATOM 0 HG22 ILE A 158 14.212 10.001 -11.442 1.00 0.00 H new ATOM 0 HG23 ILE A 158 15.677 9.131 -11.956 1.00 0.00 H new ATOM 0 HD11 ILE A 158 14.543 5.153 -12.747 1.00 0.00 H new ATOM 0 HD12 ILE A 158 13.072 6.040 -12.280 1.00 0.00 H new ATOM 0 HD13 ILE A 158 14.316 6.838 -13.272 1.00 0.00 H new ATOM 2589 N GLU A 159 13.496 9.904 -8.322 1.00 0.00 N ATOM 2590 CA GLU A 159 13.000 11.203 -7.869 1.00 0.00 C ATOM 2591 C GLU A 159 14.038 11.896 -6.989 1.00 0.00 C ATOM 2592 O GLU A 159 14.348 13.072 -7.181 1.00 0.00 O ATOM 2593 CB GLU A 159 11.680 11.011 -7.105 1.00 0.00 C ATOM 2594 CG GLU A 159 10.897 12.293 -6.836 1.00 0.00 C ATOM 2595 CD GLU A 159 11.475 13.134 -5.715 1.00 0.00 C ATOM 2596 OE1 GLU A 159 11.564 12.631 -4.577 1.00 0.00 O ATOM 2597 OE2 GLU A 159 11.821 14.305 -5.961 1.00 0.00 O ATOM 0 H GLU A 159 12.888 9.120 -8.085 1.00 0.00 H new ATOM 0 HA GLU A 159 12.818 11.838 -8.736 1.00 0.00 H new ATOM 0 HB2 GLU A 159 11.046 10.328 -7.671 1.00 0.00 H new ATOM 0 HB3 GLU A 159 11.896 10.529 -6.152 1.00 0.00 H new ATOM 0 HG2 GLU A 159 10.868 12.889 -7.748 1.00 0.00 H new ATOM 0 HG3 GLU A 159 9.867 12.035 -6.591 1.00 0.00 H new ATOM 2604 N LYS A 160 14.590 11.158 -6.038 1.00 0.00 N ATOM 2605 CA LYS A 160 15.581 11.717 -5.130 1.00 0.00 C ATOM 2606 C LYS A 160 16.968 11.672 -5.763 1.00 0.00 C ATOM 2607 O LYS A 160 17.893 12.358 -5.321 1.00 0.00 O ATOM 2608 CB LYS A 160 15.563 10.964 -3.797 1.00 0.00 C ATOM 2609 CG LYS A 160 16.330 11.666 -2.687 1.00 0.00 C ATOM 2610 CD LYS A 160 16.137 10.974 -1.346 1.00 0.00 C ATOM 2611 CE LYS A 160 14.673 10.959 -0.923 1.00 0.00 C ATOM 2612 NZ LYS A 160 14.103 12.329 -0.801 1.00 0.00 N ATOM 0 H LYS A 160 14.370 10.175 -5.875 1.00 0.00 H new ATOM 0 HA LYS A 160 15.331 12.760 -4.936 1.00 0.00 H new ATOM 0 HB2 LYS A 160 14.529 10.827 -3.481 1.00 0.00 H new ATOM 0 HB3 LYS A 160 15.985 9.970 -3.946 1.00 0.00 H new ATOM 0 HG2 LYS A 160 17.391 11.689 -2.936 1.00 0.00 H new ATOM 0 HG3 LYS A 160 15.998 12.702 -2.613 1.00 0.00 H new ATOM 0 HD2 LYS A 160 16.508 9.951 -1.408 1.00 0.00 H new ATOM 0 HD3 LYS A 160 16.730 11.483 -0.586 1.00 0.00 H new ATOM 0 HE2 LYS A 160 14.093 10.391 -1.650 1.00 0.00 H new ATOM 0 HE3 LYS A 160 14.579 10.443 0.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 13.167 12.277 -0.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 14.734 12.917 -0.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 14.010 12.752 -1.747 1.00 0.00 H new ATOM 2626 N LEU A 161 17.100 10.876 -6.814 1.00 0.00 N ATOM 2627 CA LEU A 161 18.339 10.803 -7.574 1.00 0.00 C ATOM 2628 C LEU A 161 18.504 12.079 -8.389 1.00 0.00 C ATOM 2629 O LEU A 161 19.607 12.425 -8.814 1.00 0.00 O ATOM 2630 CB LEU A 161 18.324 9.585 -8.501 1.00 0.00 C ATOM 2631 CG LEU A 161 19.694 9.117 -8.987 1.00 0.00 C ATOM 2632 CD1 LEU A 161 20.516 8.601 -7.818 1.00 0.00 C ATOM 2633 CD2 LEU A 161 19.540 8.040 -10.047 1.00 0.00 C ATOM 0 H LEU A 161 16.359 10.268 -7.162 1.00 0.00 H new ATOM 0 HA LEU A 161 19.177 10.700 -6.885 1.00 0.00 H new ATOM 0 HB2 LEU A 161 17.840 8.759 -7.980 1.00 0.00 H new ATOM 0 HB3 LEU A 161 17.709 9.818 -9.370 1.00 0.00 H new ATOM 0 HG LEU A 161 20.216 9.964 -9.432 1.00 0.00 H new ATOM 0 HD11 LEU A 161 21.491 8.270 -8.177 1.00 0.00 H new ATOM 0 HD12 LEU A 161 20.650 9.399 -7.087 1.00 0.00 H new ATOM 0 HD13 LEU A 161 19.998 7.764 -7.350 1.00 0.00 H new ATOM 0 HD21 LEU A 161 20.525 7.717 -10.383 1.00 0.00 H new ATOM 0 HD22 LEU A 161 19.003 7.190 -9.626 1.00 0.00 H new ATOM 0 HD23 LEU A 161 18.981 8.440 -10.893 1.00 0.00 H new ATOM 2645 N GLU A 162 17.395 12.784 -8.578 1.00 0.00 N ATOM 2646 CA GLU A 162 17.386 14.069 -9.267 1.00 0.00 C ATOM 2647 C GLU A 162 17.961 15.170 -8.379 1.00 0.00 C ATOM 2648 O GLU A 162 17.815 16.349 -8.682 1.00 0.00 O ATOM 2649 CB GLU A 162 15.965 14.451 -9.682 1.00 0.00 C ATOM 2650 CG GLU A 162 15.311 13.481 -10.650 1.00 0.00 C ATOM 2651 CD GLU A 162 13.955 13.963 -11.117 1.00 0.00 C ATOM 2652 OE1 GLU A 162 13.909 14.758 -12.080 1.00 0.00 O ATOM 2653 OE2 GLU A 162 12.931 13.570 -10.520 1.00 0.00 O ATOM 0 H GLU A 162 16.475 12.481 -8.258 1.00 0.00 H new ATOM 0 HA GLU A 162 18.007 13.967 -10.157 1.00 0.00 H new ATOM 0 HB2 GLU A 162 15.346 14.525 -8.788 1.00 0.00 H new ATOM 0 HB3 GLU A 162 15.987 15.441 -10.138 1.00 0.00 H new ATOM 0 HG2 GLU A 162 15.961 13.339 -11.513 1.00 0.00 H new ATOM 0 HG3 GLU A 162 15.203 12.509 -10.169 1.00 0.00 H new ATOM 2660 N HIS A 163 18.566 14.784 -7.262 1.00 0.00 N ATOM 2661 CA HIS A 163 19.190 15.744 -6.355 1.00 0.00 C ATOM 2662 C HIS A 163 20.266 16.579 -7.068 1.00 0.00 C ATOM 2663 O HIS A 163 21.414 16.161 -7.214 1.00 0.00 O ATOM 2664 CB HIS A 163 19.776 15.033 -5.113 1.00 0.00 C ATOM 2665 CG HIS A 163 20.931 14.105 -5.385 1.00 0.00 C ATOM 2666 ND1 HIS A 163 22.231 14.407 -5.035 1.00 0.00 N ATOM 2667 CD2 HIS A 163 20.980 12.882 -5.961 1.00 0.00 C ATOM 2668 CE1 HIS A 163 23.024 13.415 -5.386 1.00 0.00 C ATOM 2669 NE2 HIS A 163 22.291 12.476 -5.952 1.00 0.00 N ATOM 0 H HIS A 163 18.639 13.812 -6.961 1.00 0.00 H new ATOM 0 HA HIS A 163 18.412 16.429 -6.019 1.00 0.00 H new ATOM 0 HB2 HIS A 163 20.101 15.791 -4.401 1.00 0.00 H new ATOM 0 HB3 HIS A 163 18.980 14.464 -4.632 1.00 0.00 H new ATOM 0 HD1 HIS A 163 22.532 15.266 -4.575 1.00 0.00 H new ATOM 0 HD2 HIS A 163 20.142 12.327 -6.355 1.00 0.00 H new ATOM 0 HE1 HIS A 163 24.093 13.377 -5.236 1.00 0.00 H new ATOM 2678 N HIS A 164 19.879 17.753 -7.546 1.00 0.00 N ATOM 2679 CA HIS A 164 20.835 18.670 -8.152 1.00 0.00 C ATOM 2680 C HIS A 164 20.964 19.943 -7.327 1.00 0.00 C ATOM 2681 O HIS A 164 20.196 20.889 -7.488 1.00 0.00 O ATOM 2682 CB HIS A 164 20.496 18.994 -9.622 1.00 0.00 C ATOM 2683 CG HIS A 164 19.049 19.284 -9.913 1.00 0.00 C ATOM 2684 ND1 HIS A 164 18.422 20.460 -9.568 1.00 0.00 N ATOM 2685 CD2 HIS A 164 18.106 18.532 -10.528 1.00 0.00 C ATOM 2686 CE1 HIS A 164 17.161 20.415 -9.952 1.00 0.00 C ATOM 2687 NE2 HIS A 164 16.940 19.255 -10.538 1.00 0.00 N ATOM 0 H HIS A 164 18.917 18.092 -7.527 1.00 0.00 H new ATOM 0 HA HIS A 164 21.799 18.162 -8.158 1.00 0.00 H new ATOM 0 HB2 HIS A 164 21.088 19.856 -9.930 1.00 0.00 H new ATOM 0 HB3 HIS A 164 20.810 18.154 -10.241 1.00 0.00 H new ATOM 0 HD1 HIS A 164 18.864 21.245 -9.089 1.00 0.00 H new ATOM 0 HD2 HIS A 164 18.246 17.542 -10.937 1.00 0.00 H new ATOM 0 HE1 HIS A 164 16.431 21.198 -9.810 1.00 0.00 H new ATOM 2696 N HIS A 165 21.912 19.911 -6.392 1.00 0.00 N ATOM 2697 CA HIS A 165 22.280 21.072 -5.578 1.00 0.00 C ATOM 2698 C HIS A 165 21.126 21.548 -4.681 1.00 0.00 C ATOM 2699 O HIS A 165 21.200 22.623 -4.088 1.00 0.00 O ATOM 2700 CB HIS A 165 22.775 22.218 -6.475 1.00 0.00 C ATOM 2701 CG HIS A 165 23.531 23.279 -5.734 1.00 0.00 C ATOM 2702 ND1 HIS A 165 23.176 24.609 -5.747 1.00 0.00 N ATOM 2703 CD2 HIS A 165 24.633 23.196 -4.953 1.00 0.00 C ATOM 2704 CE1 HIS A 165 24.024 25.296 -5.009 1.00 0.00 C ATOM 2705 NE2 HIS A 165 24.917 24.462 -4.513 1.00 0.00 N ATOM 0 H HIS A 165 22.451 19.073 -6.175 1.00 0.00 H new ATOM 0 HA HIS A 165 23.089 20.760 -4.917 1.00 0.00 H new ATOM 0 HB2 HIS A 165 23.415 21.806 -7.256 1.00 0.00 H new ATOM 0 HB3 HIS A 165 21.919 22.674 -6.972 1.00 0.00 H new ATOM 0 HD2 HIS A 165 25.186 22.298 -4.720 1.00 0.00 H new ATOM 0 HE1 HIS A 165 23.993 26.362 -4.839 1.00 0.00 H new ATOM 0 HE2 HIS A 165 25.692 24.718 -3.902 1.00 0.00 H new ATOM 2714 N HIS A 166 20.070 20.743 -4.560 1.00 0.00 N ATOM 2715 CA HIS A 166 18.959 21.084 -3.671 1.00 0.00 C ATOM 2716 C HIS A 166 19.468 21.130 -2.233 1.00 0.00 C ATOM 2717 O HIS A 166 19.120 22.019 -1.460 1.00 0.00 O ATOM 2718 CB HIS A 166 17.813 20.071 -3.816 1.00 0.00 C ATOM 2719 CG HIS A 166 16.575 20.433 -3.045 1.00 0.00 C ATOM 2720 ND1 HIS A 166 15.597 19.520 -2.717 1.00 0.00 N ATOM 2721 CD2 HIS A 166 16.158 21.622 -2.545 1.00 0.00 C ATOM 2722 CE1 HIS A 166 14.637 20.129 -2.046 1.00 0.00 C ATOM 2723 NE2 HIS A 166 14.952 21.406 -1.928 1.00 0.00 N ATOM 0 H HIS A 166 19.960 19.861 -5.060 1.00 0.00 H new ATOM 0 HA HIS A 166 18.565 22.063 -3.944 1.00 0.00 H new ATOM 0 HB2 HIS A 166 17.557 19.977 -4.871 1.00 0.00 H new ATOM 0 HB3 HIS A 166 18.162 19.093 -3.484 1.00 0.00 H new ATOM 0 HD2 HIS A 166 16.679 22.565 -2.619 1.00 0.00 H new ATOM 0 HE1 HIS A 166 13.744 19.661 -1.659 1.00 0.00 H new ATOM 0 HE2 HIS A 166 14.391 22.115 -1.456 1.00 0.00 H new ATOM 2732 N HIS A 167 20.290 20.154 -1.892 1.00 0.00 N ATOM 2733 CA HIS A 167 21.057 20.179 -0.656 1.00 0.00 C ATOM 2734 C HIS A 167 22.459 19.688 -0.961 1.00 0.00 C ATOM 2735 O HIS A 167 23.448 20.203 -0.445 1.00 0.00 O ATOM 2736 CB HIS A 167 20.420 19.300 0.427 1.00 0.00 C ATOM 2737 CG HIS A 167 21.120 19.390 1.753 1.00 0.00 C ATOM 2738 ND1 HIS A 167 22.051 18.466 2.189 1.00 0.00 N ATOM 2739 CD2 HIS A 167 21.025 20.311 2.741 1.00 0.00 C ATOM 2740 CE1 HIS A 167 22.490 18.818 3.381 1.00 0.00 C ATOM 2741 NE2 HIS A 167 21.885 19.932 3.737 1.00 0.00 N ATOM 0 H HIS A 167 20.446 19.322 -2.462 1.00 0.00 H new ATOM 0 HA HIS A 167 21.077 21.199 -0.272 1.00 0.00 H new ATOM 0 HB2 HIS A 167 19.377 19.591 0.554 1.00 0.00 H new ATOM 0 HB3 HIS A 167 20.423 18.263 0.092 1.00 0.00 H new ATOM 0 HD2 HIS A 167 20.388 21.183 2.743 1.00 0.00 H new ATOM 0 HE1 HIS A 167 23.223 18.283 3.967 1.00 0.00 H new ATOM 0 HE2 HIS A 167 22.033 20.432 4.614 1.00 0.00 H new ATOM 2750 N HIS A 168 22.517 18.688 -1.821 1.00 0.00 N ATOM 2751 CA HIS A 168 23.770 18.123 -2.272 1.00 0.00 C ATOM 2752 C HIS A 168 23.555 17.505 -3.642 1.00 0.00 C ATOM 2753 O HIS A 168 22.726 16.578 -3.739 1.00 0.00 O ATOM 2754 CB HIS A 168 24.273 17.068 -1.283 1.00 0.00 C ATOM 2755 CG HIS A 168 25.754 16.866 -1.341 1.00 0.00 C ATOM 2756 ND1 HIS A 168 26.357 15.626 -1.313 1.00 0.00 N ATOM 2757 CD2 HIS A 168 26.758 17.769 -1.400 1.00 0.00 C ATOM 2758 CE1 HIS A 168 27.667 15.780 -1.350 1.00 0.00 C ATOM 2759 NE2 HIS A 168 27.935 17.070 -1.402 1.00 0.00 N ATOM 2760 OXT HIS A 168 24.181 17.963 -4.613 1.00 0.00 O ATOM 0 H HIS A 168 21.692 18.245 -2.226 1.00 0.00 H new ATOM 0 HA HIS A 168 24.525 18.907 -2.334 1.00 0.00 H new ATOM 0 HB2 HIS A 168 23.992 17.364 -0.272 1.00 0.00 H new ATOM 0 HB3 HIS A 168 23.775 16.120 -1.488 1.00 0.00 H new ATOM 0 HD2 HIS A 168 26.651 18.843 -1.438 1.00 0.00 H new ATOM 0 HE1 HIS A 168 28.397 14.984 -1.339 1.00 0.00 H new ATOM 0 HE2 HIS A 168 28.868 17.481 -1.438 1.00 0.00 H new TER 2769 HIS A 168