USER MOD reduce.3.24.130724 H: found=0, std=0, add=1375, rem=0, adj=45 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 18 ASN : amide:sc= -0.325 K(o=1,f=-3.5!) USER MOD Set 1.2: A 126 HIS : +bothHN:sc= 1.36 K(o=1,f=-6.1!) USER MOD Set 2.1: A 82 SER OG : rot 12:sc= 1.15 USER MOD Set 2.2: A 83 LYS NZ :NH3+ -177:sc= 0.564 (180deg=0.539) USER MOD Set 3.1: A 31 ASN :FLIP amide:sc= -0.483 F(o=-1.2,f=-0.42) USER MOD Set 3.2: A 47 SER OG : rot -145:sc= 0.0586 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 GLN :FLIP amide:sc=-0.000443 F(o=-1.2,f=-0.00044) USER MOD Single : A 9 GLN :FLIP amide:sc= -0.447 F(o=-4!,f=-0.45) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 MET CE :methyl -110:sc= -0.022 (180deg=-2.31!) USER MOD Single : A 13 GLN : amide:sc= -0.182 K(o=-0.18,f=-0.72) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 65:sc= 0.562 USER MOD Single : A 26 TYR OH : rot 150:sc= 0 USER MOD Single : A 30 SER OG : rot 140:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -158:sc= -0.0857 (180deg=-0.441) USER MOD Single : A 42 LYS NZ :NH3+ 167:sc= 0.822 (180deg=0.493) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -155:sc= 1.31 USER MOD Single : A 49 HIS : no HE2:sc= -2.88 K(o=-2.9,f=-9.4!) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= -1.62 K(o=-1.6,f=-4.6!) USER MOD Single : A 54 GLN :FLIP amide:sc= -0.0946 F(o=-1.6!,f=-0.095) USER MOD Single : A 55 LYS NZ :NH3+ -151:sc= 1.22 (180deg=1.21) USER MOD Single : A 60 LYS NZ :NH3+ 167:sc= 0.963 (180deg=0.786) USER MOD Single : A 61 TYR OH : rot -168:sc= -0.156 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 153:sc= -0.323 (180deg=-1.13) USER MOD Single : A 77 MET CE :methyl 155:sc= -0.889 (180deg=-3.37!) USER MOD Single : A 87 LYS NZ :NH3+ -149:sc= 0.873 (180deg=-0.375) USER MOD Single : A 88 ASN : amide:sc= -3.78! C(o=-3.8!,f=-11!) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -121:sc= 0.216 (180deg=-0.0723) USER MOD Single : A 95 GLN :FLIP amide:sc= -0.0198 F(o=-0.9,f=-0.02) USER MOD Single : A 97 MET CE :methyl -135:sc= 0 (180deg=-1.18) USER MOD Single : A 99 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.074) USER MOD Single : A 104 LYS NZ :NH3+ -159:sc= 0.125 (180deg=-1.25!) USER MOD Single : A 107 GLN : amide:sc= -3.21! C(o=-3.2!,f=-4!) USER MOD Single : A 108 HIS : no HE2:sc= 1.05 K(o=1,f=-5.7!) USER MOD Single : A 118 THR OG1 : rot -54:sc= 1.08 USER MOD Single : A 122 LYS NZ :NH3+ 160:sc= 0.993 (180deg=0.61) USER MOD Single : A 127 THR OG1 : rot 137:sc= 0.733 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 130:sc= -0.0122 USER MOD Single : A 138 HIS :FLIP no HE2:sc= -0.164 F(o=-1,f=-0.16) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 155:sc= 1.07 (180deg=0.478) USER MOD Single : A 143 ASN :FLIP amide:sc= -0.369 F(o=-1.4,f=-0.37) 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= -0.887 K(o=-0.89,f=-5!) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 HIS : no HD1:sc= -0.324 X(o=-0.32,f=-0.086) USER MOD Single : A 164 HIS : no HD1:sc=-0.00841 X(o=-0.0084,f=0) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 167 HIS : no HD1:sc= -0.5 X(o=-0.5,f=-0.25) USER MOD Single : A 168 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.565 10.810 15.722 1.00 0.00 N ATOM 2 CA MET A 1 6.430 9.389 16.111 1.00 0.00 C ATOM 3 C MET A 1 7.636 8.590 15.643 1.00 0.00 C ATOM 4 O MET A 1 7.850 8.421 14.441 1.00 0.00 O ATOM 5 CB MET A 1 5.157 8.778 15.514 1.00 0.00 C ATOM 6 CG MET A 1 3.872 9.260 16.165 1.00 0.00 C ATOM 7 SD MET A 1 2.405 8.503 15.432 1.00 0.00 S ATOM 8 CE MET A 1 1.119 9.097 16.529 1.00 0.00 C ATOM 0 H1 MET A 1 5.733 11.340 16.050 1.00 0.00 H new ATOM 0 H2 MET A 1 7.422 11.209 16.155 1.00 0.00 H new ATOM 0 H3 MET A 1 6.635 10.881 14.687 1.00 0.00 H new ATOM 0 HA MET A 1 6.369 9.348 17.198 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.121 9.009 14.449 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.212 7.693 15.603 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.901 9.034 17.231 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.804 10.344 16.071 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.154 8.711 16.201 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.321 8.756 17.544 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.099 10.187 16.510 1.00 0.00 H new ATOM 20 N PRO A 2 8.448 8.099 16.590 1.00 0.00 N ATOM 21 CA PRO A 2 9.617 7.280 16.278 1.00 0.00 C ATOM 22 C PRO A 2 9.222 5.906 15.738 1.00 0.00 C ATOM 23 O PRO A 2 8.966 4.973 16.500 1.00 0.00 O ATOM 24 CB PRO A 2 10.341 7.152 17.619 1.00 0.00 C ATOM 25 CG PRO A 2 9.290 7.366 18.651 1.00 0.00 C ATOM 26 CD PRO A 2 8.296 8.316 18.043 1.00 0.00 C ATOM 0 HA PRO A 2 10.235 7.726 15.499 1.00 0.00 H new ATOM 0 HB2 PRO A 2 10.803 6.171 17.725 1.00 0.00 H new ATOM 0 HB3 PRO A 2 11.137 7.891 17.709 1.00 0.00 H new ATOM 0 HG2 PRO A 2 8.813 6.424 18.923 1.00 0.00 H new ATOM 0 HG3 PRO A 2 9.718 7.781 19.563 1.00 0.00 H new ATOM 0 HD2 PRO A 2 7.281 8.101 18.376 1.00 0.00 H new ATOM 0 HD3 PRO A 2 8.509 9.349 18.318 1.00 0.00 H new ATOM 34 N VAL A 3 9.149 5.800 14.419 1.00 0.00 N ATOM 35 CA VAL A 3 8.740 4.563 13.767 1.00 0.00 C ATOM 36 C VAL A 3 9.891 3.559 13.706 1.00 0.00 C ATOM 37 O VAL A 3 9.662 2.358 13.623 1.00 0.00 O ATOM 38 CB VAL A 3 8.203 4.837 12.339 1.00 0.00 C ATOM 39 CG1 VAL A 3 9.285 5.439 11.451 1.00 0.00 C ATOM 40 CG2 VAL A 3 7.629 3.572 11.714 1.00 0.00 C ATOM 0 H VAL A 3 9.369 6.560 13.776 1.00 0.00 H new ATOM 0 HA VAL A 3 7.938 4.132 14.366 1.00 0.00 H new ATOM 0 HB VAL A 3 7.396 5.564 12.424 1.00 0.00 H new ATOM 0 HG11 VAL A 3 8.880 5.620 10.456 1.00 0.00 H new ATOM 0 HG12 VAL A 3 9.626 6.381 11.881 1.00 0.00 H new ATOM 0 HG13 VAL A 3 10.124 4.747 11.380 1.00 0.00 H new ATOM 0 HG21 VAL A 3 7.260 3.796 10.713 1.00 0.00 H new ATOM 0 HG22 VAL A 3 8.407 2.811 11.652 1.00 0.00 H new ATOM 0 HG23 VAL A 3 6.808 3.203 12.329 1.00 0.00 H new ATOM 50 N ARG A 4 11.123 4.068 13.782 1.00 0.00 N ATOM 51 CA ARG A 4 12.327 3.242 13.637 1.00 0.00 C ATOM 52 C ARG A 4 12.446 2.680 12.226 1.00 0.00 C ATOM 53 O ARG A 4 13.217 3.200 11.417 1.00 0.00 O ATOM 54 CB ARG A 4 12.360 2.107 14.665 1.00 0.00 C ATOM 55 CG ARG A 4 12.732 2.562 16.064 1.00 0.00 C ATOM 56 CD ARG A 4 12.618 1.428 17.067 1.00 0.00 C ATOM 57 NE ARG A 4 13.329 0.228 16.633 1.00 0.00 N ATOM 58 CZ ARG A 4 14.094 -0.514 17.428 1.00 0.00 C ATOM 59 NH1 ARG A 4 14.315 -0.144 18.683 1.00 0.00 N ATOM 60 NH2 ARG A 4 14.651 -1.620 16.956 1.00 0.00 N ATOM 0 H ARG A 4 11.315 5.057 13.944 1.00 0.00 H new ATOM 0 HA ARG A 4 13.183 3.891 13.822 1.00 0.00 H new ATOM 0 HB2 ARG A 4 11.381 1.628 14.696 1.00 0.00 H new ATOM 0 HB3 ARG A 4 13.074 1.352 14.336 1.00 0.00 H new ATOM 0 HG2 ARG A 4 13.752 2.947 16.063 1.00 0.00 H new ATOM 0 HG3 ARG A 4 12.081 3.383 16.366 1.00 0.00 H new ATOM 0 HD2 ARG A 4 13.015 1.755 18.028 1.00 0.00 H new ATOM 0 HD3 ARG A 4 11.566 1.188 17.222 1.00 0.00 H new ATOM 0 HE ARG A 4 13.233 -0.059 15.659 1.00 0.00 H new ATOM 0 HH11 ARG A 4 13.897 0.714 19.043 1.00 0.00 H new ATOM 0 HH12 ARG A 4 14.903 -0.718 19.288 1.00 0.00 H new ATOM 0 HH21 ARG A 4 14.492 -1.898 15.988 1.00 0.00 H new ATOM 0 HH22 ARG A 4 15.239 -2.193 17.561 1.00 0.00 H new ATOM 74 N ALA A 5 11.692 1.614 11.958 1.00 0.00 N ATOM 75 CA ALA A 5 11.634 0.966 10.641 1.00 0.00 C ATOM 76 C ALA A 5 12.908 0.174 10.333 1.00 0.00 C ATOM 77 O ALA A 5 12.848 -0.924 9.775 1.00 0.00 O ATOM 78 CB ALA A 5 11.351 1.989 9.542 1.00 0.00 C ATOM 0 H ALA A 5 11.096 1.168 12.655 1.00 0.00 H new ATOM 0 HA ALA A 5 10.810 0.253 10.670 1.00 0.00 H new ATOM 0 HB1 ALA A 5 11.313 1.485 8.576 1.00 0.00 H new ATOM 0 HB2 ALA A 5 10.395 2.476 9.735 1.00 0.00 H new ATOM 0 HB3 ALA A 5 12.143 2.738 9.529 1.00 0.00 H new ATOM 84 N GLN A 6 14.054 0.733 10.695 1.00 0.00 N ATOM 85 CA GLN A 6 15.338 0.098 10.439 1.00 0.00 C ATOM 86 C GLN A 6 15.524 -1.160 11.279 1.00 0.00 C ATOM 87 O GLN A 6 15.818 -1.086 12.470 1.00 0.00 O ATOM 88 CB GLN A 6 16.485 1.069 10.727 1.00 0.00 C ATOM 89 CG GLN A 6 16.559 2.245 9.768 1.00 0.00 C ATOM 90 CD GLN A 6 17.695 3.196 10.101 1.00 0.00 C ATOM 91 OE1 GLN A 6 18.018 3.311 11.382 1.00 0.00 O flip ATOM 92 NE2 GLN A 6 18.279 3.824 9.215 1.00 0.00 N flip ATOM 0 H GLN A 6 14.120 1.633 11.171 1.00 0.00 H new ATOM 0 HA GLN A 6 15.350 -0.184 9.386 1.00 0.00 H new ATOM 0 HB2 GLN A 6 16.378 1.449 11.743 1.00 0.00 H new ATOM 0 HB3 GLN A 6 17.427 0.523 10.688 1.00 0.00 H new ATOM 0 HG2 GLN A 6 16.687 1.873 8.751 1.00 0.00 H new ATOM 0 HG3 GLN A 6 15.615 2.789 9.792 1.00 0.00 H new ATOM 0 HE21 GLN A 6 18.001 3.709 8.240 1.00 0.00 H new ATOM 0 HE22 GLN A 6 19.040 4.459 9.457 1.00 0.00 H new ATOM 101 N ARG A 7 15.315 -2.312 10.661 1.00 0.00 N ATOM 102 CA ARG A 7 15.693 -3.581 11.269 1.00 0.00 C ATOM 103 C ARG A 7 16.873 -4.163 10.509 1.00 0.00 C ATOM 104 O ARG A 7 17.821 -4.682 11.100 1.00 0.00 O ATOM 105 CB ARG A 7 14.527 -4.570 11.281 1.00 0.00 C ATOM 106 CG ARG A 7 13.342 -4.104 12.108 1.00 0.00 C ATOM 107 CD ARG A 7 12.505 -5.279 12.583 1.00 0.00 C ATOM 108 NE ARG A 7 13.285 -6.180 13.430 1.00 0.00 N ATOM 109 CZ ARG A 7 12.928 -6.539 14.661 1.00 0.00 C ATOM 110 NH1 ARG A 7 11.743 -6.182 15.141 1.00 0.00 N ATOM 111 NH2 ARG A 7 13.745 -7.279 15.400 1.00 0.00 N ATOM 0 H ARG A 7 14.886 -2.396 9.739 1.00 0.00 H new ATOM 0 HA ARG A 7 15.973 -3.400 12.307 1.00 0.00 H new ATOM 0 HB2 ARG A 7 14.198 -4.743 10.256 1.00 0.00 H new ATOM 0 HB3 ARG A 7 14.877 -5.526 11.670 1.00 0.00 H new ATOM 0 HG2 ARG A 7 13.697 -3.536 12.968 1.00 0.00 H new ATOM 0 HG3 ARG A 7 12.724 -3.431 11.514 1.00 0.00 H new ATOM 0 HD2 ARG A 7 11.641 -4.912 13.138 1.00 0.00 H new ATOM 0 HD3 ARG A 7 12.122 -5.827 11.722 1.00 0.00 H new ATOM 0 HE ARG A 7 14.156 -6.556 13.055 1.00 0.00 H new ATOM 0 HH11 ARG A 7 11.105 -5.632 14.566 1.00 0.00 H new ATOM 0 HH12 ARG A 7 11.471 -6.458 16.085 1.00 0.00 H new ATOM 0 HH21 ARG A 7 14.647 -7.573 15.025 1.00 0.00 H new ATOM 0 HH22 ARG A 7 13.471 -7.554 16.343 1.00 0.00 H new ATOM 125 N ILE A 8 16.803 -4.066 9.190 1.00 0.00 N ATOM 126 CA ILE A 8 17.923 -4.412 8.333 1.00 0.00 C ATOM 127 C ILE A 8 18.535 -3.138 7.770 1.00 0.00 C ATOM 128 O ILE A 8 17.890 -2.086 7.756 1.00 0.00 O ATOM 129 CB ILE A 8 17.506 -5.339 7.168 1.00 0.00 C ATOM 130 CG1 ILE A 8 16.396 -4.692 6.329 1.00 0.00 C ATOM 131 CG2 ILE A 8 17.061 -6.696 7.701 1.00 0.00 C ATOM 132 CD1 ILE A 8 16.017 -5.490 5.100 1.00 0.00 C ATOM 0 H ILE A 8 15.974 -3.748 8.688 1.00 0.00 H new ATOM 0 HA ILE A 8 18.649 -4.953 8.939 1.00 0.00 H new ATOM 0 HB ILE A 8 18.371 -5.491 6.522 1.00 0.00 H new ATOM 0 HG12 ILE A 8 15.512 -4.560 6.953 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.719 -3.698 6.020 1.00 0.00 H new ATOM 0 HG21 ILE A 8 16.771 -7.337 6.868 1.00 0.00 H new ATOM 0 HG22 ILE A 8 17.883 -7.160 8.246 1.00 0.00 H new ATOM 0 HG23 ILE A 8 16.211 -6.563 8.370 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.227 -4.970 4.558 1.00 0.00 H new ATOM 0 HD12 ILE A 8 16.888 -5.600 4.454 1.00 0.00 H new ATOM 0 HD13 ILE A 8 15.662 -6.476 5.401 1.00 0.00 H new ATOM 144 N GLN A 9 19.771 -3.222 7.321 1.00 0.00 N ATOM 145 CA GLN A 9 20.453 -2.062 6.781 1.00 0.00 C ATOM 146 C GLN A 9 21.348 -2.481 5.626 1.00 0.00 C ATOM 147 O GLN A 9 22.363 -3.136 5.842 1.00 0.00 O ATOM 148 CB GLN A 9 21.281 -1.377 7.876 1.00 0.00 C ATOM 149 CG GLN A 9 21.862 -0.035 7.455 1.00 0.00 C ATOM 150 CD GLN A 9 20.856 1.106 7.497 1.00 0.00 C ATOM 151 OE1 GLN A 9 19.574 0.801 7.344 1.00 0.00 O flip ATOM 152 NE2 GLN A 9 21.231 2.261 7.687 1.00 0.00 N flip ATOM 0 H GLN A 9 20.323 -4.079 7.319 1.00 0.00 H new ATOM 0 HA GLN A 9 19.711 -1.353 6.413 1.00 0.00 H new ATOM 0 HB2 GLN A 9 20.654 -1.231 8.756 1.00 0.00 H new ATOM 0 HB3 GLN A 9 22.095 -2.039 8.171 1.00 0.00 H new ATOM 0 HG2 GLN A 9 22.702 0.208 8.106 1.00 0.00 H new ATOM 0 HG3 GLN A 9 22.258 -0.122 6.443 1.00 0.00 H new ATOM 0 HE21 GLN A 9 22.224 2.462 7.801 1.00 0.00 H new ATOM 0 HE22 GLN A 9 20.549 3.018 7.731 1.00 0.00 H new ATOM 161 N HIS A 10 20.946 -2.111 4.408 1.00 0.00 N ATOM 162 CA HIS A 10 21.684 -2.462 3.192 1.00 0.00 C ATOM 163 C HIS A 10 21.624 -3.967 2.932 1.00 0.00 C ATOM 164 O HIS A 10 22.250 -4.762 3.633 1.00 0.00 O ATOM 165 CB HIS A 10 23.143 -1.975 3.274 1.00 0.00 C ATOM 166 CG HIS A 10 24.019 -2.440 2.147 1.00 0.00 C ATOM 167 ND1 HIS A 10 24.127 -1.773 0.945 1.00 0.00 N ATOM 168 CD2 HIS A 10 24.845 -3.509 2.055 1.00 0.00 C ATOM 169 CE1 HIS A 10 24.978 -2.413 0.164 1.00 0.00 C ATOM 170 NE2 HIS A 10 25.430 -3.470 0.815 1.00 0.00 N ATOM 0 H HIS A 10 20.104 -1.562 4.237 1.00 0.00 H new ATOM 0 HA HIS A 10 21.208 -1.957 2.352 1.00 0.00 H new ATOM 0 HB2 HIS A 10 23.148 -0.885 3.296 1.00 0.00 H new ATOM 0 HB3 HIS A 10 23.574 -2.315 4.216 1.00 0.00 H new ATOM 0 HD2 HIS A 10 25.012 -4.255 2.818 1.00 0.00 H new ATOM 0 HE1 HIS A 10 25.257 -2.122 -0.838 1.00 0.00 H new ATOM 0 HE2 HIS A 10 26.103 -4.146 0.455 1.00 0.00 H new ATOM 179 N VAL A 11 20.855 -4.357 1.930 1.00 0.00 N ATOM 180 CA VAL A 11 20.771 -5.760 1.550 1.00 0.00 C ATOM 181 C VAL A 11 21.922 -6.125 0.621 1.00 0.00 C ATOM 182 O VAL A 11 22.637 -5.250 0.129 1.00 0.00 O ATOM 183 CB VAL A 11 19.426 -6.097 0.873 1.00 0.00 C ATOM 184 CG1 VAL A 11 18.266 -5.829 1.819 1.00 0.00 C ATOM 185 CG2 VAL A 11 19.263 -5.313 -0.416 1.00 0.00 C ATOM 0 H VAL A 11 20.283 -3.728 1.367 1.00 0.00 H new ATOM 0 HA VAL A 11 20.839 -6.348 2.465 1.00 0.00 H new ATOM 0 HB VAL A 11 19.424 -7.159 0.627 1.00 0.00 H new ATOM 0 HG11 VAL A 11 17.327 -6.073 1.322 1.00 0.00 H new ATOM 0 HG12 VAL A 11 18.375 -6.445 2.712 1.00 0.00 H new ATOM 0 HG13 VAL A 11 18.263 -4.777 2.102 1.00 0.00 H new ATOM 0 HG21 VAL A 11 18.308 -5.566 -0.877 1.00 0.00 H new ATOM 0 HG22 VAL A 11 19.290 -4.245 -0.198 1.00 0.00 H new ATOM 0 HG23 VAL A 11 20.074 -5.564 -1.100 1.00 0.00 H new ATOM 195 N MET A 12 22.104 -7.416 0.400 1.00 0.00 N ATOM 196 CA MET A 12 23.179 -7.900 -0.453 1.00 0.00 C ATOM 197 C MET A 12 22.820 -7.805 -1.933 1.00 0.00 C ATOM 198 O MET A 12 23.165 -6.825 -2.592 1.00 0.00 O ATOM 199 CB MET A 12 23.595 -9.330 -0.066 1.00 0.00 C ATOM 200 CG MET A 12 22.450 -10.233 0.371 1.00 0.00 C ATOM 201 SD MET A 12 21.808 -9.818 2.008 1.00 0.00 S ATOM 202 CE MET A 12 20.429 -10.951 2.133 1.00 0.00 C ATOM 0 H MET A 12 21.520 -8.150 0.800 1.00 0.00 H new ATOM 0 HA MET A 12 24.037 -7.248 -0.292 1.00 0.00 H new ATOM 0 HB2 MET A 12 24.097 -9.790 -0.917 1.00 0.00 H new ATOM 0 HB3 MET A 12 24.324 -9.275 0.742 1.00 0.00 H new ATOM 0 HG2 MET A 12 21.642 -10.165 -0.358 1.00 0.00 H new ATOM 0 HG3 MET A 12 22.791 -11.268 0.372 1.00 0.00 H new ATOM 0 HE1 MET A 12 19.494 -10.393 2.082 1.00 0.00 H new ATOM 0 HE2 MET A 12 20.470 -11.666 1.311 1.00 0.00 H new ATOM 0 HE3 MET A 12 20.482 -11.485 3.082 1.00 0.00 H new ATOM 212 N GLN A 13 22.126 -8.802 -2.450 1.00 0.00 N ATOM 213 CA GLN A 13 21.812 -8.845 -3.879 1.00 0.00 C ATOM 214 C GLN A 13 20.358 -9.189 -4.153 1.00 0.00 C ATOM 215 O GLN A 13 19.568 -8.336 -4.551 1.00 0.00 O ATOM 216 CB GLN A 13 22.718 -9.852 -4.595 1.00 0.00 C ATOM 217 CG GLN A 13 24.161 -9.397 -4.713 1.00 0.00 C ATOM 218 CD GLN A 13 24.302 -8.115 -5.511 1.00 0.00 C ATOM 219 OE1 GLN A 13 23.518 -7.842 -6.420 1.00 0.00 O ATOM 220 NE2 GLN A 13 25.300 -7.320 -5.174 1.00 0.00 N ATOM 0 H GLN A 13 21.768 -9.591 -1.912 1.00 0.00 H new ATOM 0 HA GLN A 13 21.990 -7.841 -4.265 1.00 0.00 H new ATOM 0 HB2 GLN A 13 22.688 -10.800 -4.058 1.00 0.00 H new ATOM 0 HB3 GLN A 13 22.322 -10.038 -5.593 1.00 0.00 H new ATOM 0 HG2 GLN A 13 24.574 -9.248 -3.716 1.00 0.00 H new ATOM 0 HG3 GLN A 13 24.749 -10.183 -5.187 1.00 0.00 H new ATOM 0 HE21 GLN A 13 25.928 -7.583 -4.414 1.00 0.00 H new ATOM 0 HE22 GLN A 13 25.444 -6.442 -5.673 1.00 0.00 H new ATOM 229 N ASP A 14 20.017 -10.436 -3.924 1.00 0.00 N ATOM 230 CA ASP A 14 18.722 -10.971 -4.305 1.00 0.00 C ATOM 231 C ASP A 14 18.176 -11.835 -3.185 1.00 0.00 C ATOM 232 O ASP A 14 18.422 -13.041 -3.127 1.00 0.00 O ATOM 233 CB ASP A 14 18.839 -11.785 -5.604 1.00 0.00 C ATOM 234 CG ASP A 14 17.536 -12.450 -6.017 1.00 0.00 C ATOM 235 OD1 ASP A 14 16.683 -11.774 -6.627 1.00 0.00 O ATOM 236 OD2 ASP A 14 17.370 -13.661 -5.756 1.00 0.00 O ATOM 0 H ASP A 14 20.628 -11.113 -3.467 1.00 0.00 H new ATOM 0 HA ASP A 14 18.034 -10.144 -4.482 1.00 0.00 H new ATOM 0 HB2 ASP A 14 19.174 -11.128 -6.407 1.00 0.00 H new ATOM 0 HB3 ASP A 14 19.605 -12.550 -5.477 1.00 0.00 H new ATOM 241 N THR A 15 17.496 -11.197 -2.259 1.00 0.00 N ATOM 242 CA THR A 15 16.892 -11.903 -1.149 1.00 0.00 C ATOM 243 C THR A 15 15.375 -11.734 -1.175 1.00 0.00 C ATOM 244 O THR A 15 14.859 -10.728 -1.668 1.00 0.00 O ATOM 245 CB THR A 15 17.466 -11.419 0.206 1.00 0.00 C ATOM 246 OG1 THR A 15 17.235 -12.404 1.221 1.00 0.00 O ATOM 247 CG2 THR A 15 16.855 -10.094 0.642 1.00 0.00 C ATOM 0 H THR A 15 17.347 -10.188 -2.252 1.00 0.00 H new ATOM 0 HA THR A 15 17.131 -12.961 -1.255 1.00 0.00 H new ATOM 0 HB THR A 15 18.537 -11.270 0.068 1.00 0.00 H new ATOM 0 HG1 THR A 15 17.603 -12.089 2.073 1.00 0.00 H new ATOM 0 HG21 THR A 15 17.285 -9.791 1.597 1.00 0.00 H new ATOM 0 HG22 THR A 15 17.065 -9.332 -0.109 1.00 0.00 H new ATOM 0 HG23 THR A 15 15.777 -10.209 0.751 1.00 0.00 H new ATOM 255 N ILE A 16 14.670 -12.734 -0.675 1.00 0.00 N ATOM 256 CA ILE A 16 13.220 -12.680 -0.591 1.00 0.00 C ATOM 257 C ILE A 16 12.799 -12.187 0.783 1.00 0.00 C ATOM 258 O ILE A 16 13.021 -12.867 1.787 1.00 0.00 O ATOM 259 CB ILE A 16 12.580 -14.061 -0.842 1.00 0.00 C ATOM 260 CG1 ILE A 16 12.985 -14.609 -2.212 1.00 0.00 C ATOM 261 CG2 ILE A 16 11.064 -13.969 -0.727 1.00 0.00 C ATOM 262 CD1 ILE A 16 12.418 -13.830 -3.378 1.00 0.00 C ATOM 0 H ILE A 16 15.080 -13.597 -0.319 1.00 0.00 H new ATOM 0 HA ILE A 16 12.875 -11.993 -1.364 1.00 0.00 H new ATOM 0 HB ILE A 16 12.945 -14.752 -0.082 1.00 0.00 H new ATOM 0 HG12 ILE A 16 14.073 -14.611 -2.284 1.00 0.00 H new ATOM 0 HG13 ILE A 16 12.659 -15.646 -2.288 1.00 0.00 H new ATOM 0 HG21 ILE A 16 10.625 -14.951 -0.906 1.00 0.00 H new ATOM 0 HG22 ILE A 16 10.795 -13.629 0.273 1.00 0.00 H new ATOM 0 HG23 ILE A 16 10.685 -13.262 -1.465 1.00 0.00 H new ATOM 0 HD11 ILE A 16 12.751 -14.281 -4.313 1.00 0.00 H new ATOM 0 HD12 ILE A 16 11.329 -13.849 -3.333 1.00 0.00 H new ATOM 0 HD13 ILE A 16 12.765 -12.798 -3.329 1.00 0.00 H new ATOM 274 N ILE A 17 12.206 -11.009 0.834 1.00 0.00 N ATOM 275 CA ILE A 17 11.752 -10.458 2.095 1.00 0.00 C ATOM 276 C ILE A 17 10.274 -10.762 2.303 1.00 0.00 C ATOM 277 O ILE A 17 9.407 -10.131 1.698 1.00 0.00 O ATOM 278 CB ILE A 17 12.000 -8.935 2.172 1.00 0.00 C ATOM 279 CG1 ILE A 17 13.500 -8.649 2.033 1.00 0.00 C ATOM 280 CG2 ILE A 17 11.466 -8.369 3.483 1.00 0.00 C ATOM 281 CD1 ILE A 17 13.855 -7.178 2.079 1.00 0.00 C ATOM 0 H ILE A 17 12.029 -10.419 0.021 1.00 0.00 H new ATOM 0 HA ILE A 17 12.329 -10.930 2.890 1.00 0.00 H new ATOM 0 HB ILE A 17 11.469 -8.448 1.354 1.00 0.00 H new ATOM 0 HG12 ILE A 17 14.033 -9.166 2.831 1.00 0.00 H new ATOM 0 HG13 ILE A 17 13.853 -9.068 1.091 1.00 0.00 H new ATOM 0 HG21 ILE A 17 11.650 -7.295 3.518 1.00 0.00 H new ATOM 0 HG22 ILE A 17 10.394 -8.555 3.550 1.00 0.00 H new ATOM 0 HG23 ILE A 17 11.971 -8.851 4.320 1.00 0.00 H new ATOM 0 HD11 ILE A 17 14.934 -7.061 1.974 1.00 0.00 H new ATOM 0 HD12 ILE A 17 13.352 -6.657 1.264 1.00 0.00 H new ATOM 0 HD13 ILE A 17 13.535 -6.756 3.032 1.00 0.00 H new ATOM 293 N ASN A 18 10.001 -11.760 3.137 1.00 0.00 N ATOM 294 CA ASN A 18 8.631 -12.134 3.465 1.00 0.00 C ATOM 295 C ASN A 18 8.113 -11.267 4.596 1.00 0.00 C ATOM 296 O ASN A 18 8.492 -11.449 5.754 1.00 0.00 O ATOM 297 CB ASN A 18 8.537 -13.612 3.868 1.00 0.00 C ATOM 298 CG ASN A 18 8.455 -14.552 2.679 1.00 0.00 C ATOM 299 OD1 ASN A 18 7.364 -14.885 2.212 1.00 0.00 O ATOM 300 ND2 ASN A 18 9.603 -14.994 2.190 1.00 0.00 N ATOM 0 H ASN A 18 10.713 -12.326 3.599 1.00 0.00 H new ATOM 0 HA ASN A 18 8.021 -11.981 2.575 1.00 0.00 H new ATOM 0 HB2 ASN A 18 9.407 -13.874 4.470 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.659 -13.755 4.497 1.00 0.00 H new ATOM 0 HD21 ASN A 18 9.606 -15.635 1.397 1.00 0.00 H new ATOM 0 HD22 ASN A 18 10.484 -14.693 2.606 1.00 0.00 H new ATOM 307 N PHE A 19 7.268 -10.310 4.261 1.00 0.00 N ATOM 308 CA PHE A 19 6.695 -9.427 5.261 1.00 0.00 C ATOM 309 C PHE A 19 5.213 -9.719 5.442 1.00 0.00 C ATOM 310 O PHE A 19 4.470 -9.850 4.468 1.00 0.00 O ATOM 311 CB PHE A 19 6.919 -7.954 4.891 1.00 0.00 C ATOM 312 CG PHE A 19 6.507 -7.587 3.488 1.00 0.00 C ATOM 313 CD1 PHE A 19 5.203 -7.206 3.205 1.00 0.00 C ATOM 314 CD2 PHE A 19 7.429 -7.610 2.455 1.00 0.00 C ATOM 315 CE1 PHE A 19 4.830 -6.859 1.921 1.00 0.00 C ATOM 316 CE2 PHE A 19 7.062 -7.263 1.170 1.00 0.00 C ATOM 317 CZ PHE A 19 5.762 -6.887 0.901 1.00 0.00 C ATOM 0 H PHE A 19 6.963 -10.124 3.306 1.00 0.00 H new ATOM 0 HA PHE A 19 7.201 -9.613 6.208 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.366 -7.329 5.593 1.00 0.00 H new ATOM 0 HB3 PHE A 19 7.976 -7.718 5.018 1.00 0.00 H new ATOM 0 HD1 PHE A 19 4.471 -7.180 3.998 1.00 0.00 H new ATOM 0 HD2 PHE A 19 8.449 -7.903 2.657 1.00 0.00 H new ATOM 0 HE1 PHE A 19 3.811 -6.566 1.714 1.00 0.00 H new ATOM 0 HE2 PHE A 19 7.793 -7.286 0.375 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.474 -6.615 -0.104 1.00 0.00 H new ATOM 327 N TYR A 20 4.799 -9.874 6.690 1.00 0.00 N ATOM 328 CA TYR A 20 3.397 -10.075 6.997 1.00 0.00 C ATOM 329 C TYR A 20 3.082 -9.517 8.378 1.00 0.00 C ATOM 330 O TYR A 20 3.867 -9.697 9.310 1.00 0.00 O ATOM 331 CB TYR A 20 3.038 -11.558 6.922 1.00 0.00 C ATOM 332 CG TYR A 20 1.591 -11.794 6.555 1.00 0.00 C ATOM 333 CD1 TYR A 20 1.019 -11.116 5.487 1.00 0.00 C ATOM 334 CD2 TYR A 20 0.803 -12.695 7.261 1.00 0.00 C ATOM 335 CE1 TYR A 20 -0.295 -11.325 5.132 1.00 0.00 C ATOM 336 CE2 TYR A 20 -0.517 -12.909 6.911 1.00 0.00 C ATOM 337 CZ TYR A 20 -1.060 -12.221 5.846 1.00 0.00 C ATOM 338 OH TYR A 20 -2.372 -12.435 5.491 1.00 0.00 O ATOM 0 H TYR A 20 5.415 -9.864 7.503 1.00 0.00 H new ATOM 0 HA TYR A 20 2.797 -9.543 6.259 1.00 0.00 H new ATOM 0 HB2 TYR A 20 3.678 -12.045 6.187 1.00 0.00 H new ATOM 0 HB3 TYR A 20 3.245 -12.026 7.884 1.00 0.00 H new ATOM 0 HD1 TYR A 20 1.615 -10.412 4.925 1.00 0.00 H new ATOM 0 HD2 TYR A 20 1.228 -13.235 8.094 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -0.724 -10.789 4.298 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -1.120 -13.611 7.468 1.00 0.00 H new ATOM 0 HH TYR A 20 -2.770 -13.097 6.094 1.00 0.00 H new ATOM 348 N SER A 21 1.937 -8.838 8.483 1.00 0.00 N ATOM 349 CA SER A 21 1.471 -8.240 9.737 1.00 0.00 C ATOM 350 C SER A 21 2.286 -6.998 10.101 1.00 0.00 C ATOM 351 O SER A 21 3.520 -7.022 10.107 1.00 0.00 O ATOM 352 CB SER A 21 1.504 -9.259 10.882 1.00 0.00 C ATOM 353 OG SER A 21 0.779 -10.428 10.539 1.00 0.00 O ATOM 0 H SER A 21 1.304 -8.687 7.697 1.00 0.00 H new ATOM 0 HA SER A 21 0.437 -7.931 9.584 1.00 0.00 H new ATOM 0 HB2 SER A 21 2.537 -9.521 11.112 1.00 0.00 H new ATOM 0 HB3 SER A 21 1.080 -8.814 11.782 1.00 0.00 H new ATOM 0 HG SER A 21 0.815 -11.065 11.283 1.00 0.00 H new ATOM 359 N THR A 22 1.582 -5.914 10.414 1.00 0.00 N ATOM 360 CA THR A 22 2.217 -4.645 10.750 1.00 0.00 C ATOM 361 C THR A 22 3.195 -4.790 11.915 1.00 0.00 C ATOM 362 O THR A 22 4.190 -4.067 11.988 1.00 0.00 O ATOM 363 CB THR A 22 1.163 -3.584 11.099 1.00 0.00 C ATOM 364 OG1 THR A 22 0.222 -4.124 12.037 1.00 0.00 O ATOM 365 CG2 THR A 22 0.435 -3.121 9.848 1.00 0.00 C ATOM 0 H THR A 22 0.563 -5.891 10.442 1.00 0.00 H new ATOM 0 HA THR A 22 2.776 -4.327 9.870 1.00 0.00 H new ATOM 0 HB THR A 22 1.668 -2.727 11.545 1.00 0.00 H new ATOM 0 HG1 THR A 22 -0.447 -3.443 12.258 1.00 0.00 H new ATOM 0 HG21 THR A 22 -0.308 -2.370 10.116 1.00 0.00 H new ATOM 0 HG22 THR A 22 1.151 -2.690 9.149 1.00 0.00 H new ATOM 0 HG23 THR A 22 -0.062 -3.971 9.380 1.00 0.00 H new ATOM 373 N SER A 23 2.900 -5.727 12.813 1.00 0.00 N ATOM 374 CA SER A 23 3.774 -6.041 13.939 1.00 0.00 C ATOM 375 C SER A 23 3.935 -4.845 14.881 1.00 0.00 C ATOM 376 O SER A 23 3.199 -4.727 15.862 1.00 0.00 O ATOM 377 CB SER A 23 5.136 -6.534 13.438 1.00 0.00 C ATOM 378 OG SER A 23 4.982 -7.673 12.604 1.00 0.00 O ATOM 0 H SER A 23 2.049 -6.289 12.780 1.00 0.00 H new ATOM 0 HA SER A 23 3.305 -6.841 14.512 1.00 0.00 H new ATOM 0 HB2 SER A 23 5.636 -5.738 12.886 1.00 0.00 H new ATOM 0 HB3 SER A 23 5.773 -6.782 14.287 1.00 0.00 H new ATOM 0 HG SER A 23 4.495 -7.420 11.792 1.00 0.00 H new ATOM 384 N ASP A 24 4.881 -3.961 14.583 1.00 0.00 N ATOM 385 CA ASP A 24 5.112 -2.789 15.416 1.00 0.00 C ATOM 386 C ASP A 24 5.876 -1.698 14.662 1.00 0.00 C ATOM 387 O ASP A 24 5.538 -0.521 14.787 1.00 0.00 O ATOM 388 CB ASP A 24 5.826 -3.161 16.728 1.00 0.00 C ATOM 389 CG ASP A 24 7.226 -3.712 16.546 1.00 0.00 C ATOM 390 OD1 ASP A 24 7.402 -4.676 15.770 1.00 0.00 O ATOM 391 OD2 ASP A 24 8.150 -3.208 17.220 1.00 0.00 O ATOM 0 H ASP A 24 5.498 -4.034 13.774 1.00 0.00 H new ATOM 0 HA ASP A 24 4.134 -2.383 15.674 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.877 -2.276 17.363 1.00 0.00 H new ATOM 0 HB3 ASP A 24 5.224 -3.900 17.258 1.00 0.00 H new ATOM 396 N ASP A 25 6.885 -2.064 13.868 1.00 0.00 N ATOM 397 CA ASP A 25 7.616 -1.055 13.092 1.00 0.00 C ATOM 398 C ASP A 25 7.909 -1.514 11.653 1.00 0.00 C ATOM 399 O ASP A 25 7.568 -0.819 10.700 1.00 0.00 O ATOM 400 CB ASP A 25 8.915 -0.632 13.810 1.00 0.00 C ATOM 401 CG ASP A 25 10.057 -1.624 13.675 1.00 0.00 C ATOM 402 OD1 ASP A 25 9.849 -2.821 13.967 1.00 0.00 O ATOM 403 OD2 ASP A 25 11.170 -1.207 13.297 1.00 0.00 O ATOM 0 H ASP A 25 7.209 -3.023 13.745 1.00 0.00 H new ATOM 0 HA ASP A 25 6.963 -0.185 13.020 1.00 0.00 H new ATOM 0 HB2 ASP A 25 9.238 0.331 13.414 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.700 -0.486 14.869 1.00 0.00 H new ATOM 408 N TYR A 26 8.511 -2.690 11.494 1.00 0.00 N ATOM 409 CA TYR A 26 8.944 -3.156 10.174 1.00 0.00 C ATOM 410 C TYR A 26 7.769 -3.686 9.351 1.00 0.00 C ATOM 411 O TYR A 26 7.893 -3.934 8.151 1.00 0.00 O ATOM 412 CB TYR A 26 10.014 -4.244 10.331 1.00 0.00 C ATOM 413 CG TYR A 26 10.722 -4.602 9.042 1.00 0.00 C ATOM 414 CD1 TYR A 26 11.686 -3.759 8.504 1.00 0.00 C ATOM 415 CD2 TYR A 26 10.426 -5.777 8.363 1.00 0.00 C ATOM 416 CE1 TYR A 26 12.335 -4.077 7.328 1.00 0.00 C ATOM 417 CE2 TYR A 26 11.072 -6.101 7.185 1.00 0.00 C ATOM 418 CZ TYR A 26 12.024 -5.247 6.671 1.00 0.00 C ATOM 419 OH TYR A 26 12.671 -5.565 5.500 1.00 0.00 O ATOM 0 H TYR A 26 8.711 -3.337 12.257 1.00 0.00 H new ATOM 0 HA TYR A 26 9.366 -2.306 9.638 1.00 0.00 H new ATOM 0 HB2 TYR A 26 10.753 -3.910 11.059 1.00 0.00 H new ATOM 0 HB3 TYR A 26 9.548 -5.141 10.739 1.00 0.00 H new ATOM 0 HD1 TYR A 26 11.932 -2.839 9.014 1.00 0.00 H new ATOM 0 HD2 TYR A 26 9.679 -6.448 8.762 1.00 0.00 H new ATOM 0 HE1 TYR A 26 13.084 -3.411 6.925 1.00 0.00 H new ATOM 0 HE2 TYR A 26 10.832 -7.019 6.670 1.00 0.00 H new ATOM 0 HH TYR A 26 12.729 -6.539 5.412 1.00 0.00 H new ATOM 429 N GLY A 27 6.624 -3.833 9.996 1.00 0.00 N ATOM 430 CA GLY A 27 5.457 -4.395 9.344 1.00 0.00 C ATOM 431 C GLY A 27 4.763 -3.420 8.413 1.00 0.00 C ATOM 432 O GLY A 27 3.750 -3.763 7.807 1.00 0.00 O ATOM 0 H GLY A 27 6.479 -3.570 10.971 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.755 -5.278 8.778 1.00 0.00 H new ATOM 0 HA3 GLY A 27 4.750 -4.728 10.104 1.00 0.00 H new ATOM 436 N ASP A 28 5.289 -2.200 8.320 1.00 0.00 N ATOM 437 CA ASP A 28 4.704 -1.150 7.475 1.00 0.00 C ATOM 438 C ASP A 28 4.498 -1.613 6.030 1.00 0.00 C ATOM 439 O ASP A 28 3.623 -1.105 5.324 1.00 0.00 O ATOM 440 CB ASP A 28 5.585 0.102 7.483 1.00 0.00 C ATOM 441 CG ASP A 28 5.070 1.153 6.521 1.00 0.00 C ATOM 442 OD1 ASP A 28 3.983 1.716 6.777 1.00 0.00 O ATOM 443 OD2 ASP A 28 5.716 1.390 5.480 1.00 0.00 O ATOM 0 H ASP A 28 6.127 -1.909 8.823 1.00 0.00 H new ATOM 0 HA ASP A 28 3.727 -0.918 7.898 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.620 0.516 8.491 1.00 0.00 H new ATOM 0 HB3 ASP A 28 6.606 -0.169 7.214 1.00 0.00 H new ATOM 448 N PHE A 29 5.293 -2.583 5.596 1.00 0.00 N ATOM 449 CA PHE A 29 5.182 -3.117 4.242 1.00 0.00 C ATOM 450 C PHE A 29 3.821 -3.775 4.002 1.00 0.00 C ATOM 451 O PHE A 29 3.414 -3.971 2.856 1.00 0.00 O ATOM 452 CB PHE A 29 6.305 -4.115 3.966 1.00 0.00 C ATOM 453 CG PHE A 29 7.645 -3.473 3.761 1.00 0.00 C ATOM 454 CD1 PHE A 29 7.976 -2.911 2.537 1.00 0.00 C ATOM 455 CD2 PHE A 29 8.577 -3.432 4.785 1.00 0.00 C ATOM 456 CE1 PHE A 29 9.211 -2.323 2.339 1.00 0.00 C ATOM 457 CE2 PHE A 29 9.813 -2.845 4.593 1.00 0.00 C ATOM 458 CZ PHE A 29 10.129 -2.289 3.368 1.00 0.00 C ATOM 0 H PHE A 29 6.023 -3.017 6.162 1.00 0.00 H new ATOM 0 HA PHE A 29 5.273 -2.278 3.552 1.00 0.00 H new ATOM 0 HB2 PHE A 29 6.371 -4.814 4.800 1.00 0.00 H new ATOM 0 HB3 PHE A 29 6.052 -4.698 3.080 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.260 -2.933 1.729 1.00 0.00 H new ATOM 0 HD2 PHE A 29 8.335 -3.864 5.745 1.00 0.00 H new ATOM 0 HE1 PHE A 29 9.457 -1.891 1.380 1.00 0.00 H new ATOM 0 HE2 PHE A 29 10.531 -2.821 5.399 1.00 0.00 H new ATOM 0 HZ PHE A 29 11.094 -1.828 3.216 1.00 0.00 H new ATOM 468 N SER A 30 3.122 -4.120 5.076 1.00 0.00 N ATOM 469 CA SER A 30 1.782 -4.667 4.961 1.00 0.00 C ATOM 470 C SER A 30 0.778 -3.540 4.711 1.00 0.00 C ATOM 471 O SER A 30 0.833 -2.486 5.352 1.00 0.00 O ATOM 472 CB SER A 30 1.417 -5.445 6.226 1.00 0.00 C ATOM 473 OG SER A 30 2.336 -6.504 6.448 1.00 0.00 O ATOM 0 H SER A 30 3.462 -4.030 6.033 1.00 0.00 H new ATOM 0 HA SER A 30 1.750 -5.355 4.116 1.00 0.00 H new ATOM 0 HB2 SER A 30 1.415 -4.773 7.084 1.00 0.00 H new ATOM 0 HB3 SER A 30 0.408 -5.846 6.133 1.00 0.00 H new ATOM 0 HG SER A 30 2.536 -6.568 7.405 1.00 0.00 H new ATOM 479 N ASN A 31 -0.147 -3.773 3.789 1.00 0.00 N ATOM 480 CA ASN A 31 -1.091 -2.743 3.358 1.00 0.00 C ATOM 481 C ASN A 31 -2.032 -2.333 4.480 1.00 0.00 C ATOM 482 O ASN A 31 -2.679 -1.292 4.411 1.00 0.00 O ATOM 483 CB ASN A 31 -1.912 -3.239 2.169 1.00 0.00 C ATOM 484 CG ASN A 31 -1.713 -2.384 0.936 1.00 0.00 C ATOM 485 OD1 ASN A 31 -0.748 -2.758 0.110 1.00 0.00 O flip ATOM 486 ND2 ASN A 31 -2.416 -1.395 0.732 1.00 0.00 N flip ATOM 0 H ASN A 31 -0.266 -4.671 3.321 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.505 -1.871 3.066 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -1.634 -4.269 1.943 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -2.968 -3.245 2.437 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -3.148 -1.144 1.396 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -2.266 -0.826 -0.101 1.00 0.00 H new ATOM 493 N PHE A 32 -2.090 -3.145 5.522 1.00 0.00 N ATOM 494 CA PHE A 32 -3.000 -2.892 6.625 1.00 0.00 C ATOM 495 C PHE A 32 -2.343 -2.001 7.684 1.00 0.00 C ATOM 496 O PHE A 32 -2.761 -1.980 8.844 1.00 0.00 O ATOM 497 CB PHE A 32 -3.459 -4.216 7.235 1.00 0.00 C ATOM 498 CG PHE A 32 -4.809 -4.135 7.886 1.00 0.00 C ATOM 499 CD1 PHE A 32 -5.890 -3.609 7.193 1.00 0.00 C ATOM 500 CD2 PHE A 32 -5.002 -4.591 9.178 1.00 0.00 C ATOM 501 CE1 PHE A 32 -7.137 -3.540 7.778 1.00 0.00 C ATOM 502 CE2 PHE A 32 -6.247 -4.522 9.770 1.00 0.00 C ATOM 503 CZ PHE A 32 -7.316 -3.997 9.069 1.00 0.00 C ATOM 0 H PHE A 32 -1.519 -3.983 5.627 1.00 0.00 H new ATOM 0 HA PHE A 32 -3.872 -2.362 6.243 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -3.485 -4.977 6.455 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -2.726 -4.541 7.974 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.753 -3.249 6.184 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -4.170 -5.005 9.729 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -7.971 -3.130 7.228 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.386 -4.878 10.780 1.00 0.00 H new ATOM 0 HZ PHE A 32 -8.291 -3.944 9.530 1.00 0.00 H new ATOM 513 N ALA A 33 -1.305 -1.270 7.278 1.00 0.00 N ATOM 514 CA ALA A 33 -0.701 -0.256 8.137 1.00 0.00 C ATOM 515 C ALA A 33 -1.678 0.898 8.347 1.00 0.00 C ATOM 516 O ALA A 33 -2.746 0.924 7.741 1.00 0.00 O ATOM 517 CB ALA A 33 0.603 0.248 7.532 1.00 0.00 C ATOM 0 H ALA A 33 -0.867 -1.362 6.361 1.00 0.00 H new ATOM 0 HA ALA A 33 -0.475 -0.704 9.105 1.00 0.00 H new ATOM 0 HB1 ALA A 33 1.039 1.003 8.186 1.00 0.00 H new ATOM 0 HB2 ALA A 33 1.299 -0.584 7.423 1.00 0.00 H new ATOM 0 HB3 ALA A 33 0.405 0.686 6.554 1.00 0.00 H new ATOM 523 N ALA A 34 -1.315 1.862 9.183 1.00 0.00 N ATOM 524 CA ALA A 34 -2.216 2.963 9.490 1.00 0.00 C ATOM 525 C ALA A 34 -1.498 4.306 9.449 1.00 0.00 C ATOM 526 O ALA A 34 -1.077 4.831 10.483 1.00 0.00 O ATOM 527 CB ALA A 34 -2.877 2.755 10.846 1.00 0.00 C ATOM 0 H ALA A 34 -0.412 1.904 9.656 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.989 2.977 8.721 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -3.546 3.589 11.056 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.447 1.826 10.834 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.111 2.701 11.620 1.00 0.00 H new ATOM 533 N TRP A 35 -1.339 4.843 8.251 1.00 0.00 N ATOM 534 CA TRP A 35 -0.723 6.154 8.072 1.00 0.00 C ATOM 535 C TRP A 35 -1.685 7.103 7.368 1.00 0.00 C ATOM 536 O TRP A 35 -2.361 6.716 6.416 1.00 0.00 O ATOM 537 CB TRP A 35 0.571 6.045 7.260 1.00 0.00 C ATOM 538 CG TRP A 35 1.654 5.269 7.947 1.00 0.00 C ATOM 539 CD1 TRP A 35 1.884 3.929 7.854 1.00 0.00 C ATOM 540 CD2 TRP A 35 2.656 5.787 8.833 1.00 0.00 C ATOM 541 NE1 TRP A 35 2.969 3.582 8.619 1.00 0.00 N ATOM 542 CE2 TRP A 35 3.459 4.703 9.233 1.00 0.00 C ATOM 543 CE3 TRP A 35 2.954 7.060 9.326 1.00 0.00 C ATOM 544 CZ2 TRP A 35 4.540 4.853 10.096 1.00 0.00 C ATOM 545 CZ3 TRP A 35 4.028 7.208 10.185 1.00 0.00 C ATOM 546 CH2 TRP A 35 4.807 6.109 10.564 1.00 0.00 C ATOM 0 H TRP A 35 -1.628 4.392 7.383 1.00 0.00 H new ATOM 0 HA TRP A 35 -0.486 6.548 9.060 1.00 0.00 H new ATOM 0 HB2 TRP A 35 0.350 5.572 6.303 1.00 0.00 H new ATOM 0 HB3 TRP A 35 0.938 7.048 7.043 1.00 0.00 H new ATOM 0 HD1 TRP A 35 1.298 3.240 7.264 1.00 0.00 H new ATOM 0 HE1 TRP A 35 3.349 2.640 8.715 1.00 0.00 H new ATOM 0 HE3 TRP A 35 2.356 7.913 9.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 5.146 4.007 10.386 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 4.269 8.188 10.570 1.00 0.00 H new ATOM 0 HH2 TRP A 35 5.636 6.256 11.240 1.00 0.00 H new ATOM 557 N PRO A 36 -1.767 8.358 7.836 1.00 0.00 N ATOM 558 CA PRO A 36 -2.614 9.379 7.219 1.00 0.00 C ATOM 559 C PRO A 36 -2.046 9.845 5.882 1.00 0.00 C ATOM 560 O PRO A 36 -0.988 10.478 5.831 1.00 0.00 O ATOM 561 CB PRO A 36 -2.611 10.534 8.233 1.00 0.00 C ATOM 562 CG PRO A 36 -1.932 10.006 9.458 1.00 0.00 C ATOM 563 CD PRO A 36 -1.046 8.885 9.000 1.00 0.00 C ATOM 0 HA PRO A 36 -3.614 9.002 7.004 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -2.082 11.400 7.836 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -3.627 10.857 8.459 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.349 10.787 9.946 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.663 9.652 10.185 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -0.050 9.239 8.733 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -0.918 8.128 9.774 1.00 0.00 H new ATOM 571 N ILE A 37 -2.738 9.522 4.802 1.00 0.00 N ATOM 572 CA ILE A 37 -2.286 9.897 3.477 1.00 0.00 C ATOM 573 C ILE A 37 -3.151 11.017 2.911 1.00 0.00 C ATOM 574 O ILE A 37 -4.361 10.864 2.732 1.00 0.00 O ATOM 575 CB ILE A 37 -2.266 8.687 2.513 1.00 0.00 C ATOM 576 CG1 ILE A 37 -3.612 7.950 2.530 1.00 0.00 C ATOM 577 CG2 ILE A 37 -1.133 7.742 2.886 1.00 0.00 C ATOM 578 CD1 ILE A 37 -3.673 6.755 1.599 1.00 0.00 C ATOM 0 H ILE A 37 -3.615 9.001 4.819 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.262 10.259 3.572 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.098 9.054 1.501 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -3.819 7.616 3.547 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -4.401 8.650 2.258 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.127 6.893 2.202 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.182 8.270 2.818 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.278 7.385 3.906 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -4.656 6.289 1.669 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.499 7.083 0.574 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.908 6.033 1.883 1.00 0.00 H new ATOM 590 N LYS A 38 -2.525 12.160 2.667 1.00 0.00 N ATOM 591 CA LYS A 38 -3.222 13.314 2.119 1.00 0.00 C ATOM 592 C LYS A 38 -3.351 13.171 0.604 1.00 0.00 C ATOM 593 O LYS A 38 -2.423 13.488 -0.142 1.00 0.00 O ATOM 594 CB LYS A 38 -2.461 14.596 2.471 1.00 0.00 C ATOM 595 CG LYS A 38 -3.298 15.865 2.414 1.00 0.00 C ATOM 596 CD LYS A 38 -4.397 15.850 3.462 1.00 0.00 C ATOM 597 CE LYS A 38 -4.958 17.243 3.711 1.00 0.00 C ATOM 598 NZ LYS A 38 -3.942 18.150 4.314 1.00 0.00 N ATOM 0 H LYS A 38 -1.532 12.312 2.841 1.00 0.00 H new ATOM 0 HA LYS A 38 -4.221 13.370 2.551 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.048 14.494 3.474 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.618 14.702 1.788 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -2.657 16.733 2.569 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -3.739 15.968 1.423 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.199 15.187 3.138 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.005 15.444 4.394 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -5.310 17.666 2.770 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -5.822 17.174 4.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -4.422 18.932 4.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -3.363 17.619 4.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -3.331 18.533 3.565 1.00 0.00 H new ATOM 612 N VAL A 39 -4.491 12.662 0.162 1.00 0.00 N ATOM 613 CA VAL A 39 -4.729 12.427 -1.255 1.00 0.00 C ATOM 614 C VAL A 39 -5.910 13.256 -1.736 1.00 0.00 C ATOM 615 O VAL A 39 -6.995 13.190 -1.155 1.00 0.00 O ATOM 616 CB VAL A 39 -5.014 10.935 -1.544 1.00 0.00 C ATOM 617 CG1 VAL A 39 -5.093 10.676 -3.041 1.00 0.00 C ATOM 618 CG2 VAL A 39 -3.963 10.046 -0.904 1.00 0.00 C ATOM 0 H VAL A 39 -5.270 12.402 0.767 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.825 12.720 -1.788 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.981 10.690 -1.104 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.294 9.619 -3.217 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -5.895 11.275 -3.472 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.146 10.948 -3.508 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.187 9.002 -1.123 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -2.981 10.298 -1.304 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -3.965 10.199 0.175 1.00 0.00 H new ATOM 628 N ASP A 40 -5.683 14.052 -2.779 1.00 0.00 N ATOM 629 CA ASP A 40 -6.732 14.887 -3.373 1.00 0.00 C ATOM 630 C ASP A 40 -7.236 15.907 -2.347 1.00 0.00 C ATOM 631 O ASP A 40 -8.384 16.350 -2.385 1.00 0.00 O ATOM 632 CB ASP A 40 -7.880 14.003 -3.890 1.00 0.00 C ATOM 633 CG ASP A 40 -8.861 14.757 -4.770 1.00 0.00 C ATOM 634 OD1 ASP A 40 -8.470 15.179 -5.876 1.00 0.00 O ATOM 635 OD2 ASP A 40 -10.027 14.926 -4.357 1.00 0.00 O ATOM 0 H ASP A 40 -4.775 14.138 -3.235 1.00 0.00 H new ATOM 0 HA ASP A 40 -6.319 15.435 -4.220 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -7.463 13.168 -4.453 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.415 13.578 -3.040 1.00 0.00 H new ATOM 640 N GLY A 41 -6.350 16.278 -1.427 1.00 0.00 N ATOM 641 CA GLY A 41 -6.691 17.253 -0.409 1.00 0.00 C ATOM 642 C GLY A 41 -7.435 16.634 0.756 1.00 0.00 C ATOM 643 O GLY A 41 -7.902 17.338 1.648 1.00 0.00 O ATOM 0 H GLY A 41 -5.397 15.918 -1.370 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -5.780 17.727 -0.044 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -7.304 18.038 -0.852 1.00 0.00 H new ATOM 647 N LYS A 42 -7.531 15.314 0.758 1.00 0.00 N ATOM 648 CA LYS A 42 -8.283 14.607 1.780 1.00 0.00 C ATOM 649 C LYS A 42 -7.364 13.698 2.580 1.00 0.00 C ATOM 650 O LYS A 42 -6.493 13.035 2.018 1.00 0.00 O ATOM 651 CB LYS A 42 -9.399 13.793 1.126 1.00 0.00 C ATOM 652 CG LYS A 42 -10.331 14.644 0.285 1.00 0.00 C ATOM 653 CD LYS A 42 -11.235 13.802 -0.597 1.00 0.00 C ATOM 654 CE LYS A 42 -12.126 14.682 -1.457 1.00 0.00 C ATOM 655 NZ LYS A 42 -11.336 15.683 -2.223 1.00 0.00 N ATOM 0 H LYS A 42 -7.096 14.710 0.061 1.00 0.00 H new ATOM 0 HA LYS A 42 -8.725 15.333 2.462 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -8.958 13.018 0.500 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -9.976 13.287 1.901 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -10.941 15.267 0.939 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -9.743 15.317 -0.338 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -10.630 13.157 -1.234 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -11.850 13.150 0.023 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -12.693 14.060 -2.149 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -12.849 15.196 -0.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -11.937 16.113 -2.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -10.993 16.423 -1.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -10.524 15.214 -2.673 1.00 0.00 H new ATOM 669 N THR A 43 -7.546 13.690 3.888 1.00 0.00 N ATOM 670 CA THR A 43 -6.737 12.867 4.764 1.00 0.00 C ATOM 671 C THR A 43 -7.349 11.477 4.904 1.00 0.00 C ATOM 672 O THR A 43 -8.289 11.277 5.674 1.00 0.00 O ATOM 673 CB THR A 43 -6.605 13.509 6.159 1.00 0.00 C ATOM 674 OG1 THR A 43 -6.257 14.896 6.029 1.00 0.00 O ATOM 675 CG2 THR A 43 -5.549 12.792 6.987 1.00 0.00 C ATOM 0 H THR A 43 -8.252 14.248 4.368 1.00 0.00 H new ATOM 0 HA THR A 43 -5.745 12.784 4.319 1.00 0.00 H new ATOM 0 HB THR A 43 -7.565 13.421 6.668 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.177 15.298 6.919 1.00 0.00 H new ATOM 0 HG21 THR A 43 -5.474 13.263 7.967 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.830 11.746 7.108 1.00 0.00 H new ATOM 0 HG23 THR A 43 -4.586 12.853 6.480 1.00 0.00 H new ATOM 683 N TRP A 44 -6.836 10.530 4.136 1.00 0.00 N ATOM 684 CA TRP A 44 -7.317 9.163 4.208 1.00 0.00 C ATOM 685 C TRP A 44 -6.506 8.388 5.234 1.00 0.00 C ATOM 686 O TRP A 44 -5.277 8.374 5.179 1.00 0.00 O ATOM 687 CB TRP A 44 -7.218 8.474 2.843 1.00 0.00 C ATOM 688 CG TRP A 44 -7.903 9.220 1.743 1.00 0.00 C ATOM 689 CD1 TRP A 44 -7.334 10.125 0.897 1.00 0.00 C ATOM 690 CD2 TRP A 44 -9.282 9.128 1.372 1.00 0.00 C ATOM 691 NE1 TRP A 44 -8.274 10.603 0.018 1.00 0.00 N ATOM 692 CE2 TRP A 44 -9.478 10.005 0.289 1.00 0.00 C ATOM 693 CE3 TRP A 44 -10.370 8.389 1.847 1.00 0.00 C ATOM 694 CZ2 TRP A 44 -10.717 10.166 -0.323 1.00 0.00 C ATOM 695 CZ3 TRP A 44 -11.600 8.549 1.237 1.00 0.00 C ATOM 696 CH2 TRP A 44 -11.764 9.430 0.162 1.00 0.00 C ATOM 0 H TRP A 44 -6.089 10.683 3.458 1.00 0.00 H new ATOM 0 HA TRP A 44 -8.365 9.183 4.507 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -6.167 8.348 2.585 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -7.650 7.476 2.917 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.296 10.422 0.916 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -8.105 11.290 -0.716 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -10.251 7.706 2.675 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -10.848 10.847 -1.151 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -12.448 7.985 1.596 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -12.737 9.531 -0.295 1.00 0.00 H new ATOM 707 N PRO A 45 -7.178 7.754 6.202 1.00 0.00 N ATOM 708 CA PRO A 45 -6.518 6.941 7.226 1.00 0.00 C ATOM 709 C PRO A 45 -5.982 5.620 6.667 1.00 0.00 C ATOM 710 O PRO A 45 -6.433 4.550 7.069 1.00 0.00 O ATOM 711 CB PRO A 45 -7.624 6.681 8.262 1.00 0.00 C ATOM 712 CG PRO A 45 -8.755 7.582 7.881 1.00 0.00 C ATOM 713 CD PRO A 45 -8.629 7.807 6.405 1.00 0.00 C ATOM 0 HA PRO A 45 -5.647 7.448 7.641 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -7.934 5.636 8.250 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.274 6.897 9.271 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -9.715 7.127 8.125 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -8.702 8.525 8.425 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -9.148 7.039 5.831 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -9.047 8.767 6.103 1.00 0.00 H new ATOM 721 N THR A 46 -5.060 5.725 5.708 1.00 0.00 N ATOM 722 CA THR A 46 -4.315 4.593 5.150 1.00 0.00 C ATOM 723 C THR A 46 -5.001 4.037 3.902 1.00 0.00 C ATOM 724 O THR A 46 -6.169 4.348 3.631 1.00 0.00 O ATOM 725 CB THR A 46 -4.038 3.472 6.195 1.00 0.00 C ATOM 726 OG1 THR A 46 -2.682 3.028 6.080 1.00 0.00 O ATOM 727 CG2 THR A 46 -4.966 2.270 6.022 1.00 0.00 C ATOM 0 H THR A 46 -4.804 6.619 5.288 1.00 0.00 H new ATOM 0 HA THR A 46 -3.340 4.982 4.856 1.00 0.00 H new ATOM 0 HB THR A 46 -4.223 3.901 7.180 1.00 0.00 H new ATOM 0 HG1 THR A 46 -2.608 2.111 6.417 1.00 0.00 H new ATOM 0 HG21 THR A 46 -4.731 1.518 6.775 1.00 0.00 H new ATOM 0 HG22 THR A 46 -6.001 2.590 6.139 1.00 0.00 H new ATOM 0 HG23 THR A 46 -4.828 1.844 5.028 1.00 0.00 H new ATOM 735 N SER A 47 -4.258 3.222 3.151 1.00 0.00 N ATOM 736 CA SER A 47 -4.694 2.711 1.856 1.00 0.00 C ATOM 737 C SER A 47 -6.069 2.054 1.925 1.00 0.00 C ATOM 738 O SER A 47 -6.904 2.298 1.063 1.00 0.00 O ATOM 739 CB SER A 47 -3.654 1.727 1.319 1.00 0.00 C ATOM 740 OG SER A 47 -3.181 0.877 2.348 1.00 0.00 O ATOM 0 H SER A 47 -3.332 2.898 3.428 1.00 0.00 H new ATOM 0 HA SER A 47 -4.785 3.558 1.176 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.093 1.128 0.521 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.819 2.276 0.884 1.00 0.00 H new ATOM 0 HG SER A 47 -2.233 0.679 2.199 1.00 0.00 H new ATOM 746 N GLU A 48 -6.293 1.242 2.960 1.00 0.00 N ATOM 747 CA GLU A 48 -7.577 0.560 3.179 1.00 0.00 C ATOM 748 C GLU A 48 -8.776 1.490 2.942 1.00 0.00 C ATOM 749 O GLU A 48 -9.733 1.126 2.263 1.00 0.00 O ATOM 750 CB GLU A 48 -7.618 0.011 4.611 1.00 0.00 C ATOM 751 CG GLU A 48 -8.920 -0.682 4.986 1.00 0.00 C ATOM 752 CD GLU A 48 -9.209 -1.902 4.135 1.00 0.00 C ATOM 753 OE1 GLU A 48 -8.313 -2.757 3.995 1.00 0.00 O ATOM 754 OE2 GLU A 48 -10.344 -2.015 3.624 1.00 0.00 O ATOM 0 H GLU A 48 -5.592 1.037 3.672 1.00 0.00 H new ATOM 0 HA GLU A 48 -7.652 -0.254 2.458 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -6.796 -0.694 4.740 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -7.445 0.833 5.306 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -8.878 -0.979 6.034 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.743 0.026 4.888 1.00 0.00 H new ATOM 761 N HIS A 49 -8.707 2.706 3.473 1.00 0.00 N ATOM 762 CA HIS A 49 -9.831 3.634 3.370 1.00 0.00 C ATOM 763 C HIS A 49 -9.946 4.205 1.959 1.00 0.00 C ATOM 764 O HIS A 49 -11.034 4.249 1.393 1.00 0.00 O ATOM 765 CB HIS A 49 -9.709 4.758 4.399 1.00 0.00 C ATOM 766 CG HIS A 49 -9.943 4.305 5.810 1.00 0.00 C ATOM 767 ND1 HIS A 49 -8.930 3.902 6.650 1.00 0.00 N ATOM 768 CD2 HIS A 49 -11.083 4.208 6.534 1.00 0.00 C ATOM 769 CE1 HIS A 49 -9.435 3.579 7.824 1.00 0.00 C ATOM 770 NE2 HIS A 49 -10.739 3.757 7.785 1.00 0.00 N ATOM 0 H HIS A 49 -7.896 3.070 3.973 1.00 0.00 H new ATOM 0 HA HIS A 49 -10.742 3.075 3.583 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -8.715 5.199 4.327 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -10.424 5.543 4.154 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -7.941 3.860 6.402 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -12.080 4.442 6.191 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -8.873 3.227 8.676 1.00 0.00 H new ATOM 779 N TYR A 50 -8.823 4.636 1.394 1.00 0.00 N ATOM 780 CA TYR A 50 -8.806 5.120 0.009 1.00 0.00 C ATOM 781 C TYR A 50 -9.246 4.010 -0.954 1.00 0.00 C ATOM 782 O TYR A 50 -9.922 4.264 -1.955 1.00 0.00 O ATOM 783 CB TYR A 50 -7.403 5.617 -0.357 1.00 0.00 C ATOM 784 CG TYR A 50 -7.283 6.154 -1.768 1.00 0.00 C ATOM 785 CD1 TYR A 50 -7.811 7.393 -2.107 1.00 0.00 C ATOM 786 CD2 TYR A 50 -6.641 5.421 -2.758 1.00 0.00 C ATOM 787 CE1 TYR A 50 -7.700 7.887 -3.393 1.00 0.00 C ATOM 788 CE2 TYR A 50 -6.525 5.909 -4.045 1.00 0.00 C ATOM 789 CZ TYR A 50 -7.057 7.141 -4.357 1.00 0.00 C ATOM 790 OH TYR A 50 -6.942 7.632 -5.637 1.00 0.00 O ATOM 0 H TYR A 50 -7.918 4.662 1.864 1.00 0.00 H new ATOM 0 HA TYR A 50 -9.508 5.949 -0.079 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -7.113 6.400 0.344 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -6.695 4.798 -0.231 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -8.316 7.980 -1.354 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.226 4.454 -2.517 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -8.115 8.853 -3.641 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.020 5.328 -4.803 1.00 0.00 H new ATOM 0 HH TYR A 50 -6.461 6.985 -6.194 1.00 0.00 H new ATOM 800 N PHE A 51 -8.863 2.785 -0.621 1.00 0.00 N ATOM 801 CA PHE A 51 -9.181 1.600 -1.409 1.00 0.00 C ATOM 802 C PHE A 51 -10.690 1.407 -1.533 1.00 0.00 C ATOM 803 O PHE A 51 -11.233 1.375 -2.638 1.00 0.00 O ATOM 804 CB PHE A 51 -8.535 0.377 -0.742 1.00 0.00 C ATOM 805 CG PHE A 51 -8.774 -0.940 -1.430 1.00 0.00 C ATOM 806 CD1 PHE A 51 -7.972 -1.341 -2.486 1.00 0.00 C ATOM 807 CD2 PHE A 51 -9.786 -1.787 -1.002 1.00 0.00 C ATOM 808 CE1 PHE A 51 -8.177 -2.559 -3.106 1.00 0.00 C ATOM 809 CE2 PHE A 51 -9.993 -3.008 -1.615 1.00 0.00 C ATOM 810 CZ PHE A 51 -9.188 -3.394 -2.668 1.00 0.00 C ATOM 0 H PHE A 51 -8.315 2.583 0.215 1.00 0.00 H new ATOM 0 HA PHE A 51 -8.786 1.724 -2.417 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -7.460 0.545 -0.680 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -8.905 0.305 0.281 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -7.178 -0.694 -2.829 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -10.420 -1.488 -0.180 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -7.548 -2.858 -3.932 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -10.783 -3.659 -1.271 1.00 0.00 H new ATOM 0 HZ PHE A 51 -9.348 -4.348 -3.149 1.00 0.00 H new ATOM 820 N GLN A 52 -11.361 1.304 -0.393 1.00 0.00 N ATOM 821 CA GLN A 52 -12.796 1.034 -0.363 1.00 0.00 C ATOM 822 C GLN A 52 -13.594 2.208 -0.927 1.00 0.00 C ATOM 823 O GLN A 52 -14.625 2.014 -1.573 1.00 0.00 O ATOM 824 CB GLN A 52 -13.236 0.725 1.068 1.00 0.00 C ATOM 825 CG GLN A 52 -12.416 -0.382 1.712 1.00 0.00 C ATOM 826 CD GLN A 52 -12.775 -1.772 1.219 1.00 0.00 C ATOM 827 OE1 GLN A 52 -13.291 -1.955 0.111 1.00 0.00 O ATOM 828 NE2 GLN A 52 -12.450 -2.769 2.022 1.00 0.00 N ATOM 0 H GLN A 52 -10.934 1.404 0.528 1.00 0.00 H new ATOM 0 HA GLN A 52 -12.995 0.167 -0.993 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -13.154 1.629 1.671 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -14.287 0.437 1.066 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -11.359 -0.199 1.518 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -12.554 -0.342 2.793 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -12.026 -2.576 2.929 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -12.623 -3.732 1.735 1.00 0.00 H new ATOM 837 N ALA A 53 -13.103 3.422 -0.702 1.00 0.00 N ATOM 838 CA ALA A 53 -13.772 4.619 -1.202 1.00 0.00 C ATOM 839 C ALA A 53 -13.749 4.664 -2.724 1.00 0.00 C ATOM 840 O ALA A 53 -14.658 5.203 -3.354 1.00 0.00 O ATOM 841 CB ALA A 53 -13.130 5.874 -0.631 1.00 0.00 C ATOM 0 H ALA A 53 -12.247 3.604 -0.178 1.00 0.00 H new ATOM 0 HA ALA A 53 -14.811 4.579 -0.875 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.645 6.754 -1.017 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -13.204 5.858 0.456 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -12.080 5.911 -0.922 1.00 0.00 H new ATOM 847 N GLN A 54 -12.706 4.095 -3.312 1.00 0.00 N ATOM 848 CA GLN A 54 -12.583 4.051 -4.760 1.00 0.00 C ATOM 849 C GLN A 54 -13.323 2.831 -5.308 1.00 0.00 C ATOM 850 O GLN A 54 -13.786 2.827 -6.450 1.00 0.00 O ATOM 851 CB GLN A 54 -11.107 3.989 -5.160 1.00 0.00 C ATOM 852 CG GLN A 54 -10.813 4.598 -6.521 1.00 0.00 C ATOM 853 CD GLN A 54 -10.890 6.113 -6.514 1.00 0.00 C ATOM 854 OE1 GLN A 54 -10.562 6.725 -5.384 1.00 0.00 O flip ATOM 855 NE2 GLN A 54 -11.236 6.732 -7.518 1.00 0.00 N flip ATOM 0 H GLN A 54 -11.934 3.658 -2.808 1.00 0.00 H new ATOM 0 HA GLN A 54 -13.025 4.954 -5.180 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -10.514 4.506 -4.406 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -10.784 2.948 -5.161 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -9.819 4.290 -6.845 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -11.521 4.206 -7.251 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -11.481 6.227 -8.369 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -11.278 7.751 -7.500 1.00 0.00 H new ATOM 864 N LYS A 55 -13.429 1.807 -4.469 1.00 0.00 N ATOM 865 CA LYS A 55 -14.076 0.551 -4.833 1.00 0.00 C ATOM 866 C LYS A 55 -15.577 0.736 -5.033 1.00 0.00 C ATOM 867 O LYS A 55 -16.147 0.270 -6.020 1.00 0.00 O ATOM 868 CB LYS A 55 -13.816 -0.492 -3.742 1.00 0.00 C ATOM 869 CG LYS A 55 -14.433 -1.852 -4.016 1.00 0.00 C ATOM 870 CD LYS A 55 -14.151 -2.811 -2.874 1.00 0.00 C ATOM 871 CE LYS A 55 -14.717 -4.192 -3.142 1.00 0.00 C ATOM 872 NZ LYS A 55 -14.510 -5.101 -1.984 1.00 0.00 N ATOM 0 H LYS A 55 -13.068 1.824 -3.515 1.00 0.00 H new ATOM 0 HA LYS A 55 -13.654 0.208 -5.778 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -12.740 -0.613 -3.621 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -14.203 -0.115 -2.796 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -15.509 -1.747 -4.152 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -14.032 -2.258 -4.945 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -13.075 -2.884 -2.719 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -14.580 -2.415 -1.953 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -15.782 -4.114 -3.358 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -14.242 -4.615 -4.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -14.435 -6.082 -2.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -13.635 -4.838 -1.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -15.315 -5.020 -1.331 1.00 0.00 H new ATOM 886 N PHE A 56 -16.215 1.403 -4.087 1.00 0.00 N ATOM 887 CA PHE A 56 -17.644 1.662 -4.172 1.00 0.00 C ATOM 888 C PHE A 56 -17.893 2.986 -4.879 1.00 0.00 C ATOM 889 O PHE A 56 -17.125 3.934 -4.716 1.00 0.00 O ATOM 890 CB PHE A 56 -18.273 1.689 -2.776 1.00 0.00 C ATOM 891 CG PHE A 56 -18.183 0.379 -2.041 1.00 0.00 C ATOM 892 CD1 PHE A 56 -17.088 0.090 -1.240 1.00 0.00 C ATOM 893 CD2 PHE A 56 -19.198 -0.559 -2.146 1.00 0.00 C ATOM 894 CE1 PHE A 56 -17.007 -1.111 -0.561 1.00 0.00 C ATOM 895 CE2 PHE A 56 -19.122 -1.760 -1.468 1.00 0.00 C ATOM 896 CZ PHE A 56 -18.026 -2.037 -0.675 1.00 0.00 C ATOM 0 H PHE A 56 -15.767 1.776 -3.250 1.00 0.00 H new ATOM 0 HA PHE A 56 -18.106 0.858 -4.745 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -17.784 2.462 -2.183 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -19.322 1.972 -2.866 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -16.290 0.812 -1.146 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -20.058 -0.349 -2.765 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -16.148 -1.325 0.058 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -19.920 -2.482 -1.558 1.00 0.00 H new ATOM 0 HZ PHE A 56 -17.965 -2.976 -0.145 1.00 0.00 H new ATOM 906 N LEU A 57 -18.949 3.048 -5.679 1.00 0.00 N ATOM 907 CA LEU A 57 -19.310 4.294 -6.350 1.00 0.00 C ATOM 908 C LEU A 57 -20.485 4.954 -5.643 1.00 0.00 C ATOM 909 O LEU A 57 -20.983 5.993 -6.078 1.00 0.00 O ATOM 910 CB LEU A 57 -19.640 4.074 -7.835 1.00 0.00 C ATOM 911 CG LEU A 57 -20.913 3.274 -8.134 1.00 0.00 C ATOM 912 CD1 LEU A 57 -21.389 3.553 -9.550 1.00 0.00 C ATOM 913 CD2 LEU A 57 -20.668 1.785 -7.960 1.00 0.00 C ATOM 0 H LEU A 57 -19.566 2.261 -5.879 1.00 0.00 H new ATOM 0 HA LEU A 57 -18.443 4.953 -6.301 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -19.727 5.049 -8.315 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -18.797 3.564 -8.301 1.00 0.00 H new ATOM 0 HG LEU A 57 -21.683 3.586 -7.428 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -22.294 2.979 -9.750 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -21.603 4.616 -9.659 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -20.612 3.264 -10.258 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -21.585 1.238 -8.177 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -19.882 1.463 -8.644 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -20.360 1.584 -6.934 1.00 0.00 H new ATOM 925 N ASP A 58 -20.919 4.346 -4.546 1.00 0.00 N ATOM 926 CA ASP A 58 -22.009 4.898 -3.749 1.00 0.00 C ATOM 927 C ASP A 58 -21.515 6.115 -2.980 1.00 0.00 C ATOM 928 O ASP A 58 -20.559 6.027 -2.208 1.00 0.00 O ATOM 929 CB ASP A 58 -22.564 3.854 -2.780 1.00 0.00 C ATOM 930 CG ASP A 58 -23.802 4.342 -2.048 1.00 0.00 C ATOM 931 OD1 ASP A 58 -23.668 5.155 -1.111 1.00 0.00 O ATOM 932 OD2 ASP A 58 -24.916 3.915 -2.406 1.00 0.00 O ATOM 0 H ASP A 58 -20.534 3.472 -4.188 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.813 5.195 -4.422 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -22.806 2.944 -3.330 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -21.795 3.592 -2.053 1.00 0.00 H new ATOM 937 N GLU A 59 -22.176 7.240 -3.195 1.00 0.00 N ATOM 938 CA GLU A 59 -21.738 8.515 -2.648 1.00 0.00 C ATOM 939 C GLU A 59 -21.770 8.514 -1.121 1.00 0.00 C ATOM 940 O GLU A 59 -20.777 8.853 -0.468 1.00 0.00 O ATOM 941 CB GLU A 59 -22.623 9.627 -3.204 1.00 0.00 C ATOM 942 CG GLU A 59 -22.172 11.027 -2.836 1.00 0.00 C ATOM 943 CD GLU A 59 -22.925 12.079 -3.616 1.00 0.00 C ATOM 944 OE1 GLU A 59 -22.546 12.339 -4.778 1.00 0.00 O ATOM 945 OE2 GLU A 59 -23.912 12.627 -3.090 1.00 0.00 O ATOM 0 H GLU A 59 -23.029 7.296 -3.752 1.00 0.00 H new ATOM 0 HA GLU A 59 -20.703 8.685 -2.946 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -22.654 9.542 -4.290 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -23.641 9.479 -2.844 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -22.321 11.189 -1.768 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -21.104 11.127 -3.027 1.00 0.00 H new ATOM 952 N LYS A 60 -22.900 8.116 -0.551 1.00 0.00 N ATOM 953 CA LYS A 60 -23.057 8.124 0.895 1.00 0.00 C ATOM 954 C LYS A 60 -22.160 7.071 1.531 1.00 0.00 C ATOM 955 O LYS A 60 -21.634 7.269 2.622 1.00 0.00 O ATOM 956 CB LYS A 60 -24.514 7.878 1.293 1.00 0.00 C ATOM 957 CG LYS A 60 -24.803 8.202 2.752 1.00 0.00 C ATOM 958 CD LYS A 60 -26.242 7.888 3.128 1.00 0.00 C ATOM 959 CE LYS A 60 -26.475 6.392 3.260 1.00 0.00 C ATOM 960 NZ LYS A 60 -25.705 5.806 4.391 1.00 0.00 N ATOM 0 H LYS A 60 -23.716 7.786 -1.066 1.00 0.00 H new ATOM 0 HA LYS A 60 -22.764 9.109 1.258 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -25.163 8.481 0.659 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -24.764 6.834 1.104 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -24.128 7.632 3.391 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -24.602 9.257 2.936 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -26.487 8.379 4.070 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -26.913 8.295 2.372 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -27.538 6.202 3.408 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -26.189 5.897 2.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -26.052 4.846 4.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -24.697 5.765 4.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -25.827 6.398 5.238 1.00 0.00 H new ATOM 974 N TYR A 61 -21.974 5.956 0.841 1.00 0.00 N ATOM 975 CA TYR A 61 -21.136 4.888 1.356 1.00 0.00 C ATOM 976 C TYR A 61 -19.677 5.327 1.384 1.00 0.00 C ATOM 977 O TYR A 61 -18.933 4.950 2.282 1.00 0.00 O ATOM 978 CB TYR A 61 -21.298 3.621 0.518 1.00 0.00 C ATOM 979 CG TYR A 61 -21.052 2.344 1.290 1.00 0.00 C ATOM 980 CD1 TYR A 61 -21.647 2.135 2.528 1.00 0.00 C ATOM 981 CD2 TYR A 61 -20.250 1.335 0.772 1.00 0.00 C ATOM 982 CE1 TYR A 61 -21.450 0.962 3.227 1.00 0.00 C ATOM 983 CE2 TYR A 61 -20.043 0.159 1.469 1.00 0.00 C ATOM 984 CZ TYR A 61 -20.647 -0.024 2.693 1.00 0.00 C ATOM 985 OH TYR A 61 -20.462 -1.201 3.380 1.00 0.00 O ATOM 0 H TYR A 61 -22.390 5.769 -0.071 1.00 0.00 H new ATOM 0 HA TYR A 61 -21.452 4.664 2.375 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -22.306 3.596 0.105 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -20.609 3.664 -0.325 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -22.275 2.905 2.951 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -19.780 1.471 -0.191 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -21.922 0.817 4.187 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -19.411 -0.613 1.055 1.00 0.00 H new ATOM 0 HH TYR A 61 -19.730 -1.707 2.970 1.00 0.00 H new ATOM 995 N ARG A 62 -19.278 6.137 0.403 1.00 0.00 N ATOM 996 CA ARG A 62 -17.939 6.725 0.399 1.00 0.00 C ATOM 997 C ARG A 62 -17.754 7.620 1.618 1.00 0.00 C ATOM 998 O ARG A 62 -16.665 7.694 2.192 1.00 0.00 O ATOM 999 CB ARG A 62 -17.693 7.527 -0.880 1.00 0.00 C ATOM 1000 CG ARG A 62 -17.451 6.665 -2.107 1.00 0.00 C ATOM 1001 CD ARG A 62 -17.219 7.516 -3.345 1.00 0.00 C ATOM 1002 NE ARG A 62 -16.840 6.706 -4.500 1.00 0.00 N ATOM 1003 CZ ARG A 62 -17.027 7.067 -5.769 1.00 0.00 C ATOM 1004 NH1 ARG A 62 -17.640 8.207 -6.064 1.00 0.00 N ATOM 1005 NH2 ARG A 62 -16.609 6.274 -6.746 1.00 0.00 N ATOM 0 H ARG A 62 -19.858 6.399 -0.394 1.00 0.00 H new ATOM 0 HA ARG A 62 -17.214 5.912 0.437 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -18.552 8.172 -1.064 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -16.832 8.178 -0.729 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -16.587 6.023 -1.938 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -18.308 6.011 -2.269 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -18.125 8.076 -3.576 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -16.436 8.247 -3.142 1.00 0.00 H new ATOM 0 HE ARG A 62 -16.402 5.802 -4.323 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -17.973 8.816 -5.316 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -17.778 8.474 -7.039 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -16.147 5.392 -6.525 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -16.750 6.546 -7.719 1.00 0.00 H new ATOM 1019 N GLU A 63 -18.830 8.299 2.005 1.00 0.00 N ATOM 1020 CA GLU A 63 -18.840 9.093 3.226 1.00 0.00 C ATOM 1021 C GLU A 63 -18.586 8.188 4.431 1.00 0.00 C ATOM 1022 O GLU A 63 -17.771 8.505 5.296 1.00 0.00 O ATOM 1023 CB GLU A 63 -20.184 9.817 3.372 1.00 0.00 C ATOM 1024 CG GLU A 63 -20.275 10.728 4.584 1.00 0.00 C ATOM 1025 CD GLU A 63 -19.363 11.931 4.485 1.00 0.00 C ATOM 1026 OE1 GLU A 63 -19.743 12.919 3.823 1.00 0.00 O ATOM 1027 OE2 GLU A 63 -18.267 11.904 5.073 1.00 0.00 O ATOM 0 H GLU A 63 -19.709 8.314 1.487 1.00 0.00 H new ATOM 0 HA GLU A 63 -18.049 9.841 3.175 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -20.365 10.408 2.474 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -20.979 9.074 3.430 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -21.304 11.067 4.701 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -20.023 10.160 5.479 1.00 0.00 H new ATOM 1034 N GLU A 64 -19.273 7.046 4.467 1.00 0.00 N ATOM 1035 CA GLU A 64 -19.073 6.057 5.526 1.00 0.00 C ATOM 1036 C GLU A 64 -17.644 5.512 5.523 1.00 0.00 C ATOM 1037 O GLU A 64 -17.082 5.228 6.581 1.00 0.00 O ATOM 1038 CB GLU A 64 -20.064 4.893 5.395 1.00 0.00 C ATOM 1039 CG GLU A 64 -21.349 5.072 6.189 1.00 0.00 C ATOM 1040 CD GLU A 64 -22.263 6.141 5.631 1.00 0.00 C ATOM 1041 OE1 GLU A 64 -22.139 7.314 6.035 1.00 0.00 O ATOM 1042 OE2 GLU A 64 -23.146 5.799 4.818 1.00 0.00 O ATOM 0 H GLU A 64 -19.974 6.783 3.774 1.00 0.00 H new ATOM 0 HA GLU A 64 -19.250 6.569 6.472 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -20.316 4.763 4.343 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -19.574 3.976 5.721 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -21.886 4.124 6.214 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -21.097 5.323 7.219 1.00 0.00 H new ATOM 1049 N ILE A 65 -17.057 5.369 4.339 1.00 0.00 N ATOM 1050 CA ILE A 65 -15.696 4.854 4.226 1.00 0.00 C ATOM 1051 C ILE A 65 -14.704 5.786 4.923 1.00 0.00 C ATOM 1052 O ILE A 65 -13.778 5.331 5.599 1.00 0.00 O ATOM 1053 CB ILE A 65 -15.252 4.668 2.756 1.00 0.00 C ATOM 1054 CG1 ILE A 65 -16.222 3.763 1.988 1.00 0.00 C ATOM 1055 CG2 ILE A 65 -13.847 4.088 2.708 1.00 0.00 C ATOM 1056 CD1 ILE A 65 -16.387 2.381 2.586 1.00 0.00 C ATOM 0 H ILE A 65 -17.499 5.601 3.449 1.00 0.00 H new ATOM 0 HA ILE A 65 -15.700 3.877 4.710 1.00 0.00 H new ATOM 0 HB ILE A 65 -15.257 5.647 2.276 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -17.198 4.247 1.946 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.872 3.663 0.961 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -13.542 3.960 1.670 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -13.156 4.766 3.209 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.835 3.121 3.212 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.089 1.805 1.983 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -15.422 1.874 2.603 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.769 2.468 3.603 1.00 0.00 H new ATOM 1068 N ARG A 66 -14.906 7.090 4.769 1.00 0.00 N ATOM 1069 CA ARG A 66 -14.021 8.072 5.391 1.00 0.00 C ATOM 1070 C ARG A 66 -14.527 8.440 6.782 1.00 0.00 C ATOM 1071 O ARG A 66 -13.920 9.241 7.488 1.00 0.00 O ATOM 1072 CB ARG A 66 -13.896 9.330 4.520 1.00 0.00 C ATOM 1073 CG ARG A 66 -15.163 10.169 4.442 1.00 0.00 C ATOM 1074 CD ARG A 66 -14.942 11.438 3.632 1.00 0.00 C ATOM 1075 NE ARG A 66 -16.107 12.317 3.665 1.00 0.00 N ATOM 1076 CZ ARG A 66 -16.183 13.491 3.044 1.00 0.00 C ATOM 1077 NH1 ARG A 66 -15.154 13.942 2.330 1.00 0.00 N ATOM 1078 NH2 ARG A 66 -17.292 14.216 3.136 1.00 0.00 N ATOM 0 H ARG A 66 -15.669 7.491 4.223 1.00 0.00 H new ATOM 0 HA ARG A 66 -13.032 7.623 5.485 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -13.088 9.949 4.911 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -13.610 9.032 3.511 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -15.962 9.582 3.990 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -15.490 10.431 5.448 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -14.075 11.971 4.022 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -14.716 11.174 2.599 1.00 0.00 H new ATOM 0 HE ARG A 66 -16.919 12.010 4.201 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -14.302 13.387 2.257 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -15.218 14.843 1.856 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -18.082 13.872 3.682 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -17.353 15.117 2.661 1.00 0.00 H new ATOM 1092 N ARG A 67 -15.643 7.835 7.166 1.00 0.00 N ATOM 1093 CA ARG A 67 -16.251 8.076 8.467 1.00 0.00 C ATOM 1094 C ARG A 67 -15.582 7.218 9.530 1.00 0.00 C ATOM 1095 O ARG A 67 -15.512 7.592 10.701 1.00 0.00 O ATOM 1096 CB ARG A 67 -17.742 7.737 8.413 1.00 0.00 C ATOM 1097 CG ARG A 67 -18.659 8.815 8.958 1.00 0.00 C ATOM 1098 CD ARG A 67 -18.619 10.069 8.103 1.00 0.00 C ATOM 1099 NE ARG A 67 -19.914 10.743 8.093 1.00 0.00 N ATOM 1100 CZ ARG A 67 -20.095 12.036 8.335 1.00 0.00 C ATOM 1101 NH1 ARG A 67 -19.064 12.830 8.591 1.00 0.00 N ATOM 1102 NH2 ARG A 67 -21.318 12.539 8.305 1.00 0.00 N ATOM 0 H ARG A 67 -16.150 7.166 6.587 1.00 0.00 H new ATOM 0 HA ARG A 67 -16.121 9.128 8.721 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -18.017 7.535 7.378 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -17.912 6.818 8.973 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -19.680 8.437 9.002 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -18.366 9.061 9.979 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -17.856 10.748 8.484 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -18.334 9.808 7.084 1.00 0.00 H new ATOM 0 HE ARG A 67 -20.739 10.180 7.885 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -18.118 12.449 8.604 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -19.217 13.821 8.775 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -22.113 11.935 8.097 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -21.466 13.531 8.490 1.00 0.00 H new ATOM 1116 N VAL A 68 -15.099 6.054 9.113 1.00 0.00 N ATOM 1117 CA VAL A 68 -14.508 5.107 10.040 1.00 0.00 C ATOM 1118 C VAL A 68 -13.007 5.333 10.174 1.00 0.00 C ATOM 1119 O VAL A 68 -12.293 5.503 9.183 1.00 0.00 O ATOM 1120 CB VAL A 68 -14.786 3.643 9.621 1.00 0.00 C ATOM 1121 CG1 VAL A 68 -16.282 3.393 9.507 1.00 0.00 C ATOM 1122 CG2 VAL A 68 -14.084 3.288 8.318 1.00 0.00 C ATOM 0 H VAL A 68 -15.106 5.747 8.140 1.00 0.00 H new ATOM 0 HA VAL A 68 -14.977 5.278 11.009 1.00 0.00 H new ATOM 0 HB VAL A 68 -14.382 2.996 10.400 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -16.457 2.358 9.212 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -16.757 3.580 10.470 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -16.706 4.061 8.757 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -14.303 2.253 8.057 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -14.438 3.945 7.523 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -13.008 3.412 8.439 1.00 0.00 H new ATOM 1132 N SER A 69 -12.538 5.348 11.405 1.00 0.00 N ATOM 1133 CA SER A 69 -11.124 5.497 11.680 1.00 0.00 C ATOM 1134 C SER A 69 -10.429 4.150 11.532 1.00 0.00 C ATOM 1135 O SER A 69 -9.321 4.057 10.997 1.00 0.00 O ATOM 1136 CB SER A 69 -10.922 6.035 13.096 1.00 0.00 C ATOM 1137 OG SER A 69 -11.764 7.150 13.346 1.00 0.00 O ATOM 0 H SER A 69 -13.121 5.258 12.237 1.00 0.00 H new ATOM 0 HA SER A 69 -10.693 6.203 10.970 1.00 0.00 H new ATOM 0 HB2 SER A 69 -11.132 5.248 13.820 1.00 0.00 H new ATOM 0 HB3 SER A 69 -9.880 6.325 13.233 1.00 0.00 H new ATOM 0 HG SER A 69 -11.616 7.473 14.259 1.00 0.00 H new ATOM 1143 N SER A 70 -11.106 3.104 11.983 1.00 0.00 N ATOM 1144 CA SER A 70 -10.551 1.764 11.966 1.00 0.00 C ATOM 1145 C SER A 70 -10.619 1.155 10.570 1.00 0.00 C ATOM 1146 O SER A 70 -11.690 1.087 9.961 1.00 0.00 O ATOM 1147 CB SER A 70 -11.295 0.878 12.965 1.00 0.00 C ATOM 1148 OG SER A 70 -11.327 1.477 14.249 1.00 0.00 O ATOM 0 H SER A 70 -12.049 3.162 12.368 1.00 0.00 H new ATOM 0 HA SER A 70 -9.502 1.827 12.254 1.00 0.00 H new ATOM 0 HB2 SER A 70 -12.313 0.705 12.615 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.809 -0.096 13.026 1.00 0.00 H new ATOM 0 HG SER A 70 -11.809 0.893 14.871 1.00 0.00 H new ATOM 1154 N PRO A 71 -9.468 0.711 10.041 1.00 0.00 N ATOM 1155 CA PRO A 71 -9.398 0.059 8.730 1.00 0.00 C ATOM 1156 C PRO A 71 -10.138 -1.278 8.723 1.00 0.00 C ATOM 1157 O PRO A 71 -10.651 -1.710 7.694 1.00 0.00 O ATOM 1158 CB PRO A 71 -7.896 -0.150 8.507 1.00 0.00 C ATOM 1159 CG PRO A 71 -7.296 -0.128 9.872 1.00 0.00 C ATOM 1160 CD PRO A 71 -8.140 0.819 10.678 1.00 0.00 C ATOM 0 HA PRO A 71 -9.869 0.654 7.948 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -7.700 -1.097 8.005 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -7.477 0.636 7.879 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -7.296 -1.124 10.315 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -6.259 0.206 9.837 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -8.173 0.534 11.730 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -7.755 1.838 10.636 1.00 0.00 H new ATOM 1168 N MET A 72 -10.208 -1.910 9.893 1.00 0.00 N ATOM 1169 CA MET A 72 -10.892 -3.193 10.036 1.00 0.00 C ATOM 1170 C MET A 72 -12.361 -3.070 9.657 1.00 0.00 C ATOM 1171 O MET A 72 -12.926 -3.961 9.023 1.00 0.00 O ATOM 1172 CB MET A 72 -10.780 -3.714 11.470 1.00 0.00 C ATOM 1173 CG MET A 72 -9.364 -4.063 11.892 1.00 0.00 C ATOM 1174 SD MET A 72 -9.300 -4.834 13.520 1.00 0.00 S ATOM 1175 CE MET A 72 -10.319 -6.282 13.240 1.00 0.00 C ATOM 0 H MET A 72 -9.799 -1.554 10.757 1.00 0.00 H new ATOM 0 HA MET A 72 -10.408 -3.899 9.362 1.00 0.00 H new ATOM 0 HB2 MET A 72 -11.176 -2.961 12.151 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.408 -4.599 11.574 1.00 0.00 H new ATOM 0 HG2 MET A 72 -8.925 -4.737 11.157 1.00 0.00 H new ATOM 0 HG3 MET A 72 -8.756 -3.158 11.898 1.00 0.00 H new ATOM 0 HE1 MET A 72 -10.017 -7.077 13.922 1.00 0.00 H new ATOM 0 HE2 MET A 72 -11.365 -6.030 13.416 1.00 0.00 H new ATOM 0 HE3 MET A 72 -10.195 -6.621 12.211 1.00 0.00 H new ATOM 1185 N VAL A 73 -12.973 -1.955 10.042 1.00 0.00 N ATOM 1186 CA VAL A 73 -14.376 -1.715 9.740 1.00 0.00 C ATOM 1187 C VAL A 73 -14.566 -1.555 8.237 1.00 0.00 C ATOM 1188 O VAL A 73 -15.487 -2.128 7.653 1.00 0.00 O ATOM 1189 CB VAL A 73 -14.906 -0.459 10.465 1.00 0.00 C ATOM 1190 CG1 VAL A 73 -16.395 -0.274 10.206 1.00 0.00 C ATOM 1191 CG2 VAL A 73 -14.632 -0.550 11.960 1.00 0.00 C ATOM 0 H VAL A 73 -12.518 -1.205 10.563 1.00 0.00 H new ATOM 0 HA VAL A 73 -14.943 -2.576 10.094 1.00 0.00 H new ATOM 0 HB VAL A 73 -14.380 0.410 10.069 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -16.747 0.617 10.726 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -16.567 -0.161 9.136 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -16.939 -1.146 10.570 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.012 0.344 12.455 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -15.129 -1.430 12.368 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -13.558 -0.629 12.129 1.00 0.00 H new ATOM 1201 N ALA A 74 -13.663 -0.799 7.618 1.00 0.00 N ATOM 1202 CA ALA A 74 -13.712 -0.559 6.181 1.00 0.00 C ATOM 1203 C ALA A 74 -13.631 -1.869 5.407 1.00 0.00 C ATOM 1204 O ALA A 74 -14.424 -2.105 4.501 1.00 0.00 O ATOM 1205 CB ALA A 74 -12.591 0.381 5.761 1.00 0.00 C ATOM 0 H ALA A 74 -12.885 -0.341 8.093 1.00 0.00 H new ATOM 0 HA ALA A 74 -14.666 -0.087 5.947 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -12.642 0.550 4.685 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -12.699 1.332 6.283 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.629 -0.065 6.013 1.00 0.00 H new ATOM 1211 N ALA A 75 -12.682 -2.721 5.780 1.00 0.00 N ATOM 1212 CA ALA A 75 -12.530 -4.027 5.151 1.00 0.00 C ATOM 1213 C ALA A 75 -13.784 -4.878 5.344 1.00 0.00 C ATOM 1214 O ALA A 75 -14.312 -5.457 4.387 1.00 0.00 O ATOM 1215 CB ALA A 75 -11.311 -4.745 5.716 1.00 0.00 C ATOM 0 H ALA A 75 -12.004 -2.529 6.518 1.00 0.00 H new ATOM 0 HA ALA A 75 -12.386 -3.875 4.081 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -11.209 -5.719 5.238 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -10.417 -4.151 5.524 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.434 -4.879 6.791 1.00 0.00 H new ATOM 1221 N ARG A 76 -14.270 -4.927 6.582 1.00 0.00 N ATOM 1222 CA ARG A 76 -15.425 -5.750 6.928 1.00 0.00 C ATOM 1223 C ARG A 76 -16.642 -5.359 6.091 1.00 0.00 C ATOM 1224 O ARG A 76 -17.292 -6.218 5.491 1.00 0.00 O ATOM 1225 CB ARG A 76 -15.728 -5.626 8.433 1.00 0.00 C ATOM 1226 CG ARG A 76 -16.810 -6.574 8.945 1.00 0.00 C ATOM 1227 CD ARG A 76 -18.208 -6.000 8.761 1.00 0.00 C ATOM 1228 NE ARG A 76 -19.251 -6.935 9.179 1.00 0.00 N ATOM 1229 CZ ARG A 76 -20.439 -6.561 9.649 1.00 0.00 C ATOM 1230 NH1 ARG A 76 -20.733 -5.271 9.770 1.00 0.00 N ATOM 1231 NH2 ARG A 76 -21.334 -7.477 9.991 1.00 0.00 N ATOM 0 H ARG A 76 -13.879 -4.404 7.365 1.00 0.00 H new ATOM 0 HA ARG A 76 -15.191 -6.791 6.706 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.810 -5.809 8.991 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -16.032 -4.601 8.646 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -16.737 -7.525 8.418 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -16.640 -6.781 10.002 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -18.298 -5.078 9.335 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -18.356 -5.739 7.713 1.00 0.00 H new ATOM 0 HE ARG A 76 -19.057 -7.934 9.106 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -20.048 -4.564 9.502 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -21.644 -4.987 10.130 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -21.112 -8.468 9.894 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -22.244 -7.191 10.351 1.00 0.00 H new ATOM 1245 N MET A 77 -16.940 -4.067 6.037 1.00 0.00 N ATOM 1246 CA MET A 77 -18.087 -3.589 5.269 1.00 0.00 C ATOM 1247 C MET A 77 -17.738 -3.463 3.789 1.00 0.00 C ATOM 1248 O MET A 77 -18.615 -3.283 2.950 1.00 0.00 O ATOM 1249 CB MET A 77 -18.595 -2.246 5.810 1.00 0.00 C ATOM 1250 CG MET A 77 -17.589 -1.115 5.709 1.00 0.00 C ATOM 1251 SD MET A 77 -18.243 0.443 6.338 1.00 0.00 S ATOM 1252 CE MET A 77 -16.807 1.501 6.181 1.00 0.00 C ATOM 0 H MET A 77 -16.410 -3.336 6.511 1.00 0.00 H new ATOM 0 HA MET A 77 -18.884 -4.325 5.376 1.00 0.00 H new ATOM 0 HB2 MET A 77 -19.497 -1.965 5.266 1.00 0.00 H new ATOM 0 HB3 MET A 77 -18.880 -2.372 6.855 1.00 0.00 H new ATOM 0 HG2 MET A 77 -16.691 -1.380 6.266 1.00 0.00 H new ATOM 0 HG3 MET A 77 -17.292 -0.988 4.668 1.00 0.00 H new ATOM 0 HE1 MET A 77 -17.128 2.539 6.094 1.00 0.00 H new ATOM 0 HE2 MET A 77 -16.174 1.389 7.062 1.00 0.00 H new ATOM 0 HE3 MET A 77 -16.244 1.220 5.291 1.00 0.00 H new ATOM 1262 N GLY A 78 -16.453 -3.561 3.475 1.00 0.00 N ATOM 1263 CA GLY A 78 -16.016 -3.513 2.094 1.00 0.00 C ATOM 1264 C GLY A 78 -16.175 -4.851 1.405 1.00 0.00 C ATOM 1265 O GLY A 78 -16.122 -4.941 0.177 1.00 0.00 O ATOM 0 H GLY A 78 -15.702 -3.673 4.156 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -16.590 -2.758 1.557 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -14.971 -3.206 2.054 1.00 0.00 H new ATOM 1269 N ARG A 79 -16.343 -5.901 2.202 1.00 0.00 N ATOM 1270 CA ARG A 79 -16.610 -7.236 1.670 1.00 0.00 C ATOM 1271 C ARG A 79 -18.081 -7.386 1.282 1.00 0.00 C ATOM 1272 O ARG A 79 -18.463 -8.367 0.643 1.00 0.00 O ATOM 1273 CB ARG A 79 -16.252 -8.308 2.701 1.00 0.00 C ATOM 1274 CG ARG A 79 -14.806 -8.268 3.161 1.00 0.00 C ATOM 1275 CD ARG A 79 -14.545 -9.295 4.250 1.00 0.00 C ATOM 1276 NE ARG A 79 -13.234 -9.115 4.865 1.00 0.00 N ATOM 1277 CZ ARG A 79 -12.893 -9.623 6.050 1.00 0.00 C ATOM 1278 NH1 ARG A 79 -13.749 -10.385 6.723 1.00 0.00 N ATOM 1279 NH2 ARG A 79 -11.688 -9.379 6.554 1.00 0.00 N ATOM 0 H ARG A 79 -16.299 -5.855 3.220 1.00 0.00 H new ATOM 0 HA ARG A 79 -15.992 -7.366 0.782 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -16.901 -8.193 3.569 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -16.459 -9.290 2.275 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -14.147 -8.458 2.314 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -14.568 -7.272 3.533 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -15.318 -9.218 5.014 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -14.613 -10.297 3.827 1.00 0.00 H new ATOM 0 HE ARG A 79 -12.537 -8.568 4.359 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -14.671 -10.583 6.333 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -13.484 -10.772 7.629 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -11.025 -8.804 6.035 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -11.426 -9.767 7.460 1.00 0.00 H new ATOM 1293 N ASP A 80 -18.896 -6.411 1.672 1.00 0.00 N ATOM 1294 CA ASP A 80 -20.336 -6.464 1.427 1.00 0.00 C ATOM 1295 C ASP A 80 -20.639 -6.246 -0.052 1.00 0.00 C ATOM 1296 O ASP A 80 -20.005 -5.419 -0.707 1.00 0.00 O ATOM 1297 CB ASP A 80 -21.060 -5.414 2.276 1.00 0.00 C ATOM 1298 CG ASP A 80 -22.567 -5.484 2.129 1.00 0.00 C ATOM 1299 OD1 ASP A 80 -23.202 -6.283 2.849 1.00 0.00 O ATOM 1300 OD2 ASP A 80 -23.130 -4.745 1.295 1.00 0.00 O ATOM 0 H ASP A 80 -18.584 -5.572 2.161 1.00 0.00 H new ATOM 0 HA ASP A 80 -20.695 -7.453 1.711 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -20.794 -5.553 3.324 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -20.716 -4.420 1.989 1.00 0.00 H new ATOM 1305 N ARG A 81 -21.602 -6.995 -0.577 1.00 0.00 N ATOM 1306 CA ARG A 81 -21.940 -6.908 -1.990 1.00 0.00 C ATOM 1307 C ARG A 81 -23.408 -6.560 -2.186 1.00 0.00 C ATOM 1308 O ARG A 81 -23.977 -6.795 -3.255 1.00 0.00 O ATOM 1309 CB ARG A 81 -21.610 -8.217 -2.706 1.00 0.00 C ATOM 1310 CG ARG A 81 -20.129 -8.556 -2.679 1.00 0.00 C ATOM 1311 CD ARG A 81 -19.814 -9.796 -3.499 1.00 0.00 C ATOM 1312 NE ARG A 81 -20.572 -10.969 -3.062 1.00 0.00 N ATOM 1313 CZ ARG A 81 -20.312 -11.656 -1.948 1.00 0.00 C ATOM 1314 NH1 ARG A 81 -19.380 -11.233 -1.102 1.00 0.00 N ATOM 1315 NH2 ARG A 81 -21.000 -12.757 -1.671 1.00 0.00 N ATOM 0 H ARG A 81 -22.159 -7.666 -0.048 1.00 0.00 H new ATOM 0 HA ARG A 81 -21.339 -6.109 -2.424 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -22.171 -9.029 -2.242 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -21.942 -8.151 -3.742 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -19.557 -7.712 -3.064 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -19.812 -8.713 -1.648 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -20.032 -9.598 -4.548 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -18.748 -10.011 -3.430 1.00 0.00 H new ATOM 0 HE ARG A 81 -21.348 -11.281 -3.646 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -18.859 -10.379 -1.302 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -19.185 -11.762 -0.252 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -21.728 -13.078 -2.310 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -20.801 -13.282 -0.819 1.00 0.00 H new ATOM 1329 N SER A 82 -24.021 -5.998 -1.156 1.00 0.00 N ATOM 1330 CA SER A 82 -25.371 -5.479 -1.285 1.00 0.00 C ATOM 1331 C SER A 82 -25.309 -3.971 -1.514 1.00 0.00 C ATOM 1332 O SER A 82 -26.329 -3.283 -1.554 1.00 0.00 O ATOM 1333 CB SER A 82 -26.224 -5.833 -0.056 1.00 0.00 C ATOM 1334 OG SER A 82 -25.598 -5.454 1.163 1.00 0.00 O ATOM 0 H SER A 82 -23.608 -5.891 -0.229 1.00 0.00 H new ATOM 0 HA SER A 82 -25.854 -5.945 -2.144 1.00 0.00 H new ATOM 0 HB2 SER A 82 -27.192 -5.338 -0.134 1.00 0.00 H new ATOM 0 HB3 SER A 82 -26.414 -6.906 -0.046 1.00 0.00 H new ATOM 0 HG SER A 82 -24.829 -4.878 0.970 1.00 0.00 H new ATOM 1340 N LYS A 83 -24.086 -3.476 -1.666 1.00 0.00 N ATOM 1341 CA LYS A 83 -23.838 -2.078 -1.981 1.00 0.00 C ATOM 1342 C LYS A 83 -23.490 -1.950 -3.459 1.00 0.00 C ATOM 1343 O LYS A 83 -23.094 -2.932 -4.086 1.00 0.00 O ATOM 1344 CB LYS A 83 -22.684 -1.542 -1.129 1.00 0.00 C ATOM 1345 CG LYS A 83 -22.879 -1.746 0.363 1.00 0.00 C ATOM 1346 CD LYS A 83 -24.056 -0.948 0.896 1.00 0.00 C ATOM 1347 CE LYS A 83 -24.355 -1.314 2.340 1.00 0.00 C ATOM 1348 NZ LYS A 83 -24.724 -2.748 2.473 1.00 0.00 N ATOM 0 H LYS A 83 -23.238 -4.036 -1.574 1.00 0.00 H new ATOM 0 HA LYS A 83 -24.734 -1.496 -1.764 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -21.760 -2.032 -1.436 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -22.562 -0.477 -1.328 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -23.037 -2.805 0.567 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -21.972 -1.451 0.891 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -23.839 0.118 0.825 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -24.936 -1.136 0.280 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -23.482 -1.103 2.958 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -25.168 -0.692 2.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -24.971 -2.953 3.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -25.540 -2.954 1.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -23.919 -3.342 2.187 1.00 0.00 H new ATOM 1362 N PRO A 84 -23.640 -0.750 -4.041 1.00 0.00 N ATOM 1363 CA PRO A 84 -23.294 -0.513 -5.444 1.00 0.00 C ATOM 1364 C PRO A 84 -21.801 -0.699 -5.718 1.00 0.00 C ATOM 1365 O PRO A 84 -20.970 0.110 -5.294 1.00 0.00 O ATOM 1366 CB PRO A 84 -23.710 0.946 -5.683 1.00 0.00 C ATOM 1367 CG PRO A 84 -24.651 1.266 -4.569 1.00 0.00 C ATOM 1368 CD PRO A 84 -24.179 0.458 -3.398 1.00 0.00 C ATOM 0 HA PRO A 84 -23.792 -1.221 -6.106 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -22.846 1.610 -5.673 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -24.192 1.065 -6.653 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -24.639 2.332 -4.340 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -25.676 1.008 -4.835 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -23.418 0.985 -2.822 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -24.993 0.224 -2.712 1.00 0.00 H new ATOM 1376 N LEU A 85 -21.470 -1.783 -6.408 1.00 0.00 N ATOM 1377 CA LEU A 85 -20.097 -2.059 -6.808 1.00 0.00 C ATOM 1378 C LEU A 85 -19.875 -1.636 -8.254 1.00 0.00 C ATOM 1379 O LEU A 85 -20.808 -1.632 -9.056 1.00 0.00 O ATOM 1380 CB LEU A 85 -19.781 -3.548 -6.649 1.00 0.00 C ATOM 1381 CG LEU A 85 -19.705 -4.050 -5.207 1.00 0.00 C ATOM 1382 CD1 LEU A 85 -19.529 -5.558 -5.177 1.00 0.00 C ATOM 1383 CD2 LEU A 85 -18.562 -3.374 -4.466 1.00 0.00 C ATOM 0 H LEU A 85 -22.141 -2.491 -6.704 1.00 0.00 H new ATOM 0 HA LEU A 85 -19.430 -1.488 -6.163 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -20.543 -4.122 -7.176 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -18.829 -3.755 -7.139 1.00 0.00 H new ATOM 0 HG LEU A 85 -20.641 -3.798 -4.708 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -19.477 -5.898 -4.143 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -20.376 -6.033 -5.673 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -18.608 -5.827 -5.694 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -18.523 -3.744 -3.441 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -17.621 -3.597 -4.968 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -18.722 -2.296 -4.457 1.00 0.00 H new ATOM 1395 N ARG A 86 -18.644 -1.273 -8.579 1.00 0.00 N ATOM 1396 CA ARG A 86 -18.308 -0.845 -9.929 1.00 0.00 C ATOM 1397 C ARG A 86 -17.718 -2.010 -10.725 1.00 0.00 C ATOM 1398 O ARG A 86 -16.947 -2.812 -10.194 1.00 0.00 O ATOM 1399 CB ARG A 86 -17.332 0.341 -9.883 1.00 0.00 C ATOM 1400 CG ARG A 86 -16.037 0.041 -9.147 1.00 0.00 C ATOM 1401 CD ARG A 86 -15.206 1.298 -8.921 1.00 0.00 C ATOM 1402 NE ARG A 86 -14.707 1.879 -10.170 1.00 0.00 N ATOM 1403 CZ ARG A 86 -13.969 2.993 -10.228 1.00 0.00 C ATOM 1404 NH1 ARG A 86 -13.657 3.642 -9.112 1.00 0.00 N ATOM 1405 NH2 ARG A 86 -13.526 3.446 -11.396 1.00 0.00 N ATOM 0 H ARG A 86 -17.860 -1.266 -7.926 1.00 0.00 H new ATOM 0 HA ARG A 86 -19.218 -0.518 -10.432 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -17.097 0.646 -10.903 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -17.825 1.186 -9.403 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -16.264 -0.421 -8.186 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -15.454 -0.681 -9.718 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -15.810 2.038 -8.397 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -14.362 1.059 -8.274 1.00 0.00 H new ATOM 0 HE ARG A 86 -14.935 1.407 -11.045 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -13.980 3.291 -8.211 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -13.094 4.492 -9.156 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -13.748 2.944 -12.255 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -12.964 4.296 -11.433 1.00 0.00 H new ATOM 1419 N LYS A 87 -18.087 -2.105 -11.993 1.00 0.00 N ATOM 1420 CA LYS A 87 -17.623 -3.192 -12.847 1.00 0.00 C ATOM 1421 C LYS A 87 -16.196 -2.920 -13.305 1.00 0.00 C ATOM 1422 O LYS A 87 -15.418 -3.842 -13.544 1.00 0.00 O ATOM 1423 CB LYS A 87 -18.550 -3.350 -14.058 1.00 0.00 C ATOM 1424 CG LYS A 87 -18.179 -4.492 -15.003 1.00 0.00 C ATOM 1425 CD LYS A 87 -18.435 -5.872 -14.398 1.00 0.00 C ATOM 1426 CE LYS A 87 -17.271 -6.360 -13.541 1.00 0.00 C ATOM 1427 NZ LYS A 87 -15.998 -6.450 -14.315 1.00 0.00 N ATOM 0 H LYS A 87 -18.708 -1.442 -12.456 1.00 0.00 H new ATOM 0 HA LYS A 87 -17.639 -4.120 -12.276 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -19.568 -3.508 -13.701 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -18.551 -2.417 -14.621 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -18.751 -4.394 -15.926 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -17.126 -4.408 -15.270 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -19.339 -5.837 -13.790 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -18.617 -6.588 -15.199 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -17.134 -5.683 -12.698 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -17.512 -7.339 -13.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -15.411 -7.218 -13.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -16.212 -6.645 -15.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -15.482 -5.550 -14.241 1.00 0.00 H new ATOM 1441 N ASN A 88 -15.852 -1.645 -13.393 1.00 0.00 N ATOM 1442 CA ASN A 88 -14.512 -1.226 -13.795 1.00 0.00 C ATOM 1443 C ASN A 88 -13.559 -1.248 -12.609 1.00 0.00 C ATOM 1444 O ASN A 88 -12.470 -0.675 -12.658 1.00 0.00 O ATOM 1445 CB ASN A 88 -14.545 0.173 -14.430 1.00 0.00 C ATOM 1446 CG ASN A 88 -15.154 1.237 -13.531 1.00 0.00 C ATOM 1447 OD1 ASN A 88 -15.933 0.943 -12.626 1.00 0.00 O ATOM 1448 ND2 ASN A 88 -14.811 2.491 -13.778 1.00 0.00 N ATOM 0 H ASN A 88 -16.487 -0.873 -13.190 1.00 0.00 H new ATOM 0 HA ASN A 88 -14.149 -1.934 -14.540 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -13.529 0.468 -14.691 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -15.112 0.127 -15.360 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -15.195 3.246 -13.210 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -14.162 2.702 -14.536 1.00 0.00 H new ATOM 1455 N TRP A 89 -13.975 -1.926 -11.546 1.00 0.00 N ATOM 1456 CA TRP A 89 -13.132 -2.114 -10.378 1.00 0.00 C ATOM 1457 C TRP A 89 -11.887 -2.906 -10.753 1.00 0.00 C ATOM 1458 O TRP A 89 -10.797 -2.623 -10.271 1.00 0.00 O ATOM 1459 CB TRP A 89 -13.907 -2.832 -9.269 1.00 0.00 C ATOM 1460 CG TRP A 89 -13.069 -3.169 -8.074 1.00 0.00 C ATOM 1461 CD1 TRP A 89 -12.916 -4.400 -7.504 1.00 0.00 C ATOM 1462 CD2 TRP A 89 -12.258 -2.270 -7.316 1.00 0.00 C ATOM 1463 NE1 TRP A 89 -12.065 -4.318 -6.430 1.00 0.00 N ATOM 1464 CE2 TRP A 89 -11.645 -3.019 -6.296 1.00 0.00 C ATOM 1465 CE3 TRP A 89 -11.992 -0.900 -7.400 1.00 0.00 C ATOM 1466 CZ2 TRP A 89 -10.782 -2.444 -5.371 1.00 0.00 C ATOM 1467 CZ3 TRP A 89 -11.134 -0.331 -6.480 1.00 0.00 C ATOM 1468 CH2 TRP A 89 -10.538 -1.101 -5.476 1.00 0.00 C ATOM 0 H TRP A 89 -14.897 -2.356 -11.472 1.00 0.00 H new ATOM 0 HA TRP A 89 -12.826 -1.136 -10.007 1.00 0.00 H new ATOM 0 HB2 TRP A 89 -14.739 -2.203 -8.953 1.00 0.00 H new ATOM 0 HB3 TRP A 89 -14.336 -3.749 -9.672 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -13.394 -5.305 -7.848 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -11.790 -5.096 -5.830 1.00 0.00 H new ATOM 0 HE3 TRP A 89 -12.450 -0.298 -8.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -10.319 -3.037 -4.596 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 -10.920 0.726 -6.537 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -9.872 -0.627 -4.770 1.00 0.00 H new ATOM 1479 N GLU A 90 -12.057 -3.877 -11.642 1.00 0.00 N ATOM 1480 CA GLU A 90 -10.947 -4.714 -12.077 1.00 0.00 C ATOM 1481 C GLU A 90 -9.930 -3.872 -12.848 1.00 0.00 C ATOM 1482 O GLU A 90 -8.725 -4.132 -12.802 1.00 0.00 O ATOM 1483 CB GLU A 90 -11.459 -5.854 -12.963 1.00 0.00 C ATOM 1484 CG GLU A 90 -10.510 -7.038 -13.062 1.00 0.00 C ATOM 1485 CD GLU A 90 -10.437 -7.825 -11.772 1.00 0.00 C ATOM 1486 OE1 GLU A 90 -11.474 -8.386 -11.359 1.00 0.00 O ATOM 1487 OE2 GLU A 90 -9.347 -7.905 -11.172 1.00 0.00 O ATOM 0 H GLU A 90 -12.952 -4.104 -12.075 1.00 0.00 H new ATOM 0 HA GLU A 90 -10.464 -5.141 -11.198 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -12.416 -6.201 -12.573 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -11.644 -5.466 -13.965 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -10.836 -7.695 -13.868 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.514 -6.681 -13.324 1.00 0.00 H new ATOM 1494 N SER A 91 -10.427 -2.850 -13.538 1.00 0.00 N ATOM 1495 CA SER A 91 -9.586 -1.984 -14.348 1.00 0.00 C ATOM 1496 C SER A 91 -8.714 -1.083 -13.472 1.00 0.00 C ATOM 1497 O SER A 91 -7.508 -0.961 -13.692 1.00 0.00 O ATOM 1498 CB SER A 91 -10.469 -1.132 -15.262 1.00 0.00 C ATOM 1499 OG SER A 91 -11.444 -1.936 -15.908 1.00 0.00 O ATOM 0 H SER A 91 -11.416 -2.602 -13.550 1.00 0.00 H new ATOM 0 HA SER A 91 -8.924 -2.606 -14.950 1.00 0.00 H new ATOM 0 HB2 SER A 91 -10.961 -0.354 -14.679 1.00 0.00 H new ATOM 0 HB3 SER A 91 -9.852 -0.630 -16.007 1.00 0.00 H new ATOM 0 HG SER A 91 -12.000 -1.374 -16.487 1.00 0.00 H new ATOM 1505 N VAL A 92 -9.328 -0.470 -12.466 1.00 0.00 N ATOM 1506 CA VAL A 92 -8.630 0.484 -11.609 1.00 0.00 C ATOM 1507 C VAL A 92 -8.038 -0.197 -10.378 1.00 0.00 C ATOM 1508 O VAL A 92 -7.382 0.445 -9.563 1.00 0.00 O ATOM 1509 CB VAL A 92 -9.566 1.627 -11.160 1.00 0.00 C ATOM 1510 CG1 VAL A 92 -10.070 2.407 -12.364 1.00 0.00 C ATOM 1511 CG2 VAL A 92 -10.731 1.083 -10.346 1.00 0.00 C ATOM 0 H VAL A 92 -10.308 -0.616 -12.223 1.00 0.00 H new ATOM 0 HA VAL A 92 -7.818 0.903 -12.204 1.00 0.00 H new ATOM 0 HB VAL A 92 -8.997 2.305 -10.525 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -10.728 3.209 -12.029 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -9.223 2.834 -12.902 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -10.620 1.739 -13.026 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -11.377 1.906 -10.040 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -11.302 0.380 -10.952 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -10.350 0.573 -9.461 1.00 0.00 H new ATOM 1521 N LYS A 93 -8.269 -1.500 -10.273 1.00 0.00 N ATOM 1522 CA LYS A 93 -7.820 -2.309 -9.138 1.00 0.00 C ATOM 1523 C LYS A 93 -6.343 -2.054 -8.823 1.00 0.00 C ATOM 1524 O LYS A 93 -5.976 -1.719 -7.690 1.00 0.00 O ATOM 1525 CB LYS A 93 -8.043 -3.782 -9.487 1.00 0.00 C ATOM 1526 CG LYS A 93 -7.996 -4.744 -8.313 1.00 0.00 C ATOM 1527 CD LYS A 93 -8.383 -6.141 -8.772 1.00 0.00 C ATOM 1528 CE LYS A 93 -8.435 -7.137 -7.627 1.00 0.00 C ATOM 1529 NZ LYS A 93 -8.916 -8.471 -8.085 1.00 0.00 N ATOM 0 H LYS A 93 -8.778 -2.033 -10.978 1.00 0.00 H new ATOM 0 HA LYS A 93 -8.390 -2.038 -8.250 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -9.012 -3.879 -9.976 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -7.288 -4.084 -10.213 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -6.995 -4.758 -7.883 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -8.675 -4.408 -7.529 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -9.357 -6.103 -9.260 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -7.666 -6.486 -9.517 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.443 -7.238 -7.186 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -9.094 -6.760 -6.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -9.774 -8.730 -7.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -9.133 -8.432 -9.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -8.177 -9.183 -7.916 1.00 0.00 H new ATOM 1543 N GLU A 94 -5.512 -2.192 -9.847 1.00 0.00 N ATOM 1544 CA GLU A 94 -4.075 -1.991 -9.716 1.00 0.00 C ATOM 1545 C GLU A 94 -3.756 -0.529 -9.416 1.00 0.00 C ATOM 1546 O GLU A 94 -2.893 -0.225 -8.591 1.00 0.00 O ATOM 1547 CB GLU A 94 -3.384 -2.415 -11.008 1.00 0.00 C ATOM 1548 CG GLU A 94 -3.711 -3.837 -11.423 1.00 0.00 C ATOM 1549 CD GLU A 94 -3.318 -4.118 -12.856 1.00 0.00 C ATOM 1550 OE1 GLU A 94 -2.123 -4.381 -13.109 1.00 0.00 O ATOM 1551 OE2 GLU A 94 -4.203 -4.069 -13.733 1.00 0.00 O ATOM 0 H GLU A 94 -5.813 -2.445 -10.788 1.00 0.00 H new ATOM 0 HA GLU A 94 -3.712 -2.598 -8.887 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -3.675 -1.734 -11.808 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -2.305 -2.319 -10.884 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -3.195 -4.534 -10.763 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -4.780 -4.013 -11.300 1.00 0.00 H new ATOM 1558 N GLN A 95 -4.473 0.368 -10.085 1.00 0.00 N ATOM 1559 CA GLN A 95 -4.253 1.799 -9.939 1.00 0.00 C ATOM 1560 C GLN A 95 -4.520 2.248 -8.508 1.00 0.00 C ATOM 1561 O GLN A 95 -3.695 2.923 -7.903 1.00 0.00 O ATOM 1562 CB GLN A 95 -5.151 2.571 -10.912 1.00 0.00 C ATOM 1563 CG GLN A 95 -5.015 4.086 -10.819 1.00 0.00 C ATOM 1564 CD GLN A 95 -3.613 4.586 -11.124 1.00 0.00 C ATOM 1565 OE1 GLN A 95 -2.898 3.876 -11.985 1.00 0.00 O flip ATOM 1566 NE2 GLN A 95 -3.179 5.609 -10.596 1.00 0.00 N flip ATOM 0 H GLN A 95 -5.217 0.124 -10.739 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.210 2.011 -10.173 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -4.918 2.258 -11.930 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -6.190 2.298 -10.725 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -5.717 4.550 -11.512 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -5.297 4.408 -9.817 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -3.759 6.129 -9.938 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -2.239 5.937 -10.816 1.00 0.00 H new ATOM 1575 N VAL A 96 -5.669 1.854 -7.971 1.00 0.00 N ATOM 1576 CA VAL A 96 -6.059 2.237 -6.619 1.00 0.00 C ATOM 1577 C VAL A 96 -5.020 1.778 -5.603 1.00 0.00 C ATOM 1578 O VAL A 96 -4.569 2.567 -4.767 1.00 0.00 O ATOM 1579 CB VAL A 96 -7.438 1.654 -6.242 1.00 0.00 C ATOM 1580 CG1 VAL A 96 -7.824 2.045 -4.822 1.00 0.00 C ATOM 1581 CG2 VAL A 96 -8.496 2.117 -7.232 1.00 0.00 C ATOM 0 H VAL A 96 -6.349 1.267 -8.454 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.124 3.325 -6.600 1.00 0.00 H new ATOM 0 HB VAL A 96 -7.373 0.567 -6.286 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.799 1.622 -4.581 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -7.080 1.662 -4.124 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -7.870 3.131 -4.743 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -9.463 1.698 -6.954 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -8.555 3.205 -7.219 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -8.229 1.780 -8.234 1.00 0.00 H new ATOM 1591 N MET A 97 -4.630 0.510 -5.695 1.00 0.00 N ATOM 1592 CA MET A 97 -3.636 -0.049 -4.784 1.00 0.00 C ATOM 1593 C MET A 97 -2.309 0.699 -4.870 1.00 0.00 C ATOM 1594 O MET A 97 -1.796 1.183 -3.859 1.00 0.00 O ATOM 1595 CB MET A 97 -3.413 -1.536 -5.070 1.00 0.00 C ATOM 1596 CG MET A 97 -4.249 -2.456 -4.196 1.00 0.00 C ATOM 1597 SD MET A 97 -3.865 -2.264 -2.445 1.00 0.00 S ATOM 1598 CE MET A 97 -4.906 -3.530 -1.721 1.00 0.00 C ATOM 0 H MET A 97 -4.986 -0.148 -6.389 1.00 0.00 H new ATOM 0 HA MET A 97 -4.026 0.066 -3.773 1.00 0.00 H new ATOM 0 HB2 MET A 97 -3.644 -1.735 -6.117 1.00 0.00 H new ATOM 0 HB3 MET A 97 -2.358 -1.771 -4.926 1.00 0.00 H new ATOM 0 HG2 MET A 97 -5.306 -2.248 -4.359 1.00 0.00 H new ATOM 0 HG3 MET A 97 -4.078 -3.491 -4.493 1.00 0.00 H new ATOM 0 HE1 MET A 97 -5.417 -3.125 -0.847 1.00 0.00 H new ATOM 0 HE2 MET A 97 -5.644 -3.857 -2.453 1.00 0.00 H new ATOM 0 HE3 MET A 97 -4.291 -4.379 -1.421 1.00 0.00 H new ATOM 1608 N ARG A 98 -1.770 0.818 -6.076 1.00 0.00 N ATOM 1609 CA ARG A 98 -0.455 1.416 -6.258 1.00 0.00 C ATOM 1610 C ARG A 98 -0.481 2.921 -5.980 1.00 0.00 C ATOM 1611 O ARG A 98 0.515 3.488 -5.537 1.00 0.00 O ATOM 1612 CB ARG A 98 0.078 1.129 -7.668 1.00 0.00 C ATOM 1613 CG ARG A 98 1.502 1.618 -7.889 1.00 0.00 C ATOM 1614 CD ARG A 98 2.104 1.065 -9.173 1.00 0.00 C ATOM 1615 NE ARG A 98 1.337 1.437 -10.362 1.00 0.00 N ATOM 1616 CZ ARG A 98 1.743 2.333 -11.262 1.00 0.00 C ATOM 1617 NH1 ARG A 98 2.900 2.963 -11.104 1.00 0.00 N ATOM 1618 NH2 ARG A 98 0.996 2.591 -12.327 1.00 0.00 N ATOM 0 H ARG A 98 -2.220 0.510 -6.938 1.00 0.00 H new ATOM 0 HA ARG A 98 0.222 0.961 -5.535 1.00 0.00 H new ATOM 0 HB2 ARG A 98 0.038 0.055 -7.851 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -0.578 1.602 -8.399 1.00 0.00 H new ATOM 0 HG2 ARG A 98 1.509 2.707 -7.925 1.00 0.00 H new ATOM 0 HG3 ARG A 98 2.122 1.323 -7.042 1.00 0.00 H new ATOM 0 HD2 ARG A 98 3.126 1.429 -9.276 1.00 0.00 H new ATOM 0 HD3 ARG A 98 2.158 -0.022 -9.106 1.00 0.00 H new ATOM 0 HE ARG A 98 0.436 0.983 -10.512 1.00 0.00 H new ATOM 0 HH11 ARG A 98 3.483 2.763 -10.291 1.00 0.00 H new ATOM 0 HH12 ARG A 98 3.206 3.648 -11.795 1.00 0.00 H new ATOM 0 HH21 ARG A 98 0.110 2.104 -12.458 1.00 0.00 H new ATOM 0 HH22 ARG A 98 1.308 3.277 -13.015 1.00 0.00 H new ATOM 1632 N LYS A 99 -1.620 3.565 -6.222 1.00 0.00 N ATOM 1633 CA LYS A 99 -1.752 4.995 -5.956 1.00 0.00 C ATOM 1634 C LYS A 99 -1.768 5.260 -4.454 1.00 0.00 C ATOM 1635 O LYS A 99 -1.138 6.208 -3.976 1.00 0.00 O ATOM 1636 CB LYS A 99 -3.025 5.560 -6.594 1.00 0.00 C ATOM 1637 CG LYS A 99 -3.175 7.064 -6.419 1.00 0.00 C ATOM 1638 CD LYS A 99 -2.074 7.822 -7.145 1.00 0.00 C ATOM 1639 CE LYS A 99 -2.157 9.317 -6.882 1.00 0.00 C ATOM 1640 NZ LYS A 99 -1.798 9.665 -5.479 1.00 0.00 N ATOM 0 H LYS A 99 -2.459 3.124 -6.599 1.00 0.00 H new ATOM 0 HA LYS A 99 -0.891 5.496 -6.399 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -3.024 5.324 -7.658 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -3.892 5.063 -6.158 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.147 7.380 -6.798 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -3.150 7.312 -5.358 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -1.102 7.449 -6.824 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -2.149 7.636 -8.216 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -1.490 9.842 -7.566 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -3.168 9.665 -7.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -1.704 10.697 -5.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -2.543 9.329 -4.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -0.896 9.212 -5.229 1.00 0.00 H new ATOM 1654 N ALA A 100 -2.491 4.423 -3.719 1.00 0.00 N ATOM 1655 CA ALA A 100 -2.560 4.543 -2.271 1.00 0.00 C ATOM 1656 C ALA A 100 -1.198 4.263 -1.653 1.00 0.00 C ATOM 1657 O ALA A 100 -0.741 4.986 -0.763 1.00 0.00 O ATOM 1658 CB ALA A 100 -3.608 3.596 -1.714 1.00 0.00 C ATOM 0 H ALA A 100 -3.038 3.653 -4.105 1.00 0.00 H new ATOM 0 HA ALA A 100 -2.849 5.563 -2.016 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -3.649 3.696 -0.629 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -4.582 3.841 -2.138 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -3.346 2.570 -1.974 1.00 0.00 H new ATOM 1664 N LEU A 101 -0.547 3.217 -2.146 1.00 0.00 N ATOM 1665 CA LEU A 101 0.794 2.871 -1.707 1.00 0.00 C ATOM 1666 C LEU A 101 1.774 3.986 -2.038 1.00 0.00 C ATOM 1667 O LEU A 101 2.618 4.341 -1.214 1.00 0.00 O ATOM 1668 CB LEU A 101 1.239 1.560 -2.350 1.00 0.00 C ATOM 1669 CG LEU A 101 0.551 0.319 -1.790 1.00 0.00 C ATOM 1670 CD1 LEU A 101 0.889 -0.906 -2.622 1.00 0.00 C ATOM 1671 CD2 LEU A 101 0.957 0.114 -0.339 1.00 0.00 C ATOM 0 H LEU A 101 -0.931 2.592 -2.854 1.00 0.00 H new ATOM 0 HA LEU A 101 0.779 2.742 -0.625 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.050 1.613 -3.422 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.316 1.453 -2.221 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.528 0.466 -1.835 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.388 -1.779 -2.204 1.00 0.00 H new ATOM 0 HD12 LEU A 101 0.555 -0.752 -3.648 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.967 -1.067 -2.611 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.462 -0.774 0.055 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.038 -0.016 -0.278 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.662 0.984 0.248 1.00 0.00 H new ATOM 1683 N ARG A 102 1.648 4.544 -3.241 1.00 0.00 N ATOM 1684 CA ARG A 102 2.479 5.667 -3.651 1.00 0.00 C ATOM 1685 C ARG A 102 2.338 6.811 -2.662 1.00 0.00 C ATOM 1686 O ARG A 102 3.331 7.324 -2.164 1.00 0.00 O ATOM 1687 CB ARG A 102 2.106 6.147 -5.059 1.00 0.00 C ATOM 1688 CG ARG A 102 2.874 7.384 -5.502 1.00 0.00 C ATOM 1689 CD ARG A 102 2.466 7.840 -6.896 1.00 0.00 C ATOM 1690 NE ARG A 102 3.022 6.994 -7.954 1.00 0.00 N ATOM 1691 CZ ARG A 102 2.546 6.957 -9.203 1.00 0.00 C ATOM 1692 NH1 ARG A 102 1.478 7.672 -9.534 1.00 0.00 N ATOM 1693 NH2 ARG A 102 3.147 6.221 -10.132 1.00 0.00 N ATOM 0 H ARG A 102 0.978 4.235 -3.946 1.00 0.00 H new ATOM 0 HA ARG A 102 3.515 5.330 -3.668 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.290 5.341 -5.770 1.00 0.00 H new ATOM 0 HB3 ARG A 102 1.038 6.362 -5.090 1.00 0.00 H new ATOM 0 HG2 ARG A 102 2.701 8.192 -4.791 1.00 0.00 H new ATOM 0 HG3 ARG A 102 3.943 7.171 -5.489 1.00 0.00 H new ATOM 0 HD2 ARG A 102 1.379 7.839 -6.970 1.00 0.00 H new ATOM 0 HD3 ARG A 102 2.795 8.868 -7.048 1.00 0.00 H new ATOM 0 HE ARG A 102 3.818 6.399 -7.725 1.00 0.00 H new ATOM 0 HH11 ARG A 102 1.016 8.253 -8.834 1.00 0.00 H new ATOM 0 HH12 ARG A 102 1.119 7.640 -10.488 1.00 0.00 H new ATOM 0 HH21 ARG A 102 3.978 5.679 -9.895 1.00 0.00 H new ATOM 0 HH22 ARG A 102 2.778 6.198 -11.082 1.00 0.00 H new ATOM 1707 N ALA A 103 1.097 7.172 -2.359 1.00 0.00 N ATOM 1708 CA ALA A 103 0.813 8.291 -1.470 1.00 0.00 C ATOM 1709 C ALA A 103 1.475 8.117 -0.107 1.00 0.00 C ATOM 1710 O ALA A 103 1.954 9.087 0.482 1.00 0.00 O ATOM 1711 CB ALA A 103 -0.687 8.463 -1.307 1.00 0.00 C ATOM 0 H ALA A 103 0.266 6.702 -2.719 1.00 0.00 H new ATOM 0 HA ALA A 103 1.232 9.188 -1.926 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -0.887 9.302 -0.641 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.139 8.657 -2.280 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.114 7.554 -0.883 1.00 0.00 H new ATOM 1717 N LYS A 104 1.517 6.886 0.387 1.00 0.00 N ATOM 1718 CA LYS A 104 2.090 6.619 1.698 1.00 0.00 C ATOM 1719 C LYS A 104 3.601 6.855 1.689 1.00 0.00 C ATOM 1720 O LYS A 104 4.119 7.646 2.483 1.00 0.00 O ATOM 1721 CB LYS A 104 1.792 5.188 2.148 1.00 0.00 C ATOM 1722 CG LYS A 104 1.989 4.988 3.641 1.00 0.00 C ATOM 1723 CD LYS A 104 1.901 3.525 4.051 1.00 0.00 C ATOM 1724 CE LYS A 104 3.077 2.723 3.518 1.00 0.00 C ATOM 1725 NZ LYS A 104 3.223 1.424 4.221 1.00 0.00 N ATOM 0 H LYS A 104 1.163 6.061 -0.098 1.00 0.00 H new ATOM 0 HA LYS A 104 1.629 7.309 2.405 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.765 4.935 1.885 1.00 0.00 H new ATOM 0 HB3 LYS A 104 2.439 4.499 1.605 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.961 5.385 3.932 1.00 0.00 H new ATOM 0 HG3 LYS A 104 1.236 5.560 4.183 1.00 0.00 H new ATOM 0 HD2 LYS A 104 1.873 3.452 5.138 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.970 3.098 3.679 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.942 2.546 2.451 1.00 0.00 H new ATOM 0 HE3 LYS A 104 3.993 3.302 3.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 4.195 1.073 4.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 3.022 1.553 5.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.555 0.735 3.820 1.00 0.00 H new ATOM 1739 N PHE A 105 4.302 6.180 0.781 1.00 0.00 N ATOM 1740 CA PHE A 105 5.759 6.287 0.706 1.00 0.00 C ATOM 1741 C PHE A 105 6.188 7.663 0.195 1.00 0.00 C ATOM 1742 O PHE A 105 7.258 8.162 0.544 1.00 0.00 O ATOM 1743 CB PHE A 105 6.334 5.187 -0.194 1.00 0.00 C ATOM 1744 CG PHE A 105 6.101 3.795 0.327 1.00 0.00 C ATOM 1745 CD1 PHE A 105 6.817 3.318 1.412 1.00 0.00 C ATOM 1746 CD2 PHE A 105 5.168 2.964 -0.271 1.00 0.00 C ATOM 1747 CE1 PHE A 105 6.607 2.038 1.892 1.00 0.00 C ATOM 1748 CE2 PHE A 105 4.954 1.684 0.202 1.00 0.00 C ATOM 1749 CZ PHE A 105 5.675 1.220 1.284 1.00 0.00 C ATOM 0 H PHE A 105 3.888 5.555 0.089 1.00 0.00 H new ATOM 0 HA PHE A 105 6.154 6.160 1.714 1.00 0.00 H new ATOM 0 HB2 PHE A 105 5.891 5.273 -1.186 1.00 0.00 H new ATOM 0 HB3 PHE A 105 7.406 5.348 -0.309 1.00 0.00 H new ATOM 0 HD1 PHE A 105 7.548 3.953 1.889 1.00 0.00 H new ATOM 0 HD2 PHE A 105 4.601 3.321 -1.118 1.00 0.00 H new ATOM 0 HE1 PHE A 105 7.171 1.679 2.740 1.00 0.00 H new ATOM 0 HE2 PHE A 105 4.223 1.047 -0.274 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.510 0.219 1.654 1.00 0.00 H new ATOM 1759 N GLU A 106 5.349 8.272 -0.632 1.00 0.00 N ATOM 1760 CA GLU A 106 5.624 9.598 -1.175 1.00 0.00 C ATOM 1761 C GLU A 106 5.582 10.649 -0.071 1.00 0.00 C ATOM 1762 O GLU A 106 6.455 11.515 0.017 1.00 0.00 O ATOM 1763 CB GLU A 106 4.592 9.945 -2.253 1.00 0.00 C ATOM 1764 CG GLU A 106 4.864 11.245 -2.988 1.00 0.00 C ATOM 1765 CD GLU A 106 3.689 11.675 -3.849 1.00 0.00 C ATOM 1766 OE1 GLU A 106 3.423 11.018 -4.880 1.00 0.00 O ATOM 1767 OE2 GLU A 106 3.013 12.667 -3.496 1.00 0.00 O ATOM 0 H GLU A 106 4.466 7.867 -0.944 1.00 0.00 H new ATOM 0 HA GLU A 106 6.621 9.590 -1.615 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.556 9.132 -2.979 1.00 0.00 H new ATOM 0 HB3 GLU A 106 3.607 10.003 -1.790 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.088 12.029 -2.265 1.00 0.00 H new ATOM 0 HG3 GLU A 106 5.748 11.128 -3.615 1.00 0.00 H new ATOM 1774 N GLN A 107 4.571 10.553 0.781 1.00 0.00 N ATOM 1775 CA GLN A 107 4.318 11.571 1.788 1.00 0.00 C ATOM 1776 C GLN A 107 5.153 11.348 3.049 1.00 0.00 C ATOM 1777 O GLN A 107 5.526 12.305 3.723 1.00 0.00 O ATOM 1778 CB GLN A 107 2.824 11.598 2.116 1.00 0.00 C ATOM 1779 CG GLN A 107 2.399 12.736 3.029 1.00 0.00 C ATOM 1780 CD GLN A 107 0.932 13.081 2.861 1.00 0.00 C ATOM 1781 OE1 GLN A 107 0.262 13.485 3.808 1.00 0.00 O ATOM 1782 NE2 GLN A 107 0.426 12.935 1.642 1.00 0.00 N ATOM 0 H GLN A 107 3.910 9.776 0.794 1.00 0.00 H new ATOM 0 HA GLN A 107 4.617 12.538 1.383 1.00 0.00 H new ATOM 0 HB2 GLN A 107 2.262 11.667 1.185 1.00 0.00 H new ATOM 0 HB3 GLN A 107 2.551 10.652 2.584 1.00 0.00 H new ATOM 0 HG2 GLN A 107 2.590 12.460 4.066 1.00 0.00 H new ATOM 0 HG3 GLN A 107 3.005 13.617 2.817 1.00 0.00 H new ATOM 0 HE21 GLN A 107 1.016 12.596 0.882 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -0.553 13.161 1.466 1.00 0.00 H new ATOM 1791 N HIS A 108 5.451 10.097 3.374 1.00 0.00 N ATOM 1792 CA HIS A 108 6.281 9.808 4.537 1.00 0.00 C ATOM 1793 C HIS A 108 7.658 9.315 4.116 1.00 0.00 C ATOM 1794 O HIS A 108 7.809 8.210 3.592 1.00 0.00 O ATOM 1795 CB HIS A 108 5.605 8.797 5.468 1.00 0.00 C ATOM 1796 CG HIS A 108 4.616 9.426 6.399 1.00 0.00 C ATOM 1797 ND1 HIS A 108 4.919 9.756 7.702 1.00 0.00 N ATOM 1798 CD2 HIS A 108 3.327 9.795 6.211 1.00 0.00 C ATOM 1799 CE1 HIS A 108 3.862 10.303 8.275 1.00 0.00 C ATOM 1800 NE2 HIS A 108 2.883 10.339 7.393 1.00 0.00 N ATOM 0 H HIS A 108 5.136 9.276 2.857 1.00 0.00 H new ATOM 0 HA HIS A 108 6.407 10.739 5.090 1.00 0.00 H new ATOM 0 HB2 HIS A 108 5.100 8.041 4.868 1.00 0.00 H new ATOM 0 HB3 HIS A 108 6.368 8.283 6.052 1.00 0.00 H new ATOM 0 HD1 HIS A 108 5.820 9.602 8.154 1.00 0.00 H new ATOM 0 HD2 HIS A 108 2.754 9.683 5.302 1.00 0.00 H new ATOM 0 HE1 HIS A 108 3.809 10.660 9.293 1.00 0.00 H new ATOM 1809 N ALA A 109 8.659 10.150 4.363 1.00 0.00 N ATOM 1810 CA ALA A 109 10.032 9.864 3.967 1.00 0.00 C ATOM 1811 C ALA A 109 10.608 8.690 4.752 1.00 0.00 C ATOM 1812 O ALA A 109 11.509 8.003 4.272 1.00 0.00 O ATOM 1813 CB ALA A 109 10.901 11.098 4.153 1.00 0.00 C ATOM 0 H ALA A 109 8.543 11.043 4.842 1.00 0.00 H new ATOM 0 HA ALA A 109 10.024 9.588 2.913 1.00 0.00 H new ATOM 0 HB1 ALA A 109 11.924 10.871 3.854 1.00 0.00 H new ATOM 0 HB2 ALA A 109 10.515 11.911 3.538 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.888 11.398 5.201 1.00 0.00 H new ATOM 1819 N GLU A 110 10.089 8.468 5.956 1.00 0.00 N ATOM 1820 CA GLU A 110 10.532 7.359 6.795 1.00 0.00 C ATOM 1821 C GLU A 110 10.313 6.043 6.068 1.00 0.00 C ATOM 1822 O GLU A 110 11.214 5.211 5.960 1.00 0.00 O ATOM 1823 CB GLU A 110 9.762 7.312 8.123 1.00 0.00 C ATOM 1824 CG GLU A 110 9.530 8.662 8.781 1.00 0.00 C ATOM 1825 CD GLU A 110 8.298 9.369 8.252 1.00 0.00 C ATOM 1826 OE1 GLU A 110 8.402 10.074 7.231 1.00 0.00 O ATOM 1827 OE2 GLU A 110 7.213 9.208 8.849 1.00 0.00 O ATOM 0 H GLU A 110 9.358 9.044 6.374 1.00 0.00 H new ATOM 0 HA GLU A 110 11.591 7.512 7.005 1.00 0.00 H new ATOM 0 HB2 GLU A 110 8.795 6.839 7.948 1.00 0.00 H new ATOM 0 HB3 GLU A 110 10.307 6.675 8.819 1.00 0.00 H new ATOM 0 HG2 GLU A 110 9.430 8.524 9.858 1.00 0.00 H new ATOM 0 HG3 GLU A 110 10.403 9.294 8.620 1.00 0.00 H new ATOM 1834 N LEU A 111 9.106 5.887 5.551 1.00 0.00 N ATOM 1835 CA LEU A 111 8.696 4.657 4.900 1.00 0.00 C ATOM 1836 C LEU A 111 9.370 4.527 3.544 1.00 0.00 C ATOM 1837 O LEU A 111 9.741 3.434 3.124 1.00 0.00 O ATOM 1838 CB LEU A 111 7.176 4.639 4.747 1.00 0.00 C ATOM 1839 CG LEU A 111 6.402 5.018 6.011 1.00 0.00 C ATOM 1840 CD1 LEU A 111 4.909 4.909 5.772 1.00 0.00 C ATOM 1841 CD2 LEU A 111 6.822 4.145 7.185 1.00 0.00 C ATOM 0 H LEU A 111 8.385 6.608 5.571 1.00 0.00 H new ATOM 0 HA LEU A 111 9.000 3.809 5.514 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.897 5.325 3.947 1.00 0.00 H new ATOM 0 HB3 LEU A 111 6.868 3.641 4.434 1.00 0.00 H new ATOM 0 HG LEU A 111 6.637 6.053 6.257 1.00 0.00 H new ATOM 0 HD11 LEU A 111 4.374 5.182 6.682 1.00 0.00 H new ATOM 0 HD12 LEU A 111 4.620 5.582 4.965 1.00 0.00 H new ATOM 0 HD13 LEU A 111 4.658 3.884 5.498 1.00 0.00 H new ATOM 0 HD21 LEU A 111 6.258 4.433 8.072 1.00 0.00 H new ATOM 0 HD22 LEU A 111 6.621 3.099 6.951 1.00 0.00 H new ATOM 0 HD23 LEU A 111 7.887 4.277 7.373 1.00 0.00 H new ATOM 1853 N ARG A 112 9.537 5.655 2.865 1.00 0.00 N ATOM 1854 CA ARG A 112 10.224 5.673 1.585 1.00 0.00 C ATOM 1855 C ARG A 112 11.690 5.290 1.760 1.00 0.00 C ATOM 1856 O ARG A 112 12.253 4.570 0.937 1.00 0.00 O ATOM 1857 CB ARG A 112 10.097 7.048 0.931 1.00 0.00 C ATOM 1858 CG ARG A 112 10.925 7.211 -0.333 1.00 0.00 C ATOM 1859 CD ARG A 112 10.165 7.968 -1.411 1.00 0.00 C ATOM 1860 NE ARG A 112 9.560 9.204 -0.912 1.00 0.00 N ATOM 1861 CZ ARG A 112 9.765 10.406 -1.451 1.00 0.00 C ATOM 1862 NH1 ARG A 112 10.598 10.546 -2.476 1.00 0.00 N ATOM 1863 NH2 ARG A 112 9.135 11.469 -0.965 1.00 0.00 N ATOM 0 H ARG A 112 9.206 6.567 3.181 1.00 0.00 H new ATOM 0 HA ARG A 112 9.756 4.938 0.930 1.00 0.00 H new ATOM 0 HB2 ARG A 112 9.049 7.230 0.692 1.00 0.00 H new ATOM 0 HB3 ARG A 112 10.397 7.810 1.650 1.00 0.00 H new ATOM 0 HG2 ARG A 112 11.847 7.742 -0.098 1.00 0.00 H new ATOM 0 HG3 ARG A 112 11.210 6.229 -0.710 1.00 0.00 H new ATOM 0 HD2 ARG A 112 10.844 8.205 -2.230 1.00 0.00 H new ATOM 0 HD3 ARG A 112 9.385 7.325 -1.819 1.00 0.00 H new ATOM 0 HE ARG A 112 8.943 9.142 -0.102 1.00 0.00 H new ATOM 0 HH11 ARG A 112 11.083 9.732 -2.853 1.00 0.00 H new ATOM 0 HH12 ARG A 112 10.752 11.467 -2.886 1.00 0.00 H new ATOM 0 HH21 ARG A 112 8.494 11.366 -0.179 1.00 0.00 H new ATOM 0 HH22 ARG A 112 9.293 12.388 -1.378 1.00 0.00 H new ATOM 1877 N ALA A 113 12.298 5.767 2.841 1.00 0.00 N ATOM 1878 CA ALA A 113 13.667 5.391 3.170 1.00 0.00 C ATOM 1879 C ALA A 113 13.752 3.891 3.403 1.00 0.00 C ATOM 1880 O ALA A 113 14.652 3.224 2.896 1.00 0.00 O ATOM 1881 CB ALA A 113 14.153 6.149 4.398 1.00 0.00 C ATOM 0 H ALA A 113 11.866 6.413 3.502 1.00 0.00 H new ATOM 0 HA ALA A 113 14.312 5.655 2.332 1.00 0.00 H new ATOM 0 HB1 ALA A 113 15.177 5.853 4.626 1.00 0.00 H new ATOM 0 HB2 ALA A 113 14.120 7.221 4.201 1.00 0.00 H new ATOM 0 HB3 ALA A 113 13.510 5.916 5.247 1.00 0.00 H new ATOM 1887 N LEU A 114 12.792 3.373 4.157 1.00 0.00 N ATOM 1888 CA LEU A 114 12.707 1.945 4.436 1.00 0.00 C ATOM 1889 C LEU A 114 12.536 1.154 3.142 1.00 0.00 C ATOM 1890 O LEU A 114 13.231 0.163 2.909 1.00 0.00 O ATOM 1891 CB LEU A 114 11.529 1.673 5.377 1.00 0.00 C ATOM 1892 CG LEU A 114 11.335 0.211 5.784 1.00 0.00 C ATOM 1893 CD1 LEU A 114 12.545 -0.294 6.551 1.00 0.00 C ATOM 1894 CD2 LEU A 114 10.071 0.057 6.616 1.00 0.00 C ATOM 0 H LEU A 114 12.054 3.927 4.591 1.00 0.00 H new ATOM 0 HA LEU A 114 13.633 1.625 4.914 1.00 0.00 H new ATOM 0 HB2 LEU A 114 11.663 2.269 6.280 1.00 0.00 H new ATOM 0 HB3 LEU A 114 10.615 2.023 4.897 1.00 0.00 H new ATOM 0 HG LEU A 114 11.229 -0.389 4.880 1.00 0.00 H new ATOM 0 HD11 LEU A 114 12.389 -1.335 6.832 1.00 0.00 H new ATOM 0 HD12 LEU A 114 13.432 -0.217 5.923 1.00 0.00 H new ATOM 0 HD13 LEU A 114 12.683 0.308 7.449 1.00 0.00 H new ATOM 0 HD21 LEU A 114 9.946 -0.988 6.898 1.00 0.00 H new ATOM 0 HD22 LEU A 114 10.150 0.668 7.515 1.00 0.00 H new ATOM 0 HD23 LEU A 114 9.209 0.380 6.032 1.00 0.00 H new ATOM 1906 N LEU A 115 11.618 1.611 2.299 1.00 0.00 N ATOM 1907 CA LEU A 115 11.338 0.962 1.026 1.00 0.00 C ATOM 1908 C LEU A 115 12.586 0.914 0.144 1.00 0.00 C ATOM 1909 O LEU A 115 12.958 -0.145 -0.361 1.00 0.00 O ATOM 1910 CB LEU A 115 10.203 1.696 0.301 1.00 0.00 C ATOM 1911 CG LEU A 115 9.812 1.123 -1.061 1.00 0.00 C ATOM 1912 CD1 LEU A 115 9.405 -0.336 -0.934 1.00 0.00 C ATOM 1913 CD2 LEU A 115 8.684 1.942 -1.674 1.00 0.00 C ATOM 0 H LEU A 115 11.049 2.439 2.478 1.00 0.00 H new ATOM 0 HA LEU A 115 11.029 -0.064 1.227 1.00 0.00 H new ATOM 0 HB2 LEU A 115 9.323 1.692 0.944 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.495 2.738 0.167 1.00 0.00 H new ATOM 0 HG LEU A 115 10.679 1.177 -1.720 1.00 0.00 H new ATOM 0 HD11 LEU A 115 9.131 -0.724 -1.915 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.240 -0.913 -0.536 1.00 0.00 H new ATOM 0 HD13 LEU A 115 8.553 -0.419 -0.260 1.00 0.00 H new ATOM 0 HD21 LEU A 115 8.416 1.523 -2.644 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.816 1.917 -1.015 1.00 0.00 H new ATOM 0 HD23 LEU A 115 9.012 2.974 -1.803 1.00 0.00 H new ATOM 1925 N LEU A 116 13.243 2.054 -0.026 1.00 0.00 N ATOM 1926 CA LEU A 116 14.422 2.126 -0.885 1.00 0.00 C ATOM 1927 C LEU A 116 15.641 1.463 -0.238 1.00 0.00 C ATOM 1928 O LEU A 116 16.653 1.238 -0.901 1.00 0.00 O ATOM 1929 CB LEU A 116 14.746 3.580 -1.263 1.00 0.00 C ATOM 1930 CG LEU A 116 13.996 4.133 -2.487 1.00 0.00 C ATOM 1931 CD1 LEU A 116 12.520 4.344 -2.190 1.00 0.00 C ATOM 1932 CD2 LEU A 116 14.626 5.432 -2.958 1.00 0.00 C ATOM 0 H LEU A 116 12.984 2.936 0.415 1.00 0.00 H new ATOM 0 HA LEU A 116 14.184 1.574 -1.795 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.525 4.217 -0.406 1.00 0.00 H new ATOM 0 HB3 LEU A 116 15.817 3.658 -1.450 1.00 0.00 H new ATOM 0 HG LEU A 116 14.076 3.392 -3.282 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.023 4.735 -3.077 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.066 3.394 -1.909 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.412 5.054 -1.370 1.00 0.00 H new ATOM 0 HD21 LEU A 116 14.081 5.807 -3.824 1.00 0.00 H new ATOM 0 HD22 LEU A 116 14.584 6.169 -2.156 1.00 0.00 H new ATOM 0 HD23 LEU A 116 15.666 5.254 -3.232 1.00 0.00 H new ATOM 1944 N ALA A 117 15.541 1.141 1.046 1.00 0.00 N ATOM 1945 CA ALA A 117 16.633 0.479 1.753 1.00 0.00 C ATOM 1946 C ALA A 117 16.608 -1.028 1.519 1.00 0.00 C ATOM 1947 O ALA A 117 17.621 -1.706 1.693 1.00 0.00 O ATOM 1948 CB ALA A 117 16.572 0.777 3.245 1.00 0.00 C ATOM 0 H ALA A 117 14.718 1.327 1.619 1.00 0.00 H new ATOM 0 HA ALA A 117 17.568 0.873 1.355 1.00 0.00 H new ATOM 0 HB1 ALA A 117 17.396 0.273 3.751 1.00 0.00 H new ATOM 0 HB2 ALA A 117 16.652 1.852 3.405 1.00 0.00 H new ATOM 0 HB3 ALA A 117 15.625 0.419 3.649 1.00 0.00 H new ATOM 1954 N THR A 118 15.449 -1.550 1.130 1.00 0.00 N ATOM 1955 CA THR A 118 15.315 -2.978 0.877 1.00 0.00 C ATOM 1956 C THR A 118 15.801 -3.329 -0.525 1.00 0.00 C ATOM 1957 O THR A 118 16.145 -4.472 -0.805 1.00 0.00 O ATOM 1958 CB THR A 118 13.861 -3.463 1.052 1.00 0.00 C ATOM 1959 OG1 THR A 118 12.986 -2.782 0.140 1.00 0.00 O ATOM 1960 CG2 THR A 118 13.387 -3.240 2.480 1.00 0.00 C ATOM 0 H THR A 118 14.596 -1.010 0.984 1.00 0.00 H new ATOM 0 HA THR A 118 15.935 -3.487 1.615 1.00 0.00 H new ATOM 0 HB THR A 118 13.837 -4.531 0.835 1.00 0.00 H new ATOM 0 HG1 THR A 118 13.097 -1.814 0.242 1.00 0.00 H new ATOM 0 HG21 THR A 118 12.359 -3.589 2.581 1.00 0.00 H new ATOM 0 HG22 THR A 118 14.027 -3.794 3.167 1.00 0.00 H new ATOM 0 HG23 THR A 118 13.434 -2.177 2.717 1.00 0.00 H new ATOM 1968 N ALA A 119 15.828 -2.334 -1.402 1.00 0.00 N ATOM 1969 CA ALA A 119 16.282 -2.531 -2.775 1.00 0.00 C ATOM 1970 C ALA A 119 17.726 -3.030 -2.813 1.00 0.00 C ATOM 1971 O ALA A 119 18.565 -2.577 -2.035 1.00 0.00 O ATOM 1972 CB ALA A 119 16.156 -1.236 -3.560 1.00 0.00 C ATOM 0 H ALA A 119 15.540 -1.379 -1.187 1.00 0.00 H new ATOM 0 HA ALA A 119 15.649 -3.290 -3.234 1.00 0.00 H new ATOM 0 HB1 ALA A 119 16.498 -1.396 -4.583 1.00 0.00 H new ATOM 0 HB2 ALA A 119 15.114 -0.917 -3.571 1.00 0.00 H new ATOM 0 HB3 ALA A 119 16.766 -0.465 -3.090 1.00 0.00 H new ATOM 1978 N PRO A 120 18.047 -3.952 -3.738 1.00 0.00 N ATOM 1979 CA PRO A 120 17.113 -4.488 -4.719 1.00 0.00 C ATOM 1980 C PRO A 120 16.548 -5.862 -4.344 1.00 0.00 C ATOM 1981 O PRO A 120 16.406 -6.733 -5.204 1.00 0.00 O ATOM 1982 CB PRO A 120 18.013 -4.604 -5.946 1.00 0.00 C ATOM 1983 CG PRO A 120 19.382 -4.904 -5.404 1.00 0.00 C ATOM 1984 CD PRO A 120 19.380 -4.528 -3.937 1.00 0.00 C ATOM 0 HA PRO A 120 16.226 -3.866 -4.836 1.00 0.00 H new ATOM 0 HB2 PRO A 120 17.671 -5.396 -6.612 1.00 0.00 H new ATOM 0 HB3 PRO A 120 18.012 -3.680 -6.524 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.622 -5.960 -5.529 1.00 0.00 H new ATOM 0 HG3 PRO A 120 20.141 -4.339 -5.944 1.00 0.00 H new ATOM 0 HD2 PRO A 120 19.542 -5.397 -3.299 1.00 0.00 H new ATOM 0 HD3 PRO A 120 20.167 -3.811 -3.705 1.00 0.00 H new ATOM 1992 N ALA A 121 16.211 -6.053 -3.075 1.00 0.00 N ATOM 1993 CA ALA A 121 15.617 -7.308 -2.630 1.00 0.00 C ATOM 1994 C ALA A 121 14.186 -7.437 -3.142 1.00 0.00 C ATOM 1995 O ALA A 121 13.583 -6.457 -3.587 1.00 0.00 O ATOM 1996 CB ALA A 121 15.642 -7.400 -1.116 1.00 0.00 C ATOM 0 H ALA A 121 16.338 -5.359 -2.338 1.00 0.00 H new ATOM 0 HA ALA A 121 16.207 -8.128 -3.039 1.00 0.00 H new ATOM 0 HB1 ALA A 121 15.195 -8.343 -0.801 1.00 0.00 H new ATOM 0 HB2 ALA A 121 16.673 -7.353 -0.766 1.00 0.00 H new ATOM 0 HB3 ALA A 121 15.076 -6.571 -0.692 1.00 0.00 H new ATOM 2002 N LYS A 122 13.641 -8.641 -3.069 1.00 0.00 N ATOM 2003 CA LYS A 122 12.301 -8.894 -3.569 1.00 0.00 C ATOM 2004 C LYS A 122 11.269 -8.786 -2.462 1.00 0.00 C ATOM 2005 O LYS A 122 11.371 -9.447 -1.425 1.00 0.00 O ATOM 2006 CB LYS A 122 12.232 -10.267 -4.225 1.00 0.00 C ATOM 2007 CG LYS A 122 12.883 -10.306 -5.594 1.00 0.00 C ATOM 2008 CD LYS A 122 13.231 -11.721 -6.007 1.00 0.00 C ATOM 2009 CE LYS A 122 13.675 -11.777 -7.454 1.00 0.00 C ATOM 2010 NZ LYS A 122 14.451 -13.010 -7.739 1.00 0.00 N ATOM 0 H LYS A 122 14.106 -9.456 -2.669 1.00 0.00 H new ATOM 0 HA LYS A 122 12.072 -8.133 -4.315 1.00 0.00 H new ATOM 0 HB2 LYS A 122 12.718 -10.997 -3.578 1.00 0.00 H new ATOM 0 HB3 LYS A 122 11.188 -10.567 -4.317 1.00 0.00 H new ATOM 0 HG2 LYS A 122 12.210 -9.867 -6.330 1.00 0.00 H new ATOM 0 HG3 LYS A 122 13.787 -9.697 -5.585 1.00 0.00 H new ATOM 0 HD2 LYS A 122 14.024 -12.105 -5.366 1.00 0.00 H new ATOM 0 HD3 LYS A 122 12.365 -12.367 -5.865 1.00 0.00 H new ATOM 0 HE2 LYS A 122 12.802 -11.737 -8.105 1.00 0.00 H new ATOM 0 HE3 LYS A 122 14.284 -10.902 -7.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 14.449 -13.192 -8.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 15.430 -12.887 -7.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 14.018 -13.815 -7.243 1.00 0.00 H new ATOM 2024 N LEU A 123 10.276 -7.945 -2.694 1.00 0.00 N ATOM 2025 CA LEU A 123 9.208 -7.731 -1.738 1.00 0.00 C ATOM 2026 C LEU A 123 8.108 -8.759 -1.942 1.00 0.00 C ATOM 2027 O LEU A 123 7.295 -8.647 -2.864 1.00 0.00 O ATOM 2028 CB LEU A 123 8.641 -6.317 -1.890 1.00 0.00 C ATOM 2029 CG LEU A 123 9.676 -5.189 -1.824 1.00 0.00 C ATOM 2030 CD1 LEU A 123 9.007 -3.841 -2.026 1.00 0.00 C ATOM 2031 CD2 LEU A 123 10.425 -5.220 -0.499 1.00 0.00 C ATOM 0 H LEU A 123 10.189 -7.394 -3.548 1.00 0.00 H new ATOM 0 HA LEU A 123 9.611 -7.843 -0.731 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.118 -6.253 -2.844 1.00 0.00 H new ATOM 0 HB3 LEU A 123 7.899 -6.154 -1.108 1.00 0.00 H new ATOM 0 HG LEU A 123 10.398 -5.341 -2.627 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.757 -3.052 -1.976 1.00 0.00 H new ATOM 0 HD12 LEU A 123 8.521 -3.819 -3.001 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.262 -3.684 -1.246 1.00 0.00 H new ATOM 0 HD21 LEU A 123 11.154 -4.410 -0.474 1.00 0.00 H new ATOM 0 HD22 LEU A 123 9.718 -5.097 0.322 1.00 0.00 H new ATOM 0 HD23 LEU A 123 10.939 -6.175 -0.394 1.00 0.00 H new ATOM 2043 N VAL A 124 8.096 -9.769 -1.095 1.00 0.00 N ATOM 2044 CA VAL A 124 7.113 -10.828 -1.193 1.00 0.00 C ATOM 2045 C VAL A 124 6.225 -10.841 0.041 1.00 0.00 C ATOM 2046 O VAL A 124 6.655 -11.216 1.132 1.00 0.00 O ATOM 2047 CB VAL A 124 7.784 -12.209 -1.377 1.00 0.00 C ATOM 2048 CG1 VAL A 124 6.742 -13.320 -1.412 1.00 0.00 C ATOM 2049 CG2 VAL A 124 8.633 -12.227 -2.646 1.00 0.00 C ATOM 0 H VAL A 124 8.759 -9.878 -0.328 1.00 0.00 H new ATOM 0 HA VAL A 124 6.501 -10.631 -2.073 1.00 0.00 H new ATOM 0 HB VAL A 124 8.437 -12.386 -0.522 1.00 0.00 H new ATOM 0 HG11 VAL A 124 7.239 -14.281 -1.542 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.183 -13.324 -0.476 1.00 0.00 H new ATOM 0 HG13 VAL A 124 6.057 -13.150 -2.243 1.00 0.00 H new ATOM 0 HG21 VAL A 124 9.097 -13.207 -2.759 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.000 -12.023 -3.510 1.00 0.00 H new ATOM 0 HG23 VAL A 124 9.408 -11.464 -2.576 1.00 0.00 H new ATOM 2059 N GLU A 125 4.992 -10.391 -0.128 1.00 0.00 N ATOM 2060 CA GLU A 125 4.023 -10.432 0.947 1.00 0.00 C ATOM 2061 C GLU A 125 3.530 -11.858 1.114 1.00 0.00 C ATOM 2062 O GLU A 125 2.974 -12.446 0.180 1.00 0.00 O ATOM 2063 CB GLU A 125 2.851 -9.496 0.656 1.00 0.00 C ATOM 2064 CG GLU A 125 1.852 -9.405 1.798 1.00 0.00 C ATOM 2065 CD GLU A 125 0.698 -8.478 1.490 1.00 0.00 C ATOM 2066 OE1 GLU A 125 0.849 -7.252 1.692 1.00 0.00 O ATOM 2067 OE2 GLU A 125 -0.360 -8.972 1.054 1.00 0.00 O ATOM 0 H GLU A 125 4.642 -9.994 -1.000 1.00 0.00 H new ATOM 0 HA GLU A 125 4.497 -10.097 1.870 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.237 -8.500 0.440 1.00 0.00 H new ATOM 0 HB3 GLU A 125 2.336 -9.839 -0.241 1.00 0.00 H new ATOM 0 HG2 GLU A 125 1.465 -10.400 2.017 1.00 0.00 H new ATOM 0 HG3 GLU A 125 2.363 -9.057 2.696 1.00 0.00 H new ATOM 2074 N HIS A 126 3.742 -12.426 2.287 1.00 0.00 N ATOM 2075 CA HIS A 126 3.380 -13.809 2.501 1.00 0.00 C ATOM 2076 C HIS A 126 1.939 -13.879 2.980 1.00 0.00 C ATOM 2077 O HIS A 126 1.661 -14.061 4.164 1.00 0.00 O ATOM 2078 CB HIS A 126 4.336 -14.464 3.511 1.00 0.00 C ATOM 2079 CG HIS A 126 4.217 -15.961 3.607 1.00 0.00 C ATOM 2080 ND1 HIS A 126 5.186 -16.822 3.136 1.00 0.00 N ATOM 2081 CD2 HIS A 126 3.250 -16.748 4.144 1.00 0.00 C ATOM 2082 CE1 HIS A 126 4.818 -18.070 3.374 1.00 0.00 C ATOM 2083 NE2 HIS A 126 3.648 -18.053 3.986 1.00 0.00 N ATOM 0 H HIS A 126 4.157 -11.957 3.093 1.00 0.00 H new ATOM 0 HA HIS A 126 3.466 -14.360 1.564 1.00 0.00 H new ATOM 0 HB2 HIS A 126 5.361 -14.211 3.238 1.00 0.00 H new ATOM 0 HB3 HIS A 126 4.153 -14.034 4.496 1.00 0.00 H new ATOM 0 HD1 HIS A 126 6.052 -16.540 2.676 1.00 0.00 H new ATOM 0 HD2 HIS A 126 2.336 -16.410 4.610 1.00 0.00 H new ATOM 0 HE1 HIS A 126 5.380 -18.954 3.112 1.00 0.00 H new ATOM 0 HE2 HIS A 126 3.126 -18.874 4.291 1.00 0.00 H new ATOM 2092 N THR A 127 1.032 -13.722 2.035 1.00 0.00 N ATOM 2093 CA THR A 127 -0.385 -13.828 2.304 1.00 0.00 C ATOM 2094 C THR A 127 -0.859 -15.227 1.953 1.00 0.00 C ATOM 2095 O THR A 127 -0.954 -15.589 0.784 1.00 0.00 O ATOM 2096 CB THR A 127 -1.177 -12.758 1.523 1.00 0.00 C ATOM 2097 OG1 THR A 127 -0.880 -11.469 2.072 1.00 0.00 O ATOM 2098 CG2 THR A 127 -2.675 -13.009 1.585 1.00 0.00 C ATOM 0 H THR A 127 1.258 -13.518 1.062 1.00 0.00 H new ATOM 0 HA THR A 127 -0.562 -13.650 3.365 1.00 0.00 H new ATOM 0 HB THR A 127 -0.879 -12.805 0.476 1.00 0.00 H new ATOM 0 HG1 THR A 127 -0.741 -10.828 1.344 1.00 0.00 H new ATOM 0 HG21 THR A 127 -3.197 -12.234 1.023 1.00 0.00 H new ATOM 0 HG22 THR A 127 -2.899 -13.984 1.152 1.00 0.00 H new ATOM 0 HG23 THR A 127 -3.005 -12.989 2.624 1.00 0.00 H new ATOM 2106 N GLU A 128 -1.105 -16.016 2.987 1.00 0.00 N ATOM 2107 CA GLU A 128 -1.411 -17.428 2.819 1.00 0.00 C ATOM 2108 C GLU A 128 -2.919 -17.666 2.884 1.00 0.00 C ATOM 2109 O GLU A 128 -3.403 -18.757 2.589 1.00 0.00 O ATOM 2110 CB GLU A 128 -0.674 -18.224 3.898 1.00 0.00 C ATOM 2111 CG GLU A 128 -0.434 -19.680 3.546 1.00 0.00 C ATOM 2112 CD GLU A 128 0.637 -20.301 4.416 1.00 0.00 C ATOM 2113 OE1 GLU A 128 1.833 -20.023 4.177 1.00 0.00 O ATOM 2114 OE2 GLU A 128 0.295 -21.072 5.338 1.00 0.00 O ATOM 0 H GLU A 128 -1.099 -15.700 3.957 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.076 -17.763 1.837 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.286 -17.747 4.093 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.248 -18.176 4.824 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -1.363 -20.239 3.659 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -0.141 -19.757 2.499 1.00 0.00 H new ATOM 2121 N ASN A 129 -3.657 -16.631 3.262 1.00 0.00 N ATOM 2122 CA ASN A 129 -5.112 -16.697 3.279 1.00 0.00 C ATOM 2123 C ASN A 129 -5.655 -16.099 1.989 1.00 0.00 C ATOM 2124 O ASN A 129 -5.776 -14.876 1.869 1.00 0.00 O ATOM 2125 CB ASN A 129 -5.673 -15.957 4.501 1.00 0.00 C ATOM 2126 CG ASN A 129 -7.187 -16.044 4.604 1.00 0.00 C ATOM 2127 OD1 ASN A 129 -7.909 -15.184 4.104 1.00 0.00 O ATOM 2128 ND2 ASN A 129 -7.679 -17.084 5.262 1.00 0.00 N ATOM 0 H ASN A 129 -3.272 -15.735 3.561 1.00 0.00 H new ATOM 0 HA ASN A 129 -5.425 -17.739 3.350 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -5.228 -16.372 5.406 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -5.377 -14.909 4.452 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -8.688 -17.190 5.367 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -7.049 -17.778 5.664 1.00 0.00 H new ATOM 2135 N ASP A 130 -5.946 -16.976 1.025 1.00 0.00 N ATOM 2136 CA ASP A 130 -6.336 -16.574 -0.332 1.00 0.00 C ATOM 2137 C ASP A 130 -5.160 -15.964 -1.086 1.00 0.00 C ATOM 2138 O ASP A 130 -4.218 -15.438 -0.490 1.00 0.00 O ATOM 2139 CB ASP A 130 -7.505 -15.579 -0.329 1.00 0.00 C ATOM 2140 CG ASP A 130 -8.859 -16.249 -0.259 1.00 0.00 C ATOM 2141 OD1 ASP A 130 -9.231 -16.938 -1.232 1.00 0.00 O ATOM 2142 OD2 ASP A 130 -9.568 -16.079 0.756 1.00 0.00 O ATOM 0 H ASP A 130 -5.918 -17.986 1.162 1.00 0.00 H new ATOM 0 HA ASP A 130 -6.660 -17.483 -0.839 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -7.397 -14.904 0.520 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -7.456 -14.968 -1.230 1.00 0.00 H new ATOM 2147 N ALA A 131 -5.205 -16.045 -2.402 1.00 0.00 N ATOM 2148 CA ALA A 131 -4.213 -15.383 -3.221 1.00 0.00 C ATOM 2149 C ALA A 131 -4.782 -14.073 -3.748 1.00 0.00 C ATOM 2150 O ALA A 131 -5.337 -14.011 -4.846 1.00 0.00 O ATOM 2151 CB ALA A 131 -3.747 -16.283 -4.357 1.00 0.00 C ATOM 0 H ALA A 131 -5.915 -16.560 -2.923 1.00 0.00 H new ATOM 0 HA ALA A 131 -3.338 -15.164 -2.609 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -3.002 -15.758 -4.955 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -3.307 -17.191 -3.945 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.598 -16.545 -4.986 1.00 0.00 H new ATOM 2157 N TYR A 132 -4.657 -13.034 -2.938 1.00 0.00 N ATOM 2158 CA TYR A 132 -5.174 -11.721 -3.280 1.00 0.00 C ATOM 2159 C TYR A 132 -4.124 -10.670 -2.951 1.00 0.00 C ATOM 2160 O TYR A 132 -3.927 -10.337 -1.787 1.00 0.00 O ATOM 2161 CB TYR A 132 -6.474 -11.452 -2.512 1.00 0.00 C ATOM 2162 CG TYR A 132 -7.150 -10.147 -2.872 1.00 0.00 C ATOM 2163 CD1 TYR A 132 -7.688 -9.950 -4.136 1.00 0.00 C ATOM 2164 CD2 TYR A 132 -7.253 -9.115 -1.948 1.00 0.00 C ATOM 2165 CE1 TYR A 132 -8.307 -8.764 -4.472 1.00 0.00 C ATOM 2166 CE2 TYR A 132 -7.873 -7.924 -2.277 1.00 0.00 C ATOM 2167 CZ TYR A 132 -8.398 -7.755 -3.540 1.00 0.00 C ATOM 2168 OH TYR A 132 -9.014 -6.570 -3.872 1.00 0.00 O ATOM 0 H TYR A 132 -4.196 -13.078 -2.029 1.00 0.00 H new ATOM 0 HA TYR A 132 -5.396 -11.678 -4.346 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -7.169 -12.271 -2.698 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.258 -11.454 -1.444 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -7.621 -10.740 -4.870 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -6.843 -9.245 -0.958 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -8.718 -8.628 -5.461 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -7.946 -7.130 -1.548 1.00 0.00 H new ATOM 0 HH TYR A 132 -9.674 -6.340 -3.185 1.00 0.00 H new ATOM 2178 N TRP A 133 -3.434 -10.190 -3.989 1.00 0.00 N ATOM 2179 CA TRP A 133 -2.288 -9.287 -3.830 1.00 0.00 C ATOM 2180 C TRP A 133 -1.157 -9.995 -3.080 1.00 0.00 C ATOM 2181 O TRP A 133 -0.207 -9.372 -2.610 1.00 0.00 O ATOM 2182 CB TRP A 133 -2.693 -7.988 -3.123 1.00 0.00 C ATOM 2183 CG TRP A 133 -3.680 -7.165 -3.902 1.00 0.00 C ATOM 2184 CD1 TRP A 133 -4.954 -6.855 -3.532 1.00 0.00 C ATOM 2185 CD2 TRP A 133 -3.475 -6.555 -5.184 1.00 0.00 C ATOM 2186 NE1 TRP A 133 -5.557 -6.088 -4.501 1.00 0.00 N ATOM 2187 CE2 TRP A 133 -4.669 -5.889 -5.524 1.00 0.00 C ATOM 2188 CE3 TRP A 133 -2.398 -6.504 -6.074 1.00 0.00 C ATOM 2189 CZ2 TRP A 133 -4.814 -5.185 -6.717 1.00 0.00 C ATOM 2190 CZ3 TRP A 133 -2.545 -5.804 -7.257 1.00 0.00 C ATOM 2191 CH2 TRP A 133 -3.745 -5.152 -7.568 1.00 0.00 C ATOM 0 H TRP A 133 -3.652 -10.414 -4.960 1.00 0.00 H new ATOM 0 HA TRP A 133 -1.928 -9.015 -4.822 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -3.122 -8.231 -2.151 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -1.800 -7.391 -2.937 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -5.423 -7.167 -2.610 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -6.510 -5.726 -4.464 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -1.468 -7.002 -5.842 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -5.739 -4.683 -6.961 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -1.721 -5.759 -7.953 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -3.827 -4.612 -8.500 1.00 0.00 H new ATOM 2202 N GLY A 134 -1.247 -11.317 -3.046 1.00 0.00 N ATOM 2203 CA GLY A 134 -0.284 -12.135 -2.352 1.00 0.00 C ATOM 2204 C GLY A 134 -0.134 -13.464 -3.048 1.00 0.00 C ATOM 2205 O GLY A 134 -1.052 -13.909 -3.738 1.00 0.00 O ATOM 0 H GLY A 134 -1.992 -11.845 -3.501 1.00 0.00 H new ATOM 0 HA2 GLY A 134 0.678 -11.625 -2.315 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -0.603 -12.290 -1.321 1.00 0.00 H new ATOM 2209 N ASP A 135 1.001 -14.111 -2.868 1.00 0.00 N ATOM 2210 CA ASP A 135 1.323 -15.305 -3.652 1.00 0.00 C ATOM 2211 C ASP A 135 0.811 -16.588 -3.009 1.00 0.00 C ATOM 2212 O ASP A 135 1.434 -17.648 -3.139 1.00 0.00 O ATOM 2213 CB ASP A 135 2.828 -15.396 -3.881 1.00 0.00 C ATOM 2214 CG ASP A 135 3.209 -15.000 -5.292 1.00 0.00 C ATOM 2215 OD1 ASP A 135 2.299 -14.654 -6.079 1.00 0.00 O ATOM 2216 OD2 ASP A 135 4.409 -15.038 -5.618 1.00 0.00 O ATOM 0 H ASP A 135 1.716 -13.839 -2.193 1.00 0.00 H new ATOM 0 HA ASP A 135 0.812 -15.203 -4.609 1.00 0.00 H new ATOM 0 HB2 ASP A 135 3.343 -14.749 -3.171 1.00 0.00 H new ATOM 0 HB3 ASP A 135 3.164 -16.415 -3.686 1.00 0.00 H new ATOM 2221 N GLY A 136 -0.341 -16.499 -2.351 1.00 0.00 N ATOM 2222 CA GLY A 136 -0.941 -17.666 -1.720 1.00 0.00 C ATOM 2223 C GLY A 136 -0.035 -18.294 -0.681 1.00 0.00 C ATOM 2224 O GLY A 136 -0.169 -19.469 -0.352 1.00 0.00 O ATOM 0 H GLY A 136 -0.874 -15.636 -2.242 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -1.882 -17.378 -1.251 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -1.180 -18.406 -2.484 1.00 0.00 H new ATOM 2228 N GLY A 137 0.908 -17.507 -0.184 1.00 0.00 N ATOM 2229 CA GLY A 137 1.857 -17.997 0.796 1.00 0.00 C ATOM 2230 C GLY A 137 2.974 -18.812 0.172 1.00 0.00 C ATOM 2231 O GLY A 137 4.148 -18.525 0.387 1.00 0.00 O ATOM 0 H GLY A 137 1.034 -16.529 -0.445 1.00 0.00 H new ATOM 0 HA2 GLY A 137 2.286 -17.152 1.334 1.00 0.00 H new ATOM 0 HA3 GLY A 137 1.332 -18.609 1.530 1.00 0.00 H new ATOM 2235 N HIS A 138 2.605 -19.819 -0.611 1.00 0.00 N ATOM 2236 CA HIS A 138 3.576 -20.746 -1.192 1.00 0.00 C ATOM 2237 C HIS A 138 4.474 -20.080 -2.238 1.00 0.00 C ATOM 2238 O HIS A 138 5.628 -20.467 -2.390 1.00 0.00 O ATOM 2239 CB HIS A 138 2.878 -21.980 -1.792 1.00 0.00 C ATOM 2240 CG HIS A 138 1.728 -21.668 -2.704 1.00 0.00 C ATOM 2241 ND1 HIS A 138 0.400 -21.607 -2.458 1.00 0.00 N flip ATOM 2242 CD2 HIS A 138 1.881 -21.362 -4.038 1.00 0.00 C flip ATOM 2243 CE1 HIS A 138 -0.221 -21.265 -3.630 1.00 0.00 C flip ATOM 2244 NE2 HIS A 138 0.694 -21.119 -4.567 1.00 0.00 N flip ATOM 0 H HIS A 138 1.636 -20.017 -0.861 1.00 0.00 H new ATOM 0 HA HIS A 138 4.219 -21.070 -0.373 1.00 0.00 H new ATOM 0 HB2 HIS A 138 3.614 -22.564 -2.344 1.00 0.00 H new ATOM 0 HB3 HIS A 138 2.518 -22.609 -0.978 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -0.056 -21.783 -1.563 1.00 0.00 H new ATOM 0 HD2 HIS A 138 2.821 -21.326 -4.568 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -1.285 -21.136 -3.764 1.00 0.00 H new ATOM 2253 N GLY A 139 3.964 -19.085 -2.957 1.00 0.00 N ATOM 2254 CA GLY A 139 4.790 -18.411 -3.942 1.00 0.00 C ATOM 2255 C GLY A 139 4.237 -18.514 -5.348 1.00 0.00 C ATOM 2256 O GLY A 139 4.981 -18.754 -6.301 1.00 0.00 O ATOM 0 H GLY A 139 3.008 -18.737 -2.878 1.00 0.00 H new ATOM 0 HA2 GLY A 139 4.884 -17.360 -3.671 1.00 0.00 H new ATOM 0 HA3 GLY A 139 5.793 -18.837 -3.920 1.00 0.00 H new ATOM 2260 N LYS A 140 2.926 -18.350 -5.468 1.00 0.00 N ATOM 2261 CA LYS A 140 2.263 -18.308 -6.764 1.00 0.00 C ATOM 2262 C LYS A 140 0.799 -17.933 -6.587 1.00 0.00 C ATOM 2263 O LYS A 140 -0.052 -18.802 -6.414 1.00 0.00 O ATOM 2264 CB LYS A 140 2.348 -19.655 -7.495 1.00 0.00 C ATOM 2265 CG LYS A 140 1.732 -19.622 -8.886 1.00 0.00 C ATOM 2266 CD LYS A 140 1.213 -20.988 -9.301 1.00 0.00 C ATOM 2267 CE LYS A 140 0.529 -20.936 -10.657 1.00 0.00 C ATOM 2268 NZ LYS A 140 -0.218 -22.188 -10.948 1.00 0.00 N ATOM 0 H LYS A 140 2.295 -18.243 -4.674 1.00 0.00 H new ATOM 0 HA LYS A 140 2.776 -17.558 -7.366 1.00 0.00 H new ATOM 0 HB2 LYS A 140 3.394 -19.952 -7.575 1.00 0.00 H new ATOM 0 HB3 LYS A 140 1.844 -20.417 -6.900 1.00 0.00 H new ATOM 0 HG2 LYS A 140 0.915 -18.901 -8.906 1.00 0.00 H new ATOM 0 HG3 LYS A 140 2.476 -19.281 -9.606 1.00 0.00 H new ATOM 0 HD2 LYS A 140 2.040 -21.697 -9.337 1.00 0.00 H new ATOM 0 HD3 LYS A 140 0.511 -21.354 -8.552 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -0.156 -20.089 -10.686 1.00 0.00 H new ATOM 0 HE3 LYS A 140 1.275 -20.769 -11.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -0.670 -22.113 -11.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 0.440 -22.993 -10.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -0.947 -22.334 -10.221 1.00 0.00 H new ATOM 2282 N GLY A 141 0.512 -16.644 -6.569 1.00 0.00 N ATOM 2283 CA GLY A 141 -0.869 -16.221 -6.555 1.00 0.00 C ATOM 2284 C GLY A 141 -1.086 -14.856 -7.173 1.00 0.00 C ATOM 2285 O GLY A 141 -1.699 -14.753 -8.235 1.00 0.00 O ATOM 0 H GLY A 141 1.200 -15.891 -6.564 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -1.471 -16.954 -7.091 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -1.226 -16.206 -5.525 1.00 0.00 H new ATOM 2289 N LYS A 142 -0.527 -13.821 -6.555 1.00 0.00 N ATOM 2290 CA LYS A 142 -0.764 -12.439 -6.980 1.00 0.00 C ATOM 2291 C LYS A 142 0.273 -11.495 -6.377 1.00 0.00 C ATOM 2292 O LYS A 142 -0.065 -10.407 -5.915 1.00 0.00 O ATOM 2293 CB LYS A 142 -2.171 -11.960 -6.571 1.00 0.00 C ATOM 2294 CG LYS A 142 -3.305 -12.478 -7.448 1.00 0.00 C ATOM 2295 CD LYS A 142 -4.644 -11.879 -7.048 1.00 0.00 C ATOM 2296 CE LYS A 142 -5.793 -12.454 -7.867 1.00 0.00 C ATOM 2297 NZ LYS A 142 -6.001 -13.907 -7.609 1.00 0.00 N ATOM 0 H LYS A 142 0.097 -13.910 -5.753 1.00 0.00 H new ATOM 0 HA LYS A 142 -0.682 -12.423 -8.067 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -2.358 -12.266 -5.542 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -2.187 -10.870 -6.587 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -3.097 -12.239 -8.491 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -3.356 -13.564 -7.374 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -4.824 -12.067 -5.989 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -4.611 -10.797 -7.179 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -6.709 -11.911 -7.634 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -5.592 -12.301 -8.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -6.987 -14.160 -7.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -5.362 -14.462 -8.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -5.799 -14.115 -6.610 1.00 0.00 H new ATOM 2311 N ASN A 143 1.537 -11.908 -6.402 1.00 0.00 N ATOM 2312 CA ASN A 143 2.658 -11.085 -5.910 1.00 0.00 C ATOM 2313 C ASN A 143 2.799 -9.765 -6.689 1.00 0.00 C ATOM 2314 O ASN A 143 3.728 -8.990 -6.455 1.00 0.00 O ATOM 2315 CB ASN A 143 3.972 -11.877 -6.003 1.00 0.00 C ATOM 2316 CG ASN A 143 5.156 -11.188 -5.332 1.00 0.00 C ATOM 2317 OD1 ASN A 143 4.915 -10.525 -4.208 1.00 0.00 O flip ATOM 2318 ND2 ASN A 143 6.286 -11.273 -5.812 1.00 0.00 N flip ATOM 0 H ASN A 143 1.822 -12.819 -6.761 1.00 0.00 H new ATOM 0 HA ASN A 143 2.443 -10.836 -4.871 1.00 0.00 H new ATOM 0 HB2 ASN A 143 3.828 -12.857 -5.547 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.210 -12.046 -7.053 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.435 -11.791 -6.678 1.00 0.00 H new ATOM 0 HD22 ASN A 143 7.074 -10.825 -5.344 1.00 0.00 H new ATOM 2325 N ARG A 144 1.866 -9.498 -7.599 1.00 0.00 N ATOM 2326 CA ARG A 144 1.892 -8.278 -8.393 1.00 0.00 C ATOM 2327 C ARG A 144 1.864 -7.042 -7.495 1.00 0.00 C ATOM 2328 O ARG A 144 2.313 -5.974 -7.897 1.00 0.00 O ATOM 2329 CB ARG A 144 0.714 -8.233 -9.367 1.00 0.00 C ATOM 2330 CG ARG A 144 0.568 -9.485 -10.218 1.00 0.00 C ATOM 2331 CD ARG A 144 -0.332 -9.242 -11.417 1.00 0.00 C ATOM 2332 NE ARG A 144 0.342 -8.452 -12.447 1.00 0.00 N ATOM 2333 CZ ARG A 144 -0.153 -7.344 -12.996 1.00 0.00 C ATOM 2334 NH1 ARG A 144 -1.312 -6.851 -12.576 1.00 0.00 N ATOM 2335 NH2 ARG A 144 0.524 -6.726 -13.957 1.00 0.00 N ATOM 0 H ARG A 144 1.080 -10.115 -7.804 1.00 0.00 H new ATOM 0 HA ARG A 144 2.820 -8.278 -8.964 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -0.206 -8.080 -8.802 1.00 0.00 H new ATOM 0 HB3 ARG A 144 0.831 -7.371 -10.024 1.00 0.00 H new ATOM 0 HG2 ARG A 144 1.551 -9.811 -10.560 1.00 0.00 H new ATOM 0 HG3 ARG A 144 0.158 -10.292 -9.612 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -0.644 -10.198 -11.838 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -1.236 -8.725 -11.095 1.00 0.00 H new ATOM 0 HE ARG A 144 1.256 -8.772 -12.768 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -1.826 -7.321 -11.831 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -1.688 -6.002 -12.998 1.00 0.00 H new ATOM 0 HH21 ARG A 144 1.419 -7.100 -14.272 1.00 0.00 H new ATOM 0 HH22 ARG A 144 0.149 -5.877 -14.380 1.00 0.00 H new ATOM 2349 N LEU A 145 1.338 -7.195 -6.279 1.00 0.00 N ATOM 2350 CA LEU A 145 1.329 -6.104 -5.304 1.00 0.00 C ATOM 2351 C LEU A 145 2.758 -5.696 -4.963 1.00 0.00 C ATOM 2352 O LEU A 145 3.114 -4.519 -5.027 1.00 0.00 O ATOM 2353 CB LEU A 145 0.592 -6.523 -4.030 1.00 0.00 C ATOM 2354 CG LEU A 145 0.445 -5.427 -2.973 1.00 0.00 C ATOM 2355 CD1 LEU A 145 -0.449 -4.309 -3.485 1.00 0.00 C ATOM 2356 CD2 LEU A 145 -0.106 -6.007 -1.680 1.00 0.00 C ATOM 0 H LEU A 145 0.914 -8.061 -5.947 1.00 0.00 H new ATOM 0 HA LEU A 145 0.807 -5.254 -5.745 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -0.402 -6.877 -4.304 1.00 0.00 H new ATOM 0 HB3 LEU A 145 1.120 -7.367 -3.585 1.00 0.00 H new ATOM 0 HG LEU A 145 1.431 -5.009 -2.768 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -0.542 -3.538 -2.720 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -0.011 -3.876 -4.385 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -1.435 -4.710 -3.718 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -0.204 -5.214 -0.938 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -1.083 -6.451 -1.868 1.00 0.00 H new ATOM 0 HD23 LEU A 145 0.574 -6.772 -1.305 1.00 0.00 H new ATOM 2368 N GLY A 146 3.577 -6.687 -4.619 1.00 0.00 N ATOM 2369 CA GLY A 146 4.974 -6.435 -4.342 1.00 0.00 C ATOM 2370 C GLY A 146 5.706 -5.950 -5.574 1.00 0.00 C ATOM 2371 O GLY A 146 6.628 -5.145 -5.478 1.00 0.00 O ATOM 0 H GLY A 146 3.293 -7.662 -4.528 1.00 0.00 H new ATOM 0 HA2 GLY A 146 5.060 -5.691 -3.550 1.00 0.00 H new ATOM 0 HA3 GLY A 146 5.443 -7.348 -3.975 1.00 0.00 H new ATOM 2375 N TYR A 147 5.280 -6.435 -6.734 1.00 0.00 N ATOM 2376 CA TYR A 147 5.852 -6.002 -8.003 1.00 0.00 C ATOM 2377 C TYR A 147 5.546 -4.526 -8.250 1.00 0.00 C ATOM 2378 O TYR A 147 6.402 -3.774 -8.718 1.00 0.00 O ATOM 2379 CB TYR A 147 5.308 -6.858 -9.151 1.00 0.00 C ATOM 2380 CG TYR A 147 5.897 -6.508 -10.497 1.00 0.00 C ATOM 2381 CD1 TYR A 147 7.180 -6.914 -10.839 1.00 0.00 C ATOM 2382 CD2 TYR A 147 5.173 -5.768 -11.424 1.00 0.00 C ATOM 2383 CE1 TYR A 147 7.729 -6.590 -12.063 1.00 0.00 C ATOM 2384 CE2 TYR A 147 5.713 -5.442 -12.652 1.00 0.00 C ATOM 2385 CZ TYR A 147 6.989 -5.854 -12.968 1.00 0.00 C ATOM 2386 OH TYR A 147 7.530 -5.522 -14.189 1.00 0.00 O ATOM 0 H TYR A 147 4.539 -7.130 -6.822 1.00 0.00 H new ATOM 0 HA TYR A 147 6.934 -6.128 -7.957 1.00 0.00 H new ATOM 0 HB2 TYR A 147 5.509 -7.908 -8.937 1.00 0.00 H new ATOM 0 HB3 TYR A 147 4.225 -6.744 -9.197 1.00 0.00 H new ATOM 0 HD1 TYR A 147 7.758 -7.494 -10.135 1.00 0.00 H new ATOM 0 HD2 TYR A 147 4.172 -5.443 -11.180 1.00 0.00 H new ATOM 0 HE1 TYR A 147 8.730 -6.910 -12.312 1.00 0.00 H new ATOM 0 HE2 TYR A 147 5.138 -4.866 -13.362 1.00 0.00 H new ATOM 0 HH TYR A 147 6.878 -5.004 -14.706 1.00 0.00 H new ATOM 2396 N LEU A 148 4.321 -4.115 -7.928 1.00 0.00 N ATOM 2397 CA LEU A 148 3.936 -2.712 -8.023 1.00 0.00 C ATOM 2398 C LEU A 148 4.788 -1.873 -7.080 1.00 0.00 C ATOM 2399 O LEU A 148 5.190 -0.761 -7.419 1.00 0.00 O ATOM 2400 CB LEU A 148 2.450 -2.528 -7.690 1.00 0.00 C ATOM 2401 CG LEU A 148 1.473 -3.175 -8.672 1.00 0.00 C ATOM 2402 CD1 LEU A 148 0.039 -2.965 -8.207 1.00 0.00 C ATOM 2403 CD2 LEU A 148 1.668 -2.611 -10.071 1.00 0.00 C ATOM 0 H LEU A 148 3.580 -4.734 -7.600 1.00 0.00 H new ATOM 0 HA LEU A 148 4.101 -2.381 -9.048 1.00 0.00 H new ATOM 0 HB2 LEU A 148 2.264 -2.937 -6.697 1.00 0.00 H new ATOM 0 HB3 LEU A 148 2.236 -1.460 -7.641 1.00 0.00 H new ATOM 0 HG LEU A 148 1.674 -4.246 -8.704 1.00 0.00 H new ATOM 0 HD11 LEU A 148 -0.645 -3.431 -8.916 1.00 0.00 H new ATOM 0 HD12 LEU A 148 -0.094 -3.416 -7.224 1.00 0.00 H new ATOM 0 HD13 LEU A 148 -0.172 -1.897 -8.148 1.00 0.00 H new ATOM 0 HD21 LEU A 148 0.964 -3.084 -10.755 1.00 0.00 H new ATOM 0 HD22 LEU A 148 1.494 -1.535 -10.057 1.00 0.00 H new ATOM 0 HD23 LEU A 148 2.687 -2.809 -10.405 1.00 0.00 H new ATOM 2415 N LEU A 149 5.063 -2.421 -5.902 1.00 0.00 N ATOM 2416 CA LEU A 149 5.937 -1.771 -4.932 1.00 0.00 C ATOM 2417 C LEU A 149 7.351 -1.631 -5.485 1.00 0.00 C ATOM 2418 O LEU A 149 8.019 -0.629 -5.241 1.00 0.00 O ATOM 2419 CB LEU A 149 5.967 -2.555 -3.617 1.00 0.00 C ATOM 2420 CG LEU A 149 4.694 -2.471 -2.775 1.00 0.00 C ATOM 2421 CD1 LEU A 149 4.789 -3.408 -1.580 1.00 0.00 C ATOM 2422 CD2 LEU A 149 4.464 -1.039 -2.313 1.00 0.00 C ATOM 0 H LEU A 149 4.691 -3.319 -5.594 1.00 0.00 H new ATOM 0 HA LEU A 149 5.537 -0.776 -4.738 1.00 0.00 H new ATOM 0 HB2 LEU A 149 6.165 -3.603 -3.843 1.00 0.00 H new ATOM 0 HB3 LEU A 149 6.803 -2.195 -3.018 1.00 0.00 H new ATOM 0 HG LEU A 149 3.847 -2.778 -3.388 1.00 0.00 H new ATOM 0 HD11 LEU A 149 3.876 -3.338 -0.989 1.00 0.00 H new ATOM 0 HD12 LEU A 149 4.917 -4.432 -1.930 1.00 0.00 H new ATOM 0 HD13 LEU A 149 5.642 -3.126 -0.963 1.00 0.00 H new ATOM 0 HD21 LEU A 149 3.554 -0.992 -1.714 1.00 0.00 H new ATOM 0 HD22 LEU A 149 5.312 -0.710 -1.712 1.00 0.00 H new ATOM 0 HD23 LEU A 149 4.361 -0.389 -3.182 1.00 0.00 H new ATOM 2434 N MET A 150 7.800 -2.634 -6.235 1.00 0.00 N ATOM 2435 CA MET A 150 9.117 -2.590 -6.864 1.00 0.00 C ATOM 2436 C MET A 150 9.192 -1.426 -7.841 1.00 0.00 C ATOM 2437 O MET A 150 10.110 -0.606 -7.782 1.00 0.00 O ATOM 2438 CB MET A 150 9.411 -3.887 -7.619 1.00 0.00 C ATOM 2439 CG MET A 150 9.358 -5.142 -6.766 1.00 0.00 C ATOM 2440 SD MET A 150 9.592 -6.634 -7.751 1.00 0.00 S ATOM 2441 CE MET A 150 9.279 -7.913 -6.539 1.00 0.00 C ATOM 0 H MET A 150 7.272 -3.486 -6.422 1.00 0.00 H new ATOM 0 HA MET A 150 9.857 -2.463 -6.074 1.00 0.00 H new ATOM 0 HB2 MET A 150 8.695 -3.987 -8.434 1.00 0.00 H new ATOM 0 HB3 MET A 150 10.400 -3.812 -8.071 1.00 0.00 H new ATOM 0 HG2 MET A 150 10.128 -5.091 -5.996 1.00 0.00 H new ATOM 0 HG3 MET A 150 8.397 -5.192 -6.253 1.00 0.00 H new ATOM 0 HE1 MET A 150 9.388 -8.892 -7.006 1.00 0.00 H new ATOM 0 HE2 MET A 150 9.992 -7.821 -5.720 1.00 0.00 H new ATOM 0 HE3 MET A 150 8.266 -7.807 -6.151 1.00 0.00 H new ATOM 2451 N GLU A 151 8.212 -1.366 -8.735 1.00 0.00 N ATOM 2452 CA GLU A 151 8.143 -0.317 -9.745 1.00 0.00 C ATOM 2453 C GLU A 151 7.973 1.046 -9.081 1.00 0.00 C ATOM 2454 O GLU A 151 8.619 2.023 -9.459 1.00 0.00 O ATOM 2455 CB GLU A 151 6.976 -0.590 -10.699 1.00 0.00 C ATOM 2456 CG GLU A 151 6.987 0.279 -11.946 1.00 0.00 C ATOM 2457 CD GLU A 151 5.762 0.071 -12.810 1.00 0.00 C ATOM 2458 OE1 GLU A 151 5.500 -1.080 -13.213 1.00 0.00 O ATOM 2459 OE2 GLU A 151 5.061 1.062 -13.101 1.00 0.00 O ATOM 0 H GLU A 151 7.447 -2.039 -8.780 1.00 0.00 H new ATOM 0 HA GLU A 151 9.073 -0.312 -10.314 1.00 0.00 H new ATOM 0 HB2 GLU A 151 7.001 -1.638 -10.998 1.00 0.00 H new ATOM 0 HB3 GLU A 151 6.038 -0.432 -10.166 1.00 0.00 H new ATOM 0 HG2 GLU A 151 7.047 1.327 -11.654 1.00 0.00 H new ATOM 0 HG3 GLU A 151 7.881 0.059 -12.530 1.00 0.00 H new ATOM 2466 N LEU A 152 7.105 1.094 -8.077 1.00 0.00 N ATOM 2467 CA LEU A 152 6.852 2.316 -7.325 1.00 0.00 C ATOM 2468 C LEU A 152 8.117 2.801 -6.631 1.00 0.00 C ATOM 2469 O LEU A 152 8.451 3.984 -6.686 1.00 0.00 O ATOM 2470 CB LEU A 152 5.757 2.068 -6.290 1.00 0.00 C ATOM 2471 CG LEU A 152 5.457 3.245 -5.366 1.00 0.00 C ATOM 2472 CD1 LEU A 152 4.935 4.427 -6.165 1.00 0.00 C ATOM 2473 CD2 LEU A 152 4.462 2.831 -4.293 1.00 0.00 C ATOM 0 H LEU A 152 6.560 0.291 -7.763 1.00 0.00 H new ATOM 0 HA LEU A 152 6.527 3.087 -8.023 1.00 0.00 H new ATOM 0 HB2 LEU A 152 4.840 1.795 -6.813 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.044 1.212 -5.680 1.00 0.00 H new ATOM 0 HG LEU A 152 6.381 3.551 -4.875 1.00 0.00 H new ATOM 0 HD11 LEU A 152 4.726 5.258 -5.491 1.00 0.00 H new ATOM 0 HD12 LEU A 152 5.684 4.732 -6.895 1.00 0.00 H new ATOM 0 HD13 LEU A 152 4.019 4.140 -6.683 1.00 0.00 H new ATOM 0 HD21 LEU A 152 4.256 3.680 -3.640 1.00 0.00 H new ATOM 0 HD22 LEU A 152 3.535 2.502 -4.763 1.00 0.00 H new ATOM 0 HD23 LEU A 152 4.880 2.014 -3.705 1.00 0.00 H new ATOM 2485 N ARG A 153 8.814 1.878 -5.980 1.00 0.00 N ATOM 2486 CA ARG A 153 10.052 2.198 -5.288 1.00 0.00 C ATOM 2487 C ARG A 153 11.078 2.773 -6.257 1.00 0.00 C ATOM 2488 O ARG A 153 11.811 3.698 -5.916 1.00 0.00 O ATOM 2489 CB ARG A 153 10.628 0.952 -4.614 1.00 0.00 C ATOM 2490 CG ARG A 153 11.956 1.202 -3.922 1.00 0.00 C ATOM 2491 CD ARG A 153 12.675 -0.097 -3.598 1.00 0.00 C ATOM 2492 NE ARG A 153 12.800 -0.971 -4.771 1.00 0.00 N ATOM 2493 CZ ARG A 153 13.418 -0.637 -5.914 1.00 0.00 C ATOM 2494 NH1 ARG A 153 14.011 0.546 -6.047 1.00 0.00 N ATOM 2495 NH2 ARG A 153 13.446 -1.493 -6.925 1.00 0.00 N ATOM 0 H ARG A 153 8.539 0.898 -5.918 1.00 0.00 H new ATOM 0 HA ARG A 153 9.827 2.944 -4.526 1.00 0.00 H new ATOM 0 HB2 ARG A 153 9.910 0.578 -3.884 1.00 0.00 H new ATOM 0 HB3 ARG A 153 10.758 0.170 -5.362 1.00 0.00 H new ATOM 0 HG2 ARG A 153 12.589 1.818 -4.561 1.00 0.00 H new ATOM 0 HG3 ARG A 153 11.787 1.763 -3.003 1.00 0.00 H new ATOM 0 HD2 ARG A 153 13.667 0.127 -3.207 1.00 0.00 H new ATOM 0 HD3 ARG A 153 12.134 -0.623 -2.811 1.00 0.00 H new ATOM 0 HE ARG A 153 12.386 -1.901 -4.713 1.00 0.00 H new ATOM 0 HH11 ARG A 153 13.999 1.212 -5.275 1.00 0.00 H new ATOM 0 HH12 ARG A 153 14.477 0.787 -6.921 1.00 0.00 H new ATOM 0 HH21 ARG A 153 12.998 -2.405 -6.834 1.00 0.00 H new ATOM 0 HH22 ARG A 153 13.916 -1.240 -7.794 1.00 0.00 H new ATOM 2509 N GLU A 154 11.128 2.211 -7.460 1.00 0.00 N ATOM 2510 CA GLU A 154 12.054 2.680 -8.483 1.00 0.00 C ATOM 2511 C GLU A 154 11.696 4.102 -8.902 1.00 0.00 C ATOM 2512 O GLU A 154 12.565 4.960 -9.046 1.00 0.00 O ATOM 2513 CB GLU A 154 12.020 1.749 -9.697 1.00 0.00 C ATOM 2514 CG GLU A 154 13.394 1.427 -10.260 1.00 0.00 C ATOM 2515 CD GLU A 154 14.183 0.488 -9.368 1.00 0.00 C ATOM 2516 OE1 GLU A 154 14.071 -0.744 -9.545 1.00 0.00 O ATOM 2517 OE2 GLU A 154 14.922 0.965 -8.480 1.00 0.00 O ATOM 0 H GLU A 154 10.538 1.431 -7.750 1.00 0.00 H new ATOM 0 HA GLU A 154 13.062 2.677 -8.069 1.00 0.00 H new ATOM 0 HB2 GLU A 154 11.525 0.819 -9.417 1.00 0.00 H new ATOM 0 HB3 GLU A 154 11.415 2.208 -10.479 1.00 0.00 H new ATOM 0 HG2 GLU A 154 13.282 0.977 -11.247 1.00 0.00 H new ATOM 0 HG3 GLU A 154 13.954 2.352 -10.393 1.00 0.00 H new ATOM 2524 N GLN A 155 10.404 4.348 -9.071 1.00 0.00 N ATOM 2525 CA GLN A 155 9.909 5.667 -9.449 1.00 0.00 C ATOM 2526 C GLN A 155 10.213 6.703 -8.370 1.00 0.00 C ATOM 2527 O GLN A 155 10.594 7.832 -8.674 1.00 0.00 O ATOM 2528 CB GLN A 155 8.404 5.601 -9.714 1.00 0.00 C ATOM 2529 CG GLN A 155 8.052 4.895 -11.012 1.00 0.00 C ATOM 2530 CD GLN A 155 6.576 4.574 -11.132 1.00 0.00 C ATOM 2531 OE1 GLN A 155 5.723 5.255 -10.556 1.00 0.00 O ATOM 2532 NE2 GLN A 155 6.265 3.539 -11.894 1.00 0.00 N ATOM 0 H GLN A 155 9.674 3.646 -8.951 1.00 0.00 H new ATOM 0 HA GLN A 155 10.421 5.976 -10.360 1.00 0.00 H new ATOM 0 HB2 GLN A 155 7.919 5.086 -8.885 1.00 0.00 H new ATOM 0 HB3 GLN A 155 8.002 6.614 -9.739 1.00 0.00 H new ATOM 0 HG2 GLN A 155 8.351 5.522 -11.852 1.00 0.00 H new ATOM 0 HG3 GLN A 155 8.626 3.971 -11.083 1.00 0.00 H new ATOM 0 HE21 GLN A 155 7.002 3.003 -12.352 1.00 0.00 H new ATOM 0 HE22 GLN A 155 5.288 3.277 -12.024 1.00 0.00 H new ATOM 2541 N LEU A 156 10.071 6.311 -7.112 1.00 0.00 N ATOM 2542 CA LEU A 156 10.335 7.220 -6.005 1.00 0.00 C ATOM 2543 C LEU A 156 11.833 7.337 -5.756 1.00 0.00 C ATOM 2544 O LEU A 156 12.288 8.221 -5.027 1.00 0.00 O ATOM 2545 CB LEU A 156 9.606 6.765 -4.739 1.00 0.00 C ATOM 2546 CG LEU A 156 8.077 6.831 -4.812 1.00 0.00 C ATOM 2547 CD1 LEU A 156 7.461 6.427 -3.482 1.00 0.00 C ATOM 2548 CD2 LEU A 156 7.620 8.228 -5.205 1.00 0.00 C ATOM 0 H LEU A 156 9.776 5.375 -6.833 1.00 0.00 H new ATOM 0 HA LEU A 156 9.955 8.205 -6.274 1.00 0.00 H new ATOM 0 HB2 LEU A 156 9.900 5.739 -4.518 1.00 0.00 H new ATOM 0 HB3 LEU A 156 9.942 7.380 -3.904 1.00 0.00 H new ATOM 0 HG LEU A 156 7.741 6.130 -5.576 1.00 0.00 H new ATOM 0 HD11 LEU A 156 6.375 6.480 -3.553 1.00 0.00 H new ATOM 0 HD12 LEU A 156 7.759 5.408 -3.238 1.00 0.00 H new ATOM 0 HD13 LEU A 156 7.807 7.103 -2.700 1.00 0.00 H new ATOM 0 HD21 LEU A 156 6.531 8.255 -5.252 1.00 0.00 H new ATOM 0 HD22 LEU A 156 7.969 8.947 -4.464 1.00 0.00 H new ATOM 0 HD23 LEU A 156 8.031 8.484 -6.181 1.00 0.00 H new ATOM 2560 N ALA A 157 12.594 6.437 -6.365 1.00 0.00 N ATOM 2561 CA ALA A 157 14.044 6.510 -6.325 1.00 0.00 C ATOM 2562 C ALA A 157 14.535 7.551 -7.319 1.00 0.00 C ATOM 2563 O ALA A 157 15.520 8.241 -7.072 1.00 0.00 O ATOM 2564 CB ALA A 157 14.662 5.151 -6.626 1.00 0.00 C ATOM 0 H ALA A 157 12.227 5.646 -6.894 1.00 0.00 H new ATOM 0 HA ALA A 157 14.352 6.805 -5.322 1.00 0.00 H new ATOM 0 HB1 ALA A 157 15.749 5.230 -6.591 1.00 0.00 H new ATOM 0 HB2 ALA A 157 14.326 4.426 -5.884 1.00 0.00 H new ATOM 0 HB3 ALA A 157 14.354 4.823 -7.619 1.00 0.00 H new ATOM 2570 N ILE A 158 13.821 7.674 -8.435 1.00 0.00 N ATOM 2571 CA ILE A 158 14.139 8.674 -9.447 1.00 0.00 C ATOM 2572 C ILE A 158 14.136 10.077 -8.844 1.00 0.00 C ATOM 2573 O ILE A 158 14.983 10.905 -9.182 1.00 0.00 O ATOM 2574 CB ILE A 158 13.162 8.591 -10.655 1.00 0.00 C ATOM 2575 CG1 ILE A 158 13.763 7.737 -11.778 1.00 0.00 C ATOM 2576 CG2 ILE A 158 12.797 9.974 -11.189 1.00 0.00 C ATOM 2577 CD1 ILE A 158 14.083 6.313 -11.378 1.00 0.00 C ATOM 0 H ILE A 158 13.015 7.090 -8.661 1.00 0.00 H new ATOM 0 HA ILE A 158 15.142 8.462 -9.817 1.00 0.00 H new ATOM 0 HB ILE A 158 12.247 8.120 -10.297 1.00 0.00 H new ATOM 0 HG12 ILE A 158 13.066 7.718 -12.616 1.00 0.00 H new ATOM 0 HG13 ILE A 158 14.676 8.216 -12.133 1.00 0.00 H new ATOM 0 HG21 ILE A 158 12.113 9.870 -12.032 1.00 0.00 H new ATOM 0 HG22 ILE A 158 12.316 10.553 -10.401 1.00 0.00 H new ATOM 0 HG23 ILE A 158 13.701 10.488 -11.516 1.00 0.00 H new ATOM 0 HD11 ILE A 158 14.504 5.781 -12.231 1.00 0.00 H new ATOM 0 HD12 ILE A 158 14.805 6.318 -10.562 1.00 0.00 H new ATOM 0 HD13 ILE A 158 13.171 5.813 -11.052 1.00 0.00 H new ATOM 2589 N GLU A 159 13.201 10.335 -7.934 1.00 0.00 N ATOM 2590 CA GLU A 159 13.146 11.631 -7.262 1.00 0.00 C ATOM 2591 C GLU A 159 14.409 11.856 -6.431 1.00 0.00 C ATOM 2592 O GLU A 159 14.904 12.979 -6.324 1.00 0.00 O ATOM 2593 CB GLU A 159 11.909 11.745 -6.370 1.00 0.00 C ATOM 2594 CG GLU A 159 11.741 13.132 -5.771 1.00 0.00 C ATOM 2595 CD GLU A 159 10.582 13.234 -4.807 1.00 0.00 C ATOM 2596 OE1 GLU A 159 10.760 12.882 -3.624 1.00 0.00 O ATOM 2597 OE2 GLU A 159 9.498 13.701 -5.217 1.00 0.00 O ATOM 0 H GLU A 159 12.479 9.674 -7.647 1.00 0.00 H new ATOM 0 HA GLU A 159 13.082 12.400 -8.032 1.00 0.00 H new ATOM 0 HB2 GLU A 159 11.022 11.496 -6.953 1.00 0.00 H new ATOM 0 HB3 GLU A 159 11.978 11.013 -5.566 1.00 0.00 H new ATOM 0 HG2 GLU A 159 12.659 13.410 -5.254 1.00 0.00 H new ATOM 0 HG3 GLU A 159 11.598 13.852 -6.576 1.00 0.00 H new ATOM 2604 N LYS A 160 14.939 10.781 -5.855 1.00 0.00 N ATOM 2605 CA LYS A 160 16.165 10.870 -5.076 1.00 0.00 C ATOM 2606 C LYS A 160 17.369 11.076 -5.988 1.00 0.00 C ATOM 2607 O LYS A 160 18.382 11.630 -5.572 1.00 0.00 O ATOM 2608 CB LYS A 160 16.365 9.630 -4.197 1.00 0.00 C ATOM 2609 CG LYS A 160 15.533 9.644 -2.927 1.00 0.00 C ATOM 2610 CD LYS A 160 16.094 8.682 -1.892 1.00 0.00 C ATOM 2611 CE LYS A 160 15.337 8.774 -0.577 1.00 0.00 C ATOM 2612 NZ LYS A 160 16.005 8.003 0.505 1.00 0.00 N ATOM 0 H LYS A 160 14.540 9.844 -5.914 1.00 0.00 H new ATOM 0 HA LYS A 160 16.074 11.734 -4.418 1.00 0.00 H new ATOM 0 HB2 LYS A 160 16.115 8.741 -4.776 1.00 0.00 H new ATOM 0 HB3 LYS A 160 17.419 9.550 -3.930 1.00 0.00 H new ATOM 0 HG2 LYS A 160 15.510 10.653 -2.515 1.00 0.00 H new ATOM 0 HG3 LYS A 160 14.504 9.372 -3.160 1.00 0.00 H new ATOM 0 HD2 LYS A 160 16.039 7.663 -2.274 1.00 0.00 H new ATOM 0 HD3 LYS A 160 17.148 8.903 -1.722 1.00 0.00 H new ATOM 0 HE2 LYS A 160 15.253 9.819 -0.279 1.00 0.00 H new ATOM 0 HE3 LYS A 160 14.323 8.400 -0.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 15.457 8.092 1.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 16.062 7.001 0.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 16.964 8.376 0.656 1.00 0.00 H new ATOM 2626 N LEU A 161 17.251 10.639 -7.236 1.00 0.00 N ATOM 2627 CA LEU A 161 18.297 10.870 -8.230 1.00 0.00 C ATOM 2628 C LEU A 161 18.315 12.336 -8.652 1.00 0.00 C ATOM 2629 O LEU A 161 19.346 12.858 -9.083 1.00 0.00 O ATOM 2630 CB LEU A 161 18.096 9.972 -9.455 1.00 0.00 C ATOM 2631 CG LEU A 161 18.831 8.626 -9.419 1.00 0.00 C ATOM 2632 CD1 LEU A 161 18.419 7.799 -8.209 1.00 0.00 C ATOM 2633 CD2 LEU A 161 18.570 7.853 -10.703 1.00 0.00 C ATOM 0 H LEU A 161 16.443 10.123 -7.585 1.00 0.00 H new ATOM 0 HA LEU A 161 19.256 10.621 -7.775 1.00 0.00 H new ATOM 0 HB2 LEU A 161 17.029 9.780 -9.571 1.00 0.00 H new ATOM 0 HB3 LEU A 161 18.420 10.519 -10.341 1.00 0.00 H new ATOM 0 HG LEU A 161 19.899 8.828 -9.335 1.00 0.00 H new ATOM 0 HD11 LEU A 161 18.959 6.852 -8.215 1.00 0.00 H new ATOM 0 HD12 LEU A 161 18.656 8.346 -7.297 1.00 0.00 H new ATOM 0 HD13 LEU A 161 17.347 7.606 -8.248 1.00 0.00 H new ATOM 0 HD21 LEU A 161 19.096 6.899 -10.667 1.00 0.00 H new ATOM 0 HD22 LEU A 161 17.500 7.673 -10.808 1.00 0.00 H new ATOM 0 HD23 LEU A 161 18.926 8.432 -11.555 1.00 0.00 H new ATOM 2645 N GLU A 162 17.178 13.007 -8.484 1.00 0.00 N ATOM 2646 CA GLU A 162 17.048 14.416 -8.844 1.00 0.00 C ATOM 2647 C GLU A 162 17.729 15.320 -7.814 1.00 0.00 C ATOM 2648 O GLU A 162 17.585 16.542 -7.856 1.00 0.00 O ATOM 2649 CB GLU A 162 15.573 14.806 -8.974 1.00 0.00 C ATOM 2650 CG GLU A 162 14.812 14.004 -10.016 1.00 0.00 C ATOM 2651 CD GLU A 162 13.389 14.490 -10.198 1.00 0.00 C ATOM 2652 OE1 GLU A 162 12.535 14.191 -9.338 1.00 0.00 O ATOM 2653 OE2 GLU A 162 13.121 15.195 -11.194 1.00 0.00 O ATOM 0 H GLU A 162 16.329 12.594 -8.098 1.00 0.00 H new ATOM 0 HA GLU A 162 17.542 14.554 -9.806 1.00 0.00 H new ATOM 0 HB2 GLU A 162 15.087 14.679 -8.006 1.00 0.00 H new ATOM 0 HB3 GLU A 162 15.508 15.864 -9.226 1.00 0.00 H new ATOM 0 HG2 GLU A 162 15.337 14.063 -10.969 1.00 0.00 H new ATOM 0 HG3 GLU A 162 14.799 12.954 -9.723 1.00 0.00 H new ATOM 2660 N HIS A 163 18.478 14.719 -6.894 1.00 0.00 N ATOM 2661 CA HIS A 163 19.216 15.487 -5.894 1.00 0.00 C ATOM 2662 C HIS A 163 20.485 16.090 -6.498 1.00 0.00 C ATOM 2663 O HIS A 163 21.195 16.854 -5.846 1.00 0.00 O ATOM 2664 CB HIS A 163 19.556 14.624 -4.665 1.00 0.00 C ATOM 2665 CG HIS A 163 20.601 13.555 -4.875 1.00 0.00 C ATOM 2666 ND1 HIS A 163 21.243 12.927 -3.827 1.00 0.00 N ATOM 2667 CD2 HIS A 163 21.102 12.988 -6.005 1.00 0.00 C ATOM 2668 CE1 HIS A 163 22.088 12.029 -4.301 1.00 0.00 C ATOM 2669 NE2 HIS A 163 22.022 12.046 -5.618 1.00 0.00 N ATOM 0 H HIS A 163 18.590 13.708 -6.819 1.00 0.00 H new ATOM 0 HA HIS A 163 18.573 16.302 -5.563 1.00 0.00 H new ATOM 0 HB2 HIS A 163 19.895 15.283 -3.866 1.00 0.00 H new ATOM 0 HB3 HIS A 163 18.640 14.146 -4.317 1.00 0.00 H new ATOM 0 HD2 HIS A 163 20.827 13.234 -7.020 1.00 0.00 H new ATOM 0 HE1 HIS A 163 22.726 11.389 -3.710 1.00 0.00 H new ATOM 0 HE2 HIS A 163 22.566 11.455 -6.247 1.00 0.00 H new ATOM 2678 N HIS A 164 20.760 15.731 -7.746 1.00 0.00 N ATOM 2679 CA HIS A 164 21.922 16.242 -8.458 1.00 0.00 C ATOM 2680 C HIS A 164 21.528 17.476 -9.264 1.00 0.00 C ATOM 2681 O HIS A 164 20.639 17.411 -10.110 1.00 0.00 O ATOM 2682 CB HIS A 164 22.494 15.156 -9.379 1.00 0.00 C ATOM 2683 CG HIS A 164 23.753 15.552 -10.094 1.00 0.00 C ATOM 2684 ND1 HIS A 164 25.010 15.358 -9.569 1.00 0.00 N ATOM 2685 CD2 HIS A 164 23.940 16.125 -11.306 1.00 0.00 C ATOM 2686 CE1 HIS A 164 25.915 15.793 -10.423 1.00 0.00 C ATOM 2687 NE2 HIS A 164 25.291 16.261 -11.486 1.00 0.00 N ATOM 0 H HIS A 164 20.189 15.083 -8.288 1.00 0.00 H new ATOM 0 HA HIS A 164 22.691 16.523 -7.739 1.00 0.00 H new ATOM 0 HB2 HIS A 164 22.692 14.262 -8.788 1.00 0.00 H new ATOM 0 HB3 HIS A 164 21.739 14.889 -10.118 1.00 0.00 H new ATOM 0 HD2 HIS A 164 23.168 16.420 -12.001 1.00 0.00 H new ATOM 0 HE1 HIS A 164 26.985 15.770 -10.277 1.00 0.00 H new ATOM 0 HE2 HIS A 164 25.742 16.660 -12.310 1.00 0.00 H new ATOM 2696 N HIS A 165 22.192 18.592 -9.000 1.00 0.00 N ATOM 2697 CA HIS A 165 21.852 19.855 -9.643 1.00 0.00 C ATOM 2698 C HIS A 165 22.714 20.077 -10.887 1.00 0.00 C ATOM 2699 O HIS A 165 23.353 19.143 -11.373 1.00 0.00 O ATOM 2700 CB HIS A 165 22.028 21.014 -8.654 1.00 0.00 C ATOM 2701 CG HIS A 165 21.129 20.925 -7.455 1.00 0.00 C ATOM 2702 ND1 HIS A 165 21.595 20.704 -6.175 1.00 0.00 N ATOM 2703 CD2 HIS A 165 19.782 21.034 -7.345 1.00 0.00 C ATOM 2704 CE1 HIS A 165 20.579 20.681 -5.334 1.00 0.00 C ATOM 2705 NE2 HIS A 165 19.468 20.880 -6.016 1.00 0.00 N ATOM 0 H HIS A 165 22.971 18.650 -8.344 1.00 0.00 H new ATOM 0 HA HIS A 165 20.808 19.816 -9.955 1.00 0.00 H new ATOM 0 HB2 HIS A 165 23.065 21.040 -8.319 1.00 0.00 H new ATOM 0 HB3 HIS A 165 21.837 21.954 -9.172 1.00 0.00 H new ATOM 0 HD2 HIS A 165 19.086 21.209 -8.152 1.00 0.00 H new ATOM 0 HE1 HIS A 165 20.646 20.525 -4.267 1.00 0.00 H new ATOM 0 HE2 HIS A 165 18.528 20.914 -5.621 1.00 0.00 H new ATOM 2714 N HIS A 166 22.713 21.312 -11.395 1.00 0.00 N ATOM 2715 CA HIS A 166 23.476 21.682 -12.593 1.00 0.00 C ATOM 2716 C HIS A 166 22.879 21.054 -13.848 1.00 0.00 C ATOM 2717 O HIS A 166 23.610 20.650 -14.754 1.00 0.00 O ATOM 2718 CB HIS A 166 24.954 21.287 -12.474 1.00 0.00 C ATOM 2719 CG HIS A 166 25.776 22.233 -11.657 1.00 0.00 C ATOM 2720 ND1 HIS A 166 26.484 23.274 -12.209 1.00 0.00 N ATOM 2721 CD2 HIS A 166 26.023 22.276 -10.328 1.00 0.00 C ATOM 2722 CE1 HIS A 166 27.133 23.916 -11.257 1.00 0.00 C ATOM 2723 NE2 HIS A 166 26.873 23.331 -10.102 1.00 0.00 N ATOM 0 H HIS A 166 22.184 22.084 -10.989 1.00 0.00 H new ATOM 0 HA HIS A 166 23.415 22.767 -12.676 1.00 0.00 H new ATOM 0 HB2 HIS A 166 25.019 20.292 -12.033 1.00 0.00 H new ATOM 0 HB3 HIS A 166 25.383 21.221 -13.474 1.00 0.00 H new ATOM 0 HD2 HIS A 166 25.625 21.604 -9.582 1.00 0.00 H new ATOM 0 HE1 HIS A 166 27.770 24.776 -11.398 1.00 0.00 H new ATOM 0 HE2 HIS A 166 27.242 23.615 -9.194 1.00 0.00 H new ATOM 2732 N HIS A 167 21.554 20.984 -13.903 1.00 0.00 N ATOM 2733 CA HIS A 167 20.868 20.465 -15.078 1.00 0.00 C ATOM 2734 C HIS A 167 19.437 20.985 -15.145 1.00 0.00 C ATOM 2735 O HIS A 167 18.566 20.531 -14.404 1.00 0.00 O ATOM 2736 CB HIS A 167 20.873 18.934 -15.078 1.00 0.00 C ATOM 2737 CG HIS A 167 21.572 18.345 -16.265 1.00 0.00 C ATOM 2738 ND1 HIS A 167 21.361 17.058 -16.705 1.00 0.00 N ATOM 2739 CD2 HIS A 167 22.494 18.878 -17.101 1.00 0.00 C ATOM 2740 CE1 HIS A 167 22.123 16.825 -17.756 1.00 0.00 C ATOM 2741 NE2 HIS A 167 22.820 17.912 -18.018 1.00 0.00 N ATOM 0 H HIS A 167 20.935 21.280 -13.148 1.00 0.00 H new ATOM 0 HA HIS A 167 21.405 20.815 -15.960 1.00 0.00 H new ATOM 0 HB2 HIS A 167 21.356 18.579 -14.167 1.00 0.00 H new ATOM 0 HB3 HIS A 167 19.844 18.574 -15.055 1.00 0.00 H new ATOM 0 HD2 HIS A 167 22.898 19.879 -17.054 1.00 0.00 H new ATOM 0 HE1 HIS A 167 22.168 15.899 -18.309 1.00 0.00 H new ATOM 0 HE2 HIS A 167 23.492 18.018 -18.778 1.00 0.00 H new ATOM 2750 N HIS A 168 19.213 21.952 -16.023 1.00 0.00 N ATOM 2751 CA HIS A 168 17.889 22.517 -16.226 1.00 0.00 C ATOM 2752 C HIS A 168 17.739 22.968 -17.673 1.00 0.00 C ATOM 2753 O HIS A 168 17.190 22.196 -18.480 1.00 0.00 O ATOM 2754 CB HIS A 168 17.647 23.695 -15.273 1.00 0.00 C ATOM 2755 CG HIS A 168 16.294 24.323 -15.424 1.00 0.00 C ATOM 2756 ND1 HIS A 168 15.144 23.768 -14.908 1.00 0.00 N ATOM 2757 CD2 HIS A 168 15.908 25.463 -16.046 1.00 0.00 C ATOM 2758 CE1 HIS A 168 14.115 24.536 -15.205 1.00 0.00 C ATOM 2759 NE2 HIS A 168 14.549 25.570 -15.895 1.00 0.00 N ATOM 2760 OXT HIS A 168 18.194 24.084 -18.004 1.00 0.00 O ATOM 0 H HIS A 168 19.938 22.364 -16.610 1.00 0.00 H new ATOM 0 HA HIS A 168 17.145 21.750 -16.011 1.00 0.00 H new ATOM 0 HB2 HIS A 168 17.765 23.350 -14.246 1.00 0.00 H new ATOM 0 HB3 HIS A 168 18.411 24.453 -15.445 1.00 0.00 H new ATOM 0 HD2 HIS A 168 16.551 26.159 -16.565 1.00 0.00 H new ATOM 0 HE1 HIS A 168 13.088 24.349 -14.929 1.00 0.00 H new ATOM 0 HE2 HIS A 168 13.969 26.327 -16.258 1.00 0.00 H new TER 2769 HIS A 168