USER MOD reduce.3.24.130724 H: found=0, std=0, add=1354, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1354 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 14 TYR OH : rot 33:sc= 1.19 USER MOD Set 1.2: B 68 SER OG : rot -76:sc= 1.21 USER MOD Set 2.1: B 57 SER OG : rot 180:sc= 0 USER MOD Set 2.2: B 59 THR OG1 : rot 180:sc= 0.108 USER MOD Set 3.1: A 57 SER OG : rot 180:sc= 0.0507 USER MOD Set 3.2: A 59 THR OG1 : rot 180:sc= 0.0712 USER MOD Single : A 1 THR N :NH3+ 140:sc= 0.274 (180deg=0.0485) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.179 USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -0.449 K(o=-0.45,f=-6.7!) USER MOD Single : A 20 SER OG : rot 180:sc= -1.08 USER MOD Single : A 21 HIS :FLIP no HE2:sc= -2.98! C(o=-3.6!,f=-3!) USER MOD Single : A 25 LYS NZ :NH3+ -159:sc= -0.0757 (180deg=-0.532) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 31 SER OG : rot 60:sc= -0.141 USER MOD Single : A 38 ASN : amide:sc= 0.244 X(o=0.24,f=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 51 THR OG1 : rot 77:sc= 0.0116 USER MOD Single : A 53 THR OG1 : rot 170:sc= -0.101 USER MOD Single : A 55 ASN : amide:sc= -1.11 K(o=-1.1,f=-7.3!) USER MOD Single : A 56 MET CE :methyl 160:sc= -2.12 (180deg=-3.51!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 68 SER OG : rot 68:sc= 0.464 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ -168:sc= -0.586 (180deg=-0.809) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 MET CE :methyl -169:sc= -2.63 (180deg=-2.98!) USER MOD Single : A 77 GLN : amide:sc= -1.2 K(o=-1.2,f=-6.1!) USER MOD Single : B 1 THR N :NH3+ -135:sc= 0.388 (180deg=0.0067) USER MOD Single : B 1 THR OG1 : rot 127:sc= 1.38 USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot 180:sc= 0.014 USER MOD Single : B 10 LYS NZ :NH3+ -146:sc= 0 (180deg=-0.33) USER MOD Single : B 11 ASN : amide:sc= 0 X(o=0,f=-0.033) USER MOD Single : B 14 TYR OH : rot 24:sc= 0.791 USER MOD Single : B 20 SER OG : rot 147:sc= -0.0286 USER MOD Single : B 21 HIS :FLIP no HE2:sc= -2.81! C(o=-3.6!,f=-2.8!) USER MOD Single : B 25 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.069) USER MOD Single : B 28 SER OG : rot 88:sc= 0.0214 USER MOD Single : B 29 GLN : amide:sc= -0.06 X(o=-0.06,f=-0.43) USER MOD Single : B 31 SER OG : rot 109:sc= -0.559 USER MOD Single : B 38 ASN : amide:sc= -0.774 X(o=-0.77,f=-0.49) USER MOD Single : B 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 ASN : amide:sc= -0.0341 K(o=-0.034,f=-0.56) USER MOD Single : B 51 THR OG1 : rot 180:sc= -0.0419 USER MOD Single : B 53 THR OG1 : rot 100:sc= -0.196 USER MOD Single : B 55 ASN : amide:sc= -1.01 K(o=-1,f=-7.6!) USER MOD Single : B 56 MET CE :methyl 143:sc= -1.75 (180deg=-3.71!) USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 63 THR OG1 : rot -170:sc= -0.202 USER MOD Single : B 69 LYS NZ :NH3+ -158:sc= -0.0228 (180deg=-0.594) USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 LYS NZ :NH3+ -159:sc= -0.0128 (180deg=-0.198) USER MOD Single : B 74 MET CE :methyl -161:sc= -0.103 (180deg=-0.592) USER MOD Single : B 77 GLN : amide:sc= 0 X(o=0,f=-0.04) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 12.970 -4.180 5.964 1.00 0.00 N ATOM 2 CA THR A 1 14.219 -3.882 5.203 1.00 0.00 C ATOM 3 C THR A 1 14.590 -2.402 5.317 1.00 0.00 C ATOM 4 O THR A 1 13.741 -1.527 5.129 1.00 0.00 O ATOM 5 CB THR A 1 14.010 -4.267 3.732 1.00 0.00 C ATOM 6 OG1 THR A 1 13.121 -5.368 3.616 1.00 0.00 O ATOM 7 CG2 THR A 1 15.298 -4.635 3.016 1.00 0.00 C ATOM 0 H1 THR A 1 12.383 -4.844 5.421 1.00 0.00 H new ATOM 0 H2 THR A 1 13.215 -4.605 6.881 1.00 0.00 H new ATOM 0 H3 THR A 1 12.441 -3.299 6.121 1.00 0.00 H new ATOM 0 HA THR A 1 15.040 -4.463 5.623 1.00 0.00 H new ATOM 0 HB THR A 1 13.594 -3.376 3.261 1.00 0.00 H new ATOM 0 HG1 THR A 1 13.002 -5.594 2.670 1.00 0.00 H new ATOM 0 HG21 THR A 1 15.077 -4.896 1.981 1.00 0.00 H new ATOM 0 HG22 THR A 1 15.982 -3.786 3.038 1.00 0.00 H new ATOM 0 HG23 THR A 1 15.761 -5.487 3.514 1.00 0.00 H new ATOM 17 N LYS A 2 15.858 -2.130 5.627 1.00 0.00 N ATOM 18 CA LYS A 2 16.337 -0.756 5.769 1.00 0.00 C ATOM 19 C LYS A 2 17.161 -0.331 4.556 1.00 0.00 C ATOM 20 O LYS A 2 18.155 -0.971 4.211 1.00 0.00 O ATOM 21 CB LYS A 2 17.170 -0.609 7.047 1.00 0.00 C ATOM 22 CG LYS A 2 16.570 0.361 8.053 1.00 0.00 C ATOM 23 CD LYS A 2 16.999 0.030 9.475 1.00 0.00 C ATOM 24 CE LYS A 2 17.697 1.210 10.137 1.00 0.00 C ATOM 25 NZ LYS A 2 16.735 2.111 10.834 1.00 0.00 N ATOM 0 H LYS A 2 16.571 -2.843 5.784 1.00 0.00 H new ATOM 0 HA LYS A 2 15.466 -0.104 5.836 1.00 0.00 H new ATOM 0 HB2 LYS A 2 17.277 -1.587 7.516 1.00 0.00 H new ATOM 0 HB3 LYS A 2 18.172 -0.272 6.782 1.00 0.00 H new ATOM 0 HG2 LYS A 2 16.877 1.377 7.807 1.00 0.00 H new ATOM 0 HG3 LYS A 2 15.483 0.331 7.984 1.00 0.00 H new ATOM 0 HD2 LYS A 2 16.126 -0.254 10.063 1.00 0.00 H new ATOM 0 HD3 LYS A 2 17.669 -0.830 9.463 1.00 0.00 H new ATOM 0 HE2 LYS A 2 18.432 0.841 10.853 1.00 0.00 H new ATOM 0 HE3 LYS A 2 18.243 1.777 9.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 17.253 2.900 11.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 16.049 2.484 10.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 16.231 1.578 11.571 1.00 0.00 H new ATOM 39 N VAL A 3 16.739 0.760 3.918 1.00 0.00 N ATOM 40 CA VAL A 3 17.428 1.287 2.746 1.00 0.00 C ATOM 41 C VAL A 3 18.252 2.521 3.110 1.00 0.00 C ATOM 42 O VAL A 3 17.720 3.495 3.647 1.00 0.00 O ATOM 43 CB VAL A 3 16.430 1.667 1.627 1.00 0.00 C ATOM 44 CG1 VAL A 3 17.167 2.020 0.345 1.00 0.00 C ATOM 45 CG2 VAL A 3 15.430 0.542 1.382 1.00 0.00 C ATOM 0 H VAL A 3 15.918 1.297 4.197 1.00 0.00 H new ATOM 0 HA VAL A 3 18.087 0.498 2.383 1.00 0.00 H new ATOM 0 HB VAL A 3 15.875 2.546 1.955 1.00 0.00 H new ATOM 0 HG11 VAL A 3 16.446 2.284 -0.428 1.00 0.00 H new ATOM 0 HG12 VAL A 3 17.830 2.866 0.527 1.00 0.00 H new ATOM 0 HG13 VAL A 3 17.755 1.163 0.016 1.00 0.00 H new ATOM 0 HG21 VAL A 3 14.740 0.835 0.591 1.00 0.00 H new ATOM 0 HG22 VAL A 3 15.963 -0.360 1.083 1.00 0.00 H new ATOM 0 HG23 VAL A 3 14.871 0.346 2.297 1.00 0.00 H new ATOM 55 N THR A 4 19.550 2.478 2.814 1.00 0.00 N ATOM 56 CA THR A 4 20.436 3.599 3.113 1.00 0.00 C ATOM 57 C THR A 4 21.227 4.019 1.875 1.00 0.00 C ATOM 58 O THR A 4 22.077 3.274 1.386 1.00 0.00 O ATOM 59 CB THR A 4 21.394 3.247 4.258 1.00 0.00 C ATOM 60 OG1 THR A 4 20.833 2.260 5.108 1.00 0.00 O ATOM 61 CG2 THR A 4 21.751 4.439 5.119 1.00 0.00 C ATOM 0 H THR A 4 20.009 1.683 2.370 1.00 0.00 H new ATOM 0 HA THR A 4 19.814 4.438 3.425 1.00 0.00 H new ATOM 0 HB THR A 4 22.297 2.877 3.772 1.00 0.00 H new ATOM 0 HG1 THR A 4 21.464 2.052 5.829 1.00 0.00 H new ATOM 0 HG21 THR A 4 22.431 4.125 5.911 1.00 0.00 H new ATOM 0 HG22 THR A 4 22.235 5.199 4.505 1.00 0.00 H new ATOM 0 HG23 THR A 4 20.845 4.852 5.562 1.00 0.00 H new ATOM 69 N LEU A 5 20.943 5.224 1.379 1.00 0.00 N ATOM 70 CA LEU A 5 21.623 5.760 0.202 1.00 0.00 C ATOM 71 C LEU A 5 22.598 6.864 0.607 1.00 0.00 C ATOM 72 O LEU A 5 22.468 7.451 1.681 1.00 0.00 O ATOM 73 CB LEU A 5 20.609 6.316 -0.806 1.00 0.00 C ATOM 74 CG LEU A 5 19.645 5.291 -1.417 1.00 0.00 C ATOM 75 CD1 LEU A 5 20.411 4.133 -2.045 1.00 0.00 C ATOM 76 CD2 LEU A 5 18.668 4.782 -0.368 1.00 0.00 C ATOM 0 H LEU A 5 20.243 5.849 1.778 1.00 0.00 H new ATOM 0 HA LEU A 5 22.176 4.946 -0.267 1.00 0.00 H new ATOM 0 HB2 LEU A 5 20.021 7.090 -0.312 1.00 0.00 H new ATOM 0 HB3 LEU A 5 21.157 6.799 -1.615 1.00 0.00 H new ATOM 0 HG LEU A 5 19.076 5.787 -2.203 1.00 0.00 H new ATOM 0 HD11 LEU A 5 19.706 3.419 -2.472 1.00 0.00 H new ATOM 0 HD12 LEU A 5 21.064 4.512 -2.831 1.00 0.00 H new ATOM 0 HD13 LEU A 5 21.012 3.638 -1.282 1.00 0.00 H new ATOM 0 HD21 LEU A 5 17.993 4.056 -0.821 1.00 0.00 H new ATOM 0 HD22 LEU A 5 19.220 4.307 0.443 1.00 0.00 H new ATOM 0 HD23 LEU A 5 18.090 5.618 0.027 1.00 0.00 H new ATOM 88 N VAL A 6 23.571 7.148 -0.258 1.00 0.00 N ATOM 89 CA VAL A 6 24.558 8.189 0.021 1.00 0.00 C ATOM 90 C VAL A 6 24.867 9.009 -1.229 1.00 0.00 C ATOM 91 O VAL A 6 25.632 8.577 -2.095 1.00 0.00 O ATOM 92 CB VAL A 6 25.873 7.603 0.580 1.00 0.00 C ATOM 93 CG1 VAL A 6 26.801 8.718 1.043 1.00 0.00 C ATOM 94 CG2 VAL A 6 25.589 6.631 1.718 1.00 0.00 C ATOM 0 H VAL A 6 23.696 6.675 -1.153 1.00 0.00 H new ATOM 0 HA VAL A 6 24.116 8.837 0.778 1.00 0.00 H new ATOM 0 HB VAL A 6 26.370 7.054 -0.219 1.00 0.00 H new ATOM 0 HG11 VAL A 6 27.722 8.286 1.434 1.00 0.00 H new ATOM 0 HG12 VAL A 6 27.034 9.370 0.201 1.00 0.00 H new ATOM 0 HG13 VAL A 6 26.311 9.297 1.826 1.00 0.00 H new ATOM 0 HG21 VAL A 6 26.529 6.230 2.097 1.00 0.00 H new ATOM 0 HG22 VAL A 6 25.067 7.153 2.520 1.00 0.00 H new ATOM 0 HG23 VAL A 6 24.967 5.814 1.352 1.00 0.00 H new ATOM 104 N LYS A 7 24.273 10.198 -1.311 1.00 0.00 N ATOM 105 CA LYS A 7 24.486 11.089 -2.450 1.00 0.00 C ATOM 106 C LYS A 7 25.802 11.855 -2.306 1.00 0.00 C ATOM 107 O LYS A 7 26.244 12.144 -1.193 1.00 0.00 O ATOM 108 CB LYS A 7 23.316 12.073 -2.594 1.00 0.00 C ATOM 109 CG LYS A 7 23.242 13.126 -1.499 1.00 0.00 C ATOM 110 CD LYS A 7 22.536 14.386 -1.981 1.00 0.00 C ATOM 111 CE LYS A 7 21.035 14.174 -2.119 1.00 0.00 C ATOM 112 NZ LYS A 7 20.338 15.397 -2.611 1.00 0.00 N ATOM 0 H LYS A 7 23.640 10.567 -0.602 1.00 0.00 H new ATOM 0 HA LYS A 7 24.540 10.475 -3.349 1.00 0.00 H new ATOM 0 HB2 LYS A 7 23.396 12.574 -3.559 1.00 0.00 H new ATOM 0 HB3 LYS A 7 22.383 11.510 -2.603 1.00 0.00 H new ATOM 0 HG2 LYS A 7 22.713 12.719 -0.637 1.00 0.00 H new ATOM 0 HG3 LYS A 7 24.249 13.377 -1.166 1.00 0.00 H new ATOM 0 HD2 LYS A 7 22.726 15.200 -1.281 1.00 0.00 H new ATOM 0 HD3 LYS A 7 22.950 14.690 -2.942 1.00 0.00 H new ATOM 0 HE2 LYS A 7 20.848 13.349 -2.807 1.00 0.00 H new ATOM 0 HE3 LYS A 7 20.620 13.885 -1.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 19.318 15.207 -2.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 20.494 16.178 -1.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 20.715 15.659 -3.544 1.00 0.00 H new ATOM 126 N SER A 8 26.420 12.185 -3.440 1.00 0.00 N ATOM 127 CA SER A 8 27.683 12.925 -3.438 1.00 0.00 C ATOM 128 C SER A 8 27.450 14.396 -3.099 1.00 0.00 C ATOM 129 O SER A 8 26.329 14.898 -3.208 1.00 0.00 O ATOM 130 CB SER A 8 28.372 12.803 -4.799 1.00 0.00 C ATOM 131 OG SER A 8 29.761 12.570 -4.648 1.00 0.00 O ATOM 0 H SER A 8 26.069 11.953 -4.369 1.00 0.00 H new ATOM 0 HA SER A 8 28.329 12.493 -2.674 1.00 0.00 H new ATOM 0 HB2 SER A 8 27.923 11.987 -5.366 1.00 0.00 H new ATOM 0 HB3 SER A 8 28.213 13.716 -5.374 1.00 0.00 H new ATOM 0 HG SER A 8 30.178 12.494 -5.532 1.00 0.00 H new ATOM 137 N ARG A 9 28.515 15.085 -2.682 1.00 0.00 N ATOM 138 CA ARG A 9 28.424 16.501 -2.325 1.00 0.00 C ATOM 139 C ARG A 9 28.004 17.341 -3.531 1.00 0.00 C ATOM 140 O ARG A 9 28.821 17.649 -4.400 1.00 0.00 O ATOM 141 CB ARG A 9 29.765 17.006 -1.775 1.00 0.00 C ATOM 142 CG ARG A 9 30.067 16.524 -0.364 1.00 0.00 C ATOM 143 CD ARG A 9 29.176 17.205 0.664 1.00 0.00 C ATOM 144 NE ARG A 9 29.349 16.640 2.004 1.00 0.00 N ATOM 145 CZ ARG A 9 28.563 16.926 3.045 1.00 0.00 C ATOM 146 NH1 ARG A 9 27.546 17.775 2.913 1.00 0.00 N ATOM 147 NH2 ARG A 9 28.795 16.362 4.224 1.00 0.00 N ATOM 0 H ARG A 9 29.448 14.685 -2.584 1.00 0.00 H new ATOM 0 HA ARG A 9 27.664 16.603 -1.550 1.00 0.00 H new ATOM 0 HB2 ARG A 9 30.566 16.681 -2.440 1.00 0.00 H new ATOM 0 HB3 ARG A 9 29.765 18.096 -1.785 1.00 0.00 H new ATOM 0 HG2 ARG A 9 29.926 15.444 -0.310 1.00 0.00 H new ATOM 0 HG3 ARG A 9 31.113 16.721 -0.128 1.00 0.00 H new ATOM 0 HD2 ARG A 9 29.401 18.271 0.689 1.00 0.00 H new ATOM 0 HD3 ARG A 9 28.133 17.107 0.361 1.00 0.00 H new ATOM 0 HE ARG A 9 30.118 15.987 2.151 1.00 0.00 H new ATOM 0 HH11 ARG A 9 27.361 18.213 2.011 1.00 0.00 H new ATOM 0 HH12 ARG A 9 26.951 17.987 3.714 1.00 0.00 H new ATOM 0 HH21 ARG A 9 29.573 15.711 4.334 1.00 0.00 H new ATOM 0 HH22 ARG A 9 28.196 16.579 5.020 1.00 0.00 H new ATOM 161 N LYS A 10 26.717 17.693 -3.579 1.00 0.00 N ATOM 162 CA LYS A 10 26.165 18.485 -4.679 1.00 0.00 C ATOM 163 C LYS A 10 26.345 17.759 -6.020 1.00 0.00 C ATOM 164 O LYS A 10 26.604 18.386 -7.049 1.00 0.00 O ATOM 165 CB LYS A 10 26.823 19.873 -4.724 1.00 0.00 C ATOM 166 CG LYS A 10 25.921 20.957 -5.302 1.00 0.00 C ATOM 167 CD LYS A 10 26.133 22.295 -4.605 1.00 0.00 C ATOM 168 CE LYS A 10 24.824 22.865 -4.076 1.00 0.00 C ATOM 169 NZ LYS A 10 24.833 24.356 -4.043 1.00 0.00 N ATOM 0 H LYS A 10 26.035 17.440 -2.864 1.00 0.00 H new ATOM 0 HA LYS A 10 25.097 18.613 -4.504 1.00 0.00 H new ATOM 0 HB2 LYS A 10 27.119 20.158 -3.715 1.00 0.00 H new ATOM 0 HB3 LYS A 10 27.734 19.815 -5.319 1.00 0.00 H new ATOM 0 HG2 LYS A 10 26.120 21.066 -6.368 1.00 0.00 H new ATOM 0 HG3 LYS A 10 24.878 20.655 -5.202 1.00 0.00 H new ATOM 0 HD2 LYS A 10 26.835 22.169 -3.781 1.00 0.00 H new ATOM 0 HD3 LYS A 10 26.583 23.002 -5.302 1.00 0.00 H new ATOM 0 HE2 LYS A 10 24.001 22.522 -4.702 1.00 0.00 H new ATOM 0 HE3 LYS A 10 24.642 22.482 -3.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 23.923 24.701 -3.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 25.602 24.685 -3.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 24.980 24.724 -5.005 1.00 0.00 H new ATOM 183 N ASN A 11 26.205 16.430 -5.994 1.00 0.00 N ATOM 184 CA ASN A 11 26.348 15.609 -7.196 1.00 0.00 C ATOM 185 C ASN A 11 25.778 14.208 -6.969 1.00 0.00 C ATOM 186 O ASN A 11 25.733 13.728 -5.836 1.00 0.00 O ATOM 187 CB ASN A 11 27.825 15.513 -7.604 1.00 0.00 C ATOM 188 CG ASN A 11 28.011 15.206 -9.082 1.00 0.00 C ATOM 189 OD1 ASN A 11 27.414 14.270 -9.614 1.00 0.00 O ATOM 190 ND2 ASN A 11 28.846 15.992 -9.753 1.00 0.00 N ATOM 0 H ASN A 11 25.992 15.900 -5.149 1.00 0.00 H new ATOM 0 HA ASN A 11 25.787 16.085 -8.000 1.00 0.00 H new ATOM 0 HB2 ASN A 11 28.324 16.453 -7.368 1.00 0.00 H new ATOM 0 HB3 ASN A 11 28.311 14.737 -7.013 1.00 0.00 H new ATOM 0 HD21 ASN A 11 29.012 15.830 -10.746 1.00 0.00 H new ATOM 0 HD22 ASN A 11 29.321 16.757 -9.275 1.00 0.00 H new ATOM 197 N GLU A 12 25.347 13.560 -8.054 1.00 0.00 N ATOM 198 CA GLU A 12 24.782 12.210 -7.987 1.00 0.00 C ATOM 199 C GLU A 12 23.555 12.165 -7.074 1.00 0.00 C ATOM 200 O GLU A 12 23.658 11.827 -5.892 1.00 0.00 O ATOM 201 CB GLU A 12 25.838 11.210 -7.501 1.00 0.00 C ATOM 202 CG GLU A 12 27.066 11.132 -8.396 1.00 0.00 C ATOM 203 CD GLU A 12 28.006 10.006 -8.005 1.00 0.00 C ATOM 204 OE1 GLU A 12 28.337 9.898 -6.805 1.00 0.00 O ATOM 205 OE2 GLU A 12 28.412 9.235 -8.899 1.00 0.00 O ATOM 0 H GLU A 12 25.379 13.952 -8.995 1.00 0.00 H new ATOM 0 HA GLU A 12 24.466 11.932 -8.993 1.00 0.00 H new ATOM 0 HB2 GLU A 12 26.151 11.486 -6.494 1.00 0.00 H new ATOM 0 HB3 GLU A 12 25.385 10.221 -7.434 1.00 0.00 H new ATOM 0 HG2 GLU A 12 26.749 10.993 -9.429 1.00 0.00 H new ATOM 0 HG3 GLU A 12 27.603 12.080 -8.352 1.00 0.00 H new ATOM 212 N GLU A 13 22.394 12.511 -7.631 1.00 0.00 N ATOM 213 CA GLU A 13 21.143 12.516 -6.877 1.00 0.00 C ATOM 214 C GLU A 13 20.622 11.092 -6.657 1.00 0.00 C ATOM 215 O GLU A 13 21.150 10.132 -7.222 1.00 0.00 O ATOM 216 CB GLU A 13 20.090 13.355 -7.608 1.00 0.00 C ATOM 217 CG GLU A 13 19.959 13.032 -9.088 1.00 0.00 C ATOM 218 CD GLU A 13 18.579 13.346 -9.635 1.00 0.00 C ATOM 219 OE1 GLU A 13 17.634 12.591 -9.326 1.00 0.00 O ATOM 220 OE2 GLU A 13 18.445 14.347 -10.369 1.00 0.00 O ATOM 0 H GLU A 13 22.295 12.792 -8.606 1.00 0.00 H new ATOM 0 HA GLU A 13 21.339 12.959 -5.900 1.00 0.00 H new ATOM 0 HB2 GLU A 13 19.123 13.205 -7.127 1.00 0.00 H new ATOM 0 HB3 GLU A 13 20.341 14.410 -7.498 1.00 0.00 H new ATOM 0 HG2 GLU A 13 20.704 13.598 -9.647 1.00 0.00 H new ATOM 0 HG3 GLU A 13 20.176 11.976 -9.246 1.00 0.00 H new ATOM 227 N TYR A 14 19.583 10.966 -5.830 1.00 0.00 N ATOM 228 CA TYR A 14 18.991 9.661 -5.533 1.00 0.00 C ATOM 229 C TYR A 14 18.199 9.123 -6.723 1.00 0.00 C ATOM 230 O TYR A 14 18.227 7.922 -6.999 1.00 0.00 O ATOM 231 CB TYR A 14 18.076 9.740 -4.309 1.00 0.00 C ATOM 232 CG TYR A 14 18.761 10.236 -3.055 1.00 0.00 C ATOM 233 CD1 TYR A 14 19.731 9.469 -2.416 1.00 0.00 C ATOM 234 CD2 TYR A 14 18.430 11.466 -2.505 1.00 0.00 C ATOM 235 CE1 TYR A 14 20.352 9.919 -1.266 1.00 0.00 C ATOM 236 CE2 TYR A 14 19.047 11.923 -1.358 1.00 0.00 C ATOM 237 CZ TYR A 14 20.005 11.146 -0.741 1.00 0.00 C ATOM 238 OH TYR A 14 20.613 11.597 0.407 1.00 0.00 O ATOM 0 H TYR A 14 19.135 11.750 -5.355 1.00 0.00 H new ATOM 0 HA TYR A 14 19.814 8.978 -5.322 1.00 0.00 H new ATOM 0 HB2 TYR A 14 17.238 10.399 -4.537 1.00 0.00 H new ATOM 0 HB3 TYR A 14 17.660 8.751 -4.116 1.00 0.00 H new ATOM 0 HD1 TYR A 14 20.003 8.507 -2.825 1.00 0.00 H new ATOM 0 HD2 TYR A 14 17.677 12.076 -2.982 1.00 0.00 H new ATOM 0 HE1 TYR A 14 21.104 9.314 -0.782 1.00 0.00 H new ATOM 0 HE2 TYR A 14 18.781 12.885 -0.945 1.00 0.00 H new ATOM 0 HH TYR A 14 21.538 11.274 0.436 1.00 0.00 H new ATOM 248 N GLY A 15 17.486 10.014 -7.416 1.00 0.00 N ATOM 249 CA GLY A 15 16.690 9.609 -8.563 1.00 0.00 C ATOM 250 C GLY A 15 15.655 8.555 -8.210 1.00 0.00 C ATOM 251 O GLY A 15 15.552 7.533 -8.886 1.00 0.00 O ATOM 0 H GLY A 15 17.447 11.010 -7.201 1.00 0.00 H new ATOM 0 HA2 GLY A 15 16.187 10.482 -8.979 1.00 0.00 H new ATOM 0 HA3 GLY A 15 17.349 9.221 -9.340 1.00 0.00 H new ATOM 255 N LEU A 16 14.887 8.802 -7.150 1.00 0.00 N ATOM 256 CA LEU A 16 13.856 7.860 -6.718 1.00 0.00 C ATOM 257 C LEU A 16 12.483 8.526 -6.702 1.00 0.00 C ATOM 258 O LEU A 16 12.324 9.631 -6.179 1.00 0.00 O ATOM 259 CB LEU A 16 14.191 7.284 -5.334 1.00 0.00 C ATOM 260 CG LEU A 16 14.290 8.306 -4.194 1.00 0.00 C ATOM 261 CD1 LEU A 16 12.991 8.356 -3.400 1.00 0.00 C ATOM 262 CD2 LEU A 16 15.457 7.967 -3.276 1.00 0.00 C ATOM 0 H LEU A 16 14.959 9.643 -6.577 1.00 0.00 H new ATOM 0 HA LEU A 16 13.828 7.039 -7.434 1.00 0.00 H new ATOM 0 HB2 LEU A 16 13.430 6.549 -5.073 1.00 0.00 H new ATOM 0 HB3 LEU A 16 15.139 6.751 -5.403 1.00 0.00 H new ATOM 0 HG LEU A 16 14.464 9.289 -4.632 1.00 0.00 H new ATOM 0 HD11 LEU A 16 13.083 9.087 -2.597 1.00 0.00 H new ATOM 0 HD12 LEU A 16 12.172 8.643 -4.060 1.00 0.00 H new ATOM 0 HD13 LEU A 16 12.787 7.373 -2.975 1.00 0.00 H new ATOM 0 HD21 LEU A 16 15.513 8.702 -2.473 1.00 0.00 H new ATOM 0 HD22 LEU A 16 15.309 6.975 -2.850 1.00 0.00 H new ATOM 0 HD23 LEU A 16 16.385 7.982 -3.847 1.00 0.00 H new ATOM 274 N ARG A 17 11.495 7.850 -7.289 1.00 0.00 N ATOM 275 CA ARG A 17 10.133 8.373 -7.350 1.00 0.00 C ATOM 276 C ARG A 17 9.326 7.930 -6.133 1.00 0.00 C ATOM 277 O ARG A 17 9.056 6.743 -5.954 1.00 0.00 O ATOM 278 CB ARG A 17 9.442 7.909 -8.636 1.00 0.00 C ATOM 279 CG ARG A 17 9.895 8.660 -9.878 1.00 0.00 C ATOM 280 CD ARG A 17 9.010 9.866 -10.157 1.00 0.00 C ATOM 281 NE ARG A 17 8.555 9.910 -11.548 1.00 0.00 N ATOM 282 CZ ARG A 17 7.675 10.798 -12.019 1.00 0.00 C ATOM 283 NH1 ARG A 17 7.147 11.718 -11.216 1.00 0.00 N ATOM 284 NH2 ARG A 17 7.321 10.766 -13.299 1.00 0.00 N ATOM 0 H ARG A 17 11.614 6.938 -7.729 1.00 0.00 H new ATOM 0 HA ARG A 17 10.187 9.462 -7.350 1.00 0.00 H new ATOM 0 HB2 ARG A 17 9.632 6.845 -8.776 1.00 0.00 H new ATOM 0 HB3 ARG A 17 8.365 8.029 -8.523 1.00 0.00 H new ATOM 0 HG2 ARG A 17 10.927 8.987 -9.750 1.00 0.00 H new ATOM 0 HG3 ARG A 17 9.877 7.989 -10.737 1.00 0.00 H new ATOM 0 HD2 ARG A 17 8.145 9.840 -9.494 1.00 0.00 H new ATOM 0 HD3 ARG A 17 9.560 10.779 -9.928 1.00 0.00 H new ATOM 0 HE ARG A 17 8.933 9.220 -12.197 1.00 0.00 H new ATOM 0 HH11 ARG A 17 7.413 11.749 -10.232 1.00 0.00 H new ATOM 0 HH12 ARG A 17 6.476 12.392 -11.584 1.00 0.00 H new ATOM 0 HH21 ARG A 17 7.721 10.064 -13.921 1.00 0.00 H new ATOM 0 HH22 ARG A 17 6.649 11.444 -13.659 1.00 0.00 H new ATOM 298 N LEU A 18 8.945 8.896 -5.300 1.00 0.00 N ATOM 299 CA LEU A 18 8.170 8.613 -4.096 1.00 0.00 C ATOM 300 C LEU A 18 6.699 8.985 -4.294 1.00 0.00 C ATOM 301 O LEU A 18 6.385 10.064 -4.802 1.00 0.00 O ATOM 302 CB LEU A 18 8.756 9.380 -2.902 1.00 0.00 C ATOM 303 CG LEU A 18 8.468 8.786 -1.518 1.00 0.00 C ATOM 304 CD1 LEU A 18 6.979 8.839 -1.207 1.00 0.00 C ATOM 305 CD2 LEU A 18 8.988 7.357 -1.425 1.00 0.00 C ATOM 0 H LEU A 18 9.161 9.883 -5.438 1.00 0.00 H new ATOM 0 HA LEU A 18 8.226 7.543 -3.894 1.00 0.00 H new ATOM 0 HB2 LEU A 18 9.836 9.444 -3.031 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.371 10.400 -2.926 1.00 0.00 H new ATOM 0 HG LEU A 18 8.992 9.387 -0.775 1.00 0.00 H new ATOM 0 HD11 LEU A 18 6.798 8.412 -0.220 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.641 9.875 -1.222 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.430 8.267 -1.956 1.00 0.00 H new ATOM 0 HD21 LEU A 18 8.773 6.955 -0.435 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.499 6.742 -2.180 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.065 7.350 -1.593 1.00 0.00 H new ATOM 317 N ALA A 19 5.805 8.084 -3.888 1.00 0.00 N ATOM 318 CA ALA A 19 4.367 8.308 -4.012 1.00 0.00 C ATOM 319 C ALA A 19 3.626 7.840 -2.761 1.00 0.00 C ATOM 320 O ALA A 19 4.181 7.109 -1.938 1.00 0.00 O ATOM 321 CB ALA A 19 3.829 7.597 -5.244 1.00 0.00 C ATOM 0 H ALA A 19 6.054 7.188 -3.469 1.00 0.00 H new ATOM 0 HA ALA A 19 4.199 9.379 -4.120 1.00 0.00 H new ATOM 0 HB1 ALA A 19 2.756 7.772 -5.325 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.328 7.982 -6.133 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.017 6.527 -5.158 1.00 0.00 H new ATOM 327 N SER A 20 2.369 8.263 -2.622 1.00 0.00 N ATOM 328 CA SER A 20 1.556 7.883 -1.467 1.00 0.00 C ATOM 329 C SER A 20 0.175 7.389 -1.901 1.00 0.00 C ATOM 330 O SER A 20 -0.345 7.804 -2.938 1.00 0.00 O ATOM 331 CB SER A 20 1.412 9.065 -0.503 1.00 0.00 C ATOM 332 OG SER A 20 0.750 10.156 -1.118 1.00 0.00 O ATOM 0 H SER A 20 1.893 8.867 -3.292 1.00 0.00 H new ATOM 0 HA SER A 20 2.065 7.066 -0.955 1.00 0.00 H new ATOM 0 HB2 SER A 20 0.855 8.751 0.380 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.398 9.381 -0.162 1.00 0.00 H new ATOM 0 HG SER A 20 0.672 10.894 -0.478 1.00 0.00 H new ATOM 338 N HIS A 21 -0.411 6.502 -1.097 1.00 0.00 N ATOM 339 CA HIS A 21 -1.733 5.950 -1.391 1.00 0.00 C ATOM 340 C HIS A 21 -2.746 6.361 -0.319 1.00 0.00 C ATOM 341 O HIS A 21 -2.395 7.026 0.656 1.00 0.00 O ATOM 342 CB HIS A 21 -1.663 4.422 -1.473 1.00 0.00 C ATOM 343 CG HIS A 21 -1.780 3.901 -2.867 1.00 0.00 C ATOM 344 ND1 HIS A 21 -0.983 4.078 -3.941 1.00 0.00 N flip ATOM 345 CD2 HIS A 21 -2.813 3.092 -3.288 1.00 0.00 C flip ATOM 346 CE1 HIS A 21 -1.536 3.379 -4.984 1.00 0.00 C flip ATOM 347 NE2 HIS A 21 -2.641 2.792 -4.562 1.00 0.00 N flip ATOM 0 H HIS A 21 0.009 6.150 -0.237 1.00 0.00 H new ATOM 0 HA HIS A 21 -2.059 6.349 -2.352 1.00 0.00 H new ATOM 0 HB2 HIS A 21 -0.719 4.085 -1.044 1.00 0.00 H new ATOM 0 HB3 HIS A 21 -2.460 3.995 -0.865 1.00 0.00 H new ATOM 0 HD1 HIS A 21 -0.126 4.630 -3.972 1.00 0.00 H new ATOM 0 HD2 HIS A 21 -3.634 2.756 -2.672 1.00 0.00 H new ATOM 0 HE1 HIS A 21 -1.134 3.319 -5.985 1.00 0.00 H new ATOM 356 N ILE A 22 -4.004 5.953 -0.502 1.00 0.00 N ATOM 357 CA ILE A 22 -5.065 6.272 0.454 1.00 0.00 C ATOM 358 C ILE A 22 -5.893 5.029 0.777 1.00 0.00 C ATOM 359 O ILE A 22 -6.580 4.492 -0.088 1.00 0.00 O ATOM 360 CB ILE A 22 -6.004 7.377 -0.084 1.00 0.00 C ATOM 361 CG1 ILE A 22 -5.199 8.586 -0.574 1.00 0.00 C ATOM 362 CG2 ILE A 22 -7.004 7.800 0.984 1.00 0.00 C ATOM 363 CD1 ILE A 22 -4.474 9.328 0.529 1.00 0.00 C ATOM 0 H ILE A 22 -4.312 5.402 -1.303 1.00 0.00 H new ATOM 0 HA ILE A 22 -4.579 6.635 1.359 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.556 6.969 -0.930 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -4.471 8.250 -1.312 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -5.872 9.277 -1.082 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.655 8.578 0.585 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.605 6.940 1.280 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -6.468 8.185 1.852 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -3.928 10.170 0.103 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -5.197 9.696 1.257 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -3.774 8.653 1.022 1.00 0.00 H new ATOM 375 N PHE A 23 -5.823 4.575 2.028 1.00 0.00 N ATOM 376 CA PHE A 23 -6.566 3.390 2.462 1.00 0.00 C ATOM 377 C PHE A 23 -7.567 3.736 3.570 1.00 0.00 C ATOM 378 O PHE A 23 -7.725 4.901 3.936 1.00 0.00 O ATOM 379 CB PHE A 23 -5.594 2.308 2.949 1.00 0.00 C ATOM 380 CG PHE A 23 -4.934 2.643 4.257 1.00 0.00 C ATOM 381 CD1 PHE A 23 -3.925 3.590 4.313 1.00 0.00 C ATOM 382 CD2 PHE A 23 -5.335 2.026 5.432 1.00 0.00 C ATOM 383 CE1 PHE A 23 -3.329 3.915 5.512 1.00 0.00 C ATOM 384 CE2 PHE A 23 -4.738 2.346 6.635 1.00 0.00 C ATOM 385 CZ PHE A 23 -3.734 3.294 6.675 1.00 0.00 C ATOM 0 H PHE A 23 -5.260 5.009 2.759 1.00 0.00 H new ATOM 0 HA PHE A 23 -7.127 3.011 1.607 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -6.133 1.366 3.053 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -4.825 2.153 2.192 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -3.602 4.079 3.406 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -6.123 1.287 5.406 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -2.544 4.656 5.541 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -5.055 1.856 7.544 1.00 0.00 H new ATOM 0 HZ PHE A 23 -3.267 3.548 7.615 1.00 0.00 H new ATOM 395 N VAL A 24 -8.244 2.711 4.102 1.00 0.00 N ATOM 396 CA VAL A 24 -9.230 2.905 5.166 1.00 0.00 C ATOM 397 C VAL A 24 -8.618 2.675 6.550 1.00 0.00 C ATOM 398 O VAL A 24 -8.165 1.574 6.866 1.00 0.00 O ATOM 399 CB VAL A 24 -10.444 1.961 4.995 1.00 0.00 C ATOM 400 CG1 VAL A 24 -11.545 2.314 5.988 1.00 0.00 C ATOM 401 CG2 VAL A 24 -10.974 2.015 3.569 1.00 0.00 C ATOM 0 H VAL A 24 -8.125 1.740 3.812 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.565 3.939 5.089 1.00 0.00 H new ATOM 0 HB VAL A 24 -10.112 0.943 5.198 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -12.389 1.638 5.851 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.163 2.216 7.004 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -11.871 3.340 5.820 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -11.827 1.343 3.472 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -11.285 3.033 3.335 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -10.190 1.707 2.877 1.00 0.00 H new ATOM 411 N LYS A 25 -8.623 3.725 7.373 1.00 0.00 N ATOM 412 CA LYS A 25 -8.083 3.653 8.730 1.00 0.00 C ATOM 413 C LYS A 25 -9.031 2.893 9.662 1.00 0.00 C ATOM 414 O LYS A 25 -8.584 2.141 10.528 1.00 0.00 O ATOM 415 CB LYS A 25 -7.825 5.064 9.273 1.00 0.00 C ATOM 416 CG LYS A 25 -7.183 5.091 10.654 1.00 0.00 C ATOM 417 CD LYS A 25 -5.704 4.737 10.597 1.00 0.00 C ATOM 418 CE LYS A 25 -5.004 5.021 11.921 1.00 0.00 C ATOM 419 NZ LYS A 25 -5.116 6.453 12.324 1.00 0.00 N ATOM 0 H LYS A 25 -8.997 4.640 7.121 1.00 0.00 H new ATOM 0 HA LYS A 25 -7.139 3.109 8.690 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.181 5.598 8.574 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.771 5.605 9.313 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.303 6.082 11.091 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.700 4.389 11.309 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -5.592 3.682 10.345 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.224 5.307 9.802 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -5.435 4.392 12.700 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -3.951 4.750 11.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -4.362 6.683 13.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -5.021 7.059 11.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -6.043 6.618 12.767 1.00 0.00 H new ATOM 433 N GLU A 26 -10.338 3.099 9.478 1.00 0.00 N ATOM 434 CA GLU A 26 -11.351 2.436 10.303 1.00 0.00 C ATOM 435 C GLU A 26 -12.759 2.755 9.799 1.00 0.00 C ATOM 436 O GLU A 26 -12.934 3.573 8.894 1.00 0.00 O ATOM 437 CB GLU A 26 -11.213 2.870 11.767 1.00 0.00 C ATOM 438 CG GLU A 26 -10.817 1.741 12.704 1.00 0.00 C ATOM 439 CD GLU A 26 -10.634 2.210 14.135 1.00 0.00 C ATOM 440 OE1 GLU A 26 -11.630 2.219 14.889 1.00 0.00 O ATOM 441 OE2 GLU A 26 -9.496 2.574 14.499 1.00 0.00 O ATOM 0 H GLU A 26 -10.719 3.720 8.764 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.192 1.360 10.232 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.468 3.663 11.833 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -12.160 3.293 12.102 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.581 0.964 12.675 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -9.890 1.289 12.352 1.00 0.00 H new ATOM 448 N ILE A 27 -13.761 2.108 10.396 1.00 0.00 N ATOM 449 CA ILE A 27 -15.156 2.328 10.017 1.00 0.00 C ATOM 450 C ILE A 27 -16.055 2.357 11.253 1.00 0.00 C ATOM 451 O ILE A 27 -15.912 1.530 12.155 1.00 0.00 O ATOM 452 CB ILE A 27 -15.671 1.243 9.041 1.00 0.00 C ATOM 453 CG1 ILE A 27 -14.743 1.118 7.829 1.00 0.00 C ATOM 454 CG2 ILE A 27 -17.090 1.564 8.589 1.00 0.00 C ATOM 455 CD1 ILE A 27 -13.869 -0.116 7.860 1.00 0.00 C ATOM 0 H ILE A 27 -13.632 1.427 11.144 1.00 0.00 H new ATOM 0 HA ILE A 27 -15.194 3.292 9.511 1.00 0.00 H new ATOM 0 HB ILE A 27 -15.679 0.288 9.567 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -15.345 1.104 6.921 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -14.107 2.002 7.776 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -17.437 0.791 7.903 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -17.749 1.601 9.457 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -17.101 2.530 8.083 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -13.239 -0.138 6.971 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -13.240 -0.094 8.750 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -14.497 -1.006 7.881 1.00 0.00 H new ATOM 467 N SER A 28 -16.980 3.316 11.287 1.00 0.00 N ATOM 468 CA SER A 28 -17.904 3.459 12.411 1.00 0.00 C ATOM 469 C SER A 28 -19.153 2.602 12.213 1.00 0.00 C ATOM 470 O SER A 28 -19.571 2.350 11.082 1.00 0.00 O ATOM 471 CB SER A 28 -18.304 4.925 12.587 1.00 0.00 C ATOM 472 OG SER A 28 -17.202 5.704 13.018 1.00 0.00 O ATOM 0 H SER A 28 -17.109 4.006 10.547 1.00 0.00 H new ATOM 0 HA SER A 28 -17.391 3.115 13.309 1.00 0.00 H new ATOM 0 HB2 SER A 28 -18.685 5.317 11.644 1.00 0.00 H new ATOM 0 HB3 SER A 28 -19.113 5.000 13.313 1.00 0.00 H new ATOM 0 HG SER A 28 -17.482 6.637 13.122 1.00 0.00 H new ATOM 478 N GLN A 29 -19.747 2.165 13.324 1.00 0.00 N ATOM 479 CA GLN A 29 -20.954 1.342 13.279 1.00 0.00 C ATOM 480 C GLN A 29 -22.191 2.205 13.041 1.00 0.00 C ATOM 481 O GLN A 29 -22.159 3.420 13.250 1.00 0.00 O ATOM 482 CB GLN A 29 -21.110 0.549 14.580 1.00 0.00 C ATOM 483 CG GLN A 29 -20.070 -0.549 14.751 1.00 0.00 C ATOM 484 CD GLN A 29 -19.253 -0.398 16.022 1.00 0.00 C ATOM 485 OE1 GLN A 29 -18.772 0.691 16.340 1.00 0.00 O ATOM 486 NE2 GLN A 29 -19.089 -1.494 16.754 1.00 0.00 N ATOM 0 H GLN A 29 -19.411 2.368 14.266 1.00 0.00 H new ATOM 0 HA GLN A 29 -20.855 0.642 12.449 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -21.044 1.235 15.424 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -22.105 0.104 14.608 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -20.570 -1.518 14.760 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -19.400 -0.544 13.892 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -19.505 -2.375 16.453 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -18.547 -1.454 17.617 1.00 0.00 H new ATOM 495 N ASP A 30 -23.279 1.570 12.597 1.00 0.00 N ATOM 496 CA ASP A 30 -24.532 2.277 12.319 1.00 0.00 C ATOM 497 C ASP A 30 -24.333 3.356 11.251 1.00 0.00 C ATOM 498 O ASP A 30 -25.044 4.363 11.233 1.00 0.00 O ATOM 499 CB ASP A 30 -25.087 2.908 13.601 1.00 0.00 C ATOM 500 CG ASP A 30 -25.401 1.879 14.671 1.00 0.00 C ATOM 501 OD1 ASP A 30 -24.454 1.245 15.184 1.00 0.00 O ATOM 502 OD2 ASP A 30 -26.595 1.709 14.998 1.00 0.00 O ATOM 0 H ASP A 30 -23.317 0.566 12.422 1.00 0.00 H new ATOM 0 HA ASP A 30 -25.249 1.548 11.941 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -24.363 3.623 13.992 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -25.992 3.467 13.364 1.00 0.00 H new ATOM 507 N SER A 31 -23.357 3.144 10.365 1.00 0.00 N ATOM 508 CA SER A 31 -23.062 4.099 9.302 1.00 0.00 C ATOM 509 C SER A 31 -23.271 3.468 7.927 1.00 0.00 C ATOM 510 O SER A 31 -23.458 2.256 7.810 1.00 0.00 O ATOM 511 CB SER A 31 -21.623 4.608 9.436 1.00 0.00 C ATOM 512 OG SER A 31 -21.453 5.358 10.627 1.00 0.00 O ATOM 0 H SER A 31 -22.759 2.318 10.365 1.00 0.00 H new ATOM 0 HA SER A 31 -23.748 4.940 9.398 1.00 0.00 H new ATOM 0 HB2 SER A 31 -20.934 3.763 9.434 1.00 0.00 H new ATOM 0 HB3 SER A 31 -21.372 5.227 8.575 1.00 0.00 H new ATOM 0 HG SER A 31 -21.661 4.794 11.401 1.00 0.00 H new ATOM 518 N LEU A 32 -23.239 4.303 6.887 1.00 0.00 N ATOM 519 CA LEU A 32 -23.425 3.831 5.515 1.00 0.00 C ATOM 520 C LEU A 32 -22.365 2.792 5.139 1.00 0.00 C ATOM 521 O LEU A 32 -22.667 1.815 4.455 1.00 0.00 O ATOM 522 CB LEU A 32 -23.384 5.005 4.534 1.00 0.00 C ATOM 523 CG LEU A 32 -24.488 6.049 4.723 1.00 0.00 C ATOM 524 CD1 LEU A 32 -23.963 7.443 4.413 1.00 0.00 C ATOM 525 CD2 LEU A 32 -25.686 5.722 3.844 1.00 0.00 C ATOM 0 H LEU A 32 -23.086 5.308 6.969 1.00 0.00 H new ATOM 0 HA LEU A 32 -24.404 3.355 5.456 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -22.417 5.501 4.625 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -23.447 4.612 3.519 1.00 0.00 H new ATOM 0 HG LEU A 32 -24.809 6.027 5.765 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -24.761 8.172 4.553 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -23.136 7.678 5.083 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -23.615 7.479 3.381 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -26.461 6.474 3.991 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -25.379 5.717 2.798 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -26.077 4.741 4.112 1.00 0.00 H new ATOM 537 N ALA A 33 -21.128 3.002 5.594 1.00 0.00 N ATOM 538 CA ALA A 33 -20.034 2.072 5.308 1.00 0.00 C ATOM 539 C ALA A 33 -20.321 0.690 5.897 1.00 0.00 C ATOM 540 O ALA A 33 -20.132 -0.327 5.229 1.00 0.00 O ATOM 541 CB ALA A 33 -18.719 2.613 5.850 1.00 0.00 C ATOM 0 H ALA A 33 -20.859 3.806 6.161 1.00 0.00 H new ATOM 0 HA ALA A 33 -19.952 1.971 4.226 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -17.917 1.909 5.628 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -18.499 3.572 5.381 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -18.797 2.746 6.929 1.00 0.00 H new ATOM 547 N ALA A 34 -20.786 0.664 7.147 1.00 0.00 N ATOM 548 CA ALA A 34 -21.108 -0.592 7.823 1.00 0.00 C ATOM 549 C ALA A 34 -22.299 -1.279 7.158 1.00 0.00 C ATOM 550 O ALA A 34 -22.316 -2.501 7.009 1.00 0.00 O ATOM 551 CB ALA A 34 -21.389 -0.347 9.298 1.00 0.00 C ATOM 0 H ALA A 34 -20.948 1.498 7.711 1.00 0.00 H new ATOM 0 HA ALA A 34 -20.245 -1.253 7.740 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -21.627 -1.293 9.785 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -20.509 0.092 9.768 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -22.233 0.335 9.399 1.00 0.00 H new ATOM 557 N ARG A 35 -23.290 -0.484 6.754 1.00 0.00 N ATOM 558 CA ARG A 35 -24.481 -1.016 6.095 1.00 0.00 C ATOM 559 C ARG A 35 -24.160 -1.475 4.672 1.00 0.00 C ATOM 560 O ARG A 35 -24.651 -2.511 4.223 1.00 0.00 O ATOM 561 CB ARG A 35 -25.594 0.034 6.066 1.00 0.00 C ATOM 562 CG ARG A 35 -26.571 -0.086 7.227 1.00 0.00 C ATOM 563 CD ARG A 35 -28.016 0.010 6.759 1.00 0.00 C ATOM 564 NE ARG A 35 -28.344 -1.008 5.759 1.00 0.00 N ATOM 565 CZ ARG A 35 -29.584 -1.260 5.329 1.00 0.00 C ATOM 566 NH1 ARG A 35 -30.618 -0.584 5.820 1.00 0.00 N ATOM 567 NH2 ARG A 35 -29.789 -2.192 4.405 1.00 0.00 N ATOM 0 H ARG A 35 -23.291 0.529 6.872 1.00 0.00 H new ATOM 0 HA ARG A 35 -24.823 -1.878 6.668 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -25.146 1.028 6.080 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -26.143 -0.055 5.129 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -26.416 -1.037 7.736 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -26.371 0.701 7.954 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -28.681 -0.098 7.616 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -28.195 1.000 6.339 1.00 0.00 H new ATOM 0 HE ARG A 35 -27.580 -1.558 5.367 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -30.468 0.133 6.530 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -31.561 -0.782 5.487 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -29.000 -2.715 4.024 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -30.735 -2.385 4.076 1.00 0.00 H new ATOM 581 N ASP A 36 -23.330 -0.701 3.970 1.00 0.00 N ATOM 582 CA ASP A 36 -22.942 -1.037 2.601 1.00 0.00 C ATOM 583 C ASP A 36 -22.042 -2.271 2.573 1.00 0.00 C ATOM 584 O ASP A 36 -22.131 -3.092 1.660 1.00 0.00 O ATOM 585 CB ASP A 36 -22.222 0.139 1.934 1.00 0.00 C ATOM 586 CG ASP A 36 -22.412 0.153 0.426 1.00 0.00 C ATOM 587 OD1 ASP A 36 -23.574 0.209 -0.027 1.00 0.00 O ATOM 588 OD2 ASP A 36 -21.398 0.112 -0.299 1.00 0.00 O ATOM 0 H ASP A 36 -22.915 0.160 4.327 1.00 0.00 H new ATOM 0 HA ASP A 36 -23.855 -1.255 2.046 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -22.593 1.074 2.353 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -21.158 0.087 2.163 1.00 0.00 H new ATOM 593 N GLY A 37 -21.171 -2.391 3.576 1.00 0.00 N ATOM 594 CA GLY A 37 -20.263 -3.523 3.645 1.00 0.00 C ATOM 595 C GLY A 37 -19.253 -3.534 2.509 1.00 0.00 C ATOM 596 O GLY A 37 -18.792 -4.600 2.098 1.00 0.00 O ATOM 0 H GLY A 37 -21.080 -1.723 4.341 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -19.733 -3.501 4.597 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -20.839 -4.448 3.622 1.00 0.00 H new ATOM 600 N ASN A 38 -18.909 -2.349 1.999 1.00 0.00 N ATOM 601 CA ASN A 38 -17.947 -2.238 0.902 1.00 0.00 C ATOM 602 C ASN A 38 -16.616 -1.649 1.373 1.00 0.00 C ATOM 603 O ASN A 38 -15.578 -1.868 0.745 1.00 0.00 O ATOM 604 CB ASN A 38 -18.525 -1.384 -0.230 1.00 0.00 C ATOM 605 CG ASN A 38 -19.346 -2.201 -1.209 1.00 0.00 C ATOM 606 OD1 ASN A 38 -18.910 -2.467 -2.330 1.00 0.00 O ATOM 607 ND2 ASN A 38 -20.542 -2.604 -0.793 1.00 0.00 N ATOM 0 H ASN A 38 -19.281 -1.457 2.327 1.00 0.00 H new ATOM 0 HA ASN A 38 -17.755 -3.245 0.532 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -19.148 -0.597 0.194 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -17.711 -0.893 -0.763 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -21.137 -3.156 -1.410 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -20.865 -2.361 0.144 1.00 0.00 H new ATOM 614 N ILE A 39 -16.646 -0.901 2.480 1.00 0.00 N ATOM 615 CA ILE A 39 -15.439 -0.290 3.022 1.00 0.00 C ATOM 616 C ILE A 39 -15.008 -0.986 4.310 1.00 0.00 C ATOM 617 O ILE A 39 -15.570 -0.739 5.378 1.00 0.00 O ATOM 618 CB ILE A 39 -15.648 1.215 3.302 1.00 0.00 C ATOM 619 CG1 ILE A 39 -16.321 1.896 2.106 1.00 0.00 C ATOM 620 CG2 ILE A 39 -14.321 1.889 3.625 1.00 0.00 C ATOM 621 CD1 ILE A 39 -17.663 2.511 2.436 1.00 0.00 C ATOM 0 H ILE A 39 -17.493 -0.707 3.014 1.00 0.00 H new ATOM 0 HA ILE A 39 -14.657 -0.403 2.272 1.00 0.00 H new ATOM 0 HB ILE A 39 -16.303 1.315 4.168 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -15.660 2.672 1.721 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -16.452 1.165 1.308 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -14.489 2.948 3.819 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -13.882 1.423 4.507 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -13.641 1.778 2.780 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -18.080 2.975 1.542 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -18.341 1.735 2.792 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -17.536 3.266 3.211 1.00 0.00 H new ATOM 633 N GLN A 40 -14.008 -1.860 4.200 1.00 0.00 N ATOM 634 CA GLN A 40 -13.496 -2.595 5.354 1.00 0.00 C ATOM 635 C GLN A 40 -12.116 -2.077 5.754 1.00 0.00 C ATOM 636 O GLN A 40 -11.376 -1.556 4.918 1.00 0.00 O ATOM 637 CB GLN A 40 -13.427 -4.094 5.044 1.00 0.00 C ATOM 638 CG GLN A 40 -14.088 -4.965 6.101 1.00 0.00 C ATOM 639 CD GLN A 40 -15.588 -5.097 5.896 1.00 0.00 C ATOM 640 OE1 GLN A 40 -16.332 -4.128 6.046 1.00 0.00 O ATOM 641 NE2 GLN A 40 -16.041 -6.298 5.554 1.00 0.00 N ATOM 0 H GLN A 40 -13.536 -2.076 3.322 1.00 0.00 H new ATOM 0 HA GLN A 40 -14.180 -2.440 6.189 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -13.904 -4.280 4.082 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -12.382 -4.388 4.944 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -13.634 -5.956 6.085 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -13.896 -4.542 7.087 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -15.390 -7.075 5.440 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -17.040 -6.443 5.406 1.00 0.00 H new ATOM 650 N GLU A 41 -11.776 -2.221 7.037 1.00 0.00 N ATOM 651 CA GLU A 41 -10.479 -1.765 7.543 1.00 0.00 C ATOM 652 C GLU A 41 -9.334 -2.456 6.804 1.00 0.00 C ATOM 653 O GLU A 41 -9.308 -3.683 6.692 1.00 0.00 O ATOM 654 CB GLU A 41 -10.362 -2.025 9.048 1.00 0.00 C ATOM 655 CG GLU A 41 -9.344 -1.128 9.742 1.00 0.00 C ATOM 656 CD GLU A 41 -9.049 -1.563 11.167 1.00 0.00 C ATOM 657 OE1 GLU A 41 -10.009 -1.770 11.938 1.00 0.00 O ATOM 658 OE2 GLU A 41 -7.855 -1.694 11.510 1.00 0.00 O ATOM 0 H GLU A 41 -12.377 -2.648 7.742 1.00 0.00 H new ATOM 0 HA GLU A 41 -10.410 -0.692 7.366 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -11.338 -1.879 9.511 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -10.085 -3.067 9.208 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -8.417 -1.127 9.168 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -9.715 -0.103 9.750 1.00 0.00 H new ATOM 665 N GLY A 42 -8.393 -1.658 6.299 1.00 0.00 N ATOM 666 CA GLY A 42 -7.261 -2.209 5.572 1.00 0.00 C ATOM 667 C GLY A 42 -7.387 -2.043 4.064 1.00 0.00 C ATOM 668 O GLY A 42 -6.380 -2.038 3.355 1.00 0.00 O ATOM 0 H GLY A 42 -8.395 -0.641 6.381 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -6.346 -1.722 5.911 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.165 -3.269 5.809 1.00 0.00 H new ATOM 672 N ASP A 43 -8.623 -1.906 3.573 1.00 0.00 N ATOM 673 CA ASP A 43 -8.865 -1.739 2.140 1.00 0.00 C ATOM 674 C ASP A 43 -8.147 -0.500 1.606 1.00 0.00 C ATOM 675 O ASP A 43 -8.222 0.577 2.200 1.00 0.00 O ATOM 676 CB ASP A 43 -10.370 -1.634 1.854 1.00 0.00 C ATOM 677 CG ASP A 43 -10.874 -2.738 0.937 1.00 0.00 C ATOM 678 OD1 ASP A 43 -10.472 -3.904 1.129 1.00 0.00 O ATOM 679 OD2 ASP A 43 -11.675 -2.434 0.028 1.00 0.00 O ATOM 0 H ASP A 43 -9.467 -1.908 4.146 1.00 0.00 H new ATOM 0 HA ASP A 43 -8.469 -2.617 1.630 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -10.918 -1.672 2.796 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -10.582 -0.666 1.400 1.00 0.00 H new ATOM 684 N VAL A 44 -7.447 -0.666 0.486 1.00 0.00 N ATOM 685 CA VAL A 44 -6.706 0.431 -0.131 1.00 0.00 C ATOM 686 C VAL A 44 -7.513 1.083 -1.254 1.00 0.00 C ATOM 687 O VAL A 44 -7.918 0.416 -2.207 1.00 0.00 O ATOM 688 CB VAL A 44 -5.351 -0.052 -0.696 1.00 0.00 C ATOM 689 CG1 VAL A 44 -4.499 1.128 -1.140 1.00 0.00 C ATOM 690 CG2 VAL A 44 -4.606 -0.894 0.333 1.00 0.00 C ATOM 0 H VAL A 44 -7.378 -1.552 -0.014 1.00 0.00 H new ATOM 0 HA VAL A 44 -6.523 1.167 0.652 1.00 0.00 H new ATOM 0 HB VAL A 44 -5.551 -0.675 -1.568 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.550 0.764 -1.534 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -5.024 1.685 -1.916 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -4.311 1.782 -0.288 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -3.655 -1.223 -0.086 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.422 -0.298 1.227 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -5.208 -1.764 0.595 1.00 0.00 H new ATOM 700 N VAL A 45 -7.739 2.390 -1.131 1.00 0.00 N ATOM 701 CA VAL A 45 -8.492 3.148 -2.129 1.00 0.00 C ATOM 702 C VAL A 45 -7.555 3.801 -3.144 1.00 0.00 C ATOM 703 O VAL A 45 -6.453 4.233 -2.800 1.00 0.00 O ATOM 704 CB VAL A 45 -9.359 4.246 -1.471 1.00 0.00 C ATOM 705 CG1 VAL A 45 -10.423 4.739 -2.437 1.00 0.00 C ATOM 706 CG2 VAL A 45 -9.996 3.740 -0.182 1.00 0.00 C ATOM 0 H VAL A 45 -7.409 2.949 -0.344 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.143 2.438 -2.638 1.00 0.00 H new ATOM 0 HB VAL A 45 -8.708 5.084 -1.219 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -11.022 5.511 -1.955 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -9.945 5.152 -3.325 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -11.066 3.908 -2.725 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -10.600 4.532 0.260 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -10.629 2.880 -0.402 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.215 3.445 0.519 1.00 0.00 H new ATOM 716 N LEU A 46 -8.002 3.871 -4.394 1.00 0.00 N ATOM 717 CA LEU A 46 -7.212 4.472 -5.465 1.00 0.00 C ATOM 718 C LEU A 46 -7.928 5.673 -6.083 1.00 0.00 C ATOM 719 O LEU A 46 -7.287 6.658 -6.455 1.00 0.00 O ATOM 720 CB LEU A 46 -6.909 3.434 -6.549 1.00 0.00 C ATOM 721 CG LEU A 46 -5.870 2.376 -6.164 1.00 0.00 C ATOM 722 CD1 LEU A 46 -6.534 1.203 -5.457 1.00 0.00 C ATOM 723 CD2 LEU A 46 -5.112 1.901 -7.397 1.00 0.00 C ATOM 0 H LEU A 46 -8.911 3.517 -4.692 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.277 4.822 -5.028 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.837 2.929 -6.816 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -6.561 3.954 -7.441 1.00 0.00 H new ATOM 0 HG LEU A 46 -5.157 2.829 -5.475 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -5.779 0.463 -5.192 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.029 1.556 -4.552 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.271 0.749 -6.120 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -4.378 1.150 -7.106 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -5.813 1.466 -8.110 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -4.602 2.747 -7.859 1.00 0.00 H new ATOM 735 N LYS A 47 -9.257 5.589 -6.205 1.00 0.00 N ATOM 736 CA LYS A 47 -10.036 6.676 -6.796 1.00 0.00 C ATOM 737 C LYS A 47 -11.212 7.084 -5.906 1.00 0.00 C ATOM 738 O LYS A 47 -11.769 6.264 -5.174 1.00 0.00 O ATOM 739 CB LYS A 47 -10.549 6.259 -8.178 1.00 0.00 C ATOM 740 CG LYS A 47 -10.357 7.319 -9.252 1.00 0.00 C ATOM 741 CD LYS A 47 -10.199 6.698 -10.633 1.00 0.00 C ATOM 742 CE LYS A 47 -10.768 7.599 -11.719 1.00 0.00 C ATOM 743 NZ LYS A 47 -9.958 7.553 -12.969 1.00 0.00 N ATOM 0 H LYS A 47 -9.810 4.786 -5.905 1.00 0.00 H new ATOM 0 HA LYS A 47 -9.378 7.540 -6.893 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -10.036 5.347 -8.485 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -11.610 6.019 -8.104 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -11.212 7.996 -9.253 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -9.477 7.918 -9.019 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -9.143 6.511 -10.830 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -10.704 5.732 -10.659 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -11.792 7.297 -11.940 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -10.810 8.625 -11.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -10.382 8.181 -13.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -8.987 7.866 -12.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -9.938 6.579 -13.334 1.00 0.00 H new ATOM 757 N ILE A 48 -11.583 8.364 -5.991 1.00 0.00 N ATOM 758 CA ILE A 48 -12.695 8.910 -5.217 1.00 0.00 C ATOM 759 C ILE A 48 -13.633 9.707 -6.122 1.00 0.00 C ATOM 760 O ILE A 48 -13.276 10.783 -6.605 1.00 0.00 O ATOM 761 CB ILE A 48 -12.208 9.830 -4.072 1.00 0.00 C ATOM 762 CG1 ILE A 48 -10.978 9.236 -3.378 1.00 0.00 C ATOM 763 CG2 ILE A 48 -13.328 10.065 -3.066 1.00 0.00 C ATOM 764 CD1 ILE A 48 -11.258 7.953 -2.623 1.00 0.00 C ATOM 0 H ILE A 48 -11.123 9.045 -6.595 1.00 0.00 H new ATOM 0 HA ILE A 48 -13.223 8.062 -4.780 1.00 0.00 H new ATOM 0 HB ILE A 48 -11.922 10.789 -4.504 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -10.208 9.045 -4.126 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -10.573 9.973 -2.684 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -12.969 10.714 -2.267 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -14.173 10.538 -3.566 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -13.644 9.111 -2.644 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -10.338 7.595 -2.160 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -12.004 8.141 -1.851 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -11.633 7.198 -3.314 1.00 0.00 H new ATOM 776 N ASN A 49 -14.829 9.167 -6.349 1.00 0.00 N ATOM 777 CA ASN A 49 -15.830 9.814 -7.198 1.00 0.00 C ATOM 778 C ASN A 49 -15.279 10.089 -8.603 1.00 0.00 C ATOM 779 O ASN A 49 -15.616 11.096 -9.226 1.00 0.00 O ATOM 780 CB ASN A 49 -16.320 11.116 -6.553 1.00 0.00 C ATOM 781 CG ASN A 49 -17.818 11.107 -6.301 1.00 0.00 C ATOM 782 OD1 ASN A 49 -18.601 10.739 -7.176 1.00 0.00 O ATOM 783 ND2 ASN A 49 -18.226 11.513 -5.102 1.00 0.00 N ATOM 0 H ASN A 49 -15.131 8.276 -5.954 1.00 0.00 H new ATOM 0 HA ASN A 49 -16.673 9.131 -7.297 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -15.796 11.271 -5.610 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -16.068 11.956 -7.200 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -19.221 11.527 -4.880 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -17.543 11.810 -4.405 1.00 0.00 H new ATOM 790 N GLY A 50 -14.435 9.181 -9.095 1.00 0.00 N ATOM 791 CA GLY A 50 -13.856 9.341 -10.419 1.00 0.00 C ATOM 792 C GLY A 50 -12.618 10.225 -10.427 1.00 0.00 C ATOM 793 O GLY A 50 -12.295 10.834 -11.448 1.00 0.00 O ATOM 0 H GLY A 50 -14.143 8.339 -8.600 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -13.597 8.360 -10.816 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -14.604 9.768 -11.087 1.00 0.00 H new ATOM 797 N THR A 51 -11.921 10.296 -9.292 1.00 0.00 N ATOM 798 CA THR A 51 -10.712 11.112 -9.179 1.00 0.00 C ATOM 799 C THR A 51 -9.654 10.386 -8.355 1.00 0.00 C ATOM 800 O THR A 51 -9.897 10.019 -7.204 1.00 0.00 O ATOM 801 CB THR A 51 -11.037 12.470 -8.542 1.00 0.00 C ATOM 802 OG1 THR A 51 -12.361 12.874 -8.854 1.00 0.00 O ATOM 803 CG2 THR A 51 -10.108 13.580 -8.985 1.00 0.00 C ATOM 0 H THR A 51 -12.173 9.798 -8.438 1.00 0.00 H new ATOM 0 HA THR A 51 -10.319 11.282 -10.181 1.00 0.00 H new ATOM 0 HB THR A 51 -10.913 12.316 -7.470 1.00 0.00 H new ATOM 0 HG1 THR A 51 -12.995 12.369 -8.303 1.00 0.00 H new ATOM 0 HG21 THR A 51 -10.395 14.511 -8.497 1.00 0.00 H new ATOM 0 HG22 THR A 51 -9.083 13.328 -8.712 1.00 0.00 H new ATOM 0 HG23 THR A 51 -10.176 13.701 -10.066 1.00 0.00 H new ATOM 811 N VAL A 52 -8.479 10.178 -8.949 1.00 0.00 N ATOM 812 CA VAL A 52 -7.385 9.490 -8.266 1.00 0.00 C ATOM 813 C VAL A 52 -6.851 10.326 -7.105 1.00 0.00 C ATOM 814 O VAL A 52 -6.622 11.527 -7.251 1.00 0.00 O ATOM 815 CB VAL A 52 -6.218 9.162 -9.226 1.00 0.00 C ATOM 816 CG1 VAL A 52 -5.181 8.291 -8.530 1.00 0.00 C ATOM 817 CG2 VAL A 52 -6.732 8.480 -10.488 1.00 0.00 C ATOM 0 H VAL A 52 -8.261 10.476 -9.900 1.00 0.00 H new ATOM 0 HA VAL A 52 -7.798 8.555 -7.886 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.741 10.099 -9.516 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -4.368 8.071 -9.221 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.786 8.819 -7.662 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -5.646 7.359 -8.208 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -5.894 8.258 -11.149 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.238 7.552 -10.220 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -7.432 9.141 -10.999 1.00 0.00 H new ATOM 827 N THR A 53 -6.659 9.682 -5.954 1.00 0.00 N ATOM 828 CA THR A 53 -6.153 10.365 -4.764 1.00 0.00 C ATOM 829 C THR A 53 -4.757 9.866 -4.393 1.00 0.00 C ATOM 830 O THR A 53 -4.417 9.762 -3.213 1.00 0.00 O ATOM 831 CB THR A 53 -7.114 10.169 -3.584 1.00 0.00 C ATOM 832 OG1 THR A 53 -7.788 8.924 -3.677 1.00 0.00 O ATOM 833 CG2 THR A 53 -8.163 11.258 -3.486 1.00 0.00 C ATOM 0 H THR A 53 -6.846 8.688 -5.821 1.00 0.00 H new ATOM 0 HA THR A 53 -6.085 11.429 -4.993 1.00 0.00 H new ATOM 0 HB THR A 53 -6.488 10.205 -2.693 1.00 0.00 H new ATOM 0 HG1 THR A 53 -8.269 8.749 -2.841 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.812 11.063 -2.632 1.00 0.00 H new ATOM 0 HG22 THR A 53 -7.674 12.224 -3.357 1.00 0.00 H new ATOM 0 HG23 THR A 53 -8.759 11.272 -4.398 1.00 0.00 H new ATOM 841 N GLU A 54 -3.945 9.572 -5.407 1.00 0.00 N ATOM 842 CA GLU A 54 -2.586 9.103 -5.189 1.00 0.00 C ATOM 843 C GLU A 54 -1.625 10.284 -5.124 1.00 0.00 C ATOM 844 O GLU A 54 -1.779 11.263 -5.857 1.00 0.00 O ATOM 845 CB GLU A 54 -2.168 8.136 -6.300 1.00 0.00 C ATOM 846 CG GLU A 54 -1.829 6.741 -5.804 1.00 0.00 C ATOM 847 CD GLU A 54 -2.645 5.663 -6.493 1.00 0.00 C ATOM 848 OE1 GLU A 54 -3.830 5.492 -6.134 1.00 0.00 O ATOM 849 OE2 GLU A 54 -2.097 4.986 -7.388 1.00 0.00 O ATOM 0 H GLU A 54 -4.210 9.652 -6.389 1.00 0.00 H new ATOM 0 HA GLU A 54 -2.551 8.571 -4.238 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -2.974 8.066 -7.030 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -1.302 8.547 -6.820 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -0.769 6.549 -5.967 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -2.000 6.690 -4.729 1.00 0.00 H new ATOM 856 N ASN A 55 -0.639 10.185 -4.236 1.00 0.00 N ATOM 857 CA ASN A 55 0.360 11.240 -4.049 1.00 0.00 C ATOM 858 C ASN A 55 -0.266 12.529 -3.494 1.00 0.00 C ATOM 859 O ASN A 55 0.376 13.581 -3.486 1.00 0.00 O ATOM 860 CB ASN A 55 1.086 11.543 -5.367 1.00 0.00 C ATOM 861 CG ASN A 55 1.634 10.299 -6.050 1.00 0.00 C ATOM 862 OD1 ASN A 55 0.960 9.272 -6.139 1.00 0.00 O ATOM 863 ND2 ASN A 55 2.865 10.386 -6.543 1.00 0.00 N ATOM 0 H ASN A 55 -0.508 9.377 -3.628 1.00 0.00 H new ATOM 0 HA ASN A 55 1.080 10.871 -3.319 1.00 0.00 H new ATOM 0 HB2 ASN A 55 0.398 12.049 -6.045 1.00 0.00 H new ATOM 0 HB3 ASN A 55 1.906 12.234 -5.172 1.00 0.00 H new ATOM 0 HD21 ASN A 55 3.283 9.584 -7.015 1.00 0.00 H new ATOM 0 HD22 ASN A 55 3.392 11.254 -6.449 1.00 0.00 H new ATOM 870 N MET A 56 -1.519 12.447 -3.031 1.00 0.00 N ATOM 871 CA MET A 56 -2.212 13.610 -2.482 1.00 0.00 C ATOM 872 C MET A 56 -2.145 13.617 -0.956 1.00 0.00 C ATOM 873 O MET A 56 -1.840 12.599 -0.331 1.00 0.00 O ATOM 874 CB MET A 56 -3.672 13.618 -2.943 1.00 0.00 C ATOM 875 CG MET A 56 -4.108 14.931 -3.574 1.00 0.00 C ATOM 876 SD MET A 56 -3.936 14.932 -5.369 1.00 0.00 S ATOM 877 CE MET A 56 -4.951 13.523 -5.815 1.00 0.00 C ATOM 0 H MET A 56 -2.069 11.588 -3.027 1.00 0.00 H new ATOM 0 HA MET A 56 -1.715 14.508 -2.850 1.00 0.00 H new ATOM 0 HB2 MET A 56 -3.821 12.813 -3.662 1.00 0.00 H new ATOM 0 HB3 MET A 56 -4.314 13.405 -2.089 1.00 0.00 H new ATOM 0 HG2 MET A 56 -5.148 15.127 -3.313 1.00 0.00 H new ATOM 0 HG3 MET A 56 -3.515 15.745 -3.156 1.00 0.00 H new ATOM 0 HE1 MET A 56 -5.236 13.597 -6.865 1.00 0.00 H new ATOM 0 HE2 MET A 56 -4.387 12.604 -5.656 1.00 0.00 H new ATOM 0 HE3 MET A 56 -5.848 13.510 -5.196 1.00 0.00 H new ATOM 887 N SER A 57 -2.437 14.773 -0.358 1.00 0.00 N ATOM 888 CA SER A 57 -2.418 14.912 1.094 1.00 0.00 C ATOM 889 C SER A 57 -3.667 14.289 1.715 1.00 0.00 C ATOM 890 O SER A 57 -4.725 14.241 1.085 1.00 0.00 O ATOM 891 CB SER A 57 -2.314 16.392 1.484 1.00 0.00 C ATOM 892 OG SER A 57 -3.563 17.050 1.346 1.00 0.00 O ATOM 0 H SER A 57 -2.689 15.625 -0.859 1.00 0.00 H new ATOM 0 HA SER A 57 -1.545 14.384 1.477 1.00 0.00 H new ATOM 0 HB2 SER A 57 -1.968 16.475 2.514 1.00 0.00 H new ATOM 0 HB3 SER A 57 -1.570 16.884 0.857 1.00 0.00 H new ATOM 0 HG SER A 57 -3.467 17.991 1.603 1.00 0.00 H new ATOM 898 N LEU A 58 -3.538 13.818 2.955 1.00 0.00 N ATOM 899 CA LEU A 58 -4.663 13.205 3.662 1.00 0.00 C ATOM 900 C LEU A 58 -5.832 14.185 3.782 1.00 0.00 C ATOM 901 O LEU A 58 -6.992 13.774 3.851 1.00 0.00 O ATOM 902 CB LEU A 58 -4.230 12.736 5.053 1.00 0.00 C ATOM 903 CG LEU A 58 -5.098 11.633 5.664 1.00 0.00 C ATOM 904 CD1 LEU A 58 -4.934 10.333 4.889 1.00 0.00 C ATOM 905 CD2 LEU A 58 -4.746 11.431 7.131 1.00 0.00 C ATOM 0 H LEU A 58 -2.670 13.849 3.489 1.00 0.00 H new ATOM 0 HA LEU A 58 -4.993 12.342 3.084 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.202 12.378 4.995 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -4.232 13.594 5.726 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.142 11.940 5.600 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -5.558 9.561 5.338 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -5.235 10.487 3.853 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -3.890 10.020 4.921 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -5.372 10.643 7.550 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -3.698 11.146 7.218 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -4.916 12.359 7.677 1.00 0.00 H new ATOM 917 N THR A 59 -5.520 15.483 3.797 1.00 0.00 N ATOM 918 CA THR A 59 -6.546 16.519 3.896 1.00 0.00 C ATOM 919 C THR A 59 -7.385 16.561 2.618 1.00 0.00 C ATOM 920 O THR A 59 -8.606 16.714 2.676 1.00 0.00 O ATOM 921 CB THR A 59 -5.912 17.894 4.142 1.00 0.00 C ATOM 922 OG1 THR A 59 -4.591 17.771 4.651 1.00 0.00 O ATOM 923 CG2 THR A 59 -6.705 18.756 5.105 1.00 0.00 C ATOM 0 H THR A 59 -4.566 15.839 3.742 1.00 0.00 H new ATOM 0 HA THR A 59 -7.190 16.275 4.741 1.00 0.00 H new ATOM 0 HB THR A 59 -5.904 18.380 3.166 1.00 0.00 H new ATOM 0 HG1 THR A 59 -4.212 18.663 4.796 1.00 0.00 H new ATOM 0 HG21 THR A 59 -6.202 19.714 5.235 1.00 0.00 H new ATOM 0 HG22 THR A 59 -7.705 18.923 4.705 1.00 0.00 H new ATOM 0 HG23 THR A 59 -6.779 18.252 6.068 1.00 0.00 H new ATOM 931 N ASP A 60 -6.719 16.416 1.468 1.00 0.00 N ATOM 932 CA ASP A 60 -7.399 16.427 0.173 1.00 0.00 C ATOM 933 C ASP A 60 -8.499 15.372 0.136 1.00 0.00 C ATOM 934 O ASP A 60 -9.581 15.610 -0.401 1.00 0.00 O ATOM 935 CB ASP A 60 -6.404 16.159 -0.960 1.00 0.00 C ATOM 936 CG ASP A 60 -6.931 16.606 -2.309 1.00 0.00 C ATOM 937 OD1 ASP A 60 -7.896 15.987 -2.805 1.00 0.00 O ATOM 938 OD2 ASP A 60 -6.378 17.573 -2.870 1.00 0.00 O ATOM 0 H ASP A 60 -5.709 16.290 1.410 1.00 0.00 H new ATOM 0 HA ASP A 60 -7.842 17.413 0.036 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -5.469 16.677 -0.749 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -6.177 15.093 -0.996 1.00 0.00 H new ATOM 943 N ALA A 61 -8.205 14.206 0.716 1.00 0.00 N ATOM 944 CA ALA A 61 -9.159 13.102 0.762 1.00 0.00 C ATOM 945 C ALA A 61 -10.445 13.519 1.472 1.00 0.00 C ATOM 946 O ALA A 61 -11.543 13.172 1.034 1.00 0.00 O ATOM 947 CB ALA A 61 -8.542 11.889 1.450 1.00 0.00 C ATOM 0 H ALA A 61 -7.310 14.004 1.161 1.00 0.00 H new ATOM 0 HA ALA A 61 -9.409 12.831 -0.264 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -9.268 11.076 1.475 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -7.658 11.569 0.899 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -8.259 12.154 2.469 1.00 0.00 H new ATOM 953 N LYS A 62 -10.299 14.271 2.563 1.00 0.00 N ATOM 954 CA LYS A 62 -11.448 14.745 3.332 1.00 0.00 C ATOM 955 C LYS A 62 -12.352 15.631 2.475 1.00 0.00 C ATOM 956 O LYS A 62 -13.577 15.568 2.581 1.00 0.00 O ATOM 957 CB LYS A 62 -10.982 15.522 4.567 1.00 0.00 C ATOM 958 CG LYS A 62 -10.079 14.719 5.496 1.00 0.00 C ATOM 959 CD LYS A 62 -10.445 14.940 6.958 1.00 0.00 C ATOM 960 CE LYS A 62 -9.216 15.201 7.817 1.00 0.00 C ATOM 961 NZ LYS A 62 -9.382 16.406 8.680 1.00 0.00 N ATOM 0 H LYS A 62 -9.395 14.565 2.934 1.00 0.00 H new ATOM 0 HA LYS A 62 -12.018 13.873 3.653 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -10.450 16.416 4.242 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.856 15.856 5.125 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.159 13.659 5.256 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.040 15.005 5.333 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.129 15.785 7.037 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.973 14.065 7.336 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -9.020 14.331 8.444 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -8.346 15.333 7.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -8.522 16.547 9.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -9.543 17.242 8.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -10.197 16.271 9.312 1.00 0.00 H new ATOM 975 N THR A 63 -11.738 16.456 1.625 1.00 0.00 N ATOM 976 CA THR A 63 -12.480 17.357 0.744 1.00 0.00 C ATOM 977 C THR A 63 -13.444 16.582 -0.154 1.00 0.00 C ATOM 978 O THR A 63 -14.609 16.955 -0.289 1.00 0.00 O ATOM 979 CB THR A 63 -11.519 18.170 -0.120 1.00 0.00 C ATOM 980 OG1 THR A 63 -10.240 18.245 0.477 1.00 0.00 O ATOM 981 CG2 THR A 63 -11.981 19.586 -0.373 1.00 0.00 C ATOM 0 H THR A 63 -10.724 16.518 1.529 1.00 0.00 H new ATOM 0 HA THR A 63 -13.059 18.032 1.374 1.00 0.00 H new ATOM 0 HB THR A 63 -11.484 17.639 -1.071 1.00 0.00 H new ATOM 0 HG1 THR A 63 -9.642 18.769 -0.096 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.248 20.102 -0.993 1.00 0.00 H new ATOM 0 HG22 THR A 63 -12.943 19.569 -0.886 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.085 20.110 0.577 1.00 0.00 H new ATOM 989 N LEU A 64 -12.952 15.500 -0.763 1.00 0.00 N ATOM 990 CA LEU A 64 -13.780 14.672 -1.641 1.00 0.00 C ATOM 991 C LEU A 64 -15.012 14.167 -0.896 1.00 0.00 C ATOM 992 O LEU A 64 -16.100 14.076 -1.467 1.00 0.00 O ATOM 993 CB LEU A 64 -12.972 13.489 -2.183 1.00 0.00 C ATOM 994 CG LEU A 64 -12.296 13.733 -3.533 1.00 0.00 C ATOM 995 CD1 LEU A 64 -10.986 12.962 -3.625 1.00 0.00 C ATOM 996 CD2 LEU A 64 -13.230 13.349 -4.673 1.00 0.00 C ATOM 0 H LEU A 64 -11.989 15.179 -0.664 1.00 0.00 H new ATOM 0 HA LEU A 64 -14.107 15.286 -2.480 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -12.207 13.226 -1.453 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -13.634 12.628 -2.275 1.00 0.00 H new ATOM 0 HG LEU A 64 -12.070 14.796 -3.618 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.521 13.149 -4.593 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -10.315 13.289 -2.831 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.183 11.895 -3.517 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -12.733 13.529 -5.626 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -13.488 12.293 -4.592 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.138 13.950 -4.618 1.00 0.00 H new ATOM 1008 N ILE A 65 -14.835 13.857 0.386 1.00 0.00 N ATOM 1009 CA ILE A 65 -15.935 13.382 1.216 1.00 0.00 C ATOM 1010 C ILE A 65 -16.877 14.535 1.568 1.00 0.00 C ATOM 1011 O ILE A 65 -18.083 14.335 1.723 1.00 0.00 O ATOM 1012 CB ILE A 65 -15.425 12.721 2.516 1.00 0.00 C ATOM 1013 CG1 ILE A 65 -14.309 11.717 2.206 1.00 0.00 C ATOM 1014 CG2 ILE A 65 -16.573 12.034 3.248 1.00 0.00 C ATOM 1015 CD1 ILE A 65 -13.612 11.179 3.438 1.00 0.00 C ATOM 0 H ILE A 65 -13.940 13.927 0.871 1.00 0.00 H new ATOM 0 HA ILE A 65 -16.475 12.632 0.638 1.00 0.00 H new ATOM 0 HB ILE A 65 -15.018 13.498 3.163 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -14.729 10.883 1.644 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -13.571 12.195 1.562 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -16.198 11.573 4.162 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -17.336 12.770 3.500 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -17.007 11.267 2.606 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -12.835 10.475 3.139 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -13.161 12.004 3.990 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -14.337 10.670 4.073 1.00 0.00 H new ATOM 1027 N GLU A 66 -16.321 15.746 1.685 1.00 0.00 N ATOM 1028 CA GLU A 66 -17.121 16.926 2.010 1.00 0.00 C ATOM 1029 C GLU A 66 -17.996 17.335 0.826 1.00 0.00 C ATOM 1030 O GLU A 66 -19.179 17.632 0.994 1.00 0.00 O ATOM 1031 CB GLU A 66 -16.215 18.093 2.418 1.00 0.00 C ATOM 1032 CG GLU A 66 -15.899 18.136 3.906 1.00 0.00 C ATOM 1033 CD GLU A 66 -14.617 18.889 4.209 1.00 0.00 C ATOM 1034 OE1 GLU A 66 -14.521 20.075 3.830 1.00 0.00 O ATOM 1035 OE2 GLU A 66 -13.709 18.291 4.824 1.00 0.00 O ATOM 0 H GLU A 66 -15.326 15.932 1.560 1.00 0.00 H new ATOM 0 HA GLU A 66 -17.770 16.671 2.848 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.281 18.028 1.860 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -16.693 19.029 2.131 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.727 18.607 4.436 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.816 17.118 4.286 1.00 0.00 H new ATOM 1042 N ARG A 67 -17.407 17.345 -0.370 1.00 0.00 N ATOM 1043 CA ARG A 67 -18.133 17.715 -1.585 1.00 0.00 C ATOM 1044 C ARG A 67 -19.302 16.761 -1.852 1.00 0.00 C ATOM 1045 O ARG A 67 -20.300 17.152 -2.460 1.00 0.00 O ATOM 1046 CB ARG A 67 -17.187 17.724 -2.790 1.00 0.00 C ATOM 1047 CG ARG A 67 -17.737 18.479 -3.993 1.00 0.00 C ATOM 1048 CD ARG A 67 -16.757 18.473 -5.158 1.00 0.00 C ATOM 1049 NE ARG A 67 -16.609 19.802 -5.755 1.00 0.00 N ATOM 1050 CZ ARG A 67 -15.883 20.787 -5.218 1.00 0.00 C ATOM 1051 NH1 ARG A 67 -15.237 20.601 -4.068 1.00 0.00 N ATOM 1052 NH2 ARG A 67 -15.804 21.962 -5.833 1.00 0.00 N ATOM 0 H ARG A 67 -16.429 17.101 -0.523 1.00 0.00 H new ATOM 0 HA ARG A 67 -18.537 18.716 -1.435 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -16.239 18.172 -2.493 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -16.976 16.696 -3.083 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -18.678 18.027 -4.307 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -17.957 19.508 -3.708 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -15.785 18.120 -4.813 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -17.100 17.770 -5.917 1.00 0.00 H new ATOM 0 HE ARG A 67 -17.090 19.987 -6.635 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -15.294 19.701 -3.591 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -14.685 21.358 -3.665 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -16.297 22.111 -6.713 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -15.250 22.715 -5.425 1.00 0.00 H new ATOM 1066 N SER A 68 -19.170 15.512 -1.398 1.00 0.00 N ATOM 1067 CA SER A 68 -20.214 14.506 -1.588 1.00 0.00 C ATOM 1068 C SER A 68 -21.503 14.912 -0.869 1.00 0.00 C ATOM 1069 O SER A 68 -21.700 14.591 0.305 1.00 0.00 O ATOM 1070 CB SER A 68 -19.733 13.146 -1.081 1.00 0.00 C ATOM 1071 OG SER A 68 -18.539 12.749 -1.735 1.00 0.00 O ATOM 0 H SER A 68 -18.349 15.175 -0.896 1.00 0.00 H new ATOM 0 HA SER A 68 -20.428 14.433 -2.654 1.00 0.00 H new ATOM 0 HB2 SER A 68 -19.563 13.195 -0.005 1.00 0.00 H new ATOM 0 HB3 SER A 68 -20.508 12.398 -1.247 1.00 0.00 H new ATOM 0 HG SER A 68 -17.807 13.343 -1.468 1.00 0.00 H new ATOM 1077 N LYS A 69 -22.373 15.629 -1.581 1.00 0.00 N ATOM 1078 CA LYS A 69 -23.641 16.096 -1.016 1.00 0.00 C ATOM 1079 C LYS A 69 -24.627 14.948 -0.780 1.00 0.00 C ATOM 1080 O LYS A 69 -25.486 15.037 0.099 1.00 0.00 O ATOM 1081 CB LYS A 69 -24.278 17.152 -1.929 1.00 0.00 C ATOM 1082 CG LYS A 69 -24.586 16.654 -3.335 1.00 0.00 C ATOM 1083 CD LYS A 69 -24.727 17.806 -4.320 1.00 0.00 C ATOM 1084 CE LYS A 69 -23.510 17.919 -5.228 1.00 0.00 C ATOM 1085 NZ LYS A 69 -22.433 18.754 -4.621 1.00 0.00 N ATOM 0 H LYS A 69 -22.223 15.900 -2.553 1.00 0.00 H new ATOM 0 HA LYS A 69 -23.415 16.542 -0.047 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -25.201 17.505 -1.470 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -23.608 18.009 -1.997 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -23.791 15.986 -3.667 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -25.507 16.071 -3.321 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -25.621 17.660 -4.926 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -24.861 18.739 -3.773 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -23.121 16.923 -5.438 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -23.809 18.352 -6.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -21.624 18.804 -5.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -22.795 19.713 -4.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -22.128 18.328 -3.723 1.00 0.00 H new ATOM 1099 N GLY A 70 -24.509 13.877 -1.568 1.00 0.00 N ATOM 1100 CA GLY A 70 -25.410 12.746 -1.417 1.00 0.00 C ATOM 1101 C GLY A 70 -24.725 11.411 -1.638 1.00 0.00 C ATOM 1102 O GLY A 70 -24.390 10.715 -0.680 1.00 0.00 O ATOM 0 H GLY A 70 -23.809 13.774 -2.303 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -25.844 12.765 -0.417 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -26.234 12.847 -2.124 1.00 0.00 H new ATOM 1106 N LYS A 71 -24.523 11.050 -2.901 1.00 0.00 N ATOM 1107 CA LYS A 71 -23.880 9.783 -3.242 1.00 0.00 C ATOM 1108 C LYS A 71 -22.356 9.904 -3.196 1.00 0.00 C ATOM 1109 O LYS A 71 -21.798 10.965 -3.481 1.00 0.00 O ATOM 1110 CB LYS A 71 -24.326 9.314 -4.630 1.00 0.00 C ATOM 1111 CG LYS A 71 -24.411 7.802 -4.764 1.00 0.00 C ATOM 1112 CD LYS A 71 -25.011 7.395 -6.101 1.00 0.00 C ATOM 1113 CE LYS A 71 -26.455 6.933 -5.952 1.00 0.00 C ATOM 1114 NZ LYS A 71 -27.293 7.929 -5.225 1.00 0.00 N ATOM 0 H LYS A 71 -24.794 11.615 -3.706 1.00 0.00 H new ATOM 0 HA LYS A 71 -24.186 9.045 -2.501 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -25.302 9.746 -4.854 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -23.629 9.698 -5.375 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -23.415 7.370 -4.664 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -25.017 7.397 -3.953 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -24.968 8.238 -6.791 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -24.416 6.594 -6.538 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -26.881 6.754 -6.939 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -26.477 5.983 -5.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -28.203 7.496 -4.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -26.799 8.234 -4.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -27.462 8.753 -5.837 1.00 0.00 H new ATOM 1128 N LEU A 72 -21.694 8.805 -2.836 1.00 0.00 N ATOM 1129 CA LEU A 72 -20.237 8.772 -2.750 1.00 0.00 C ATOM 1130 C LEU A 72 -19.679 7.563 -3.500 1.00 0.00 C ATOM 1131 O LEU A 72 -20.242 6.470 -3.433 1.00 0.00 O ATOM 1132 CB LEU A 72 -19.792 8.721 -1.283 1.00 0.00 C ATOM 1133 CG LEU A 72 -18.781 9.795 -0.862 1.00 0.00 C ATOM 1134 CD1 LEU A 72 -18.336 9.573 0.577 1.00 0.00 C ATOM 1135 CD2 LEU A 72 -17.576 9.800 -1.793 1.00 0.00 C ATOM 0 H LEU A 72 -22.147 7.923 -2.599 1.00 0.00 H new ATOM 0 HA LEU A 72 -19.849 9.680 -3.211 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -20.675 8.810 -0.650 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -19.357 7.741 -1.087 1.00 0.00 H new ATOM 0 HG LEU A 72 -19.270 10.767 -0.930 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -17.619 10.344 0.859 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -19.202 9.623 1.237 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -17.868 8.592 0.666 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -16.873 10.570 -1.474 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.087 8.826 -1.761 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -17.904 10.007 -2.812 1.00 0.00 H new ATOM 1147 N LYS A 73 -18.570 7.763 -4.207 1.00 0.00 N ATOM 1148 CA LYS A 73 -17.936 6.685 -4.960 1.00 0.00 C ATOM 1149 C LYS A 73 -16.461 6.555 -4.586 1.00 0.00 C ATOM 1150 O LYS A 73 -15.739 7.549 -4.526 1.00 0.00 O ATOM 1151 CB LYS A 73 -18.080 6.931 -6.465 1.00 0.00 C ATOM 1152 CG LYS A 73 -19.133 6.055 -7.128 1.00 0.00 C ATOM 1153 CD LYS A 73 -18.639 5.485 -8.448 1.00 0.00 C ATOM 1154 CE LYS A 73 -19.796 5.048 -9.335 1.00 0.00 C ATOM 1155 NZ LYS A 73 -19.387 4.916 -10.762 1.00 0.00 N ATOM 0 H LYS A 73 -18.092 8.662 -4.274 1.00 0.00 H new ATOM 0 HA LYS A 73 -18.438 5.751 -4.706 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -18.334 7.978 -6.631 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -17.118 6.756 -6.947 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -19.403 5.239 -6.457 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -20.037 6.639 -7.299 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -18.043 6.234 -8.969 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -17.985 4.634 -8.256 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -20.185 4.094 -8.980 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -20.607 5.772 -9.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -20.204 4.617 -11.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -19.040 5.833 -11.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -18.631 4.206 -10.842 1.00 0.00 H new ATOM 1169 N MET A 74 -16.022 5.322 -4.333 1.00 0.00 N ATOM 1170 CA MET A 74 -14.633 5.057 -3.963 1.00 0.00 C ATOM 1171 C MET A 74 -14.144 3.751 -4.586 1.00 0.00 C ATOM 1172 O MET A 74 -14.796 2.715 -4.465 1.00 0.00 O ATOM 1173 CB MET A 74 -14.484 4.991 -2.440 1.00 0.00 C ATOM 1174 CG MET A 74 -14.777 6.306 -1.730 1.00 0.00 C ATOM 1175 SD MET A 74 -16.020 6.136 -0.434 1.00 0.00 S ATOM 1176 CE MET A 74 -15.225 4.952 0.649 1.00 0.00 C ATOM 0 H MET A 74 -16.610 4.490 -4.378 1.00 0.00 H new ATOM 0 HA MET A 74 -14.024 5.877 -4.344 1.00 0.00 H new ATOM 0 HB2 MET A 74 -15.155 4.224 -2.053 1.00 0.00 H new ATOM 0 HB3 MET A 74 -13.468 4.678 -2.198 1.00 0.00 H new ATOM 0 HG2 MET A 74 -13.855 6.693 -1.295 1.00 0.00 H new ATOM 0 HG3 MET A 74 -15.117 7.040 -2.460 1.00 0.00 H new ATOM 0 HE1 MET A 74 -15.942 4.597 1.389 1.00 0.00 H new ATOM 0 HE2 MET A 74 -14.862 4.108 0.062 1.00 0.00 H new ATOM 0 HE3 MET A 74 -14.386 5.429 1.156 1.00 0.00 H new ATOM 1186 N VAL A 75 -12.990 3.807 -5.248 1.00 0.00 N ATOM 1187 CA VAL A 75 -12.414 2.624 -5.884 1.00 0.00 C ATOM 1188 C VAL A 75 -11.301 2.033 -5.022 1.00 0.00 C ATOM 1189 O VAL A 75 -10.361 2.733 -4.647 1.00 0.00 O ATOM 1190 CB VAL A 75 -11.858 2.944 -7.288 1.00 0.00 C ATOM 1191 CG1 VAL A 75 -11.434 1.667 -8.002 1.00 0.00 C ATOM 1192 CG2 VAL A 75 -12.890 3.703 -8.113 1.00 0.00 C ATOM 0 H VAL A 75 -12.437 4.657 -5.358 1.00 0.00 H new ATOM 0 HA VAL A 75 -13.218 1.896 -5.988 1.00 0.00 H new ATOM 0 HB VAL A 75 -10.979 3.578 -7.171 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -11.045 1.914 -8.990 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -10.659 1.166 -7.422 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -12.294 1.006 -8.106 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -12.480 3.919 -9.099 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -13.789 3.096 -8.219 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -13.141 4.638 -7.611 1.00 0.00 H new ATOM 1202 N VAL A 76 -11.419 0.744 -4.705 1.00 0.00 N ATOM 1203 CA VAL A 76 -10.425 0.057 -3.877 1.00 0.00 C ATOM 1204 C VAL A 76 -9.672 -1.016 -4.671 1.00 0.00 C ATOM 1205 O VAL A 76 -9.932 -1.218 -5.860 1.00 0.00 O ATOM 1206 CB VAL A 76 -11.077 -0.591 -2.636 1.00 0.00 C ATOM 1207 CG1 VAL A 76 -11.638 0.476 -1.708 1.00 0.00 C ATOM 1208 CG2 VAL A 76 -12.164 -1.578 -3.045 1.00 0.00 C ATOM 0 H VAL A 76 -12.193 0.153 -5.009 1.00 0.00 H new ATOM 0 HA VAL A 76 -9.714 0.816 -3.551 1.00 0.00 H new ATOM 0 HB VAL A 76 -10.307 -1.143 -2.097 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -12.093 0.000 -0.839 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -10.833 1.134 -1.381 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -12.391 1.060 -2.238 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -12.608 -2.021 -2.153 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -12.934 -1.056 -3.613 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -11.728 -2.364 -3.662 1.00 0.00 H new ATOM 1218 N GLN A 77 -8.734 -1.694 -4.005 1.00 0.00 N ATOM 1219 CA GLN A 77 -7.935 -2.742 -4.636 1.00 0.00 C ATOM 1220 C GLN A 77 -8.010 -4.051 -3.844 1.00 0.00 C ATOM 1221 O GLN A 77 -8.161 -4.039 -2.621 1.00 0.00 O ATOM 1222 CB GLN A 77 -6.478 -2.283 -4.754 1.00 0.00 C ATOM 1223 CG GLN A 77 -5.742 -2.862 -5.954 1.00 0.00 C ATOM 1224 CD GLN A 77 -5.235 -4.272 -5.710 1.00 0.00 C ATOM 1225 OE1 GLN A 77 -5.492 -5.178 -6.500 1.00 0.00 O ATOM 1226 NE2 GLN A 77 -4.514 -4.466 -4.609 1.00 0.00 N ATOM 0 H GLN A 77 -8.510 -1.533 -3.023 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.340 -2.927 -5.631 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -6.454 -1.195 -4.817 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -5.945 -2.562 -3.845 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -6.409 -2.865 -6.816 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -4.900 -2.216 -6.204 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -4.324 -3.686 -3.980 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -4.151 -5.395 -4.394 1.00 0.00 H new ATOM 1235 N ARG A 78 -7.901 -5.176 -4.553 1.00 0.00 N ATOM 1236 CA ARG A 78 -7.952 -6.499 -3.926 1.00 0.00 C ATOM 1237 C ARG A 78 -7.016 -7.484 -4.634 1.00 0.00 C ATOM 1238 O ARG A 78 -6.239 -8.184 -3.985 1.00 0.00 O ATOM 1239 CB ARG A 78 -9.387 -7.039 -3.937 1.00 0.00 C ATOM 1240 CG ARG A 78 -9.822 -7.644 -2.609 1.00 0.00 C ATOM 1241 CD ARG A 78 -10.530 -6.620 -1.733 1.00 0.00 C ATOM 1242 NE ARG A 78 -11.068 -7.220 -0.511 1.00 0.00 N ATOM 1243 CZ ARG A 78 -12.043 -6.679 0.227 1.00 0.00 C ATOM 1244 NH1 ARG A 78 -12.589 -5.515 -0.116 1.00 0.00 N ATOM 1245 NH2 ARG A 78 -12.472 -7.305 1.317 1.00 0.00 N ATOM 0 H ARG A 78 -7.776 -5.198 -5.565 1.00 0.00 H new ATOM 0 HA ARG A 78 -7.618 -6.393 -2.894 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -10.069 -6.230 -4.198 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -9.476 -7.795 -4.717 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -10.487 -8.488 -2.793 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -8.950 -8.034 -2.083 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -9.833 -5.825 -1.469 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -11.341 -6.159 -2.297 1.00 0.00 H new ATOM 0 HE ARG A 78 -10.673 -8.109 -0.202 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -12.264 -5.025 -0.950 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -13.332 -5.112 0.455 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.058 -8.196 1.589 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.216 -6.894 1.882 1.00 0.00 H new ATOM 1259 N ASP A 79 -7.101 -7.531 -5.969 1.00 0.00 N ATOM 1260 CA ASP A 79 -6.268 -8.423 -6.781 1.00 0.00 C ATOM 1261 C ASP A 79 -6.699 -9.880 -6.618 1.00 0.00 C ATOM 1262 O ASP A 79 -6.091 -10.641 -5.863 1.00 0.00 O ATOM 1263 CB ASP A 79 -4.783 -8.265 -6.421 1.00 0.00 C ATOM 1264 CG ASP A 79 -3.876 -8.323 -7.637 1.00 0.00 C ATOM 1265 OD1 ASP A 79 -4.199 -7.672 -8.654 1.00 0.00 O ATOM 1266 OD2 ASP A 79 -2.839 -9.015 -7.572 1.00 0.00 O ATOM 0 H ASP A 79 -7.745 -6.956 -6.513 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.404 -8.141 -7.825 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -4.637 -7.314 -5.909 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -4.497 -9.051 -5.722 1.00 0.00 H new ATOM 1271 N GLU A 80 -7.755 -10.259 -7.334 1.00 0.00 N ATOM 1272 CA GLU A 80 -8.277 -11.626 -7.276 1.00 0.00 C ATOM 1273 C GLU A 80 -7.952 -12.406 -8.553 1.00 0.00 C ATOM 1274 O GLU A 80 -7.751 -13.622 -8.506 1.00 0.00 O ATOM 1275 CB GLU A 80 -9.791 -11.609 -7.043 1.00 0.00 C ATOM 1276 CG GLU A 80 -10.560 -10.774 -8.057 1.00 0.00 C ATOM 1277 CD GLU A 80 -11.267 -9.592 -7.424 1.00 0.00 C ATOM 1278 OE1 GLU A 80 -12.311 -9.803 -6.770 1.00 0.00 O ATOM 1279 OE2 GLU A 80 -10.777 -8.454 -7.581 1.00 0.00 O ATOM 0 H GLU A 80 -8.268 -9.640 -7.962 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.791 -12.130 -6.441 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -10.165 -12.632 -7.071 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -9.991 -11.224 -6.043 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -9.872 -10.414 -8.822 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -11.293 -11.405 -8.560 1.00 0.00 H new ATOM 1286 N LEU A 81 -7.900 -11.707 -9.688 1.00 0.00 N ATOM 1287 CA LEU A 81 -7.599 -12.346 -10.967 1.00 0.00 C ATOM 1288 C LEU A 81 -6.087 -12.489 -11.160 1.00 0.00 C ATOM 1289 O LEU A 81 -5.411 -11.541 -11.561 1.00 0.00 O ATOM 1290 CB LEU A 81 -8.203 -11.541 -12.125 1.00 0.00 C ATOM 1291 CG LEU A 81 -9.244 -12.288 -12.966 1.00 0.00 C ATOM 1292 CD1 LEU A 81 -10.643 -12.064 -12.410 1.00 0.00 C ATOM 1293 CD2 LEU A 81 -9.169 -11.846 -14.421 1.00 0.00 C ATOM 0 H LEU A 81 -8.062 -10.702 -9.746 1.00 0.00 H new ATOM 0 HA LEU A 81 -8.043 -13.341 -10.961 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -8.665 -10.641 -11.719 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.395 -11.216 -12.781 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.024 -13.355 -12.918 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.368 -12.602 -13.021 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -10.690 -12.430 -11.384 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -10.875 -10.999 -12.426 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.915 -12.386 -15.004 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -9.363 -10.775 -14.486 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.176 -12.060 -14.815 1.00 0.00 H new ATOM 1305 N GLU A 82 -5.568 -13.682 -10.869 1.00 0.00 N ATOM 1306 CA GLU A 82 -4.138 -13.954 -11.009 1.00 0.00 C ATOM 1307 C GLU A 82 -3.778 -14.289 -12.458 1.00 0.00 C ATOM 1308 O GLU A 82 -2.650 -13.955 -12.876 1.00 0.00 O ATOM 1309 CB GLU A 82 -3.718 -15.107 -10.089 1.00 0.00 C ATOM 1310 CG GLU A 82 -3.468 -14.680 -8.650 1.00 0.00 C ATOM 1311 CD GLU A 82 -2.563 -15.642 -7.904 1.00 0.00 C ATOM 1312 OE1 GLU A 82 -1.405 -15.826 -8.336 1.00 0.00 O ATOM 1313 OE2 GLU A 82 -3.012 -16.212 -6.887 1.00 0.00 O ATOM 0 H GLU A 82 -6.116 -14.475 -10.535 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.599 -13.052 -10.720 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -4.494 -15.872 -10.102 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -2.812 -15.565 -10.486 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -3.020 -13.686 -8.643 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -4.421 -14.604 -8.127 1.00 0.00 H new TER 1320 GLU A 82 ATOM 1321 N THR B 1 -13.146 -3.730 -8.420 1.00 0.00 N ATOM 1322 CA THR B 1 -13.440 -3.267 -7.034 1.00 0.00 C ATOM 1323 C THR B 1 -13.933 -1.819 -7.024 1.00 0.00 C ATOM 1324 O THR B 1 -13.148 -0.884 -7.194 1.00 0.00 O ATOM 1325 CB THR B 1 -12.168 -3.404 -6.185 1.00 0.00 C ATOM 1326 OG1 THR B 1 -11.007 -3.357 -6.996 1.00 0.00 O ATOM 1327 CG2 THR B 1 -12.115 -4.690 -5.391 1.00 0.00 C ATOM 0 H1 THR B 1 -13.545 -4.680 -8.560 1.00 0.00 H new ATOM 0 H2 THR B 1 -13.571 -3.072 -9.104 1.00 0.00 H new ATOM 0 H3 THR B 1 -12.117 -3.762 -8.564 1.00 0.00 H new ATOM 0 HA THR B 1 -14.235 -3.885 -6.616 1.00 0.00 H new ATOM 0 HB THR B 1 -12.198 -2.563 -5.492 1.00 0.00 H new ATOM 0 HG1 THR B 1 -10.397 -2.670 -6.655 1.00 0.00 H new ATOM 0 HG21 THR B 1 -11.191 -4.723 -4.814 1.00 0.00 H new ATOM 0 HG22 THR B 1 -12.968 -4.735 -4.714 1.00 0.00 H new ATOM 0 HG23 THR B 1 -12.148 -5.540 -6.073 1.00 0.00 H new ATOM 1337 N LYS B 2 -15.241 -1.644 -6.831 1.00 0.00 N ATOM 1338 CA LYS B 2 -15.849 -0.314 -6.801 1.00 0.00 C ATOM 1339 C LYS B 2 -16.820 -0.184 -5.628 1.00 0.00 C ATOM 1340 O LYS B 2 -17.600 -1.098 -5.351 1.00 0.00 O ATOM 1341 CB LYS B 2 -16.584 -0.035 -8.116 1.00 0.00 C ATOM 1342 CG LYS B 2 -15.757 -0.331 -9.359 1.00 0.00 C ATOM 1343 CD LYS B 2 -16.357 0.318 -10.597 1.00 0.00 C ATOM 1344 CE LYS B 2 -15.566 -0.020 -11.853 1.00 0.00 C ATOM 1345 NZ LYS B 2 -16.406 -0.709 -12.876 1.00 0.00 N ATOM 0 H LYS B 2 -15.901 -2.409 -6.693 1.00 0.00 H new ATOM 0 HA LYS B 2 -15.052 0.418 -6.674 1.00 0.00 H new ATOM 0 HB2 LYS B 2 -17.494 -0.634 -8.146 1.00 0.00 H new ATOM 0 HB3 LYS B 2 -16.890 1.011 -8.135 1.00 0.00 H new ATOM 0 HG2 LYS B 2 -14.739 0.031 -9.214 1.00 0.00 H new ATOM 0 HG3 LYS B 2 -15.694 -1.409 -9.507 1.00 0.00 H new ATOM 0 HD2 LYS B 2 -17.389 -0.013 -10.717 1.00 0.00 H new ATOM 0 HD3 LYS B 2 -16.383 1.400 -10.464 1.00 0.00 H new ATOM 0 HE2 LYS B 2 -15.154 0.895 -12.279 1.00 0.00 H new ATOM 0 HE3 LYS B 2 -14.722 -0.657 -11.589 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 -15.828 -0.921 -13.714 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 -16.779 -1.595 -12.480 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 -17.198 -0.092 -13.148 1.00 0.00 H new ATOM 1359 N VAL B 3 -16.764 0.957 -4.941 1.00 0.00 N ATOM 1360 CA VAL B 3 -17.634 1.218 -3.795 1.00 0.00 C ATOM 1361 C VAL B 3 -18.525 2.432 -4.051 1.00 0.00 C ATOM 1362 O VAL B 3 -18.032 3.512 -4.379 1.00 0.00 O ATOM 1363 CB VAL B 3 -16.814 1.468 -2.508 1.00 0.00 C ATOM 1364 CG1 VAL B 3 -17.730 1.578 -1.297 1.00 0.00 C ATOM 1365 CG2 VAL B 3 -15.774 0.374 -2.303 1.00 0.00 C ATOM 0 H VAL B 3 -16.122 1.719 -5.160 1.00 0.00 H new ATOM 0 HA VAL B 3 -18.252 0.331 -3.659 1.00 0.00 H new ATOM 0 HB VAL B 3 -16.287 2.415 -2.623 1.00 0.00 H new ATOM 0 HG11 VAL B 3 -17.132 1.754 -0.403 1.00 0.00 H new ATOM 0 HG12 VAL B 3 -18.423 2.408 -1.439 1.00 0.00 H new ATOM 0 HG13 VAL B 3 -18.292 0.652 -1.181 1.00 0.00 H new ATOM 0 HG21 VAL B 3 -15.211 0.573 -1.391 1.00 0.00 H new ATOM 0 HG22 VAL B 3 -16.273 -0.591 -2.217 1.00 0.00 H new ATOM 0 HG23 VAL B 3 -15.093 0.356 -3.154 1.00 0.00 H new ATOM 1375 N THR B 4 -19.838 2.253 -3.898 1.00 0.00 N ATOM 1376 CA THR B 4 -20.786 3.345 -4.112 1.00 0.00 C ATOM 1377 C THR B 4 -21.733 3.488 -2.920 1.00 0.00 C ATOM 1378 O THR B 4 -22.645 2.680 -2.736 1.00 0.00 O ATOM 1379 CB THR B 4 -21.587 3.122 -5.399 1.00 0.00 C ATOM 1380 OG1 THR B 4 -20.757 2.615 -6.431 1.00 0.00 O ATOM 1381 CG2 THR B 4 -22.241 4.382 -5.920 1.00 0.00 C ATOM 0 H THR B 4 -20.266 1.367 -3.628 1.00 0.00 H new ATOM 0 HA THR B 4 -20.216 4.268 -4.211 1.00 0.00 H new ATOM 0 HB THR B 4 -22.365 2.407 -5.132 1.00 0.00 H new ATOM 0 HG1 THR B 4 -21.290 2.479 -7.242 1.00 0.00 H new ATOM 0 HG21 THR B 4 -22.792 4.155 -6.833 1.00 0.00 H new ATOM 0 HG22 THR B 4 -22.928 4.773 -5.169 1.00 0.00 H new ATOM 0 HG23 THR B 4 -21.475 5.127 -6.134 1.00 0.00 H new ATOM 1389 N LEU B 5 -21.514 4.530 -2.120 1.00 0.00 N ATOM 1390 CA LEU B 5 -22.343 4.797 -0.947 1.00 0.00 C ATOM 1391 C LEU B 5 -23.432 5.815 -1.274 1.00 0.00 C ATOM 1392 O LEU B 5 -23.222 6.723 -2.080 1.00 0.00 O ATOM 1393 CB LEU B 5 -21.483 5.315 0.209 1.00 0.00 C ATOM 1394 CG LEU B 5 -20.409 4.346 0.713 1.00 0.00 C ATOM 1395 CD1 LEU B 5 -19.658 4.953 1.888 1.00 0.00 C ATOM 1396 CD2 LEU B 5 -21.030 3.010 1.103 1.00 0.00 C ATOM 0 H LEU B 5 -20.765 5.207 -2.265 1.00 0.00 H new ATOM 0 HA LEU B 5 -22.816 3.861 -0.649 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -20.996 6.238 -0.107 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -22.139 5.570 1.042 1.00 0.00 H new ATOM 0 HG LEU B 5 -19.699 4.167 -0.095 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -18.898 4.253 2.235 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -19.180 5.881 1.574 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -20.357 5.161 2.698 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -20.250 2.336 1.458 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -21.763 3.167 1.895 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -21.522 2.570 0.235 1.00 0.00 H new ATOM 1408 N VAL B 6 -24.595 5.662 -0.644 1.00 0.00 N ATOM 1409 CA VAL B 6 -25.713 6.574 -0.872 1.00 0.00 C ATOM 1410 C VAL B 6 -26.143 7.255 0.427 1.00 0.00 C ATOM 1411 O VAL B 6 -26.851 6.665 1.244 1.00 0.00 O ATOM 1412 CB VAL B 6 -26.927 5.844 -1.486 1.00 0.00 C ATOM 1413 CG1 VAL B 6 -28.008 6.842 -1.878 1.00 0.00 C ATOM 1414 CG2 VAL B 6 -26.505 5.006 -2.687 1.00 0.00 C ATOM 0 H VAL B 6 -24.787 4.917 0.026 1.00 0.00 H new ATOM 0 HA VAL B 6 -25.363 7.329 -1.576 1.00 0.00 H new ATOM 0 HB VAL B 6 -27.338 5.172 -0.733 1.00 0.00 H new ATOM 0 HG11 VAL B 6 -28.856 6.309 -2.309 1.00 0.00 H new ATOM 0 HG12 VAL B 6 -28.335 7.390 -0.994 1.00 0.00 H new ATOM 0 HG13 VAL B 6 -27.608 7.542 -2.612 1.00 0.00 H new ATOM 0 HG21 VAL B 6 -27.377 4.501 -3.103 1.00 0.00 H new ATOM 0 HG22 VAL B 6 -26.064 5.653 -3.445 1.00 0.00 H new ATOM 0 HG23 VAL B 6 -25.771 4.264 -2.373 1.00 0.00 H new ATOM 1424 N LYS B 7 -25.717 8.505 0.603 1.00 0.00 N ATOM 1425 CA LYS B 7 -26.063 9.275 1.797 1.00 0.00 C ATOM 1426 C LYS B 7 -27.419 9.954 1.618 1.00 0.00 C ATOM 1427 O LYS B 7 -27.576 10.824 0.759 1.00 0.00 O ATOM 1428 CB LYS B 7 -24.987 10.323 2.094 1.00 0.00 C ATOM 1429 CG LYS B 7 -24.953 10.775 3.547 1.00 0.00 C ATOM 1430 CD LYS B 7 -24.672 12.266 3.665 1.00 0.00 C ATOM 1431 CE LYS B 7 -23.194 12.538 3.908 1.00 0.00 C ATOM 1432 NZ LYS B 7 -22.979 13.712 4.801 1.00 0.00 N ATOM 0 H LYS B 7 -25.132 9.006 -0.066 1.00 0.00 H new ATOM 0 HA LYS B 7 -26.122 8.588 2.641 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -24.012 9.915 1.828 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -25.154 11.192 1.457 1.00 0.00 H new ATOM 0 HG2 LYS B 7 -25.907 10.545 4.022 1.00 0.00 H new ATOM 0 HG3 LYS B 7 -24.187 10.216 4.084 1.00 0.00 H new ATOM 0 HD2 LYS B 7 -24.991 12.771 2.753 1.00 0.00 H new ATOM 0 HD3 LYS B 7 -25.259 12.684 4.483 1.00 0.00 H new ATOM 0 HE2 LYS B 7 -22.732 11.656 4.352 1.00 0.00 H new ATOM 0 HE3 LYS B 7 -22.696 12.713 2.954 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -21.959 13.861 4.939 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 -23.397 14.560 4.367 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 -23.431 13.536 5.721 1.00 0.00 H new ATOM 1446 N SER B 8 -28.396 9.545 2.424 1.00 0.00 N ATOM 1447 CA SER B 8 -29.742 10.107 2.346 1.00 0.00 C ATOM 1448 C SER B 8 -30.019 11.048 3.515 1.00 0.00 C ATOM 1449 O SER B 8 -30.100 12.265 3.335 1.00 0.00 O ATOM 1450 CB SER B 8 -30.786 8.985 2.314 1.00 0.00 C ATOM 1451 OG SER B 8 -30.334 7.839 3.019 1.00 0.00 O ATOM 0 H SER B 8 -28.281 8.826 3.139 1.00 0.00 H new ATOM 0 HA SER B 8 -29.810 10.684 1.424 1.00 0.00 H new ATOM 0 HB2 SER B 8 -31.718 9.340 2.753 1.00 0.00 H new ATOM 0 HB3 SER B 8 -31.003 8.716 1.280 1.00 0.00 H new ATOM 0 HG SER B 8 -31.021 7.141 2.983 1.00 0.00 H new ATOM 1457 N ARG B 9 -30.168 10.482 4.712 1.00 0.00 N ATOM 1458 CA ARG B 9 -30.439 11.280 5.906 1.00 0.00 C ATOM 1459 C ARG B 9 -29.180 12.002 6.377 1.00 0.00 C ATOM 1460 O ARG B 9 -28.098 11.415 6.417 1.00 0.00 O ATOM 1461 CB ARG B 9 -30.984 10.395 7.032 1.00 0.00 C ATOM 1462 CG ARG B 9 -32.357 10.819 7.530 1.00 0.00 C ATOM 1463 CD ARG B 9 -33.440 9.854 7.071 1.00 0.00 C ATOM 1464 NE ARG B 9 -34.376 9.528 8.146 1.00 0.00 N ATOM 1465 CZ ARG B 9 -34.099 8.692 9.151 1.00 0.00 C ATOM 1466 NH1 ARG B 9 -32.907 8.104 9.232 1.00 0.00 N ATOM 1467 NH2 ARG B 9 -35.017 8.446 10.081 1.00 0.00 N ATOM 0 H ARG B 9 -30.106 9.478 4.880 1.00 0.00 H new ATOM 0 HA ARG B 9 -31.190 12.026 5.646 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -31.037 9.365 6.680 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -30.283 10.411 7.867 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -32.351 10.869 8.619 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -32.583 11.821 7.166 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -33.986 10.293 6.236 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -32.977 8.938 6.703 1.00 0.00 H new ATOM 0 HE ARG B 9 -35.297 9.966 8.128 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -32.197 8.290 8.524 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -32.704 7.467 10.002 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -35.931 8.895 10.027 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -34.807 7.808 10.849 1.00 0.00 H new ATOM 1481 N LYS B 10 -29.327 13.276 6.739 1.00 0.00 N ATOM 1482 CA LYS B 10 -28.193 14.068 7.214 1.00 0.00 C ATOM 1483 C LYS B 10 -27.676 13.538 8.553 1.00 0.00 C ATOM 1484 O LYS B 10 -26.481 13.624 8.841 1.00 0.00 O ATOM 1485 CB LYS B 10 -28.575 15.544 7.349 1.00 0.00 C ATOM 1486 CG LYS B 10 -29.718 15.804 8.322 1.00 0.00 C ATOM 1487 CD LYS B 10 -29.986 17.292 8.483 1.00 0.00 C ATOM 1488 CE LYS B 10 -28.941 17.957 9.372 1.00 0.00 C ATOM 1489 NZ LYS B 10 -27.916 18.694 8.579 1.00 0.00 N ATOM 0 H LYS B 10 -30.214 13.779 6.713 1.00 0.00 H new ATOM 0 HA LYS B 10 -27.397 13.980 6.474 1.00 0.00 H new ATOM 0 HB2 LYS B 10 -27.700 16.106 7.675 1.00 0.00 H new ATOM 0 HB3 LYS B 10 -28.853 15.927 6.367 1.00 0.00 H new ATOM 0 HG2 LYS B 10 -30.620 15.307 7.966 1.00 0.00 H new ATOM 0 HG3 LYS B 10 -29.477 15.370 9.292 1.00 0.00 H new ATOM 0 HD2 LYS B 10 -29.989 17.770 7.503 1.00 0.00 H new ATOM 0 HD3 LYS B 10 -30.977 17.440 8.912 1.00 0.00 H new ATOM 0 HE2 LYS B 10 -29.434 18.647 10.056 1.00 0.00 H new ATOM 0 HE3 LYS B 10 -28.450 17.199 9.983 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 -26.995 18.632 9.059 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 -27.842 18.273 7.631 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 -28.195 19.692 8.493 1.00 0.00 H new ATOM 1503 N ASN B 11 -28.583 12.987 9.362 1.00 0.00 N ATOM 1504 CA ASN B 11 -28.220 12.437 10.667 1.00 0.00 C ATOM 1505 C ASN B 11 -27.267 11.249 10.521 1.00 0.00 C ATOM 1506 O ASN B 11 -26.411 11.024 11.377 1.00 0.00 O ATOM 1507 CB ASN B 11 -29.475 12.006 11.435 1.00 0.00 C ATOM 1508 CG ASN B 11 -30.425 13.161 11.689 1.00 0.00 C ATOM 1509 OD1 ASN B 11 -31.282 13.467 10.859 1.00 0.00 O ATOM 1510 ND2 ASN B 11 -30.277 13.813 12.837 1.00 0.00 N ATOM 0 H ASN B 11 -29.574 12.910 9.135 1.00 0.00 H new ATOM 0 HA ASN B 11 -27.710 13.220 11.227 1.00 0.00 H new ATOM 0 HB2 ASN B 11 -29.994 11.230 10.871 1.00 0.00 H new ATOM 0 HB3 ASN B 11 -29.181 11.565 12.388 1.00 0.00 H new ATOM 0 HD21 ASN B 11 -30.887 14.600 13.059 1.00 0.00 H new ATOM 0 HD22 ASN B 11 -29.554 13.526 13.497 1.00 0.00 H new ATOM 1517 N GLU B 12 -27.419 10.493 9.431 1.00 0.00 N ATOM 1518 CA GLU B 12 -26.568 9.333 9.174 1.00 0.00 C ATOM 1519 C GLU B 12 -25.426 9.698 8.227 1.00 0.00 C ATOM 1520 O GLU B 12 -25.656 10.106 7.087 1.00 0.00 O ATOM 1521 CB GLU B 12 -27.388 8.176 8.590 1.00 0.00 C ATOM 1522 CG GLU B 12 -28.079 8.513 7.276 1.00 0.00 C ATOM 1523 CD GLU B 12 -29.040 7.434 6.817 1.00 0.00 C ATOM 1524 OE1 GLU B 12 -29.968 7.095 7.585 1.00 0.00 O ATOM 1525 OE2 GLU B 12 -28.871 6.933 5.686 1.00 0.00 O ATOM 0 H GLU B 12 -28.124 10.665 8.714 1.00 0.00 H new ATOM 0 HA GLU B 12 -26.142 9.012 10.125 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -26.731 7.320 8.435 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -28.141 7.873 9.318 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -28.622 9.451 7.388 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -27.324 8.671 6.505 1.00 0.00 H new ATOM 1532 N GLU B 13 -24.193 9.547 8.707 1.00 0.00 N ATOM 1533 CA GLU B 13 -23.014 9.857 7.905 1.00 0.00 C ATOM 1534 C GLU B 13 -22.353 8.578 7.396 1.00 0.00 C ATOM 1535 O GLU B 13 -22.676 7.479 7.849 1.00 0.00 O ATOM 1536 CB GLU B 13 -22.016 10.678 8.724 1.00 0.00 C ATOM 1537 CG GLU B 13 -21.833 12.096 8.202 1.00 0.00 C ATOM 1538 CD GLU B 13 -20.411 12.607 8.346 1.00 0.00 C ATOM 1539 OE1 GLU B 13 -19.465 11.810 8.158 1.00 0.00 O ATOM 1540 OE2 GLU B 13 -20.243 13.808 8.642 1.00 0.00 O ATOM 0 H GLU B 13 -23.986 9.212 9.648 1.00 0.00 H new ATOM 0 HA GLU B 13 -23.332 10.445 7.044 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -22.354 10.720 9.760 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -21.051 10.170 8.724 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -22.119 12.129 7.151 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -22.508 12.763 8.738 1.00 0.00 H new ATOM 1547 N TYR B 14 -21.424 8.732 6.451 1.00 0.00 N ATOM 1548 CA TYR B 14 -20.711 7.588 5.878 1.00 0.00 C ATOM 1549 C TYR B 14 -19.984 6.791 6.961 1.00 0.00 C ATOM 1550 O TYR B 14 -19.915 5.562 6.894 1.00 0.00 O ATOM 1551 CB TYR B 14 -19.709 8.051 4.817 1.00 0.00 C ATOM 1552 CG TYR B 14 -20.322 8.898 3.721 1.00 0.00 C ATOM 1553 CD1 TYR B 14 -21.070 8.319 2.702 1.00 0.00 C ATOM 1554 CD2 TYR B 14 -20.155 10.277 3.710 1.00 0.00 C ATOM 1555 CE1 TYR B 14 -21.632 9.090 1.702 1.00 0.00 C ATOM 1556 CE2 TYR B 14 -20.713 11.055 2.714 1.00 0.00 C ATOM 1557 CZ TYR B 14 -21.452 10.457 1.712 1.00 0.00 C ATOM 1558 OH TYR B 14 -22.014 11.226 0.717 1.00 0.00 O ATOM 0 H TYR B 14 -21.148 9.636 6.067 1.00 0.00 H new ATOM 0 HA TYR B 14 -21.452 6.940 5.409 1.00 0.00 H new ATOM 0 HB2 TYR B 14 -18.917 8.621 5.303 1.00 0.00 H new ATOM 0 HB3 TYR B 14 -19.241 7.176 4.367 1.00 0.00 H new ATOM 0 HD1 TYR B 14 -21.214 7.249 2.692 1.00 0.00 H new ATOM 0 HD2 TYR B 14 -19.580 10.749 4.493 1.00 0.00 H new ATOM 0 HE1 TYR B 14 -22.209 8.624 0.917 1.00 0.00 H new ATOM 0 HE2 TYR B 14 -20.572 12.126 2.719 1.00 0.00 H new ATOM 0 HH TYR B 14 -22.781 10.753 0.331 1.00 0.00 H new ATOM 1568 N GLY B 15 -19.442 7.502 7.955 1.00 0.00 N ATOM 1569 CA GLY B 15 -18.726 6.851 9.042 1.00 0.00 C ATOM 1570 C GLY B 15 -17.542 6.035 8.559 1.00 0.00 C ATOM 1571 O GLY B 15 -17.349 4.899 8.995 1.00 0.00 O ATOM 0 H GLY B 15 -19.488 8.519 8.024 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -18.378 7.607 9.746 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -19.412 6.201 9.585 1.00 0.00 H new ATOM 1575 N LEU B 16 -16.746 6.613 7.659 1.00 0.00 N ATOM 1576 CA LEU B 16 -15.576 5.925 7.118 1.00 0.00 C ATOM 1577 C LEU B 16 -14.294 6.707 7.404 1.00 0.00 C ATOM 1578 O LEU B 16 -14.200 7.897 7.108 1.00 0.00 O ATOM 1579 CB LEU B 16 -15.726 5.694 5.606 1.00 0.00 C ATOM 1580 CG LEU B 16 -16.198 6.905 4.793 1.00 0.00 C ATOM 1581 CD1 LEU B 16 -15.012 7.735 4.322 1.00 0.00 C ATOM 1582 CD2 LEU B 16 -17.034 6.453 3.605 1.00 0.00 C ATOM 0 H LEU B 16 -16.890 7.553 7.291 1.00 0.00 H new ATOM 0 HA LEU B 16 -15.507 4.957 7.614 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -14.765 5.366 5.210 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -16.431 4.877 5.450 1.00 0.00 H new ATOM 0 HG LEU B 16 -16.817 7.529 5.438 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -15.371 8.589 3.747 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -14.450 8.090 5.186 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -14.365 7.122 3.695 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -17.361 7.324 3.038 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -16.435 5.807 2.963 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -17.905 5.904 3.961 1.00 0.00 H new ATOM 1594 N ARG B 17 -13.310 6.018 7.980 1.00 0.00 N ATOM 1595 CA ARG B 17 -12.023 6.626 8.308 1.00 0.00 C ATOM 1596 C ARG B 17 -10.976 6.241 7.271 1.00 0.00 C ATOM 1597 O ARG B 17 -10.909 5.084 6.852 1.00 0.00 O ATOM 1598 CB ARG B 17 -11.559 6.181 9.700 1.00 0.00 C ATOM 1599 CG ARG B 17 -11.452 7.318 10.702 1.00 0.00 C ATOM 1600 CD ARG B 17 -10.030 7.476 11.219 1.00 0.00 C ATOM 1601 NE ARG B 17 -9.935 8.496 12.265 1.00 0.00 N ATOM 1602 CZ ARG B 17 -8.797 9.095 12.630 1.00 0.00 C ATOM 1603 NH1 ARG B 17 -7.647 8.783 12.037 1.00 0.00 N ATOM 1604 NH2 ARG B 17 -8.811 10.009 13.593 1.00 0.00 N ATOM 0 H ARG B 17 -13.381 5.032 8.230 1.00 0.00 H new ATOM 0 HA ARG B 17 -12.146 7.709 8.305 1.00 0.00 H new ATOM 0 HB2 ARG B 17 -12.255 5.435 10.084 1.00 0.00 H new ATOM 0 HB3 ARG B 17 -10.588 5.695 9.611 1.00 0.00 H new ATOM 0 HG2 ARG B 17 -11.775 8.248 10.234 1.00 0.00 H new ATOM 0 HG3 ARG B 17 -12.125 7.131 11.539 1.00 0.00 H new ATOM 0 HD2 ARG B 17 -9.679 6.521 11.611 1.00 0.00 H new ATOM 0 HD3 ARG B 17 -9.372 7.743 10.392 1.00 0.00 H new ATOM 0 HE ARG B 17 -10.792 8.767 12.746 1.00 0.00 H new ATOM 0 HH11 ARG B 17 -7.629 8.081 11.297 1.00 0.00 H new ATOM 0 HH12 ARG B 17 -6.784 9.246 12.323 1.00 0.00 H new ATOM 0 HH21 ARG B 17 -9.689 10.253 14.052 1.00 0.00 H new ATOM 0 HH22 ARG B 17 -7.944 10.468 13.874 1.00 0.00 H new ATOM 1618 N LEU B 18 -10.156 7.206 6.863 1.00 0.00 N ATOM 1619 CA LEU B 18 -9.111 6.944 5.877 1.00 0.00 C ATOM 1620 C LEU B 18 -7.733 7.245 6.426 1.00 0.00 C ATOM 1621 O LEU B 18 -7.577 7.865 7.481 1.00 0.00 O ATOM 1622 CB LEU B 18 -9.296 7.756 4.596 1.00 0.00 C ATOM 1623 CG LEU B 18 -10.725 8.082 4.200 1.00 0.00 C ATOM 1624 CD1 LEU B 18 -10.743 8.656 2.794 1.00 0.00 C ATOM 1625 CD2 LEU B 18 -11.611 6.848 4.290 1.00 0.00 C ATOM 0 H LEU B 18 -10.194 8.169 7.197 1.00 0.00 H new ATOM 0 HA LEU B 18 -9.197 5.883 5.644 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -8.750 8.693 4.704 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -8.831 7.209 3.776 1.00 0.00 H new ATOM 0 HG LEU B 18 -11.122 8.823 4.893 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -11.769 8.890 2.510 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -10.142 9.565 2.764 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -10.331 7.926 2.098 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -12.629 7.109 4.001 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -11.230 6.077 3.620 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -11.609 6.473 5.313 1.00 0.00 H new ATOM 1637 N ALA B 19 -6.741 6.818 5.666 1.00 0.00 N ATOM 1638 CA ALA B 19 -5.351 7.037 6.007 1.00 0.00 C ATOM 1639 C ALA B 19 -4.492 6.950 4.750 1.00 0.00 C ATOM 1640 O ALA B 19 -4.929 6.401 3.736 1.00 0.00 O ATOM 1641 CB ALA B 19 -4.888 6.046 7.061 1.00 0.00 C ATOM 0 H ALA B 19 -6.879 6.309 4.793 1.00 0.00 H new ATOM 0 HA ALA B 19 -5.244 8.035 6.431 1.00 0.00 H new ATOM 0 HB1 ALA B 19 -3.841 6.231 7.300 1.00 0.00 H new ATOM 0 HB2 ALA B 19 -5.492 6.163 7.961 1.00 0.00 H new ATOM 0 HB3 ALA B 19 -4.999 5.031 6.680 1.00 0.00 H new ATOM 1647 N SER B 20 -3.284 7.500 4.800 1.00 0.00 N ATOM 1648 CA SER B 20 -2.405 7.478 3.637 1.00 0.00 C ATOM 1649 C SER B 20 -1.121 6.700 3.906 1.00 0.00 C ATOM 1650 O SER B 20 -0.565 6.748 5.005 1.00 0.00 O ATOM 1651 CB SER B 20 -2.071 8.903 3.191 1.00 0.00 C ATOM 1652 OG SER B 20 -1.462 9.643 4.237 1.00 0.00 O ATOM 0 H SER B 20 -2.895 7.961 5.622 1.00 0.00 H new ATOM 0 HA SER B 20 -2.941 6.967 2.837 1.00 0.00 H new ATOM 0 HB2 SER B 20 -1.403 8.869 2.330 1.00 0.00 H new ATOM 0 HB3 SER B 20 -2.982 9.408 2.868 1.00 0.00 H new ATOM 0 HG SER B 20 -0.813 10.272 3.858 1.00 0.00 H new ATOM 1658 N HIS B 21 -0.654 5.989 2.882 1.00 0.00 N ATOM 1659 CA HIS B 21 0.568 5.198 2.974 1.00 0.00 C ATOM 1660 C HIS B 21 1.649 5.786 2.069 1.00 0.00 C ATOM 1661 O HIS B 21 1.421 6.786 1.386 1.00 0.00 O ATOM 1662 CB HIS B 21 0.289 3.746 2.575 1.00 0.00 C ATOM 1663 CG HIS B 21 0.282 2.797 3.731 1.00 0.00 C ATOM 1664 ND1 HIS B 21 -0.383 2.845 4.905 1.00 0.00 N flip ATOM 1665 CD2 HIS B 21 1.025 1.637 3.757 1.00 0.00 C flip ATOM 1666 CE1 HIS B 21 -0.035 1.723 5.616 1.00 0.00 C flip ATOM 1667 NE2 HIS B 21 0.817 1.011 4.900 1.00 0.00 N flip ATOM 0 H HIS B 21 -1.110 5.946 1.971 1.00 0.00 H new ATOM 0 HA HIS B 21 0.920 5.222 4.005 1.00 0.00 H new ATOM 0 HB2 HIS B 21 -0.675 3.696 2.069 1.00 0.00 H new ATOM 0 HB3 HIS B 21 1.043 3.424 1.856 1.00 0.00 H new ATOM 0 HD1 HIS B 21 -1.024 3.578 5.207 1.00 0.00 H new ATOM 0 HD2 HIS B 21 1.676 1.294 2.966 1.00 0.00 H new ATOM 0 HE1 HIS B 21 -0.398 1.465 6.600 1.00 0.00 H new ATOM 1676 N ILE B 22 2.824 5.160 2.060 1.00 0.00 N ATOM 1677 CA ILE B 22 3.931 5.628 1.231 1.00 0.00 C ATOM 1678 C ILE B 22 4.568 4.476 0.461 1.00 0.00 C ATOM 1679 O ILE B 22 4.768 3.391 1.006 1.00 0.00 O ATOM 1680 CB ILE B 22 5.019 6.325 2.078 1.00 0.00 C ATOM 1681 CG1 ILE B 22 4.397 7.412 2.960 1.00 0.00 C ATOM 1682 CG2 ILE B 22 6.098 6.916 1.181 1.00 0.00 C ATOM 1683 CD1 ILE B 22 3.816 8.574 2.182 1.00 0.00 C ATOM 0 H ILE B 22 3.033 4.330 2.615 1.00 0.00 H new ATOM 0 HA ILE B 22 3.512 6.347 0.527 1.00 0.00 H new ATOM 0 HB ILE B 22 5.482 5.580 2.725 1.00 0.00 H new ATOM 0 HG12 ILE B 22 3.611 6.966 3.570 1.00 0.00 H new ATOM 0 HG13 ILE B 22 5.156 7.789 3.645 1.00 0.00 H new ATOM 0 HG21 ILE B 22 6.856 7.403 1.795 1.00 0.00 H new ATOM 0 HG22 ILE B 22 6.561 6.121 0.596 1.00 0.00 H new ATOM 0 HG23 ILE B 22 5.651 7.648 0.508 1.00 0.00 H new ATOM 0 HD11 ILE B 22 3.395 9.302 2.875 1.00 0.00 H new ATOM 0 HD12 ILE B 22 4.602 9.047 1.593 1.00 0.00 H new ATOM 0 HD13 ILE B 22 3.033 8.211 1.517 1.00 0.00 H new ATOM 1695 N PHE B 23 4.888 4.721 -0.808 1.00 0.00 N ATOM 1696 CA PHE B 23 5.511 3.705 -1.654 1.00 0.00 C ATOM 1697 C PHE B 23 6.436 4.344 -2.693 1.00 0.00 C ATOM 1698 O PHE B 23 6.504 5.569 -2.806 1.00 0.00 O ATOM 1699 CB PHE B 23 4.439 2.851 -2.341 1.00 0.00 C ATOM 1700 CG PHE B 23 3.686 3.581 -3.417 1.00 0.00 C ATOM 1701 CD1 PHE B 23 2.803 4.597 -3.095 1.00 0.00 C ATOM 1702 CD2 PHE B 23 3.864 3.249 -4.750 1.00 0.00 C ATOM 1703 CE1 PHE B 23 2.116 5.273 -4.081 1.00 0.00 C ATOM 1704 CE2 PHE B 23 3.180 3.923 -5.742 1.00 0.00 C ATOM 1705 CZ PHE B 23 2.301 4.936 -5.407 1.00 0.00 C ATOM 0 H PHE B 23 4.726 5.614 -1.273 1.00 0.00 H new ATOM 0 HA PHE B 23 6.116 3.060 -1.017 1.00 0.00 H new ATOM 0 HB2 PHE B 23 4.911 1.969 -2.774 1.00 0.00 H new ATOM 0 HB3 PHE B 23 3.732 2.498 -1.590 1.00 0.00 H new ATOM 0 HD1 PHE B 23 2.650 4.863 -2.060 1.00 0.00 H new ATOM 0 HD2 PHE B 23 4.545 2.454 -5.016 1.00 0.00 H new ATOM 0 HE1 PHE B 23 1.433 6.066 -3.816 1.00 0.00 H new ATOM 0 HE2 PHE B 23 3.331 3.659 -6.778 1.00 0.00 H new ATOM 0 HZ PHE B 23 1.761 5.462 -6.180 1.00 0.00 H new ATOM 1715 N VAL B 24 7.145 3.506 -3.450 1.00 0.00 N ATOM 1716 CA VAL B 24 8.066 3.989 -4.477 1.00 0.00 C ATOM 1717 C VAL B 24 7.495 3.763 -5.875 1.00 0.00 C ATOM 1718 O VAL B 24 7.310 2.624 -6.303 1.00 0.00 O ATOM 1719 CB VAL B 24 9.444 3.294 -4.376 1.00 0.00 C ATOM 1720 CG1 VAL B 24 10.453 3.950 -5.310 1.00 0.00 C ATOM 1721 CG2 VAL B 24 9.949 3.313 -2.939 1.00 0.00 C ATOM 0 H VAL B 24 7.099 2.490 -3.371 1.00 0.00 H new ATOM 0 HA VAL B 24 8.196 5.058 -4.307 1.00 0.00 H new ATOM 0 HB VAL B 24 9.324 2.255 -4.684 1.00 0.00 H new ATOM 0 HG11 VAL B 24 11.414 3.444 -5.221 1.00 0.00 H new ATOM 0 HG12 VAL B 24 10.098 3.877 -6.338 1.00 0.00 H new ATOM 0 HG13 VAL B 24 10.570 5.000 -5.040 1.00 0.00 H new ATOM 0 HG21 VAL B 24 10.920 2.820 -2.888 1.00 0.00 H new ATOM 0 HG22 VAL B 24 10.048 4.345 -2.602 1.00 0.00 H new ATOM 0 HG23 VAL B 24 9.241 2.788 -2.298 1.00 0.00 H new ATOM 1731 N LYS B 25 7.219 4.860 -6.580 1.00 0.00 N ATOM 1732 CA LYS B 25 6.672 4.788 -7.935 1.00 0.00 C ATOM 1733 C LYS B 25 7.651 4.107 -8.892 1.00 0.00 C ATOM 1734 O LYS B 25 7.245 3.309 -9.738 1.00 0.00 O ATOM 1735 CB LYS B 25 6.330 6.188 -8.447 1.00 0.00 C ATOM 1736 CG LYS B 25 5.205 6.208 -9.471 1.00 0.00 C ATOM 1737 CD LYS B 25 3.876 6.598 -8.840 1.00 0.00 C ATOM 1738 CE LYS B 25 2.920 7.196 -9.864 1.00 0.00 C ATOM 1739 NZ LYS B 25 3.312 8.579 -10.261 1.00 0.00 N ATOM 0 H LYS B 25 7.365 5.809 -6.236 1.00 0.00 H new ATOM 0 HA LYS B 25 5.762 4.190 -7.895 1.00 0.00 H new ATOM 0 HB2 LYS B 25 6.050 6.816 -7.601 1.00 0.00 H new ATOM 0 HB3 LYS B 25 7.222 6.630 -8.891 1.00 0.00 H new ATOM 0 HG2 LYS B 25 5.450 6.911 -10.267 1.00 0.00 H new ATOM 0 HG3 LYS B 25 5.114 5.224 -9.931 1.00 0.00 H new ATOM 0 HD2 LYS B 25 3.418 5.720 -8.384 1.00 0.00 H new ATOM 0 HD3 LYS B 25 4.050 7.318 -8.041 1.00 0.00 H new ATOM 0 HE2 LYS B 25 2.894 6.560 -10.749 1.00 0.00 H new ATOM 0 HE3 LYS B 25 1.911 7.211 -9.451 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 2.536 9.020 -10.795 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 3.510 9.142 -9.409 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 4.164 8.541 -10.857 1.00 0.00 H new ATOM 1753 N GLU B 26 8.940 4.430 -8.755 1.00 0.00 N ATOM 1754 CA GLU B 26 9.980 3.852 -9.607 1.00 0.00 C ATOM 1755 C GLU B 26 11.363 4.381 -9.222 1.00 0.00 C ATOM 1756 O GLU B 26 11.483 5.286 -8.393 1.00 0.00 O ATOM 1757 CB GLU B 26 9.700 4.159 -11.085 1.00 0.00 C ATOM 1758 CG GLU B 26 9.560 5.644 -11.382 1.00 0.00 C ATOM 1759 CD GLU B 26 9.151 5.919 -12.817 1.00 0.00 C ATOM 1760 OE1 GLU B 26 7.933 5.939 -13.091 1.00 0.00 O ATOM 1761 OE2 GLU B 26 10.048 6.121 -13.662 1.00 0.00 O ATOM 0 H GLU B 26 9.288 5.091 -8.060 1.00 0.00 H new ATOM 0 HA GLU B 26 9.967 2.772 -9.459 1.00 0.00 H new ATOM 0 HB2 GLU B 26 10.508 3.750 -11.692 1.00 0.00 H new ATOM 0 HB3 GLU B 26 8.785 3.649 -11.387 1.00 0.00 H new ATOM 0 HG2 GLU B 26 8.820 6.077 -10.709 1.00 0.00 H new ATOM 0 HG3 GLU B 26 10.508 6.142 -11.177 1.00 0.00 H new ATOM 1768 N ILE B 27 12.403 3.814 -9.834 1.00 0.00 N ATOM 1769 CA ILE B 27 13.777 4.231 -9.564 1.00 0.00 C ATOM 1770 C ILE B 27 14.485 4.647 -10.853 1.00 0.00 C ATOM 1771 O ILE B 27 14.303 4.025 -11.899 1.00 0.00 O ATOM 1772 CB ILE B 27 14.593 3.110 -8.882 1.00 0.00 C ATOM 1773 CG1 ILE B 27 13.830 2.541 -7.682 1.00 0.00 C ATOM 1774 CG2 ILE B 27 15.954 3.634 -8.446 1.00 0.00 C ATOM 1775 CD1 ILE B 27 13.211 1.186 -7.946 1.00 0.00 C ATOM 0 H ILE B 27 12.319 3.064 -10.520 1.00 0.00 H new ATOM 0 HA ILE B 27 13.718 5.083 -8.887 1.00 0.00 H new ATOM 0 HB ILE B 27 14.745 2.308 -9.604 1.00 0.00 H new ATOM 0 HG12 ILE B 27 14.510 2.462 -6.834 1.00 0.00 H new ATOM 0 HG13 ILE B 27 13.045 3.241 -7.396 1.00 0.00 H new ATOM 0 HG21 ILE B 27 16.516 2.832 -7.967 1.00 0.00 H new ATOM 0 HG22 ILE B 27 16.502 3.992 -9.317 1.00 0.00 H new ATOM 0 HG23 ILE B 27 15.819 4.454 -7.740 1.00 0.00 H new ATOM 0 HD11 ILE B 27 12.687 0.845 -7.053 1.00 0.00 H new ATOM 0 HD12 ILE B 27 12.506 1.263 -8.773 1.00 0.00 H new ATOM 0 HD13 ILE B 27 13.994 0.472 -8.202 1.00 0.00 H new ATOM 1787 N SER B 28 15.294 5.702 -10.767 1.00 0.00 N ATOM 1788 CA SER B 28 16.032 6.203 -11.926 1.00 0.00 C ATOM 1789 C SER B 28 17.170 5.260 -12.306 1.00 0.00 C ATOM 1790 O SER B 28 17.706 4.542 -11.458 1.00 0.00 O ATOM 1791 CB SER B 28 16.594 7.598 -11.640 1.00 0.00 C ATOM 1792 OG SER B 28 15.580 8.581 -11.730 1.00 0.00 O ATOM 0 H SER B 28 15.455 6.226 -9.907 1.00 0.00 H new ATOM 0 HA SER B 28 15.335 6.259 -12.762 1.00 0.00 H new ATOM 0 HB2 SER B 28 17.038 7.618 -10.645 1.00 0.00 H new ATOM 0 HB3 SER B 28 17.390 7.826 -12.349 1.00 0.00 H new ATOM 0 HG SER B 28 15.133 8.670 -10.863 1.00 0.00 H new ATOM 1798 N GLN B 29 17.537 5.273 -13.586 1.00 0.00 N ATOM 1799 CA GLN B 29 18.616 4.426 -14.084 1.00 0.00 C ATOM 1800 C GLN B 29 19.973 4.996 -13.685 1.00 0.00 C ATOM 1801 O GLN B 29 20.193 6.207 -13.758 1.00 0.00 O ATOM 1802 CB GLN B 29 18.530 4.287 -15.607 1.00 0.00 C ATOM 1803 CG GLN B 29 17.928 2.967 -16.066 1.00 0.00 C ATOM 1804 CD GLN B 29 18.950 2.045 -16.710 1.00 0.00 C ATOM 1805 OE1 GLN B 29 20.122 2.039 -16.335 1.00 0.00 O ATOM 1806 NE2 GLN B 29 18.509 1.259 -17.687 1.00 0.00 N ATOM 0 H GLN B 29 17.102 5.862 -14.297 1.00 0.00 H new ATOM 0 HA GLN B 29 18.508 3.438 -13.636 1.00 0.00 H new ATOM 0 HB2 GLN B 29 17.932 5.107 -16.005 1.00 0.00 H new ATOM 0 HB3 GLN B 29 19.530 4.387 -16.029 1.00 0.00 H new ATOM 0 HG2 GLN B 29 17.478 2.462 -15.212 1.00 0.00 H new ATOM 0 HG3 GLN B 29 17.126 3.166 -16.777 1.00 0.00 H new ATOM 0 HE21 GLN B 29 17.529 1.295 -17.968 1.00 0.00 H new ATOM 0 HE22 GLN B 29 19.151 0.620 -18.156 1.00 0.00 H new ATOM 1815 N ASP B 30 20.877 4.114 -13.256 1.00 0.00 N ATOM 1816 CA ASP B 30 22.217 4.517 -12.832 1.00 0.00 C ATOM 1817 C ASP B 30 22.156 5.533 -11.685 1.00 0.00 C ATOM 1818 O ASP B 30 23.025 6.399 -11.563 1.00 0.00 O ATOM 1819 CB ASP B 30 23.002 5.093 -14.016 1.00 0.00 C ATOM 1820 CG ASP B 30 23.890 4.057 -14.678 1.00 0.00 C ATOM 1821 OD1 ASP B 30 23.346 3.124 -15.306 1.00 0.00 O ATOM 1822 OD2 ASP B 30 25.128 4.174 -14.565 1.00 0.00 O ATOM 0 H ASP B 30 20.703 3.111 -13.193 1.00 0.00 H new ATOM 0 HA ASP B 30 22.734 3.630 -12.466 1.00 0.00 H new ATOM 0 HB2 ASP B 30 22.304 5.493 -14.751 1.00 0.00 H new ATOM 0 HB3 ASP B 30 23.614 5.926 -13.672 1.00 0.00 H new ATOM 1827 N SER B 31 21.129 5.412 -10.840 1.00 0.00 N ATOM 1828 CA SER B 31 20.960 6.310 -9.699 1.00 0.00 C ATOM 1829 C SER B 31 21.411 5.629 -8.408 1.00 0.00 C ATOM 1830 O SER B 31 21.686 4.430 -8.397 1.00 0.00 O ATOM 1831 CB SER B 31 19.498 6.756 -9.583 1.00 0.00 C ATOM 1832 OG SER B 31 19.397 8.171 -9.576 1.00 0.00 O ATOM 0 H SER B 31 20.403 4.701 -10.926 1.00 0.00 H new ATOM 0 HA SER B 31 21.582 7.191 -9.860 1.00 0.00 H new ATOM 0 HB2 SER B 31 18.923 6.351 -10.416 1.00 0.00 H new ATOM 0 HB3 SER B 31 19.062 6.352 -8.669 1.00 0.00 H new ATOM 0 HG SER B 31 19.007 8.475 -10.422 1.00 0.00 H new ATOM 1838 N LEU B 32 21.490 6.401 -7.324 1.00 0.00 N ATOM 1839 CA LEU B 32 21.914 5.868 -6.027 1.00 0.00 C ATOM 1840 C LEU B 32 21.052 4.681 -5.599 1.00 0.00 C ATOM 1841 O LEU B 32 21.568 3.682 -5.102 1.00 0.00 O ATOM 1842 CB LEU B 32 21.854 6.953 -4.951 1.00 0.00 C ATOM 1843 CG LEU B 32 22.859 8.092 -5.119 1.00 0.00 C ATOM 1844 CD1 LEU B 32 22.474 9.264 -4.233 1.00 0.00 C ATOM 1845 CD2 LEU B 32 24.268 7.613 -4.797 1.00 0.00 C ATOM 0 H LEU B 32 21.267 7.396 -7.317 1.00 0.00 H new ATOM 0 HA LEU B 32 22.943 5.526 -6.140 1.00 0.00 H new ATOM 0 HB2 LEU B 32 20.849 7.375 -4.939 1.00 0.00 H new ATOM 0 HB3 LEU B 32 22.016 6.487 -3.979 1.00 0.00 H new ATOM 0 HG LEU B 32 22.843 8.423 -6.157 1.00 0.00 H new ATOM 0 HD11 LEU B 32 23.197 10.070 -4.361 1.00 0.00 H new ATOM 0 HD12 LEU B 32 21.482 9.619 -4.511 1.00 0.00 H new ATOM 0 HD13 LEU B 32 22.467 8.945 -3.191 1.00 0.00 H new ATOM 0 HD21 LEU B 32 24.970 8.437 -4.922 1.00 0.00 H new ATOM 0 HD22 LEU B 32 24.305 7.258 -3.767 1.00 0.00 H new ATOM 0 HD23 LEU B 32 24.539 6.800 -5.471 1.00 0.00 H new ATOM 1857 N ALA B 33 19.740 4.799 -5.794 1.00 0.00 N ATOM 1858 CA ALA B 33 18.805 3.736 -5.427 1.00 0.00 C ATOM 1859 C ALA B 33 19.037 2.478 -6.261 1.00 0.00 C ATOM 1860 O ALA B 33 19.191 1.383 -5.716 1.00 0.00 O ATOM 1861 CB ALA B 33 17.373 4.225 -5.583 1.00 0.00 C ATOM 0 H ALA B 33 19.299 5.622 -6.205 1.00 0.00 H new ATOM 0 HA ALA B 33 18.979 3.475 -4.383 1.00 0.00 H new ATOM 0 HB1 ALA B 33 16.684 3.427 -5.308 1.00 0.00 H new ATOM 0 HB2 ALA B 33 17.210 5.085 -4.934 1.00 0.00 H new ATOM 0 HB3 ALA B 33 17.198 4.514 -6.619 1.00 0.00 H new ATOM 1867 N ALA B 34 19.067 2.644 -7.584 1.00 0.00 N ATOM 1868 CA ALA B 34 19.287 1.524 -8.499 1.00 0.00 C ATOM 1869 C ALA B 34 20.681 0.926 -8.310 1.00 0.00 C ATOM 1870 O ALA B 34 20.869 -0.284 -8.440 1.00 0.00 O ATOM 1871 CB ALA B 34 19.090 1.974 -9.940 1.00 0.00 C ATOM 0 H ALA B 34 18.941 3.545 -8.046 1.00 0.00 H new ATOM 0 HA ALA B 34 18.556 0.749 -8.271 1.00 0.00 H new ATOM 0 HB1 ALA B 34 19.257 1.131 -10.610 1.00 0.00 H new ATOM 0 HB2 ALA B 34 18.073 2.345 -10.070 1.00 0.00 H new ATOM 0 HB3 ALA B 34 19.799 2.769 -10.173 1.00 0.00 H new ATOM 1877 N ARG B 35 21.651 1.783 -7.999 1.00 0.00 N ATOM 1878 CA ARG B 35 23.028 1.351 -7.784 1.00 0.00 C ATOM 1879 C ARG B 35 23.178 0.633 -6.440 1.00 0.00 C ATOM 1880 O ARG B 35 23.864 -0.385 -6.348 1.00 0.00 O ATOM 1881 CB ARG B 35 23.971 2.555 -7.842 1.00 0.00 C ATOM 1882 CG ARG B 35 25.430 2.185 -8.048 1.00 0.00 C ATOM 1883 CD ARG B 35 26.357 3.324 -7.657 1.00 0.00 C ATOM 1884 NE ARG B 35 27.043 3.062 -6.393 1.00 0.00 N ATOM 1885 CZ ARG B 35 28.108 2.265 -6.272 1.00 0.00 C ATOM 1886 NH1 ARG B 35 28.612 1.642 -7.336 1.00 0.00 N ATOM 1887 NH2 ARG B 35 28.670 2.089 -5.081 1.00 0.00 N ATOM 0 H ARG B 35 21.506 2.787 -7.890 1.00 0.00 H new ATOM 0 HA ARG B 35 23.290 0.649 -8.576 1.00 0.00 H new ATOM 0 HB2 ARG B 35 23.655 3.213 -8.652 1.00 0.00 H new ATOM 0 HB3 ARG B 35 23.877 3.122 -6.916 1.00 0.00 H new ATOM 0 HG2 ARG B 35 25.669 1.301 -7.456 1.00 0.00 H new ATOM 0 HG3 ARG B 35 25.595 1.923 -9.093 1.00 0.00 H new ATOM 0 HD2 ARG B 35 27.095 3.478 -8.445 1.00 0.00 H new ATOM 0 HD3 ARG B 35 25.783 4.247 -7.573 1.00 0.00 H new ATOM 0 HE ARG B 35 26.687 3.516 -5.552 1.00 0.00 H new ATOM 0 HH11 ARG B 35 28.184 1.772 -8.253 1.00 0.00 H new ATOM 0 HH12 ARG B 35 29.426 1.035 -7.234 1.00 0.00 H new ATOM 0 HH21 ARG B 35 28.288 2.562 -4.262 1.00 0.00 H new ATOM 0 HH22 ARG B 35 29.483 1.481 -4.986 1.00 0.00 H new ATOM 1901 N ASP B 36 22.532 1.170 -5.405 1.00 0.00 N ATOM 1902 CA ASP B 36 22.594 0.580 -4.068 1.00 0.00 C ATOM 1903 C ASP B 36 21.877 -0.770 -4.023 1.00 0.00 C ATOM 1904 O ASP B 36 22.257 -1.656 -3.255 1.00 0.00 O ATOM 1905 CB ASP B 36 21.979 1.526 -3.033 1.00 0.00 C ATOM 1906 CG ASP B 36 23.023 2.385 -2.344 1.00 0.00 C ATOM 1907 OD1 ASP B 36 23.470 3.380 -2.955 1.00 0.00 O ATOM 1908 OD2 ASP B 36 23.388 2.068 -1.194 1.00 0.00 O ATOM 0 H ASP B 36 21.960 2.012 -5.467 1.00 0.00 H new ATOM 0 HA ASP B 36 23.645 0.421 -3.828 1.00 0.00 H new ATOM 0 HB2 ASP B 36 21.248 2.170 -3.522 1.00 0.00 H new ATOM 0 HB3 ASP B 36 21.441 0.943 -2.286 1.00 0.00 H new ATOM 1913 N GLY B 37 20.838 -0.919 -4.846 1.00 0.00 N ATOM 1914 CA GLY B 37 20.085 -2.161 -4.882 1.00 0.00 C ATOM 1915 C GLY B 37 19.263 -2.384 -3.626 1.00 0.00 C ATOM 1916 O GLY B 37 19.096 -3.523 -3.186 1.00 0.00 O ATOM 0 H GLY B 37 20.506 -0.200 -5.488 1.00 0.00 H new ATOM 0 HA2 GLY B 37 19.423 -2.155 -5.748 1.00 0.00 H new ATOM 0 HA3 GLY B 37 20.774 -2.995 -5.013 1.00 0.00 H new ATOM 1920 N ASN B 38 18.750 -1.299 -3.043 1.00 0.00 N ATOM 1921 CA ASN B 38 17.945 -1.391 -1.827 1.00 0.00 C ATOM 1922 C ASN B 38 16.489 -1.001 -2.089 1.00 0.00 C ATOM 1923 O ASN B 38 15.571 -1.611 -1.537 1.00 0.00 O ATOM 1924 CB ASN B 38 18.534 -0.503 -0.726 1.00 0.00 C ATOM 1925 CG ASN B 38 19.938 -0.919 -0.328 1.00 0.00 C ATOM 1926 OD1 ASN B 38 20.236 -2.108 -0.212 1.00 0.00 O ATOM 1927 ND2 ASN B 38 20.813 0.060 -0.114 1.00 0.00 N ATOM 0 H ASN B 38 18.878 -0.350 -3.393 1.00 0.00 H new ATOM 0 HA ASN B 38 17.964 -2.430 -1.497 1.00 0.00 H new ATOM 0 HB2 ASN B 38 18.549 0.532 -1.068 1.00 0.00 H new ATOM 0 HB3 ASN B 38 17.886 -0.539 0.150 1.00 0.00 H new ATOM 0 HD21 ASN B 38 21.771 -0.162 0.157 1.00 0.00 H new ATOM 0 HD22 ASN B 38 20.526 1.033 -0.221 1.00 0.00 H new ATOM 1934 N ILE B 39 16.282 0.013 -2.930 1.00 0.00 N ATOM 1935 CA ILE B 39 14.936 0.478 -3.258 1.00 0.00 C ATOM 1936 C ILE B 39 14.408 -0.205 -4.519 1.00 0.00 C ATOM 1937 O ILE B 39 15.122 -0.323 -5.517 1.00 0.00 O ATOM 1938 CB ILE B 39 14.897 2.008 -3.465 1.00 0.00 C ATOM 1939 CG1 ILE B 39 15.637 2.725 -2.332 1.00 0.00 C ATOM 1940 CG2 ILE B 39 13.457 2.498 -3.552 1.00 0.00 C ATOM 1941 CD1 ILE B 39 15.863 4.198 -2.591 1.00 0.00 C ATOM 0 H ILE B 39 17.030 0.527 -3.396 1.00 0.00 H new ATOM 0 HA ILE B 39 14.301 0.218 -2.411 1.00 0.00 H new ATOM 0 HB ILE B 39 15.399 2.239 -4.404 1.00 0.00 H new ATOM 0 HG12 ILE B 39 15.069 2.610 -1.409 1.00 0.00 H new ATOM 0 HG13 ILE B 39 16.601 2.240 -2.175 1.00 0.00 H new ATOM 0 HG21 ILE B 39 13.448 3.578 -3.698 1.00 0.00 H new ATOM 0 HG22 ILE B 39 12.958 2.014 -4.392 1.00 0.00 H new ATOM 0 HG23 ILE B 39 12.933 2.252 -2.628 1.00 0.00 H new ATOM 0 HD11 ILE B 39 16.392 4.639 -1.746 1.00 0.00 H new ATOM 0 HD12 ILE B 39 16.458 4.321 -3.496 1.00 0.00 H new ATOM 0 HD13 ILE B 39 14.902 4.697 -2.718 1.00 0.00 H new ATOM 1953 N GLN B 40 13.150 -0.648 -4.467 1.00 0.00 N ATOM 1954 CA GLN B 40 12.518 -1.315 -5.604 1.00 0.00 C ATOM 1955 C GLN B 40 11.174 -0.669 -5.936 1.00 0.00 C ATOM 1956 O GLN B 40 10.515 -0.102 -5.064 1.00 0.00 O ATOM 1957 CB GLN B 40 12.313 -2.802 -5.302 1.00 0.00 C ATOM 1958 CG GLN B 40 12.236 -3.673 -6.550 1.00 0.00 C ATOM 1959 CD GLN B 40 11.925 -5.123 -6.232 1.00 0.00 C ATOM 1960 OE1 GLN B 40 10.766 -5.493 -6.047 1.00 0.00 O ATOM 1961 NE2 GLN B 40 12.961 -5.955 -6.171 1.00 0.00 N ATOM 0 H GLN B 40 12.549 -0.556 -3.648 1.00 0.00 H new ATOM 0 HA GLN B 40 13.178 -1.210 -6.465 1.00 0.00 H new ATOM 0 HB2 GLN B 40 13.132 -3.153 -4.674 1.00 0.00 H new ATOM 0 HB3 GLN B 40 11.395 -2.924 -4.727 1.00 0.00 H new ATOM 0 HG2 GLN B 40 11.469 -3.279 -7.217 1.00 0.00 H new ATOM 0 HG3 GLN B 40 13.184 -3.618 -7.086 1.00 0.00 H new ATOM 0 HE21 GLN B 40 13.906 -5.606 -6.331 1.00 0.00 H new ATOM 0 HE22 GLN B 40 12.811 -6.942 -5.964 1.00 0.00 H new ATOM 1970 N GLU B 41 10.770 -0.766 -7.204 1.00 0.00 N ATOM 1971 CA GLU B 41 9.500 -0.199 -7.652 1.00 0.00 C ATOM 1972 C GLU B 41 8.328 -0.887 -6.956 1.00 0.00 C ATOM 1973 O GLU B 41 8.162 -2.104 -7.061 1.00 0.00 O ATOM 1974 CB GLU B 41 9.356 -0.341 -9.171 1.00 0.00 C ATOM 1975 CG GLU B 41 8.123 0.350 -9.740 1.00 0.00 C ATOM 1976 CD GLU B 41 6.897 -0.547 -9.771 1.00 0.00 C ATOM 1977 OE1 GLU B 41 7.027 -1.720 -10.183 1.00 0.00 O ATOM 1978 OE2 GLU B 41 5.807 -0.076 -9.384 1.00 0.00 O ATOM 0 H GLU B 41 11.305 -1.232 -7.937 1.00 0.00 H new ATOM 0 HA GLU B 41 9.491 0.859 -7.392 1.00 0.00 H new ATOM 0 HB2 GLU B 41 10.245 0.069 -9.651 1.00 0.00 H new ATOM 0 HB3 GLU B 41 9.317 -1.400 -9.425 1.00 0.00 H new ATOM 0 HG2 GLU B 41 7.903 1.236 -9.144 1.00 0.00 H new ATOM 0 HG3 GLU B 41 8.340 0.693 -10.752 1.00 0.00 H new ATOM 1985 N GLY B 42 7.521 -0.103 -6.242 1.00 0.00 N ATOM 1986 CA GLY B 42 6.379 -0.659 -5.537 1.00 0.00 C ATOM 1987 C GLY B 42 6.617 -0.817 -4.041 1.00 0.00 C ATOM 1988 O GLY B 42 5.664 -0.974 -3.276 1.00 0.00 O ATOM 0 H GLY B 42 7.638 0.905 -6.140 1.00 0.00 H new ATOM 0 HA2 GLY B 42 5.514 -0.015 -5.695 1.00 0.00 H new ATOM 0 HA3 GLY B 42 6.135 -1.632 -5.964 1.00 0.00 H new ATOM 1992 N ASP B 43 7.888 -0.776 -3.622 1.00 0.00 N ATOM 1993 CA ASP B 43 8.240 -0.917 -2.209 1.00 0.00 C ATOM 1994 C ASP B 43 7.468 0.085 -1.352 1.00 0.00 C ATOM 1995 O ASP B 43 7.543 1.296 -1.575 1.00 0.00 O ATOM 1996 CB ASP B 43 9.749 -0.723 -2.003 1.00 0.00 C ATOM 1997 CG ASP B 43 10.496 -2.032 -1.811 1.00 0.00 C ATOM 1998 OD1 ASP B 43 9.969 -2.926 -1.114 1.00 0.00 O ATOM 1999 OD2 ASP B 43 11.613 -2.160 -2.354 1.00 0.00 O ATOM 0 H ASP B 43 8.687 -0.646 -4.243 1.00 0.00 H new ATOM 0 HA ASP B 43 7.968 -1.926 -1.898 1.00 0.00 H new ATOM 0 HB2 ASP B 43 10.163 -0.198 -2.864 1.00 0.00 H new ATOM 0 HB3 ASP B 43 9.912 -0.087 -1.133 1.00 0.00 H new ATOM 2004 N VAL B 44 6.724 -0.428 -0.374 1.00 0.00 N ATOM 2005 CA VAL B 44 5.933 0.418 0.514 1.00 0.00 C ATOM 2006 C VAL B 44 6.791 0.957 1.660 1.00 0.00 C ATOM 2007 O VAL B 44 7.166 0.217 2.570 1.00 0.00 O ATOM 2008 CB VAL B 44 4.723 -0.346 1.096 1.00 0.00 C ATOM 2009 CG1 VAL B 44 3.819 0.596 1.878 1.00 0.00 C ATOM 2010 CG2 VAL B 44 3.940 -1.040 -0.010 1.00 0.00 C ATOM 0 H VAL B 44 6.653 -1.426 -0.177 1.00 0.00 H new ATOM 0 HA VAL B 44 5.564 1.252 -0.084 1.00 0.00 H new ATOM 0 HB VAL B 44 5.099 -1.108 1.779 1.00 0.00 H new ATOM 0 HG11 VAL B 44 2.973 0.038 2.280 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.381 1.043 2.698 1.00 0.00 H new ATOM 0 HG13 VAL B 44 3.454 1.383 1.217 1.00 0.00 H new ATOM 0 HG21 VAL B 44 3.093 -1.572 0.423 1.00 0.00 H new ATOM 0 HG22 VAL B 44 3.578 -0.297 -0.721 1.00 0.00 H new ATOM 0 HG23 VAL B 44 4.588 -1.749 -0.525 1.00 0.00 H new ATOM 2020 N VAL B 45 7.094 2.252 1.603 1.00 0.00 N ATOM 2021 CA VAL B 45 7.907 2.903 2.628 1.00 0.00 C ATOM 2022 C VAL B 45 7.094 3.160 3.895 1.00 0.00 C ATOM 2023 O VAL B 45 5.951 3.614 3.832 1.00 0.00 O ATOM 2024 CB VAL B 45 8.490 4.243 2.127 1.00 0.00 C ATOM 2025 CG1 VAL B 45 9.494 4.796 3.129 1.00 0.00 C ATOM 2026 CG2 VAL B 45 9.133 4.078 0.755 1.00 0.00 C ATOM 0 H VAL B 45 6.787 2.873 0.855 1.00 0.00 H new ATOM 0 HA VAL B 45 8.728 2.222 2.854 1.00 0.00 H new ATOM 0 HB VAL B 45 7.671 4.956 2.031 1.00 0.00 H new ATOM 0 HG11 VAL B 45 9.894 5.740 2.760 1.00 0.00 H new ATOM 0 HG12 VAL B 45 8.999 4.961 4.086 1.00 0.00 H new ATOM 0 HG13 VAL B 45 10.308 4.083 3.260 1.00 0.00 H new ATOM 0 HG21 VAL B 45 9.536 5.035 0.424 1.00 0.00 H new ATOM 0 HG22 VAL B 45 9.939 3.347 0.817 1.00 0.00 H new ATOM 0 HG23 VAL B 45 8.384 3.734 0.041 1.00 0.00 H new ATOM 2036 N LEU B 46 7.702 2.872 5.042 1.00 0.00 N ATOM 2037 CA LEU B 46 7.052 3.072 6.334 1.00 0.00 C ATOM 2038 C LEU B 46 7.704 4.223 7.102 1.00 0.00 C ATOM 2039 O LEU B 46 7.011 5.045 7.708 1.00 0.00 O ATOM 2040 CB LEU B 46 7.114 1.786 7.161 1.00 0.00 C ATOM 2041 CG LEU B 46 5.913 1.551 8.083 1.00 0.00 C ATOM 2042 CD1 LEU B 46 5.397 0.127 7.942 1.00 0.00 C ATOM 2043 CD2 LEU B 46 6.282 1.846 9.530 1.00 0.00 C ATOM 0 H LEU B 46 8.649 2.497 5.103 1.00 0.00 H new ATOM 0 HA LEU B 46 6.008 3.329 6.154 1.00 0.00 H new ATOM 0 HB2 LEU B 46 7.202 0.939 6.481 1.00 0.00 H new ATOM 0 HB3 LEU B 46 8.020 1.805 7.767 1.00 0.00 H new ATOM 0 HG LEU B 46 5.117 2.234 7.786 1.00 0.00 H new ATOM 0 HD11 LEU B 46 4.544 -0.018 8.605 1.00 0.00 H new ATOM 0 HD12 LEU B 46 5.089 -0.048 6.911 1.00 0.00 H new ATOM 0 HD13 LEU B 46 6.188 -0.575 8.208 1.00 0.00 H new ATOM 0 HD21 LEU B 46 5.416 1.673 10.169 1.00 0.00 H new ATOM 0 HD22 LEU B 46 7.097 1.191 9.838 1.00 0.00 H new ATOM 0 HD23 LEU B 46 6.598 2.885 9.620 1.00 0.00 H new ATOM 2055 N LYS B 47 9.040 4.278 7.074 1.00 0.00 N ATOM 2056 CA LYS B 47 9.779 5.330 7.772 1.00 0.00 C ATOM 2057 C LYS B 47 10.925 5.870 6.916 1.00 0.00 C ATOM 2058 O LYS B 47 11.490 5.150 6.091 1.00 0.00 O ATOM 2059 CB LYS B 47 10.333 4.809 9.102 1.00 0.00 C ATOM 2060 CG LYS B 47 9.260 4.376 10.092 1.00 0.00 C ATOM 2061 CD LYS B 47 9.497 2.959 10.590 1.00 0.00 C ATOM 2062 CE LYS B 47 10.574 2.913 11.666 1.00 0.00 C ATOM 2063 NZ LYS B 47 9.996 2.855 13.039 1.00 0.00 N ATOM 0 H LYS B 47 9.628 3.608 6.577 1.00 0.00 H new ATOM 0 HA LYS B 47 9.080 6.144 7.967 1.00 0.00 H new ATOM 0 HB2 LYS B 47 10.992 3.964 8.903 1.00 0.00 H new ATOM 0 HB3 LYS B 47 10.943 5.588 9.560 1.00 0.00 H new ATOM 0 HG2 LYS B 47 9.247 5.062 10.939 1.00 0.00 H new ATOM 0 HG3 LYS B 47 8.281 4.436 9.617 1.00 0.00 H new ATOM 0 HD2 LYS B 47 8.567 2.553 10.988 1.00 0.00 H new ATOM 0 HD3 LYS B 47 9.790 2.324 9.754 1.00 0.00 H new ATOM 0 HE2 LYS B 47 11.210 2.043 11.504 1.00 0.00 H new ATOM 0 HE3 LYS B 47 11.211 3.793 11.578 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 10.765 2.825 13.738 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 9.410 3.698 13.205 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 9.409 2.001 13.133 1.00 0.00 H new ATOM 2077 N ILE B 48 11.268 7.140 7.132 1.00 0.00 N ATOM 2078 CA ILE B 48 12.352 7.791 6.401 1.00 0.00 C ATOM 2079 C ILE B 48 13.270 8.537 7.367 1.00 0.00 C ATOM 2080 O ILE B 48 12.824 9.416 8.107 1.00 0.00 O ATOM 2081 CB ILE B 48 11.816 8.782 5.343 1.00 0.00 C ATOM 2082 CG1 ILE B 48 10.753 8.114 4.466 1.00 0.00 C ATOM 2083 CG2 ILE B 48 12.955 9.319 4.483 1.00 0.00 C ATOM 2084 CD1 ILE B 48 9.855 9.099 3.751 1.00 0.00 C ATOM 0 H ILE B 48 10.805 7.742 7.814 1.00 0.00 H new ATOM 0 HA ILE B 48 12.910 7.008 5.888 1.00 0.00 H new ATOM 0 HB ILE B 48 11.354 9.620 5.865 1.00 0.00 H new ATOM 0 HG12 ILE B 48 11.247 7.482 3.728 1.00 0.00 H new ATOM 0 HG13 ILE B 48 10.140 7.460 5.086 1.00 0.00 H new ATOM 0 HG21 ILE B 48 12.557 10.015 3.745 1.00 0.00 H new ATOM 0 HG22 ILE B 48 13.677 9.836 5.116 1.00 0.00 H new ATOM 0 HG23 ILE B 48 13.447 8.491 3.973 1.00 0.00 H new ATOM 0 HD11 ILE B 48 9.127 8.556 3.149 1.00 0.00 H new ATOM 0 HD12 ILE B 48 9.333 9.714 4.484 1.00 0.00 H new ATOM 0 HD13 ILE B 48 10.457 9.737 3.104 1.00 0.00 H new ATOM 2096 N ASN B 49 14.551 8.171 7.361 1.00 0.00 N ATOM 2097 CA ASN B 49 15.542 8.790 8.241 1.00 0.00 C ATOM 2098 C ASN B 49 15.148 8.627 9.713 1.00 0.00 C ATOM 2099 O ASN B 49 15.417 9.501 10.538 1.00 0.00 O ATOM 2100 CB ASN B 49 15.716 10.275 7.897 1.00 0.00 C ATOM 2101 CG ASN B 49 17.167 10.720 7.960 1.00 0.00 C ATOM 2102 OD1 ASN B 49 17.977 10.140 8.684 1.00 0.00 O ATOM 2103 ND2 ASN B 49 17.508 11.756 7.198 1.00 0.00 N ATOM 0 H ASN B 49 14.929 7.445 6.753 1.00 0.00 H new ATOM 0 HA ASN B 49 16.494 8.282 8.085 1.00 0.00 H new ATOM 0 HB2 ASN B 49 15.325 10.461 6.897 1.00 0.00 H new ATOM 0 HB3 ASN B 49 15.124 10.876 8.587 1.00 0.00 H new ATOM 0 HD21 ASN B 49 18.470 12.096 7.200 1.00 0.00 H new ATOM 0 HD22 ASN B 49 16.808 12.210 6.612 1.00 0.00 H new ATOM 2110 N GLY B 50 14.508 7.500 10.033 1.00 0.00 N ATOM 2111 CA GLY B 50 14.087 7.242 11.400 1.00 0.00 C ATOM 2112 C GLY B 50 12.822 8.000 11.780 1.00 0.00 C ATOM 2113 O GLY B 50 12.666 8.413 12.930 1.00 0.00 O ATOM 0 H GLY B 50 14.275 6.763 9.368 1.00 0.00 H new ATOM 0 HA2 GLY B 50 13.917 6.173 11.527 1.00 0.00 H new ATOM 0 HA3 GLY B 50 14.891 7.520 12.082 1.00 0.00 H new ATOM 2117 N THR B 51 11.918 8.185 10.814 1.00 0.00 N ATOM 2118 CA THR B 51 10.667 8.902 11.059 1.00 0.00 C ATOM 2119 C THR B 51 9.530 8.319 10.222 1.00 0.00 C ATOM 2120 O THR B 51 9.682 8.110 9.018 1.00 0.00 O ATOM 2121 CB THR B 51 10.831 10.395 10.744 1.00 0.00 C ATOM 2122 OG1 THR B 51 12.144 10.837 11.050 1.00 0.00 O ATOM 2123 CG2 THR B 51 9.868 11.281 11.504 1.00 0.00 C ATOM 0 H THR B 51 12.030 7.848 9.858 1.00 0.00 H new ATOM 0 HA THR B 51 10.417 8.786 12.114 1.00 0.00 H new ATOM 0 HB THR B 51 10.621 10.483 9.678 1.00 0.00 H new ATOM 0 HG1 THR B 51 12.225 11.791 10.840 1.00 0.00 H new ATOM 0 HG21 THR B 51 10.040 12.323 11.233 1.00 0.00 H new ATOM 0 HG22 THR B 51 8.844 11.005 11.252 1.00 0.00 H new ATOM 0 HG23 THR B 51 10.025 11.154 12.575 1.00 0.00 H new ATOM 2131 N VAL B 52 8.391 8.064 10.869 1.00 0.00 N ATOM 2132 CA VAL B 52 7.222 7.509 10.183 1.00 0.00 C ATOM 2133 C VAL B 52 6.684 8.492 9.144 1.00 0.00 C ATOM 2134 O VAL B 52 6.753 9.706 9.337 1.00 0.00 O ATOM 2135 CB VAL B 52 6.090 7.155 11.176 1.00 0.00 C ATOM 2136 CG1 VAL B 52 4.986 6.367 10.479 1.00 0.00 C ATOM 2137 CG2 VAL B 52 6.635 6.373 12.363 1.00 0.00 C ATOM 0 H VAL B 52 8.253 8.233 11.865 1.00 0.00 H new ATOM 0 HA VAL B 52 7.551 6.596 9.687 1.00 0.00 H new ATOM 0 HB VAL B 52 5.664 8.087 11.547 1.00 0.00 H new ATOM 0 HG11 VAL B 52 4.201 6.129 11.196 1.00 0.00 H new ATOM 0 HG12 VAL B 52 4.568 6.965 9.669 1.00 0.00 H new ATOM 0 HG13 VAL B 52 5.399 5.443 10.073 1.00 0.00 H new ATOM 0 HG21 VAL B 52 5.820 6.136 13.047 1.00 0.00 H new ATOM 0 HG22 VAL B 52 7.094 5.449 12.010 1.00 0.00 H new ATOM 0 HG23 VAL B 52 7.382 6.974 12.882 1.00 0.00 H new ATOM 2147 N THR B 53 6.156 7.962 8.041 1.00 0.00 N ATOM 2148 CA THR B 53 5.611 8.798 6.972 1.00 0.00 C ATOM 2149 C THR B 53 4.190 8.366 6.588 1.00 0.00 C ATOM 2150 O THR B 53 3.734 8.630 5.475 1.00 0.00 O ATOM 2151 CB THR B 53 6.533 8.747 5.745 1.00 0.00 C ATOM 2152 OG1 THR B 53 7.895 8.682 6.138 1.00 0.00 O ATOM 2153 CG2 THR B 53 6.381 9.941 4.826 1.00 0.00 C ATOM 0 H THR B 53 6.094 6.959 7.865 1.00 0.00 H new ATOM 0 HA THR B 53 5.557 9.823 7.340 1.00 0.00 H new ATOM 0 HB THR B 53 6.234 7.850 5.203 1.00 0.00 H new ATOM 0 HG1 THR B 53 8.208 7.755 6.080 1.00 0.00 H new ATOM 0 HG21 THR B 53 7.062 9.839 3.981 1.00 0.00 H new ATOM 0 HG22 THR B 53 5.355 9.991 4.461 1.00 0.00 H new ATOM 0 HG23 THR B 53 6.617 10.854 5.373 1.00 0.00 H new ATOM 2161 N GLU B 54 3.488 7.719 7.522 1.00 0.00 N ATOM 2162 CA GLU B 54 2.122 7.272 7.284 1.00 0.00 C ATOM 2163 C GLU B 54 1.129 8.325 7.767 1.00 0.00 C ATOM 2164 O GLU B 54 1.373 9.011 8.761 1.00 0.00 O ATOM 2165 CB GLU B 54 1.865 5.939 7.992 1.00 0.00 C ATOM 2166 CG GLU B 54 0.958 4.994 7.219 1.00 0.00 C ATOM 2167 CD GLU B 54 1.211 3.538 7.564 1.00 0.00 C ATOM 2168 OE1 GLU B 54 2.260 3.002 7.146 1.00 0.00 O ATOM 2169 OE2 GLU B 54 0.361 2.935 8.251 1.00 0.00 O ATOM 0 H GLU B 54 3.848 7.495 8.450 1.00 0.00 H new ATOM 0 HA GLU B 54 1.987 7.128 6.212 1.00 0.00 H new ATOM 0 HB2 GLU B 54 2.820 5.445 8.172 1.00 0.00 H new ATOM 0 HB3 GLU B 54 1.420 6.137 8.967 1.00 0.00 H new ATOM 0 HG2 GLU B 54 -0.083 5.239 7.431 1.00 0.00 H new ATOM 0 HG3 GLU B 54 1.109 5.143 6.150 1.00 0.00 H new ATOM 2176 N ASN B 55 0.013 8.443 7.051 1.00 0.00 N ATOM 2177 CA ASN B 55 -1.039 9.408 7.381 1.00 0.00 C ATOM 2178 C ASN B 55 -0.569 10.862 7.211 1.00 0.00 C ATOM 2179 O ASN B 55 -1.282 11.793 7.593 1.00 0.00 O ATOM 2180 CB ASN B 55 -1.545 9.194 8.812 1.00 0.00 C ATOM 2181 CG ASN B 55 -1.920 7.748 9.100 1.00 0.00 C ATOM 2182 OD1 ASN B 55 -1.127 6.832 8.886 1.00 0.00 O ATOM 2183 ND2 ASN B 55 -3.135 7.536 9.595 1.00 0.00 N ATOM 0 H ASN B 55 -0.189 7.875 6.228 1.00 0.00 H new ATOM 0 HA ASN B 55 -1.854 9.235 6.678 1.00 0.00 H new ATOM 0 HB2 ASN B 55 -0.775 9.511 9.515 1.00 0.00 H new ATOM 0 HB3 ASN B 55 -2.414 9.830 8.983 1.00 0.00 H new ATOM 0 HD21 ASN B 55 -3.439 6.587 9.812 1.00 0.00 H new ATOM 0 HD22 ASN B 55 -3.764 8.323 9.758 1.00 0.00 H new ATOM 2190 N MET B 56 0.624 11.061 6.638 1.00 0.00 N ATOM 2191 CA MET B 56 1.158 12.404 6.430 1.00 0.00 C ATOM 2192 C MET B 56 1.043 12.819 4.963 1.00 0.00 C ATOM 2193 O MET B 56 0.764 11.992 4.093 1.00 0.00 O ATOM 2194 CB MET B 56 2.623 12.461 6.876 1.00 0.00 C ATOM 2195 CG MET B 56 2.860 13.347 8.090 1.00 0.00 C ATOM 2196 SD MET B 56 3.031 12.404 9.618 1.00 0.00 S ATOM 2197 CE MET B 56 4.378 11.302 9.194 1.00 0.00 C ATOM 0 H MET B 56 1.233 10.310 6.313 1.00 0.00 H new ATOM 0 HA MET B 56 0.571 13.100 7.029 1.00 0.00 H new ATOM 0 HB2 MET B 56 2.964 11.451 7.103 1.00 0.00 H new ATOM 0 HB3 MET B 56 3.232 12.824 6.048 1.00 0.00 H new ATOM 0 HG2 MET B 56 3.761 13.940 7.931 1.00 0.00 H new ATOM 0 HG3 MET B 56 2.031 14.047 8.191 1.00 0.00 H new ATOM 0 HE1 MET B 56 5.016 11.156 10.065 1.00 0.00 H new ATOM 0 HE2 MET B 56 3.975 10.341 8.874 1.00 0.00 H new ATOM 0 HE3 MET B 56 4.964 11.738 8.384 1.00 0.00 H new ATOM 2207 N SER B 57 1.266 14.105 4.696 1.00 0.00 N ATOM 2208 CA SER B 57 1.195 14.628 3.335 1.00 0.00 C ATOM 2209 C SER B 57 2.426 14.212 2.534 1.00 0.00 C ATOM 2210 O SER B 57 3.525 14.108 3.081 1.00 0.00 O ATOM 2211 CB SER B 57 1.071 16.156 3.359 1.00 0.00 C ATOM 2212 OG SER B 57 2.311 16.770 3.673 1.00 0.00 O ATOM 0 H SER B 57 1.497 14.802 5.404 1.00 0.00 H new ATOM 0 HA SER B 57 0.312 14.211 2.852 1.00 0.00 H new ATOM 0 HB2 SER B 57 0.723 16.510 2.388 1.00 0.00 H new ATOM 0 HB3 SER B 57 0.321 16.450 4.093 1.00 0.00 H new ATOM 0 HG SER B 57 2.202 17.744 3.679 1.00 0.00 H new ATOM 2218 N LEU B 58 2.240 13.980 1.234 1.00 0.00 N ATOM 2219 CA LEU B 58 3.345 13.581 0.360 1.00 0.00 C ATOM 2220 C LEU B 58 4.472 14.613 0.409 1.00 0.00 C ATOM 2221 O LEU B 58 5.646 14.267 0.265 1.00 0.00 O ATOM 2222 CB LEU B 58 2.859 13.410 -1.081 1.00 0.00 C ATOM 2223 CG LEU B 58 3.843 12.694 -2.014 1.00 0.00 C ATOM 2224 CD1 LEU B 58 3.699 11.187 -1.883 1.00 0.00 C ATOM 2225 CD2 LEU B 58 3.629 13.131 -3.456 1.00 0.00 C ATOM 0 H LEU B 58 1.338 14.061 0.764 1.00 0.00 H new ATOM 0 HA LEU B 58 3.728 12.625 0.718 1.00 0.00 H new ATOM 0 HB2 LEU B 58 1.922 12.854 -1.069 1.00 0.00 H new ATOM 0 HB3 LEU B 58 2.640 14.395 -1.494 1.00 0.00 H new ATOM 0 HG LEU B 58 4.857 12.969 -1.722 1.00 0.00 H new ATOM 0 HD11 LEU B 58 4.405 10.695 -2.552 1.00 0.00 H new ATOM 0 HD12 LEU B 58 3.906 10.890 -0.855 1.00 0.00 H new ATOM 0 HD13 LEU B 58 2.683 10.894 -2.148 1.00 0.00 H new ATOM 0 HD21 LEU B 58 4.337 12.612 -4.102 1.00 0.00 H new ATOM 0 HD22 LEU B 58 2.612 12.888 -3.763 1.00 0.00 H new ATOM 0 HD23 LEU B 58 3.785 14.207 -3.537 1.00 0.00 H new ATOM 2237 N THR B 59 4.102 15.879 0.619 1.00 0.00 N ATOM 2238 CA THR B 59 5.075 16.968 0.698 1.00 0.00 C ATOM 2239 C THR B 59 6.057 16.732 1.847 1.00 0.00 C ATOM 2240 O THR B 59 7.250 17.009 1.717 1.00 0.00 O ATOM 2241 CB THR B 59 4.364 18.314 0.893 1.00 0.00 C ATOM 2242 OG1 THR B 59 3.013 18.249 0.461 1.00 0.00 O ATOM 2243 CG2 THR B 59 5.028 19.458 0.153 1.00 0.00 C ATOM 0 H THR B 59 3.133 16.174 0.737 1.00 0.00 H new ATOM 0 HA THR B 59 5.629 16.993 -0.240 1.00 0.00 H new ATOM 0 HB THR B 59 4.422 18.510 1.964 1.00 0.00 H new ATOM 0 HG1 THR B 59 2.583 19.119 0.598 1.00 0.00 H new ATOM 0 HG21 THR B 59 4.474 20.379 0.335 1.00 0.00 H new ATOM 0 HG22 THR B 59 6.052 19.575 0.507 1.00 0.00 H new ATOM 0 HG23 THR B 59 5.036 19.244 -0.916 1.00 0.00 H new ATOM 2251 N ASP B 60 5.544 16.216 2.966 1.00 0.00 N ATOM 2252 CA ASP B 60 6.375 15.937 4.136 1.00 0.00 C ATOM 2253 C ASP B 60 7.471 14.929 3.795 1.00 0.00 C ATOM 2254 O ASP B 60 8.626 15.104 4.183 1.00 0.00 O ATOM 2255 CB ASP B 60 5.518 15.408 5.291 1.00 0.00 C ATOM 2256 CG ASP B 60 6.247 15.447 6.621 1.00 0.00 C ATOM 2257 OD1 ASP B 60 6.846 16.496 6.943 1.00 0.00 O ATOM 2258 OD2 ASP B 60 6.215 14.429 7.343 1.00 0.00 O ATOM 0 H ASP B 60 4.558 15.984 3.085 1.00 0.00 H new ATOM 0 HA ASP B 60 6.845 16.870 4.445 1.00 0.00 H new ATOM 0 HB2 ASP B 60 4.606 16.000 5.363 1.00 0.00 H new ATOM 0 HB3 ASP B 60 5.217 14.383 5.076 1.00 0.00 H new ATOM 2263 N ALA B 61 7.103 13.882 3.053 1.00 0.00 N ATOM 2264 CA ALA B 61 8.062 12.857 2.647 1.00 0.00 C ATOM 2265 C ALA B 61 9.179 13.469 1.803 1.00 0.00 C ATOM 2266 O ALA B 61 10.338 13.072 1.908 1.00 0.00 O ATOM 2267 CB ALA B 61 7.367 11.745 1.872 1.00 0.00 C ATOM 0 H ALA B 61 6.151 13.724 2.723 1.00 0.00 H new ATOM 0 HA ALA B 61 8.501 12.429 3.548 1.00 0.00 H new ATOM 0 HB1 ALA B 61 8.099 10.993 1.579 1.00 0.00 H new ATOM 0 HB2 ALA B 61 6.605 11.284 2.501 1.00 0.00 H new ATOM 0 HB3 ALA B 61 6.898 12.161 0.980 1.00 0.00 H new ATOM 2273 N LYS B 62 8.814 14.448 0.972 1.00 0.00 N ATOM 2274 CA LYS B 62 9.777 15.131 0.112 1.00 0.00 C ATOM 2275 C LYS B 62 10.749 15.973 0.938 1.00 0.00 C ATOM 2276 O LYS B 62 11.913 16.125 0.567 1.00 0.00 O ATOM 2277 CB LYS B 62 9.051 16.023 -0.902 1.00 0.00 C ATOM 2278 CG LYS B 62 7.944 15.311 -1.666 1.00 0.00 C ATOM 2279 CD LYS B 62 7.756 15.894 -3.059 1.00 0.00 C ATOM 2280 CE LYS B 62 6.576 16.851 -3.108 1.00 0.00 C ATOM 2281 NZ LYS B 62 7.002 18.275 -2.985 1.00 0.00 N ATOM 0 H LYS B 62 7.856 14.785 0.878 1.00 0.00 H new ATOM 0 HA LYS B 62 10.345 14.370 -0.423 1.00 0.00 H new ATOM 0 HB2 LYS B 62 8.626 16.880 -0.379 1.00 0.00 H new ATOM 0 HB3 LYS B 62 9.778 16.413 -1.614 1.00 0.00 H new ATOM 0 HG2 LYS B 62 8.181 14.250 -1.745 1.00 0.00 H new ATOM 0 HG3 LYS B 62 7.010 15.389 -1.110 1.00 0.00 H new ATOM 0 HD2 LYS B 62 8.663 16.418 -3.361 1.00 0.00 H new ATOM 0 HD3 LYS B 62 7.601 15.087 -3.775 1.00 0.00 H new ATOM 0 HE2 LYS B 62 6.038 16.714 -4.046 1.00 0.00 H new ATOM 0 HE3 LYS B 62 5.881 16.610 -2.303 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 6.166 18.892 -3.023 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.493 18.413 -2.079 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 7.645 18.514 -3.767 1.00 0.00 H new ATOM 2295 N THR B 63 10.266 16.518 2.058 1.00 0.00 N ATOM 2296 CA THR B 63 11.100 17.343 2.933 1.00 0.00 C ATOM 2297 C THR B 63 12.307 16.555 3.441 1.00 0.00 C ATOM 2298 O THR B 63 13.435 17.046 3.399 1.00 0.00 O ATOM 2299 CB THR B 63 10.292 17.866 4.122 1.00 0.00 C ATOM 2300 OG1 THR B 63 8.907 17.925 3.821 1.00 0.00 O ATOM 2301 CG2 THR B 63 10.720 19.245 4.577 1.00 0.00 C ATOM 0 H THR B 63 9.305 16.403 2.379 1.00 0.00 H new ATOM 0 HA THR B 63 11.454 18.190 2.345 1.00 0.00 H new ATOM 0 HB THR B 63 10.485 17.154 4.925 1.00 0.00 H new ATOM 0 HG1 THR B 63 8.438 18.406 4.534 1.00 0.00 H new ATOM 0 HG21 THR B 63 10.107 19.556 5.423 1.00 0.00 H new ATOM 0 HG22 THR B 63 11.767 19.220 4.878 1.00 0.00 H new ATOM 0 HG23 THR B 63 10.594 19.954 3.758 1.00 0.00 H new ATOM 2309 N LEU B 64 12.068 15.329 3.914 1.00 0.00 N ATOM 2310 CA LEU B 64 13.150 14.480 4.416 1.00 0.00 C ATOM 2311 C LEU B 64 14.191 14.242 3.324 1.00 0.00 C ATOM 2312 O LEU B 64 15.389 14.171 3.601 1.00 0.00 O ATOM 2313 CB LEU B 64 12.599 13.142 4.918 1.00 0.00 C ATOM 2314 CG LEU B 64 12.219 13.110 6.402 1.00 0.00 C ATOM 2315 CD1 LEU B 64 11.199 12.012 6.671 1.00 0.00 C ATOM 2316 CD2 LEU B 64 13.457 12.915 7.267 1.00 0.00 C ATOM 0 H LEU B 64 11.141 14.905 3.960 1.00 0.00 H new ATOM 0 HA LEU B 64 13.627 14.994 5.251 1.00 0.00 H new ATOM 0 HB2 LEU B 64 11.719 12.885 4.328 1.00 0.00 H new ATOM 0 HB3 LEU B 64 13.344 12.368 4.733 1.00 0.00 H new ATOM 0 HG LEU B 64 11.767 14.067 6.661 1.00 0.00 H new ATOM 0 HD11 LEU B 64 10.942 12.006 7.730 1.00 0.00 H new ATOM 0 HD12 LEU B 64 10.301 12.197 6.081 1.00 0.00 H new ATOM 0 HD13 LEU B 64 11.622 11.046 6.395 1.00 0.00 H new ATOM 0 HD21 LEU B 64 13.167 12.895 8.318 1.00 0.00 H new ATOM 0 HD22 LEU B 64 13.939 11.973 7.005 1.00 0.00 H new ATOM 0 HD23 LEU B 64 14.152 13.737 7.098 1.00 0.00 H new ATOM 2328 N ILE B 65 13.722 14.138 2.080 1.00 0.00 N ATOM 2329 CA ILE B 65 14.608 13.928 0.941 1.00 0.00 C ATOM 2330 C ILE B 65 15.349 15.221 0.587 1.00 0.00 C ATOM 2331 O ILE B 65 16.458 15.180 0.052 1.00 0.00 O ATOM 2332 CB ILE B 65 13.836 13.422 -0.300 1.00 0.00 C ATOM 2333 CG1 ILE B 65 12.932 12.240 0.072 1.00 0.00 C ATOM 2334 CG2 ILE B 65 14.808 13.021 -1.402 1.00 0.00 C ATOM 2335 CD1 ILE B 65 11.934 11.871 -1.005 1.00 0.00 C ATOM 0 H ILE B 65 12.733 14.196 1.838 1.00 0.00 H new ATOM 0 HA ILE B 65 15.328 13.164 1.233 1.00 0.00 H new ATOM 0 HB ILE B 65 13.207 14.233 -0.669 1.00 0.00 H new ATOM 0 HG12 ILE B 65 13.555 11.373 0.289 1.00 0.00 H new ATOM 0 HG13 ILE B 65 12.392 12.482 0.987 1.00 0.00 H new ATOM 0 HG21 ILE B 65 14.250 12.667 -2.269 1.00 0.00 H new ATOM 0 HG22 ILE B 65 15.411 13.883 -1.686 1.00 0.00 H new ATOM 0 HG23 ILE B 65 15.460 12.225 -1.041 1.00 0.00 H new ATOM 0 HD11 ILE B 65 11.331 11.027 -0.669 1.00 0.00 H new ATOM 0 HD12 ILE B 65 11.285 12.723 -1.207 1.00 0.00 H new ATOM 0 HD13 ILE B 65 12.466 11.596 -1.916 1.00 0.00 H new ATOM 2347 N GLU B 66 14.736 16.369 0.892 1.00 0.00 N ATOM 2348 CA GLU B 66 15.354 17.665 0.611 1.00 0.00 C ATOM 2349 C GLU B 66 16.408 18.005 1.664 1.00 0.00 C ATOM 2350 O GLU B 66 17.466 18.543 1.345 1.00 0.00 O ATOM 2351 CB GLU B 66 14.293 18.767 0.559 1.00 0.00 C ATOM 2352 CG GLU B 66 14.202 19.467 -0.789 1.00 0.00 C ATOM 2353 CD GLU B 66 14.361 20.973 -0.682 1.00 0.00 C ATOM 2354 OE1 GLU B 66 15.365 21.427 -0.093 1.00 0.00 O ATOM 2355 OE2 GLU B 66 13.479 21.698 -1.189 1.00 0.00 O ATOM 0 H GLU B 66 13.817 16.426 1.331 1.00 0.00 H new ATOM 0 HA GLU B 66 15.843 17.600 -0.361 1.00 0.00 H new ATOM 0 HB2 GLU B 66 13.322 18.335 0.800 1.00 0.00 H new ATOM 0 HB3 GLU B 66 14.513 19.507 1.328 1.00 0.00 H new ATOM 0 HG2 GLU B 66 14.972 19.071 -1.451 1.00 0.00 H new ATOM 0 HG3 GLU B 66 13.239 19.240 -1.247 1.00 0.00 H new ATOM 2362 N ARG B 67 16.104 17.687 2.922 1.00 0.00 N ATOM 2363 CA ARG B 67 17.017 17.955 4.032 1.00 0.00 C ATOM 2364 C ARG B 67 18.092 16.868 4.170 1.00 0.00 C ATOM 2365 O ARG B 67 18.981 16.981 5.019 1.00 0.00 O ATOM 2366 CB ARG B 67 16.228 18.068 5.339 1.00 0.00 C ATOM 2367 CG ARG B 67 16.912 18.919 6.397 1.00 0.00 C ATOM 2368 CD ARG B 67 16.527 18.480 7.802 1.00 0.00 C ATOM 2369 NE ARG B 67 17.237 17.269 8.213 1.00 0.00 N ATOM 2370 CZ ARG B 67 16.734 16.034 8.133 1.00 0.00 C ATOM 2371 NH1 ARG B 67 15.506 15.828 7.659 1.00 0.00 N ATOM 2372 NH2 ARG B 67 17.462 14.994 8.528 1.00 0.00 N ATOM 0 H ARG B 67 15.229 17.242 3.198 1.00 0.00 H new ATOM 0 HA ARG B 67 17.523 18.897 3.820 1.00 0.00 H new ATOM 0 HB2 ARG B 67 15.247 18.491 5.125 1.00 0.00 H new ATOM 0 HB3 ARG B 67 16.063 17.068 5.741 1.00 0.00 H new ATOM 0 HG2 ARG B 67 17.993 18.851 6.277 1.00 0.00 H new ATOM 0 HG3 ARG B 67 16.641 19.965 6.255 1.00 0.00 H new ATOM 0 HD2 ARG B 67 16.745 19.284 8.505 1.00 0.00 H new ATOM 0 HD3 ARG B 67 15.452 18.302 7.844 1.00 0.00 H new ATOM 0 HE ARG B 67 18.180 17.375 8.586 1.00 0.00 H new ATOM 0 HH11 ARG B 67 14.939 16.618 7.352 1.00 0.00 H new ATOM 0 HH12 ARG B 67 15.133 14.880 7.603 1.00 0.00 H new ATOM 0 HH21 ARG B 67 18.404 15.139 8.892 1.00 0.00 H new ATOM 0 HH22 ARG B 67 17.079 14.051 8.467 1.00 0.00 H new ATOM 2386 N SER B 68 18.010 15.817 3.347 1.00 0.00 N ATOM 2387 CA SER B 68 18.982 14.726 3.401 1.00 0.00 C ATOM 2388 C SER B 68 20.410 15.248 3.234 1.00 0.00 C ATOM 2389 O SER B 68 20.778 15.756 2.173 1.00 0.00 O ATOM 2390 CB SER B 68 18.675 13.680 2.326 1.00 0.00 C ATOM 2391 OG SER B 68 18.774 14.235 1.024 1.00 0.00 O ATOM 0 H SER B 68 17.284 15.701 2.640 1.00 0.00 H new ATOM 0 HA SER B 68 18.903 14.258 4.382 1.00 0.00 H new ATOM 0 HB2 SER B 68 19.368 12.844 2.421 1.00 0.00 H new ATOM 0 HB3 SER B 68 17.672 13.282 2.479 1.00 0.00 H new ATOM 0 HG SER B 68 17.986 14.790 0.844 1.00 0.00 H new ATOM 2397 N LYS B 69 21.207 15.120 4.294 1.00 0.00 N ATOM 2398 CA LYS B 69 22.594 15.578 4.278 1.00 0.00 C ATOM 2399 C LYS B 69 23.522 14.509 3.696 1.00 0.00 C ATOM 2400 O LYS B 69 24.389 13.973 4.393 1.00 0.00 O ATOM 2401 CB LYS B 69 23.039 15.954 5.695 1.00 0.00 C ATOM 2402 CG LYS B 69 22.487 17.288 6.173 1.00 0.00 C ATOM 2403 CD LYS B 69 22.362 17.328 7.688 1.00 0.00 C ATOM 2404 CE LYS B 69 20.941 17.025 8.140 1.00 0.00 C ATOM 2405 NZ LYS B 69 20.526 17.882 9.287 1.00 0.00 N ATOM 0 H LYS B 69 20.914 14.701 5.177 1.00 0.00 H new ATOM 0 HA LYS B 69 22.655 16.459 3.639 1.00 0.00 H new ATOM 0 HB2 LYS B 69 22.724 15.172 6.385 1.00 0.00 H new ATOM 0 HB3 LYS B 69 24.128 15.988 5.728 1.00 0.00 H new ATOM 0 HG2 LYS B 69 23.140 18.094 5.839 1.00 0.00 H new ATOM 0 HG3 LYS B 69 21.510 17.462 5.721 1.00 0.00 H new ATOM 0 HD2 LYS B 69 23.047 16.604 8.130 1.00 0.00 H new ATOM 0 HD3 LYS B 69 22.659 18.311 8.052 1.00 0.00 H new ATOM 0 HE2 LYS B 69 20.255 17.177 7.307 1.00 0.00 H new ATOM 0 HE3 LYS B 69 20.867 15.976 8.426 1.00 0.00 H new ATOM 0 HZ1 LYS B 69 19.744 17.424 9.798 1.00 0.00 H new ATOM 0 HZ2 LYS B 69 21.331 18.013 9.932 1.00 0.00 H new ATOM 0 HZ3 LYS B 69 20.212 18.808 8.933 1.00 0.00 H new ATOM 2419 N GLY B 70 23.335 14.203 2.410 1.00 0.00 N ATOM 2420 CA GLY B 70 24.158 13.205 1.748 1.00 0.00 C ATOM 2421 C GLY B 70 23.622 11.796 1.917 1.00 0.00 C ATOM 2422 O GLY B 70 23.223 11.160 0.942 1.00 0.00 O ATOM 0 H GLY B 70 22.625 14.631 1.816 1.00 0.00 H new ATOM 0 HA2 GLY B 70 24.222 13.440 0.685 1.00 0.00 H new ATOM 0 HA3 GLY B 70 25.171 13.254 2.147 1.00 0.00 H new ATOM 2426 N LYS B 71 23.621 11.305 3.153 1.00 0.00 N ATOM 2427 CA LYS B 71 23.139 9.956 3.443 1.00 0.00 C ATOM 2428 C LYS B 71 21.640 9.944 3.748 1.00 0.00 C ATOM 2429 O LYS B 71 21.186 10.554 4.718 1.00 0.00 O ATOM 2430 CB LYS B 71 23.923 9.342 4.610 1.00 0.00 C ATOM 2431 CG LYS B 71 24.003 10.232 5.843 1.00 0.00 C ATOM 2432 CD LYS B 71 24.536 9.467 7.043 1.00 0.00 C ATOM 2433 CE LYS B 71 25.009 10.405 8.143 1.00 0.00 C ATOM 2434 NZ LYS B 71 24.701 9.872 9.501 1.00 0.00 N ATOM 0 H LYS B 71 23.948 11.820 3.970 1.00 0.00 H new ATOM 0 HA LYS B 71 23.302 9.352 2.550 1.00 0.00 H new ATOM 0 HB2 LYS B 71 23.458 8.396 4.888 1.00 0.00 H new ATOM 0 HB3 LYS B 71 24.934 9.114 4.274 1.00 0.00 H new ATOM 0 HG2 LYS B 71 24.649 11.085 5.637 1.00 0.00 H new ATOM 0 HG3 LYS B 71 23.014 10.629 6.072 1.00 0.00 H new ATOM 0 HD2 LYS B 71 23.756 8.813 7.433 1.00 0.00 H new ATOM 0 HD3 LYS B 71 25.362 8.828 6.730 1.00 0.00 H new ATOM 0 HE2 LYS B 71 26.084 10.561 8.050 1.00 0.00 H new ATOM 0 HE3 LYS B 71 24.534 11.378 8.019 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 25.040 10.541 10.222 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 23.673 9.747 9.600 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 25.175 8.955 9.630 1.00 0.00 H new ATOM 2448 N LEU B 72 20.879 9.235 2.912 1.00 0.00 N ATOM 2449 CA LEU B 72 19.429 9.125 3.083 1.00 0.00 C ATOM 2450 C LEU B 72 19.049 7.770 3.678 1.00 0.00 C ATOM 2451 O LEU B 72 19.696 6.756 3.406 1.00 0.00 O ATOM 2452 CB LEU B 72 18.714 9.308 1.739 1.00 0.00 C ATOM 2453 CG LEU B 72 17.655 10.415 1.699 1.00 0.00 C ATOM 2454 CD1 LEU B 72 16.944 10.427 0.352 1.00 0.00 C ATOM 2455 CD2 LEU B 72 16.648 10.241 2.827 1.00 0.00 C ATOM 0 H LEU B 72 21.245 8.727 2.107 1.00 0.00 H new ATOM 0 HA LEU B 72 19.116 9.912 3.769 1.00 0.00 H new ATOM 0 HB2 LEU B 72 19.463 9.518 0.975 1.00 0.00 H new ATOM 0 HB3 LEU B 72 18.239 8.365 1.469 1.00 0.00 H new ATOM 0 HG LEU B 72 18.160 11.372 1.834 1.00 0.00 H new ATOM 0 HD11 LEU B 72 16.196 11.220 0.343 1.00 0.00 H new ATOM 0 HD12 LEU B 72 17.670 10.604 -0.441 1.00 0.00 H new ATOM 0 HD13 LEU B 72 16.456 9.466 0.189 1.00 0.00 H new ATOM 0 HD21 LEU B 72 15.906 11.038 2.779 1.00 0.00 H new ATOM 0 HD22 LEU B 72 16.151 9.276 2.726 1.00 0.00 H new ATOM 0 HD23 LEU B 72 17.165 10.284 3.786 1.00 0.00 H new ATOM 2467 N LYS B 73 17.986 7.759 4.480 1.00 0.00 N ATOM 2468 CA LYS B 73 17.503 6.533 5.104 1.00 0.00 C ATOM 2469 C LYS B 73 16.025 6.317 4.782 1.00 0.00 C ATOM 2470 O LYS B 73 15.209 7.224 4.947 1.00 0.00 O ATOM 2471 CB LYS B 73 17.706 6.590 6.622 1.00 0.00 C ATOM 2472 CG LYS B 73 18.655 5.524 7.149 1.00 0.00 C ATOM 2473 CD LYS B 73 18.716 5.532 8.670 1.00 0.00 C ATOM 2474 CE LYS B 73 19.939 6.284 9.178 1.00 0.00 C ATOM 2475 NZ LYS B 73 21.209 5.563 8.879 1.00 0.00 N ATOM 0 H LYS B 73 17.442 8.590 4.712 1.00 0.00 H new ATOM 0 HA LYS B 73 18.075 5.696 4.704 1.00 0.00 H new ATOM 0 HB2 LYS B 73 18.091 7.573 6.892 1.00 0.00 H new ATOM 0 HB3 LYS B 73 16.740 6.480 7.114 1.00 0.00 H new ATOM 0 HG2 LYS B 73 18.330 4.543 6.802 1.00 0.00 H new ATOM 0 HG3 LYS B 73 19.653 5.691 6.743 1.00 0.00 H new ATOM 0 HD2 LYS B 73 17.813 5.994 9.069 1.00 0.00 H new ATOM 0 HD3 LYS B 73 18.739 4.507 9.039 1.00 0.00 H new ATOM 0 HE2 LYS B 73 19.970 7.274 8.723 1.00 0.00 H new ATOM 0 HE3 LYS B 73 19.852 6.431 10.255 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 21.956 5.895 9.521 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 21.068 4.541 9.011 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 21.490 5.749 7.895 1.00 0.00 H new ATOM 2489 N MET B 74 15.692 5.116 4.316 1.00 0.00 N ATOM 2490 CA MET B 74 14.314 4.782 3.968 1.00 0.00 C ATOM 2491 C MET B 74 14.002 3.332 4.330 1.00 0.00 C ATOM 2492 O MET B 74 14.641 2.408 3.829 1.00 0.00 O ATOM 2493 CB MET B 74 14.074 5.015 2.472 1.00 0.00 C ATOM 2494 CG MET B 74 12.903 5.937 2.174 1.00 0.00 C ATOM 2495 SD MET B 74 12.019 5.476 0.672 1.00 0.00 S ATOM 2496 CE MET B 74 13.375 5.296 -0.485 1.00 0.00 C ATOM 0 H MET B 74 16.358 4.357 4.171 1.00 0.00 H new ATOM 0 HA MET B 74 13.649 5.431 4.539 1.00 0.00 H new ATOM 0 HB2 MET B 74 14.977 5.436 2.030 1.00 0.00 H new ATOM 0 HB3 MET B 74 13.900 4.054 1.988 1.00 0.00 H new ATOM 0 HG2 MET B 74 12.211 5.923 3.016 1.00 0.00 H new ATOM 0 HG3 MET B 74 13.267 6.960 2.077 1.00 0.00 H new ATOM 0 HE1 MET B 74 12.993 5.348 -1.504 1.00 0.00 H new ATOM 0 HE2 MET B 74 14.097 6.097 -0.327 1.00 0.00 H new ATOM 0 HE3 MET B 74 13.861 4.333 -0.329 1.00 0.00 H new ATOM 2506 N VAL B 75 13.019 3.140 5.205 1.00 0.00 N ATOM 2507 CA VAL B 75 12.626 1.803 5.638 1.00 0.00 C ATOM 2508 C VAL B 75 11.320 1.372 4.975 1.00 0.00 C ATOM 2509 O VAL B 75 10.280 2.004 5.167 1.00 0.00 O ATOM 2510 CB VAL B 75 12.464 1.730 7.171 1.00 0.00 C ATOM 2511 CG1 VAL B 75 12.247 0.293 7.624 1.00 0.00 C ATOM 2512 CG2 VAL B 75 13.674 2.341 7.869 1.00 0.00 C ATOM 0 H VAL B 75 12.479 3.895 5.629 1.00 0.00 H new ATOM 0 HA VAL B 75 13.424 1.125 5.335 1.00 0.00 H new ATOM 0 HB VAL B 75 11.583 2.308 7.448 1.00 0.00 H new ATOM 0 HG11 VAL B 75 12.135 0.266 8.708 1.00 0.00 H new ATOM 0 HG12 VAL B 75 11.346 -0.104 7.156 1.00 0.00 H new ATOM 0 HG13 VAL B 75 13.104 -0.314 7.332 1.00 0.00 H new ATOM 0 HG21 VAL B 75 13.540 2.280 8.949 1.00 0.00 H new ATOM 0 HG22 VAL B 75 14.573 1.795 7.583 1.00 0.00 H new ATOM 0 HG23 VAL B 75 13.775 3.386 7.575 1.00 0.00 H new ATOM 2522 N VAL B 76 11.383 0.292 4.196 1.00 0.00 N ATOM 2523 CA VAL B 76 10.205 -0.230 3.503 1.00 0.00 C ATOM 2524 C VAL B 76 9.737 -1.549 4.116 1.00 0.00 C ATOM 2525 O VAL B 76 10.509 -2.248 4.778 1.00 0.00 O ATOM 2526 CB VAL B 76 10.472 -0.444 1.996 1.00 0.00 C ATOM 2527 CG1 VAL B 76 10.547 0.890 1.269 1.00 0.00 C ATOM 2528 CG2 VAL B 76 11.747 -1.252 1.782 1.00 0.00 C ATOM 0 H VAL B 76 12.238 -0.239 4.029 1.00 0.00 H new ATOM 0 HA VAL B 76 9.423 0.521 3.620 1.00 0.00 H new ATOM 0 HB VAL B 76 9.640 -1.011 1.579 1.00 0.00 H new ATOM 0 HG11 VAL B 76 10.736 0.717 0.209 1.00 0.00 H new ATOM 0 HG12 VAL B 76 9.603 1.422 1.387 1.00 0.00 H new ATOM 0 HG13 VAL B 76 11.356 1.488 1.689 1.00 0.00 H new ATOM 0 HG21 VAL B 76 11.915 -1.390 0.714 1.00 0.00 H new ATOM 0 HG22 VAL B 76 12.593 -0.719 2.216 1.00 0.00 H new ATOM 0 HG23 VAL B 76 11.646 -2.225 2.262 1.00 0.00 H new ATOM 2538 N GLN B 77 8.467 -1.881 3.887 1.00 0.00 N ATOM 2539 CA GLN B 77 7.883 -3.115 4.408 1.00 0.00 C ATOM 2540 C GLN B 77 7.780 -4.181 3.316 1.00 0.00 C ATOM 2541 O GLN B 77 7.575 -3.863 2.144 1.00 0.00 O ATOM 2542 CB GLN B 77 6.498 -2.836 5.006 1.00 0.00 C ATOM 2543 CG GLN B 77 5.542 -2.140 4.046 1.00 0.00 C ATOM 2544 CD GLN B 77 4.087 -2.488 4.312 1.00 0.00 C ATOM 2545 OE1 GLN B 77 3.691 -3.649 4.227 1.00 0.00 O ATOM 2546 NE2 GLN B 77 3.284 -1.479 4.635 1.00 0.00 N ATOM 0 H GLN B 77 7.821 -1.310 3.342 1.00 0.00 H new ATOM 0 HA GLN B 77 8.539 -3.494 5.191 1.00 0.00 H new ATOM 0 HB2 GLN B 77 6.054 -3.779 5.326 1.00 0.00 H new ATOM 0 HB3 GLN B 77 6.615 -2.220 5.898 1.00 0.00 H new ATOM 0 HG2 GLN B 77 5.674 -1.061 4.127 1.00 0.00 H new ATOM 0 HG3 GLN B 77 5.796 -2.416 3.023 1.00 0.00 H new ATOM 0 HE21 GLN B 77 3.655 -0.531 4.694 1.00 0.00 H new ATOM 0 HE22 GLN B 77 2.297 -1.653 4.824 1.00 0.00 H new ATOM 2555 N ARG B 78 7.923 -5.445 3.714 1.00 0.00 N ATOM 2556 CA ARG B 78 7.846 -6.561 2.773 1.00 0.00 C ATOM 2557 C ARG B 78 6.409 -7.060 2.632 1.00 0.00 C ATOM 2558 O ARG B 78 5.582 -6.864 3.525 1.00 0.00 O ATOM 2559 CB ARG B 78 8.750 -7.710 3.235 1.00 0.00 C ATOM 2560 CG ARG B 78 9.486 -8.405 2.100 1.00 0.00 C ATOM 2561 CD ARG B 78 10.461 -9.449 2.625 1.00 0.00 C ATOM 2562 NE ARG B 78 9.939 -10.810 2.491 1.00 0.00 N ATOM 2563 CZ ARG B 78 9.958 -11.510 1.352 1.00 0.00 C ATOM 2564 NH1 ARG B 78 10.456 -10.977 0.238 1.00 0.00 N ATOM 2565 NH2 ARG B 78 9.473 -12.747 1.327 1.00 0.00 N ATOM 0 H ARG B 78 8.093 -5.721 4.681 1.00 0.00 H new ATOM 0 HA ARG B 78 8.186 -6.205 1.801 1.00 0.00 H new ATOM 0 HB2 ARG B 78 9.480 -7.323 3.946 1.00 0.00 H new ATOM 0 HB3 ARG B 78 8.145 -8.444 3.767 1.00 0.00 H new ATOM 0 HG2 ARG B 78 8.765 -8.881 1.435 1.00 0.00 H new ATOM 0 HG3 ARG B 78 10.026 -7.666 1.509 1.00 0.00 H new ATOM 0 HD2 ARG B 78 11.404 -9.368 2.083 1.00 0.00 H new ATOM 0 HD3 ARG B 78 10.678 -9.246 3.674 1.00 0.00 H new ATOM 0 HE ARG B 78 9.536 -11.252 3.317 1.00 0.00 H new ATOM 0 HH11 ARG B 78 10.827 -10.027 0.249 1.00 0.00 H new ATOM 0 HH12 ARG B 78 10.466 -11.519 -0.626 1.00 0.00 H new ATOM 0 HH21 ARG B 78 9.087 -13.161 2.176 1.00 0.00 H new ATOM 0 HH22 ARG B 78 9.487 -13.283 0.459 1.00 0.00 H new ATOM 2579 N ASP B 79 6.123 -7.713 1.505 1.00 0.00 N ATOM 2580 CA ASP B 79 4.792 -8.249 1.245 1.00 0.00 C ATOM 2581 C ASP B 79 4.807 -9.777 1.280 1.00 0.00 C ATOM 2582 O ASP B 79 5.801 -10.405 0.906 1.00 0.00 O ATOM 2583 CB ASP B 79 4.275 -7.759 -0.114 1.00 0.00 C ATOM 2584 CG ASP B 79 3.047 -6.873 0.008 1.00 0.00 C ATOM 2585 OD1 ASP B 79 2.188 -7.155 0.872 1.00 0.00 O ATOM 2586 OD2 ASP B 79 2.946 -5.895 -0.762 1.00 0.00 O ATOM 0 H ASP B 79 6.798 -7.882 0.759 1.00 0.00 H new ATOM 0 HA ASP B 79 4.123 -7.891 2.027 1.00 0.00 H new ATOM 0 HB2 ASP B 79 5.066 -7.207 -0.621 1.00 0.00 H new ATOM 0 HB3 ASP B 79 4.036 -8.620 -0.738 1.00 0.00 H new ATOM 2591 N GLU B 80 3.694 -10.363 1.734 1.00 0.00 N ATOM 2592 CA GLU B 80 3.550 -11.821 1.830 1.00 0.00 C ATOM 2593 C GLU B 80 4.374 -12.391 2.987 1.00 0.00 C ATOM 2594 O GLU B 80 3.817 -12.955 3.930 1.00 0.00 O ATOM 2595 CB GLU B 80 3.948 -12.495 0.512 1.00 0.00 C ATOM 2596 CG GLU B 80 3.010 -13.615 0.094 1.00 0.00 C ATOM 2597 CD GLU B 80 2.652 -13.554 -1.378 1.00 0.00 C ATOM 2598 OE1 GLU B 80 3.462 -14.025 -2.204 1.00 0.00 O ATOM 2599 OE2 GLU B 80 1.564 -13.034 -1.705 1.00 0.00 O ATOM 0 H GLU B 80 2.872 -9.845 2.044 1.00 0.00 H new ATOM 0 HA GLU B 80 2.499 -12.033 2.028 1.00 0.00 H new ATOM 0 HB2 GLU B 80 3.977 -11.743 -0.277 1.00 0.00 H new ATOM 0 HB3 GLU B 80 4.957 -12.895 0.608 1.00 0.00 H new ATOM 0 HG2 GLU B 80 3.477 -14.576 0.311 1.00 0.00 H new ATOM 0 HG3 GLU B 80 2.098 -13.562 0.689 1.00 0.00 H new ATOM 2606 N LEU B 81 5.701 -12.237 2.905 1.00 0.00 N ATOM 2607 CA LEU B 81 6.617 -12.729 3.937 1.00 0.00 C ATOM 2608 C LEU B 81 6.691 -14.256 3.934 1.00 0.00 C ATOM 2609 O LEU B 81 5.667 -14.941 3.931 1.00 0.00 O ATOM 2610 CB LEU B 81 6.208 -12.219 5.323 1.00 0.00 C ATOM 2611 CG LEU B 81 7.047 -11.055 5.854 1.00 0.00 C ATOM 2612 CD1 LEU B 81 6.576 -9.739 5.253 1.00 0.00 C ATOM 2613 CD2 LEU B 81 6.986 -11.001 7.373 1.00 0.00 C ATOM 0 H LEU B 81 6.166 -11.771 2.126 1.00 0.00 H new ATOM 0 HA LEU B 81 7.609 -12.341 3.704 1.00 0.00 H new ATOM 0 HB2 LEU B 81 5.164 -11.908 5.286 1.00 0.00 H new ATOM 0 HB3 LEU B 81 6.270 -13.045 6.031 1.00 0.00 H new ATOM 0 HG LEU B 81 8.084 -11.216 5.558 1.00 0.00 H new ATOM 0 HD11 LEU B 81 7.184 -8.923 5.642 1.00 0.00 H new ATOM 0 HD12 LEU B 81 6.674 -9.779 4.168 1.00 0.00 H new ATOM 0 HD13 LEU B 81 5.532 -9.571 5.517 1.00 0.00 H new ATOM 0 HD21 LEU B 81 7.589 -10.167 7.732 1.00 0.00 H new ATOM 0 HD22 LEU B 81 5.952 -10.865 7.691 1.00 0.00 H new ATOM 0 HD23 LEU B 81 7.373 -11.932 7.786 1.00 0.00 H new ATOM 2625 N GLU B 82 7.918 -14.778 3.931 1.00 0.00 N ATOM 2626 CA GLU B 82 8.148 -16.221 3.924 1.00 0.00 C ATOM 2627 C GLU B 82 8.822 -16.671 5.220 1.00 0.00 C ATOM 2628 O GLU B 82 8.185 -17.427 5.983 1.00 0.00 O ATOM 2629 CB GLU B 82 9.007 -16.608 2.711 1.00 0.00 C ATOM 2630 CG GLU B 82 9.235 -18.105 2.568 1.00 0.00 C ATOM 2631 CD GLU B 82 10.039 -18.459 1.332 1.00 0.00 C ATOM 2632 OE1 GLU B 82 11.193 -17.992 1.218 1.00 0.00 O ATOM 2633 OE2 GLU B 82 9.515 -19.204 0.477 1.00 0.00 O ATOM 0 H GLU B 82 8.771 -14.219 3.933 1.00 0.00 H new ATOM 0 HA GLU B 82 7.184 -16.725 3.852 1.00 0.00 H new ATOM 0 HB2 GLU B 82 8.528 -16.236 1.806 1.00 0.00 H new ATOM 0 HB3 GLU B 82 9.973 -16.109 2.789 1.00 0.00 H new ATOM 0 HG2 GLU B 82 9.754 -18.475 3.452 1.00 0.00 H new ATOM 0 HG3 GLU B 82 8.271 -18.613 2.527 1.00 0.00 H new TER 2640 GLU B 82