USER MOD reduce.3.24.130724 H: found=0, std=0, add=1720, rem=0, adj=71 USER MOD reduce.3.24.130724 removed 1724 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: B 80 GLN : amide:sc= 0.122 K(o=0.33,f=-0.46) USER MOD Set 1.2: D 17 HIS : no HE2:sc= 0.209 K(o=0.33,f=-2) USER MOD Set 2.1: B 75 TYR OH : rot -115:sc= -0.987 USER MOD Set 2.2: B 77 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 44 LYS NZ :NH3+ -166:sc= -0.0304 (180deg=-0.286) USER MOD Set 3.2: B 65 TYR OH : rot 180:sc= -0.855 USER MOD Set 4.1: B 55 HIS : no HD1:sc= -3.93! C(o=-3.9!,f=-3.6!) USER MOD Set 4.2: B 88 SER OG : rot 180:sc= 0 USER MOD Set 5.1: B 24 CYS SG : rot 140:sc= -1.65 USER MOD Set 5.2: B 41 HIS : no HE2:sc= -5.19! C(o=-6.8!,f=-10!) USER MOD Set 6.1: A 75 TYR OH : rot -106:sc= 1.19 USER MOD Set 6.2: A 77 TYR OH : rot 57:sc= 0.181 USER MOD Set 7.1: A 67 THR OG1 : rot -114:sc= 0.835 USER MOD Set 7.2: B 43 LYS NZ :NH3+ -161:sc= 2.2 (180deg=0.761) USER MOD Set 8.1: A 53 THR OG1 : rot -160:sc= 0 USER MOD Set 8.2: A 55 HIS : no HE2:sc= -2.83 K(o=-2.8,f=-5.8!) USER MOD Set 9.1: A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 9.2: A 41 HIS : no HD1:sc= -3.99 K(o=-4,f=-6.7!) USER MOD Set10.1: A 13 MET CE :methyl -116:sc= -5.98! (180deg=-7.48!) USER MOD Set10.2: A 17 MET CE :methyl -131:sc= -3.23! (180deg=-0.629) USER MOD Set11.1: A 1 MET N :NH3+ 170:sc= 1.07 (180deg=0.783) USER MOD Set11.2: A 19 GLN : amide:sc= -0.0194 K(o=1,f=0.52) USER MOD Single : A 1 MET CE :methyl 141:sc= -0.205 (180deg=-0.952) USER MOD Single : A 2 CYS SG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -0.865 K(o=-0.86,f=-1.4) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN :FLIP amide:sc= -1.6 F(o=-2.5!,f=-1.6) USER MOD Single : A 21 SER OG : rot -103:sc= -2.1 USER MOD Single : A 24 CYS SG : rot -2:sc= -4.46! USER MOD Single : A 26 THR OG1 : rot 69:sc= 0.787 USER MOD Single : A 27 GLN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.633 X(o=-0.63,f=-0.57) USER MOD Single : A 36 LYS NZ :NH3+ 162:sc= -0.0759 (180deg=-0.446) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= -0.466 (180deg=-0.466) USER MOD Single : A 48 LYS NZ :NH3+ 169:sc= -0.0322 (180deg=-0.218) USER MOD Single : A 49 LYS NZ :NH3+ 165:sc= -0.0494 (180deg=-0.293) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= -1.8 X(o=-1.8,f=-1.4) USER MOD Single : A 56 CYS SG : rot 40:sc= -0.499 USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=-0.0028) USER MOD Single : A 64 SER OG : rot 73:sc= -0.238 USER MOD Single : A 65 TYR OH : rot -96:sc= 1.08 USER MOD Single : A 68 HIS : no HE2:sc= -3.14 K(o=-3.1,f=-5.2!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 136:sc= -0.284 (180deg=-1.39) USER MOD Single : A 72 HIS : no HE2:sc= -9.25! C(o=-9.2!,f=-16!) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.0456) USER MOD Single : A 88 SER OG : rot 145:sc= 0.0805 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -163:sc= -0.0597 (180deg=-0.395) USER MOD Single : B 2 CYS SG : rot 29:sc= 0.0729 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 ASN : amide:sc= -0.516 K(o=-0.52,f=-2.9) USER MOD Single : B 13 MET CE :methyl -132:sc= -4.27! (180deg=-8.63!) USER MOD Single : B 14 SER OG : rot -100:sc= -1.23 USER MOD Single : B 17 MET CE :methyl 143:sc= -0.318 (180deg=-2.32!) USER MOD Single : B 18 GLN :FLIP amide:sc= -1.93 F(o=-3.8!,f=-1.9) USER MOD Single : B 19 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : B 21 SER OG : rot -18:sc= 0.286 USER MOD Single : B 26 THR OG1 : rot 69:sc= 0.295 USER MOD Single : B 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 ASN : amide:sc= -2.3! C(o=-2.3!,f=-6.5!) USER MOD Single : B 36 LYS NZ :NH3+ 161:sc= -0.0519 (180deg=-0.399) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 LYS NZ :NH3+ 168:sc=-0.00911 (180deg=-0.21) USER MOD Single : B 49 LYS NZ :NH3+ -162:sc= 0.741 (180deg=0.466) USER MOD Single : B 50 TYR OH : rot 107:sc= 0.964 USER MOD Single : B 51 ASN : amide:sc= -1.78 K(o=-1.8,f=-7!) USER MOD Single : B 53 THR OG1 : rot -120:sc= -0.144 USER MOD Single : B 56 CYS SG : rot 41:sc= -1.93 USER MOD Single : B 61 ASN :FLIP amide:sc= -0.764 F(o=-2.3,f=-0.76) USER MOD Single : B 64 SER OG : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot -86:sc= 1.11 USER MOD Single : B 68 HIS : no HE2:sc= -3.58! C(o=-3.6!,f=-3.5!) USER MOD Single : B 70 THR OG1 : rot 180:sc= 0 USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 HIS : no HD1:sc= -3.63 X(o=-3.6,f=-4!) USER MOD Single : B 87 LYS NZ :NH3+ 162:sc= -0.101 (180deg=-0.494) USER MOD Single : C 1 MET CE :methyl 160:sc= -0.159 (180deg=-0.695) USER MOD Single : C 1 MET N :NH3+ -148:sc= -4.95! (180deg=-6.55!) USER MOD Single : C 2 LYS NZ :NH3+ -136:sc= 0.988 (180deg=-0.275) USER MOD Single : C 4 THR OG1 : rot 103:sc= 1.35 USER MOD Single : C 7 GLN : amide:sc= -2.68! C(o=-2.7!,f=-4.6!) USER MOD Single : C 15 LYS NZ :NH3+ -168:sc= -0.0545 (180deg=-0.291) USER MOD Single : C 16 SER OG : rot 180:sc= 0 USER MOD Single : C 17 HIS : no HD1:sc= -0.512 X(o=-0.51,f=-0.15) USER MOD Single : C 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 1 MET CE :methyl -160:sc= -0.185 (180deg=-0.859) USER MOD Single : D 1 MET N :NH3+ -137:sc= -0.925! (180deg=-1.21!) USER MOD Single : D 2 LYS NZ :NH3+ -135:sc= 1.08 (180deg=-0.716) USER MOD Single : D 4 THR OG1 : rot 115:sc= 0.771 USER MOD Single : D 7 GLN : amide:sc= -0.394 K(o=-0.39,f=-4.3!) USER MOD Single : D 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 16 SER OG : rot 180:sc=-0.00361 USER MOD Single : D 18 LYS NZ :NH3+ 166:sc= -0.041 (180deg=-0.283) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -22.896 -6.122 -10.158 1.00 0.00 N ATOM 2 CA MET A 1 -21.757 -7.004 -10.532 1.00 0.00 C ATOM 3 C MET A 1 -21.394 -6.839 -12.005 1.00 0.00 C ATOM 4 O MET A 1 -20.221 -6.714 -12.355 1.00 0.00 O ATOM 5 CB MET A 1 -22.132 -8.464 -10.245 1.00 0.00 C ATOM 6 CG MET A 1 -22.292 -8.788 -8.766 1.00 0.00 C ATOM 7 SD MET A 1 -23.745 -8.018 -8.023 1.00 0.00 S ATOM 8 CE MET A 1 -25.053 -8.731 -9.018 1.00 0.00 C ATOM 0 H1 MET A 1 -23.232 -6.373 -9.206 1.00 0.00 H new ATOM 0 H2 MET A 1 -22.584 -5.130 -10.164 1.00 0.00 H new ATOM 0 H3 MET A 1 -23.670 -6.246 -10.842 1.00 0.00 H new ATOM 0 HA MET A 1 -20.888 -6.722 -9.938 1.00 0.00 H new ATOM 0 HB2 MET A 1 -23.065 -8.696 -10.759 1.00 0.00 H new ATOM 0 HB3 MET A 1 -21.365 -9.114 -10.667 1.00 0.00 H new ATOM 0 HG2 MET A 1 -22.358 -9.869 -8.643 1.00 0.00 H new ATOM 0 HG3 MET A 1 -21.401 -8.460 -8.230 1.00 0.00 H new ATOM 0 HE1 MET A 1 -25.909 -8.960 -8.383 1.00 0.00 H new ATOM 0 HE2 MET A 1 -25.352 -8.021 -9.789 1.00 0.00 H new ATOM 0 HE3 MET A 1 -24.695 -9.647 -9.488 1.00 0.00 H new ATOM 20 N CYS A 2 -22.409 -6.840 -12.863 1.00 0.00 N ATOM 21 CA CYS A 2 -22.197 -6.691 -14.299 1.00 0.00 C ATOM 22 C CYS A 2 -21.522 -5.360 -14.612 1.00 0.00 C ATOM 23 O CYS A 2 -20.591 -5.298 -15.416 1.00 0.00 O ATOM 24 CB CYS A 2 -23.530 -6.789 -15.045 1.00 0.00 C ATOM 25 SG CYS A 2 -24.387 -8.364 -14.819 1.00 0.00 S ATOM 0 H CYS A 2 -23.386 -6.942 -12.589 1.00 0.00 H new ATOM 0 HA CYS A 2 -21.543 -7.497 -14.631 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -24.182 -5.982 -14.711 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -23.351 -6.634 -16.109 1.00 0.00 H new ATOM 0 HG CYS A 2 -25.503 -8.350 -15.485 1.00 0.00 H new ATOM 31 N ASP A 3 -21.996 -4.295 -13.972 1.00 0.00 N ATOM 32 CA ASP A 3 -21.438 -2.965 -14.182 1.00 0.00 C ATOM 33 C ASP A 3 -19.953 -2.933 -13.832 1.00 0.00 C ATOM 34 O ASP A 3 -19.543 -3.428 -12.782 1.00 0.00 O ATOM 35 CB ASP A 3 -22.193 -1.935 -13.340 1.00 0.00 C ATOM 36 CG ASP A 3 -23.665 -1.860 -13.697 1.00 0.00 C ATOM 37 OD1 ASP A 3 -24.099 -2.607 -14.600 1.00 0.00 O ATOM 38 OD2 ASP A 3 -24.387 -1.053 -13.074 1.00 0.00 O ATOM 0 H ASP A 3 -22.766 -4.328 -13.303 1.00 0.00 H new ATOM 0 HA ASP A 3 -21.548 -2.716 -15.237 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -22.091 -2.188 -12.285 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -21.738 -0.954 -13.478 1.00 0.00 H new ATOM 43 N ARG A 4 -19.153 -2.349 -14.720 1.00 0.00 N ATOM 44 CA ARG A 4 -17.713 -2.252 -14.509 1.00 0.00 C ATOM 45 C ARG A 4 -17.073 -3.634 -14.424 1.00 0.00 C ATOM 46 O ARG A 4 -17.555 -4.512 -13.707 1.00 0.00 O ATOM 47 CB ARG A 4 -17.411 -1.457 -13.235 1.00 0.00 C ATOM 48 CG ARG A 4 -17.661 0.038 -13.369 1.00 0.00 C ATOM 49 CD ARG A 4 -19.082 0.340 -13.819 1.00 0.00 C ATOM 50 NE ARG A 4 -19.346 1.777 -13.862 1.00 0.00 N ATOM 51 CZ ARG A 4 -20.496 2.309 -14.270 1.00 0.00 C ATOM 52 NH1 ARG A 4 -21.484 1.529 -14.688 1.00 0.00 N ATOM 53 NH2 ARG A 4 -20.655 3.624 -14.264 1.00 0.00 N ATOM 0 H ARG A 4 -19.479 -1.935 -15.594 1.00 0.00 H new ATOM 0 HA ARG A 4 -17.286 -1.729 -15.365 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -18.023 -1.847 -12.421 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -16.370 -1.618 -12.956 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -17.473 0.524 -12.412 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -16.956 0.461 -14.085 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -19.249 -0.090 -14.807 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -19.787 -0.139 -13.140 1.00 0.00 H new ATOM 0 HE ARG A 4 -18.605 2.410 -13.561 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -21.365 0.516 -14.698 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -22.363 1.942 -14.999 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -19.897 4.228 -13.947 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -21.536 4.033 -14.576 1.00 0.00 H new ATOM 67 N LYS A 5 -15.984 -3.819 -15.162 1.00 0.00 N ATOM 68 CA LYS A 5 -15.272 -5.091 -15.173 1.00 0.00 C ATOM 69 C LYS A 5 -14.558 -5.321 -13.834 1.00 0.00 C ATOM 70 O LYS A 5 -15.208 -5.421 -12.793 1.00 0.00 O ATOM 71 CB LYS A 5 -14.285 -5.143 -16.348 1.00 0.00 C ATOM 72 CG LYS A 5 -14.947 -5.182 -17.719 1.00 0.00 C ATOM 73 CD LYS A 5 -15.756 -3.927 -17.999 1.00 0.00 C ATOM 74 CE LYS A 5 -16.298 -3.921 -19.420 1.00 0.00 C ATOM 75 NZ LYS A 5 -17.090 -2.695 -19.708 1.00 0.00 N ATOM 0 H LYS A 5 -15.575 -3.102 -15.761 1.00 0.00 H new ATOM 0 HA LYS A 5 -15.995 -5.895 -15.307 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -13.631 -4.272 -16.297 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -13.652 -6.024 -16.237 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -14.182 -5.299 -18.487 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -15.598 -6.054 -17.782 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -16.583 -3.860 -17.292 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -15.132 -3.047 -17.843 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -15.469 -3.991 -20.125 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -16.923 -4.801 -19.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -17.441 -2.730 -20.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -17.896 -2.640 -19.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -16.488 -1.856 -19.587 1.00 0.00 H new ATOM 89 N ALA A 6 -13.226 -5.407 -13.858 1.00 0.00 N ATOM 90 CA ALA A 6 -12.449 -5.625 -12.642 1.00 0.00 C ATOM 91 C ALA A 6 -12.707 -7.010 -12.062 1.00 0.00 C ATOM 92 O ALA A 6 -13.847 -7.362 -11.759 1.00 0.00 O ATOM 93 CB ALA A 6 -12.772 -4.556 -11.610 1.00 0.00 C ATOM 0 H ALA A 6 -12.666 -5.329 -14.707 1.00 0.00 H new ATOM 0 HA ALA A 6 -11.393 -5.560 -12.903 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.185 -4.731 -10.708 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -12.529 -3.574 -12.015 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -13.833 -4.595 -11.365 1.00 0.00 H new ATOM 99 N VAL A 7 -11.643 -7.791 -11.904 1.00 0.00 N ATOM 100 CA VAL A 7 -11.756 -9.128 -11.357 1.00 0.00 C ATOM 101 C VAL A 7 -11.370 -9.160 -9.885 1.00 0.00 C ATOM 102 O VAL A 7 -10.402 -8.523 -9.472 1.00 0.00 O ATOM 103 CB VAL A 7 -10.873 -10.118 -12.125 1.00 0.00 C ATOM 104 CG1 VAL A 7 -11.392 -10.316 -13.540 1.00 0.00 C ATOM 105 CG2 VAL A 7 -9.427 -9.645 -12.140 1.00 0.00 C ATOM 0 H VAL A 7 -10.692 -7.515 -12.150 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.801 -9.422 -11.459 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.911 -11.080 -11.613 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.751 -11.022 -14.067 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -12.409 -10.707 -13.503 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -11.389 -9.361 -14.066 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -8.816 -10.361 -12.690 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -9.368 -8.670 -12.624 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -9.060 -9.565 -11.117 1.00 0.00 H new ATOM 115 N ILE A 8 -12.133 -9.910 -9.099 1.00 0.00 N ATOM 116 CA ILE A 8 -11.870 -10.029 -7.670 1.00 0.00 C ATOM 117 C ILE A 8 -10.978 -11.230 -7.368 1.00 0.00 C ATOM 118 O ILE A 8 -11.253 -12.350 -7.800 1.00 0.00 O ATOM 119 CB ILE A 8 -13.182 -10.148 -6.857 1.00 0.00 C ATOM 120 CG1 ILE A 8 -13.992 -8.850 -6.947 1.00 0.00 C ATOM 121 CG2 ILE A 8 -12.889 -10.484 -5.402 1.00 0.00 C ATOM 122 CD1 ILE A 8 -14.443 -8.502 -8.348 1.00 0.00 C ATOM 0 H ILE A 8 -12.938 -10.444 -9.426 1.00 0.00 H new ATOM 0 HA ILE A 8 -11.353 -9.117 -7.370 1.00 0.00 H new ATOM 0 HB ILE A 8 -13.772 -10.958 -7.286 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -14.869 -8.936 -6.305 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -13.390 -8.030 -6.556 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -13.826 -10.562 -4.851 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -12.356 -11.433 -5.348 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -12.275 -9.697 -4.963 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -15.010 -7.571 -8.327 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -13.571 -8.382 -8.992 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -15.074 -9.302 -8.736 1.00 0.00 H new ATOM 134 N LYS A 9 -9.912 -10.985 -6.610 1.00 0.00 N ATOM 135 CA LYS A 9 -8.979 -12.039 -6.230 1.00 0.00 C ATOM 136 C LYS A 9 -9.169 -12.410 -4.764 1.00 0.00 C ATOM 137 O LYS A 9 -9.001 -13.566 -4.375 1.00 0.00 O ATOM 138 CB LYS A 9 -7.538 -11.593 -6.480 1.00 0.00 C ATOM 139 CG LYS A 9 -7.238 -11.312 -7.942 1.00 0.00 C ATOM 140 CD LYS A 9 -7.489 -12.537 -8.807 1.00 0.00 C ATOM 141 CE LYS A 9 -7.196 -12.257 -10.273 1.00 0.00 C ATOM 142 NZ LYS A 9 -7.445 -13.452 -11.125 1.00 0.00 N ATOM 0 H LYS A 9 -9.674 -10.062 -6.247 1.00 0.00 H new ATOM 0 HA LYS A 9 -9.182 -12.918 -6.843 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -7.337 -10.694 -5.897 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.859 -12.366 -6.119 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.859 -10.486 -8.290 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.200 -10.997 -8.048 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.865 -13.361 -8.462 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -8.526 -12.855 -8.697 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -7.818 -11.430 -10.616 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -6.158 -11.942 -10.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -7.234 -13.221 -12.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.834 -14.234 -10.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -8.442 -13.737 -11.040 1.00 0.00 H new ATOM 156 N ASN A 10 -9.525 -11.417 -3.956 1.00 0.00 N ATOM 157 CA ASN A 10 -9.747 -11.622 -2.533 1.00 0.00 C ATOM 158 C ASN A 10 -10.777 -10.624 -2.021 1.00 0.00 C ATOM 159 O ASN A 10 -10.736 -9.445 -2.369 1.00 0.00 O ATOM 160 CB ASN A 10 -8.437 -11.467 -1.758 1.00 0.00 C ATOM 161 CG ASN A 10 -7.383 -12.464 -2.199 1.00 0.00 C ATOM 162 OD1 ASN A 10 -7.581 -13.675 -2.104 1.00 0.00 O ATOM 163 ND2 ASN A 10 -6.255 -11.959 -2.684 1.00 0.00 N ATOM 0 H ASN A 10 -9.666 -10.456 -4.267 1.00 0.00 H new ATOM 0 HA ASN A 10 -10.122 -12.634 -2.380 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -8.055 -10.455 -1.894 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -8.631 -11.594 -0.693 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -5.510 -12.582 -2.996 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -6.133 -10.948 -2.745 1.00 0.00 H new ATOM 170 N ALA A 11 -11.708 -11.100 -1.205 1.00 0.00 N ATOM 171 CA ALA A 11 -12.750 -10.238 -0.667 1.00 0.00 C ATOM 172 C ALA A 11 -13.284 -10.765 0.656 1.00 0.00 C ATOM 173 O ALA A 11 -13.500 -11.965 0.824 1.00 0.00 O ATOM 174 CB ALA A 11 -13.882 -10.093 -1.674 1.00 0.00 C ATOM 0 H ALA A 11 -11.763 -12.073 -0.903 1.00 0.00 H new ATOM 0 HA ALA A 11 -12.310 -9.259 -0.480 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -14.656 -9.446 -1.261 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -13.496 -9.655 -2.595 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -14.306 -11.074 -1.889 1.00 0.00 H new ATOM 180 N ASP A 12 -13.497 -9.848 1.591 1.00 0.00 N ATOM 181 CA ASP A 12 -14.008 -10.191 2.910 1.00 0.00 C ATOM 182 C ASP A 12 -14.907 -9.075 3.430 1.00 0.00 C ATOM 183 O ASP A 12 -14.660 -8.505 4.492 1.00 0.00 O ATOM 184 CB ASP A 12 -12.857 -10.436 3.889 1.00 0.00 C ATOM 185 CG ASP A 12 -11.951 -11.572 3.455 1.00 0.00 C ATOM 186 OD1 ASP A 12 -11.323 -11.456 2.381 1.00 0.00 O ATOM 187 OD2 ASP A 12 -11.868 -12.579 4.189 1.00 0.00 O ATOM 0 H ASP A 12 -13.322 -8.852 1.457 1.00 0.00 H new ATOM 0 HA ASP A 12 -14.591 -11.108 2.825 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -12.268 -9.524 3.986 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -13.265 -10.659 4.875 1.00 0.00 H new ATOM 192 N MET A 13 -15.944 -8.759 2.660 1.00 0.00 N ATOM 193 CA MET A 13 -16.876 -7.702 3.029 1.00 0.00 C ATOM 194 C MET A 13 -18.169 -7.813 2.227 1.00 0.00 C ATOM 195 O MET A 13 -18.211 -8.468 1.184 1.00 0.00 O ATOM 196 CB MET A 13 -16.230 -6.332 2.810 1.00 0.00 C ATOM 197 CG MET A 13 -15.823 -6.073 1.368 1.00 0.00 C ATOM 198 SD MET A 13 -14.864 -4.557 1.182 1.00 0.00 S ATOM 199 CE MET A 13 -15.982 -3.355 1.894 1.00 0.00 C ATOM 0 H MET A 13 -16.159 -9.221 1.776 1.00 0.00 H new ATOM 0 HA MET A 13 -17.122 -7.813 4.085 1.00 0.00 H new ATOM 0 HB2 MET A 13 -16.927 -5.556 3.127 1.00 0.00 H new ATOM 0 HB3 MET A 13 -15.350 -6.249 3.447 1.00 0.00 H new ATOM 0 HG2 MET A 13 -15.238 -6.916 1.002 1.00 0.00 H new ATOM 0 HG3 MET A 13 -16.717 -6.012 0.747 1.00 0.00 H new ATOM 0 HE1 MET A 13 -16.290 -2.645 1.126 1.00 0.00 H new ATOM 0 HE2 MET A 13 -16.860 -3.865 2.291 1.00 0.00 H new ATOM 0 HE3 MET A 13 -15.478 -2.821 2.700 1.00 0.00 H new ATOM 209 N SER A 14 -19.225 -7.179 2.731 1.00 0.00 N ATOM 210 CA SER A 14 -20.536 -7.208 2.081 1.00 0.00 C ATOM 211 C SER A 14 -20.424 -7.013 0.569 1.00 0.00 C ATOM 212 O SER A 14 -19.610 -6.225 0.090 1.00 0.00 O ATOM 213 CB SER A 14 -21.443 -6.130 2.676 1.00 0.00 C ATOM 214 OG SER A 14 -21.643 -6.341 4.063 1.00 0.00 O ATOM 0 H SER A 14 -19.199 -6.635 3.593 1.00 0.00 H new ATOM 0 HA SER A 14 -20.970 -8.192 2.261 1.00 0.00 H new ATOM 0 HB2 SER A 14 -21.000 -5.147 2.515 1.00 0.00 H new ATOM 0 HB3 SER A 14 -22.404 -6.134 2.162 1.00 0.00 H new ATOM 0 HG SER A 14 -22.225 -5.638 4.420 1.00 0.00 H new ATOM 220 N GLU A 15 -21.249 -7.747 -0.174 1.00 0.00 N ATOM 221 CA GLU A 15 -21.253 -7.673 -1.633 1.00 0.00 C ATOM 222 C GLU A 15 -21.449 -6.243 -2.121 1.00 0.00 C ATOM 223 O GLU A 15 -20.756 -5.786 -3.029 1.00 0.00 O ATOM 224 CB GLU A 15 -22.353 -8.572 -2.204 1.00 0.00 C ATOM 225 CG GLU A 15 -23.749 -8.205 -1.725 1.00 0.00 C ATOM 226 CD GLU A 15 -24.817 -9.122 -2.287 1.00 0.00 C ATOM 227 OE1 GLU A 15 -24.746 -10.342 -2.032 1.00 0.00 O ATOM 228 OE2 GLU A 15 -25.726 -8.619 -2.982 1.00 0.00 O ATOM 0 H GLU A 15 -21.927 -8.403 0.213 1.00 0.00 H new ATOM 0 HA GLU A 15 -20.281 -8.019 -1.985 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -22.326 -8.519 -3.292 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -22.144 -9.606 -1.930 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -23.778 -8.244 -0.636 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -23.970 -7.177 -2.013 1.00 0.00 H new ATOM 235 N GLU A 16 -22.398 -5.544 -1.517 1.00 0.00 N ATOM 236 CA GLU A 16 -22.685 -4.167 -1.894 1.00 0.00 C ATOM 237 C GLU A 16 -21.464 -3.278 -1.694 1.00 0.00 C ATOM 238 O GLU A 16 -21.147 -2.445 -2.543 1.00 0.00 O ATOM 239 CB GLU A 16 -23.864 -3.627 -1.080 1.00 0.00 C ATOM 240 CG GLU A 16 -23.618 -3.628 0.419 1.00 0.00 C ATOM 241 CD GLU A 16 -24.797 -3.085 1.203 1.00 0.00 C ATOM 242 OE1 GLU A 16 -25.168 -1.913 0.983 1.00 0.00 O ATOM 243 OE2 GLU A 16 -25.349 -3.833 2.039 1.00 0.00 O ATOM 0 H GLU A 16 -22.983 -5.907 -0.764 1.00 0.00 H new ATOM 0 HA GLU A 16 -22.947 -4.156 -2.952 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -24.082 -2.609 -1.403 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -24.748 -4.227 -1.295 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -23.405 -4.645 0.748 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -22.734 -3.030 0.639 1.00 0.00 H new ATOM 250 N MET A 17 -20.781 -3.458 -0.571 1.00 0.00 N ATOM 251 CA MET A 17 -19.595 -2.666 -0.271 1.00 0.00 C ATOM 252 C MET A 17 -18.514 -2.887 -1.320 1.00 0.00 C ATOM 253 O MET A 17 -17.983 -1.930 -1.887 1.00 0.00 O ATOM 254 CB MET A 17 -19.062 -3.008 1.120 1.00 0.00 C ATOM 255 CG MET A 17 -20.051 -2.720 2.238 1.00 0.00 C ATOM 256 SD MET A 17 -19.419 -3.179 3.863 1.00 0.00 S ATOM 257 CE MET A 17 -17.963 -2.141 3.966 1.00 0.00 C ATOM 0 H MET A 17 -21.026 -4.142 0.145 1.00 0.00 H new ATOM 0 HA MET A 17 -19.878 -1.613 -0.289 1.00 0.00 H new ATOM 0 HB2 MET A 17 -18.793 -4.064 1.147 1.00 0.00 H new ATOM 0 HB3 MET A 17 -18.148 -2.441 1.299 1.00 0.00 H new ATOM 0 HG2 MET A 17 -20.297 -1.658 2.235 1.00 0.00 H new ATOM 0 HG3 MET A 17 -20.977 -3.262 2.047 1.00 0.00 H new ATOM 0 HE1 MET A 17 -17.108 -2.743 4.274 1.00 0.00 H new ATOM 0 HE2 MET A 17 -17.762 -1.698 2.990 1.00 0.00 H new ATOM 0 HE3 MET A 17 -18.131 -1.349 4.696 1.00 0.00 H new ATOM 267 N GLN A 18 -18.196 -4.147 -1.583 1.00 0.00 N ATOM 268 CA GLN A 18 -17.181 -4.480 -2.577 1.00 0.00 C ATOM 269 C GLN A 18 -17.576 -3.958 -3.956 1.00 0.00 C ATOM 270 O GLN A 18 -16.730 -3.481 -4.711 1.00 0.00 O ATOM 271 CB GLN A 18 -16.933 -5.987 -2.618 1.00 0.00 C ATOM 272 CG GLN A 18 -18.191 -6.822 -2.764 1.00 0.00 C ATOM 273 CD GLN A 18 -17.903 -8.306 -2.676 1.00 0.00 C ATOM 274 OE1 GLN A 18 -18.294 -8.917 -1.565 1.00 0.00 O flip ATOM 275 NE2 GLN A 18 -17.314 -8.892 -3.586 1.00 0.00 N flip ATOM 0 H GLN A 18 -18.623 -4.953 -1.126 1.00 0.00 H new ATOM 0 HA GLN A 18 -16.251 -3.992 -2.285 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -16.264 -6.211 -3.449 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -16.418 -6.284 -1.704 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -18.902 -6.544 -1.986 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -18.663 -6.601 -3.721 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -17.032 -8.381 -4.423 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -17.109 -9.888 -3.502 1.00 0.00 H new ATOM 284 N GLN A 19 -18.865 -4.038 -4.273 1.00 0.00 N ATOM 285 CA GLN A 19 -19.358 -3.555 -5.559 1.00 0.00 C ATOM 286 C GLN A 19 -19.177 -2.045 -5.658 1.00 0.00 C ATOM 287 O GLN A 19 -18.726 -1.527 -6.679 1.00 0.00 O ATOM 288 CB GLN A 19 -20.832 -3.923 -5.740 1.00 0.00 C ATOM 289 CG GLN A 19 -21.416 -3.458 -7.064 1.00 0.00 C ATOM 290 CD GLN A 19 -22.877 -3.835 -7.218 1.00 0.00 C ATOM 291 OE1 GLN A 19 -23.233 -5.013 -7.194 1.00 0.00 O ATOM 292 NE2 GLN A 19 -23.731 -2.832 -7.382 1.00 0.00 N ATOM 0 H GLN A 19 -19.582 -4.429 -3.663 1.00 0.00 H new ATOM 0 HA GLN A 19 -18.782 -4.032 -6.352 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -20.940 -5.005 -5.665 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -21.410 -3.488 -4.925 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -21.313 -2.376 -7.143 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -20.843 -3.893 -7.883 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -23.392 -1.870 -7.396 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -24.727 -3.023 -7.494 1.00 0.00 H new ATOM 301 N ASP A 20 -19.521 -1.348 -4.581 1.00 0.00 N ATOM 302 CA ASP A 20 -19.387 0.103 -4.531 1.00 0.00 C ATOM 303 C ASP A 20 -17.928 0.500 -4.672 1.00 0.00 C ATOM 304 O ASP A 20 -17.613 1.528 -5.266 1.00 0.00 O ATOM 305 CB ASP A 20 -19.962 0.651 -3.224 1.00 0.00 C ATOM 306 CG ASP A 20 -19.864 2.161 -3.135 1.00 0.00 C ATOM 307 OD1 ASP A 20 -18.732 2.687 -3.186 1.00 0.00 O ATOM 308 OD2 ASP A 20 -20.919 2.820 -3.012 1.00 0.00 O ATOM 0 H ASP A 20 -19.896 -1.765 -3.729 1.00 0.00 H new ATOM 0 HA ASP A 20 -19.949 0.531 -5.361 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -21.007 0.352 -3.137 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -19.432 0.205 -2.382 1.00 0.00 H new ATOM 313 N SER A 21 -17.039 -0.322 -4.131 1.00 0.00 N ATOM 314 CA SER A 21 -15.616 -0.049 -4.218 1.00 0.00 C ATOM 315 C SER A 21 -15.165 -0.118 -5.667 1.00 0.00 C ATOM 316 O SER A 21 -14.421 0.737 -6.146 1.00 0.00 O ATOM 317 CB SER A 21 -14.820 -1.039 -3.367 1.00 0.00 C ATOM 318 OG SER A 21 -13.429 -0.803 -3.476 1.00 0.00 O ATOM 0 H SER A 21 -17.279 -1.178 -3.631 1.00 0.00 H new ATOM 0 HA SER A 21 -15.431 0.954 -3.834 1.00 0.00 H new ATOM 0 HB2 SER A 21 -15.125 -0.954 -2.324 1.00 0.00 H new ATOM 0 HB3 SER A 21 -15.045 -2.058 -3.683 1.00 0.00 H new ATOM 0 HG SER A 21 -13.029 -1.471 -4.071 1.00 0.00 H new ATOM 324 N VAL A 22 -15.641 -1.142 -6.362 1.00 0.00 N ATOM 325 CA VAL A 22 -15.316 -1.337 -7.765 1.00 0.00 C ATOM 326 C VAL A 22 -15.913 -0.221 -8.609 1.00 0.00 C ATOM 327 O VAL A 22 -15.264 0.317 -9.505 1.00 0.00 O ATOM 328 CB VAL A 22 -15.852 -2.693 -8.264 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.492 -2.921 -9.724 1.00 0.00 C ATOM 330 CG2 VAL A 22 -15.331 -3.827 -7.392 1.00 0.00 C ATOM 0 H VAL A 22 -16.258 -1.854 -5.972 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.230 -1.323 -7.863 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.939 -2.676 -8.190 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.883 -3.885 -10.049 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.927 -2.129 -10.334 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.408 -2.912 -9.837 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -15.720 -4.777 -7.759 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.242 -3.843 -7.428 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -15.658 -3.675 -6.363 1.00 0.00 H new ATOM 340 N GLU A 23 -17.160 0.119 -8.311 1.00 0.00 N ATOM 341 CA GLU A 23 -17.862 1.166 -9.028 1.00 0.00 C ATOM 342 C GLU A 23 -17.211 2.522 -8.792 1.00 0.00 C ATOM 343 O GLU A 23 -16.986 3.287 -9.732 1.00 0.00 O ATOM 344 CB GLU A 23 -19.327 1.199 -8.590 1.00 0.00 C ATOM 345 CG GLU A 23 -20.131 2.314 -9.229 1.00 0.00 C ATOM 346 CD GLU A 23 -20.215 2.190 -10.739 1.00 0.00 C ATOM 347 OE1 GLU A 23 -19.654 1.218 -11.289 1.00 0.00 O ATOM 348 OE2 GLU A 23 -20.843 3.065 -11.372 1.00 0.00 O ATOM 0 H GLU A 23 -17.707 -0.321 -7.571 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.809 0.949 -10.095 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -19.791 0.243 -8.834 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.370 1.307 -7.506 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -21.138 2.313 -8.813 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -19.681 3.273 -8.973 1.00 0.00 H new ATOM 355 N CYS A 24 -16.907 2.818 -7.534 1.00 0.00 N ATOM 356 CA CYS A 24 -16.281 4.092 -7.198 1.00 0.00 C ATOM 357 C CYS A 24 -14.855 4.153 -7.733 1.00 0.00 C ATOM 358 O CYS A 24 -14.360 5.223 -8.088 1.00 0.00 O ATOM 359 CB CYS A 24 -16.291 4.333 -5.688 1.00 0.00 C ATOM 360 SG CYS A 24 -15.260 3.194 -4.745 1.00 0.00 S ATOM 0 H CYS A 24 -17.081 2.203 -6.739 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.865 4.881 -7.672 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -15.957 5.352 -5.493 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -17.317 4.259 -5.327 1.00 0.00 H new ATOM 0 HG CYS A 24 -14.726 2.324 -5.550 1.00 0.00 H new ATOM 366 N ALA A 25 -14.200 2.996 -7.803 1.00 0.00 N ATOM 367 CA ALA A 25 -12.842 2.926 -8.311 1.00 0.00 C ATOM 368 C ALA A 25 -12.841 3.240 -9.795 1.00 0.00 C ATOM 369 O ALA A 25 -11.942 3.908 -10.307 1.00 0.00 O ATOM 370 CB ALA A 25 -12.245 1.552 -8.053 1.00 0.00 C ATOM 0 H ALA A 25 -14.591 2.099 -7.514 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.228 3.661 -7.791 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.227 1.519 -8.441 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -12.231 1.357 -6.981 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.848 0.794 -8.552 1.00 0.00 H new ATOM 376 N THR A 26 -13.870 2.754 -10.481 1.00 0.00 N ATOM 377 CA THR A 26 -14.007 2.980 -11.907 1.00 0.00 C ATOM 378 C THR A 26 -14.153 4.467 -12.196 1.00 0.00 C ATOM 379 O THR A 26 -13.494 5.010 -13.085 1.00 0.00 O ATOM 380 CB THR A 26 -15.211 2.214 -12.457 1.00 0.00 C ATOM 381 OG1 THR A 26 -15.072 0.824 -12.219 1.00 0.00 O ATOM 382 CG2 THR A 26 -15.413 2.406 -13.945 1.00 0.00 C ATOM 0 H THR A 26 -14.620 2.201 -10.067 1.00 0.00 H new ATOM 0 HA THR A 26 -13.107 2.614 -12.402 1.00 0.00 H new ATOM 0 HB THR A 26 -16.076 2.620 -11.933 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.155 0.647 -11.259 1.00 0.00 H new ATOM 0 HG21 THR A 26 -16.283 1.836 -14.271 1.00 0.00 H new ATOM 0 HG22 THR A 26 -15.572 3.463 -14.157 1.00 0.00 H new ATOM 0 HG23 THR A 26 -14.530 2.057 -14.480 1.00 0.00 H new ATOM 390 N GLN A 27 -15.017 5.122 -11.430 1.00 0.00 N ATOM 391 CA GLN A 27 -15.251 6.553 -11.592 1.00 0.00 C ATOM 392 C GLN A 27 -13.946 7.328 -11.441 1.00 0.00 C ATOM 393 O GLN A 27 -13.649 8.224 -12.230 1.00 0.00 O ATOM 394 CB GLN A 27 -16.274 7.046 -10.567 1.00 0.00 C ATOM 395 CG GLN A 27 -17.632 6.372 -10.690 1.00 0.00 C ATOM 396 CD GLN A 27 -18.628 6.879 -9.667 1.00 0.00 C ATOM 397 OE1 GLN A 27 -18.410 6.765 -8.460 1.00 0.00 O ATOM 398 NE2 GLN A 27 -19.732 7.443 -10.144 1.00 0.00 N ATOM 0 H GLN A 27 -15.567 4.686 -10.690 1.00 0.00 H new ATOM 0 HA GLN A 27 -15.646 6.724 -12.593 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -15.882 6.875 -9.564 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -16.400 8.123 -10.681 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -18.028 6.540 -11.692 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -17.511 5.295 -10.572 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -19.872 7.517 -11.152 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -20.439 7.802 -9.503 1.00 0.00 H new ATOM 407 N ALA A 28 -13.167 6.968 -10.426 1.00 0.00 N ATOM 408 CA ALA A 28 -11.888 7.622 -10.171 1.00 0.00 C ATOM 409 C ALA A 28 -10.981 7.541 -11.394 1.00 0.00 C ATOM 410 O ALA A 28 -10.360 8.529 -11.787 1.00 0.00 O ATOM 411 CB ALA A 28 -11.208 6.987 -8.970 1.00 0.00 C ATOM 0 H ALA A 28 -13.399 6.226 -9.766 1.00 0.00 H new ATOM 0 HA ALA A 28 -12.078 8.674 -9.958 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.254 7.482 -8.788 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.846 7.094 -8.092 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.036 5.929 -9.167 1.00 0.00 H new ATOM 417 N LEU A 29 -10.913 6.357 -11.996 1.00 0.00 N ATOM 418 CA LEU A 29 -10.086 6.147 -13.178 1.00 0.00 C ATOM 419 C LEU A 29 -10.481 7.094 -14.303 1.00 0.00 C ATOM 420 O LEU A 29 -9.628 7.680 -14.968 1.00 0.00 O ATOM 421 CB LEU A 29 -10.196 4.699 -13.650 1.00 0.00 C ATOM 422 CG LEU A 29 -9.430 3.697 -12.794 1.00 0.00 C ATOM 423 CD1 LEU A 29 -9.845 2.273 -13.134 1.00 0.00 C ATOM 424 CD2 LEU A 29 -7.932 3.873 -12.988 1.00 0.00 C ATOM 0 H LEU A 29 -11.421 5.529 -11.684 1.00 0.00 H new ATOM 0 HA LEU A 29 -9.052 6.357 -12.905 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -11.248 4.414 -13.667 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -9.832 4.635 -14.675 1.00 0.00 H new ATOM 0 HG LEU A 29 -9.671 3.884 -11.747 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.287 1.573 -12.512 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -10.912 2.151 -12.949 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.634 2.073 -14.184 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -7.398 3.151 -12.371 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.679 3.712 -14.036 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -7.644 4.883 -12.697 1.00 0.00 H new ATOM 436 N GLU A 30 -11.782 7.238 -14.513 1.00 0.00 N ATOM 437 CA GLU A 30 -12.298 8.112 -15.559 1.00 0.00 C ATOM 438 C GLU A 30 -12.013 9.581 -15.249 1.00 0.00 C ATOM 439 O GLU A 30 -11.848 10.397 -16.157 1.00 0.00 O ATOM 440 CB GLU A 30 -13.804 7.901 -15.730 1.00 0.00 C ATOM 441 CG GLU A 30 -14.178 6.480 -16.122 1.00 0.00 C ATOM 442 CD GLU A 30 -13.564 6.060 -17.443 1.00 0.00 C ATOM 443 OE1 GLU A 30 -13.851 6.718 -18.467 1.00 0.00 O ATOM 444 OE2 GLU A 30 -12.796 5.075 -17.453 1.00 0.00 O ATOM 0 H GLU A 30 -12.502 6.760 -13.971 1.00 0.00 H new ATOM 0 HA GLU A 30 -11.789 7.855 -16.488 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.307 8.156 -14.797 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.175 8.588 -16.490 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -13.853 5.794 -15.340 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -15.263 6.398 -16.187 1.00 0.00 H new ATOM 451 N LYS A 31 -11.966 9.913 -13.964 1.00 0.00 N ATOM 452 CA LYS A 31 -11.717 11.282 -13.531 1.00 0.00 C ATOM 453 C LYS A 31 -10.235 11.627 -13.591 1.00 0.00 C ATOM 454 O LYS A 31 -9.867 12.759 -13.907 1.00 0.00 O ATOM 455 CB LYS A 31 -12.243 11.498 -12.113 1.00 0.00 C ATOM 456 CG LYS A 31 -13.753 11.368 -11.997 1.00 0.00 C ATOM 457 CD LYS A 31 -14.220 11.563 -10.562 1.00 0.00 C ATOM 458 CE LYS A 31 -15.729 11.435 -10.445 1.00 0.00 C ATOM 459 NZ LYS A 31 -16.197 11.629 -9.045 1.00 0.00 N ATOM 0 H LYS A 31 -12.098 9.249 -13.201 1.00 0.00 H new ATOM 0 HA LYS A 31 -12.247 11.944 -14.216 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -11.772 10.776 -11.446 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -11.945 12.489 -11.771 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -14.233 12.105 -12.641 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -14.063 10.385 -12.351 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -13.740 10.825 -9.919 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -13.909 12.546 -10.207 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -16.207 12.170 -11.092 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -16.038 10.451 -10.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -17.232 11.534 -9.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -15.761 10.912 -8.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -15.925 12.577 -8.716 1.00 0.00 H new ATOM 473 N TYR A 32 -9.385 10.658 -13.272 1.00 0.00 N ATOM 474 CA TYR A 32 -7.948 10.891 -13.279 1.00 0.00 C ATOM 475 C TYR A 32 -7.190 9.783 -14.002 1.00 0.00 C ATOM 476 O TYR A 32 -6.254 10.051 -14.754 1.00 0.00 O ATOM 477 CB TYR A 32 -7.430 11.017 -11.846 1.00 0.00 C ATOM 478 CG TYR A 32 -8.067 12.143 -11.067 1.00 0.00 C ATOM 479 CD1 TYR A 32 -7.895 13.468 -11.451 1.00 0.00 C ATOM 480 CD2 TYR A 32 -8.843 11.882 -9.946 1.00 0.00 C ATOM 481 CE1 TYR A 32 -8.476 14.499 -10.737 1.00 0.00 C ATOM 482 CE2 TYR A 32 -9.428 12.906 -9.228 1.00 0.00 C ATOM 483 CZ TYR A 32 -9.242 14.212 -9.625 1.00 0.00 C ATOM 484 OH TYR A 32 -9.823 15.235 -8.911 1.00 0.00 O ATOM 0 H TYR A 32 -9.663 9.713 -13.008 1.00 0.00 H new ATOM 0 HA TYR A 32 -7.773 11.821 -13.820 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -7.607 10.078 -11.321 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -6.351 11.169 -11.871 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -7.298 13.695 -12.322 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -8.992 10.860 -9.630 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -8.332 15.523 -11.047 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -10.029 12.684 -8.359 1.00 0.00 H new ATOM 0 HH TYR A 32 -10.329 14.863 -8.159 1.00 0.00 H new ATOM 494 N ASN A 33 -7.588 8.538 -13.762 1.00 0.00 N ATOM 495 CA ASN A 33 -6.935 7.390 -14.383 1.00 0.00 C ATOM 496 C ASN A 33 -5.520 7.217 -13.836 1.00 0.00 C ATOM 497 O ASN A 33 -4.562 7.064 -14.594 1.00 0.00 O ATOM 498 CB ASN A 33 -6.891 7.545 -15.908 1.00 0.00 C ATOM 499 CG ASN A 33 -6.287 6.337 -16.594 1.00 0.00 C ATOM 500 OD1 ASN A 33 -6.795 5.221 -16.475 1.00 0.00 O ATOM 501 ND2 ASN A 33 -5.194 6.551 -17.318 1.00 0.00 N ATOM 0 H ASN A 33 -8.361 8.298 -13.141 1.00 0.00 H new ATOM 0 HA ASN A 33 -7.518 6.501 -14.141 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -7.902 7.705 -16.284 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -6.312 8.432 -16.164 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -4.743 5.775 -17.802 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -4.806 7.492 -17.390 1.00 0.00 H new ATOM 508 N ILE A 34 -5.400 7.241 -12.512 1.00 0.00 N ATOM 509 CA ILE A 34 -4.107 7.087 -11.859 1.00 0.00 C ATOM 510 C ILE A 34 -4.247 6.285 -10.570 1.00 0.00 C ATOM 511 O ILE A 34 -5.236 6.414 -9.850 1.00 0.00 O ATOM 512 CB ILE A 34 -3.467 8.448 -11.532 1.00 0.00 C ATOM 513 CG1 ILE A 34 -3.420 9.328 -12.782 1.00 0.00 C ATOM 514 CG2 ILE A 34 -2.069 8.253 -10.961 1.00 0.00 C ATOM 515 CD1 ILE A 34 -2.813 10.693 -12.540 1.00 0.00 C ATOM 0 H ILE A 34 -6.184 7.366 -11.871 1.00 0.00 H new ATOM 0 HA ILE A 34 -3.461 6.555 -12.558 1.00 0.00 H new ATOM 0 HB ILE A 34 -4.078 8.949 -10.781 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -2.846 8.816 -13.555 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -4.432 9.453 -13.166 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -1.630 9.225 -10.735 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -2.128 7.660 -10.048 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -1.447 7.734 -11.691 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -2.813 11.261 -13.470 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -3.399 11.224 -11.790 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -1.789 10.578 -12.185 1.00 0.00 H new ATOM 527 N GLU A 35 -3.255 5.452 -10.296 1.00 0.00 N ATOM 528 CA GLU A 35 -3.258 4.606 -9.106 1.00 0.00 C ATOM 529 C GLU A 35 -3.574 5.407 -7.843 1.00 0.00 C ATOM 530 O GLU A 35 -4.495 5.074 -7.099 1.00 0.00 O ATOM 531 CB GLU A 35 -1.906 3.912 -8.943 1.00 0.00 C ATOM 532 CG GLU A 35 -1.436 3.175 -10.188 1.00 0.00 C ATOM 533 CD GLU A 35 -0.722 4.076 -11.177 1.00 0.00 C ATOM 534 OE1 GLU A 35 0.313 4.664 -10.802 1.00 0.00 O ATOM 535 OE2 GLU A 35 -1.198 4.191 -12.326 1.00 0.00 O ATOM 0 H GLU A 35 -2.430 5.341 -10.885 1.00 0.00 H new ATOM 0 HA GLU A 35 -4.040 3.859 -9.242 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -1.158 4.656 -8.669 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -1.969 3.204 -8.116 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -0.767 2.366 -9.894 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -2.295 2.716 -10.678 1.00 0.00 H new ATOM 542 N LYS A 36 -2.798 6.457 -7.606 1.00 0.00 N ATOM 543 CA LYS A 36 -2.986 7.300 -6.429 1.00 0.00 C ATOM 544 C LYS A 36 -4.385 7.909 -6.398 1.00 0.00 C ATOM 545 O LYS A 36 -5.102 7.799 -5.403 1.00 0.00 O ATOM 546 CB LYS A 36 -1.951 8.421 -6.414 1.00 0.00 C ATOM 547 CG LYS A 36 -2.023 9.298 -5.176 1.00 0.00 C ATOM 548 CD LYS A 36 -1.313 10.622 -5.393 1.00 0.00 C ATOM 549 CE LYS A 36 -2.070 11.503 -6.373 1.00 0.00 C ATOM 550 NZ LYS A 36 -3.434 11.842 -5.876 1.00 0.00 N ATOM 0 H LYS A 36 -2.031 6.747 -8.213 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.862 6.669 -5.549 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -0.954 7.985 -6.483 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.089 9.043 -7.298 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.066 9.481 -4.918 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.573 8.776 -4.332 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -1.209 11.141 -4.440 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -0.306 10.439 -5.768 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.508 12.421 -6.545 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.150 10.993 -7.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -3.799 12.665 -6.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -4.068 11.031 -6.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -3.388 12.067 -4.862 1.00 0.00 H new ATOM 564 N ASP A 37 -4.759 8.565 -7.492 1.00 0.00 N ATOM 565 CA ASP A 37 -6.065 9.214 -7.600 1.00 0.00 C ATOM 566 C ASP A 37 -7.200 8.266 -7.215 1.00 0.00 C ATOM 567 O ASP A 37 -8.114 8.646 -6.478 1.00 0.00 O ATOM 568 CB ASP A 37 -6.273 9.738 -9.019 1.00 0.00 C ATOM 569 CG ASP A 37 -5.274 10.821 -9.382 1.00 0.00 C ATOM 570 OD1 ASP A 37 -4.056 10.551 -9.324 1.00 0.00 O ATOM 571 OD2 ASP A 37 -5.709 11.941 -9.723 1.00 0.00 O ATOM 0 H ASP A 37 -4.174 8.662 -8.322 1.00 0.00 H new ATOM 0 HA ASP A 37 -6.081 10.050 -6.900 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.185 8.913 -9.726 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -7.285 10.132 -9.114 1.00 0.00 H new ATOM 576 N ILE A 38 -7.135 7.029 -7.700 1.00 0.00 N ATOM 577 CA ILE A 38 -8.162 6.041 -7.386 1.00 0.00 C ATOM 578 C ILE A 38 -8.361 5.946 -5.877 1.00 0.00 C ATOM 579 O ILE A 38 -9.488 5.866 -5.390 1.00 0.00 O ATOM 580 CB ILE A 38 -7.804 4.647 -7.950 1.00 0.00 C ATOM 581 CG1 ILE A 38 -7.793 4.678 -9.478 1.00 0.00 C ATOM 582 CG2 ILE A 38 -8.788 3.595 -7.452 1.00 0.00 C ATOM 583 CD1 ILE A 38 -7.385 3.363 -10.107 1.00 0.00 C ATOM 0 H ILE A 38 -6.389 6.689 -8.307 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.088 6.371 -7.857 1.00 0.00 H new ATOM 0 HB ILE A 38 -6.808 4.381 -7.597 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -8.787 4.949 -9.835 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -7.110 5.459 -9.813 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -8.518 2.621 -7.861 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -8.756 3.553 -6.363 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -9.795 3.857 -7.775 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.400 3.459 -11.193 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.379 3.100 -9.780 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -8.082 2.582 -9.802 1.00 0.00 H new ATOM 595 N ALA A 39 -7.255 5.964 -5.146 1.00 0.00 N ATOM 596 CA ALA A 39 -7.296 5.890 -3.694 1.00 0.00 C ATOM 597 C ALA A 39 -7.996 7.108 -3.099 1.00 0.00 C ATOM 598 O ALA A 39 -8.678 7.006 -2.080 1.00 0.00 O ATOM 599 CB ALA A 39 -5.888 5.759 -3.134 1.00 0.00 C ATOM 0 H ALA A 39 -6.315 6.029 -5.538 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.870 5.006 -3.416 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.933 5.705 -2.046 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.424 4.853 -3.524 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -5.297 6.626 -3.430 1.00 0.00 H new ATOM 605 N ALA A 40 -7.818 8.264 -3.737 1.00 0.00 N ATOM 606 CA ALA A 40 -8.430 9.497 -3.259 1.00 0.00 C ATOM 607 C ALA A 40 -9.952 9.404 -3.272 1.00 0.00 C ATOM 608 O ALA A 40 -10.612 9.707 -2.278 1.00 0.00 O ATOM 609 CB ALA A 40 -7.966 10.677 -4.102 1.00 0.00 C ATOM 0 H ALA A 40 -7.257 8.370 -4.582 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.113 9.650 -2.227 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -8.431 11.592 -3.734 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.882 10.768 -4.035 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.253 10.517 -5.141 1.00 0.00 H new ATOM 615 N HIS A 41 -10.505 8.983 -4.404 1.00 0.00 N ATOM 616 CA HIS A 41 -11.954 8.853 -4.544 1.00 0.00 C ATOM 617 C HIS A 41 -12.516 7.759 -3.642 1.00 0.00 C ATOM 618 O HIS A 41 -13.420 8.000 -2.843 1.00 0.00 O ATOM 619 CB HIS A 41 -12.316 8.539 -5.995 1.00 0.00 C ATOM 620 CG HIS A 41 -12.223 9.716 -6.913 1.00 0.00 C ATOM 621 ND1 HIS A 41 -13.096 10.779 -6.860 1.00 0.00 N ATOM 622 CD2 HIS A 41 -11.362 9.985 -7.920 1.00 0.00 C ATOM 623 CE1 HIS A 41 -12.781 11.650 -7.801 1.00 0.00 C ATOM 624 NE2 HIS A 41 -11.733 11.193 -8.460 1.00 0.00 N ATOM 0 H HIS A 41 -9.975 8.726 -5.237 1.00 0.00 H new ATOM 0 HA HIS A 41 -12.394 9.804 -4.245 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -11.656 7.752 -6.361 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -13.332 8.145 -6.028 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -10.537 9.366 -8.240 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -13.294 12.580 -7.998 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -11.274 11.660 -9.242 1.00 0.00 H new ATOM 633 N ILE A 42 -11.986 6.553 -3.793 1.00 0.00 N ATOM 634 CA ILE A 42 -12.443 5.409 -3.014 1.00 0.00 C ATOM 635 C ILE A 42 -12.361 5.669 -1.509 1.00 0.00 C ATOM 636 O ILE A 42 -13.329 5.454 -0.778 1.00 0.00 O ATOM 637 CB ILE A 42 -11.619 4.148 -3.358 1.00 0.00 C ATOM 638 CG1 ILE A 42 -11.703 3.847 -4.857 1.00 0.00 C ATOM 639 CG2 ILE A 42 -12.098 2.952 -2.546 1.00 0.00 C ATOM 640 CD1 ILE A 42 -10.901 2.635 -5.274 1.00 0.00 C ATOM 0 H ILE A 42 -11.236 6.340 -4.451 1.00 0.00 H new ATOM 0 HA ILE A 42 -13.488 5.248 -3.277 1.00 0.00 H new ATOM 0 HB ILE A 42 -10.577 4.339 -3.101 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -12.747 3.694 -5.131 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -11.351 4.715 -5.414 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -11.504 2.075 -2.804 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -11.986 3.166 -1.483 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.147 2.758 -2.769 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -11.006 2.481 -6.348 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -9.850 2.793 -5.031 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -11.268 1.756 -4.744 1.00 0.00 H new ATOM 652 N LYS A 43 -11.197 6.116 -1.052 1.00 0.00 N ATOM 653 CA LYS A 43 -10.980 6.383 0.368 1.00 0.00 C ATOM 654 C LYS A 43 -11.949 7.437 0.903 1.00 0.00 C ATOM 655 O LYS A 43 -12.607 7.225 1.921 1.00 0.00 O ATOM 656 CB LYS A 43 -9.533 6.838 0.590 1.00 0.00 C ATOM 657 CG LYS A 43 -9.060 6.773 2.040 1.00 0.00 C ATOM 658 CD LYS A 43 -9.808 7.741 2.947 1.00 0.00 C ATOM 659 CE LYS A 43 -9.746 9.171 2.428 1.00 0.00 C ATOM 660 NZ LYS A 43 -10.474 10.117 3.317 1.00 0.00 N ATOM 0 H LYS A 43 -10.387 6.302 -1.644 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.165 5.459 0.916 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.874 6.221 -0.021 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -9.430 7.863 0.234 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.189 5.758 2.415 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -7.994 6.995 2.080 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -10.849 7.430 3.029 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.383 7.700 3.950 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -8.705 9.481 2.343 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -10.174 9.212 1.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -10.408 11.079 2.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.474 9.836 3.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -10.050 10.097 4.266 1.00 0.00 H new ATOM 674 N LYS A 44 -12.017 8.580 0.230 1.00 0.00 N ATOM 675 CA LYS A 44 -12.884 9.673 0.665 1.00 0.00 C ATOM 676 C LYS A 44 -14.365 9.303 0.624 1.00 0.00 C ATOM 677 O LYS A 44 -15.081 9.498 1.605 1.00 0.00 O ATOM 678 CB LYS A 44 -12.634 10.919 -0.184 1.00 0.00 C ATOM 679 CG LYS A 44 -11.227 11.479 -0.044 1.00 0.00 C ATOM 680 CD LYS A 44 -11.017 12.686 -0.943 1.00 0.00 C ATOM 681 CE LYS A 44 -9.611 13.244 -0.805 1.00 0.00 C ATOM 682 NZ LYS A 44 -9.320 13.676 0.591 1.00 0.00 N ATOM 0 H LYS A 44 -11.484 8.775 -0.617 1.00 0.00 H new ATOM 0 HA LYS A 44 -12.632 9.880 1.705 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -12.818 10.678 -1.231 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -13.352 11.689 0.096 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -11.048 11.761 0.994 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -10.500 10.706 -0.294 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.198 12.404 -1.980 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -11.743 13.459 -0.691 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -8.888 12.487 -1.109 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -9.488 14.091 -1.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -8.459 14.260 0.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -10.120 14.232 0.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -9.178 12.839 1.191 1.00 0.00 H new ATOM 696 N GLU A 45 -14.829 8.787 -0.510 1.00 0.00 N ATOM 697 CA GLU A 45 -16.236 8.418 -0.644 1.00 0.00 C ATOM 698 C GLU A 45 -16.684 7.510 0.495 1.00 0.00 C ATOM 699 O GLU A 45 -17.737 7.729 1.094 1.00 0.00 O ATOM 700 CB GLU A 45 -16.495 7.743 -1.991 1.00 0.00 C ATOM 701 CG GLU A 45 -16.336 8.677 -3.181 1.00 0.00 C ATOM 702 CD GLU A 45 -16.702 8.016 -4.496 1.00 0.00 C ATOM 703 OE1 GLU A 45 -17.137 6.845 -4.472 1.00 0.00 O ATOM 704 OE2 GLU A 45 -16.559 8.671 -5.548 1.00 0.00 O ATOM 0 H GLU A 45 -14.261 8.616 -1.340 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.821 9.336 -0.595 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.809 6.903 -2.105 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.505 7.333 -1.994 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.963 9.556 -3.034 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.304 9.026 -3.229 1.00 0.00 H new ATOM 711 N PHE A 46 -15.884 6.494 0.798 1.00 0.00 N ATOM 712 CA PHE A 46 -16.218 5.568 1.873 1.00 0.00 C ATOM 713 C PHE A 46 -15.973 6.196 3.244 1.00 0.00 C ATOM 714 O PHE A 46 -16.823 6.119 4.130 1.00 0.00 O ATOM 715 CB PHE A 46 -15.425 4.271 1.734 1.00 0.00 C ATOM 716 CG PHE A 46 -15.825 3.452 0.542 1.00 0.00 C ATOM 717 CD1 PHE A 46 -17.142 3.057 0.372 1.00 0.00 C ATOM 718 CD2 PHE A 46 -14.890 3.071 -0.404 1.00 0.00 C ATOM 719 CE1 PHE A 46 -17.520 2.300 -0.719 1.00 0.00 C ATOM 720 CE2 PHE A 46 -15.259 2.313 -1.499 1.00 0.00 C ATOM 721 CZ PHE A 46 -16.576 1.927 -1.656 1.00 0.00 C ATOM 0 H PHE A 46 -15.007 6.292 0.319 1.00 0.00 H new ATOM 0 HA PHE A 46 -17.280 5.338 1.793 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -14.364 4.509 1.662 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -15.558 3.674 2.636 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -17.883 3.345 1.103 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -13.859 3.370 -0.285 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -18.551 2.000 -0.839 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -14.519 2.023 -2.230 1.00 0.00 H new ATOM 0 HZ PHE A 46 -16.867 1.334 -2.510 1.00 0.00 H new ATOM 731 N ASP A 47 -14.814 6.821 3.407 1.00 0.00 N ATOM 732 CA ASP A 47 -14.460 7.467 4.665 1.00 0.00 C ATOM 733 C ASP A 47 -15.560 8.430 5.108 1.00 0.00 C ATOM 734 O ASP A 47 -15.842 8.563 6.297 1.00 0.00 O ATOM 735 CB ASP A 47 -13.133 8.216 4.510 1.00 0.00 C ATOM 736 CG ASP A 47 -12.732 8.965 5.765 1.00 0.00 C ATOM 737 OD1 ASP A 47 -13.486 9.868 6.183 1.00 0.00 O ATOM 738 OD2 ASP A 47 -11.665 8.649 6.330 1.00 0.00 O ATOM 0 H ASP A 47 -14.101 6.895 2.681 1.00 0.00 H new ATOM 0 HA ASP A 47 -14.350 6.699 5.431 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -12.348 7.506 4.250 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -13.213 8.920 3.682 1.00 0.00 H new ATOM 743 N LYS A 48 -16.169 9.103 4.142 1.00 0.00 N ATOM 744 CA LYS A 48 -17.232 10.056 4.419 1.00 0.00 C ATOM 745 C LYS A 48 -18.592 9.367 4.510 1.00 0.00 C ATOM 746 O LYS A 48 -19.411 9.696 5.368 1.00 0.00 O ATOM 747 CB LYS A 48 -17.259 11.125 3.324 1.00 0.00 C ATOM 748 CG LYS A 48 -18.438 12.073 3.427 1.00 0.00 C ATOM 749 CD LYS A 48 -18.436 12.823 4.748 1.00 0.00 C ATOM 750 CE LYS A 48 -17.186 13.675 4.902 1.00 0.00 C ATOM 751 NZ LYS A 48 -17.064 14.689 3.817 1.00 0.00 N ATOM 0 H LYS A 48 -15.942 9.005 3.152 1.00 0.00 H new ATOM 0 HA LYS A 48 -17.030 10.521 5.384 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -16.335 11.702 3.369 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -17.282 10.635 2.351 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -18.406 12.786 2.603 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -19.367 11.512 3.327 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -19.320 13.458 4.809 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -18.497 12.112 5.572 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -17.208 14.179 5.868 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -16.306 13.032 4.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.310 15.365 4.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -16.831 14.213 2.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -17.965 15.198 3.714 1.00 0.00 H new ATOM 765 N LYS A 49 -18.832 8.432 3.602 1.00 0.00 N ATOM 766 CA LYS A 49 -20.098 7.712 3.550 1.00 0.00 C ATOM 767 C LYS A 49 -20.219 6.664 4.654 1.00 0.00 C ATOM 768 O LYS A 49 -21.117 6.729 5.493 1.00 0.00 O ATOM 769 CB LYS A 49 -20.257 7.044 2.184 1.00 0.00 C ATOM 770 CG LYS A 49 -21.552 6.264 2.034 1.00 0.00 C ATOM 771 CD LYS A 49 -22.765 7.159 2.219 1.00 0.00 C ATOM 772 CE LYS A 49 -24.060 6.375 2.081 1.00 0.00 C ATOM 773 NZ LYS A 49 -24.160 5.285 3.090 1.00 0.00 N ATOM 0 H LYS A 49 -18.162 8.152 2.886 1.00 0.00 H new ATOM 0 HA LYS A 49 -20.893 8.441 3.706 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -20.211 7.808 1.408 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -19.416 6.371 2.018 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -21.587 5.801 1.048 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -21.579 5.457 2.766 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -22.726 7.629 3.202 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -22.743 7.961 1.481 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -24.907 7.051 2.192 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -24.122 5.949 1.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -25.141 4.943 3.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -23.532 4.502 2.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -23.876 5.648 4.022 1.00 0.00 H new ATOM 787 N TYR A 50 -19.322 5.691 4.629 1.00 0.00 N ATOM 788 CA TYR A 50 -19.332 4.610 5.609 1.00 0.00 C ATOM 789 C TYR A 50 -18.613 4.994 6.898 1.00 0.00 C ATOM 790 O TYR A 50 -18.788 4.335 7.921 1.00 0.00 O ATOM 791 CB TYR A 50 -18.710 3.350 5.007 1.00 0.00 C ATOM 792 CG TYR A 50 -19.516 2.776 3.861 1.00 0.00 C ATOM 793 CD1 TYR A 50 -19.764 3.528 2.719 1.00 0.00 C ATOM 794 CD2 TYR A 50 -20.033 1.489 3.925 1.00 0.00 C ATOM 795 CE1 TYR A 50 -20.504 3.015 1.674 1.00 0.00 C ATOM 796 CE2 TYR A 50 -20.773 0.966 2.881 1.00 0.00 C ATOM 797 CZ TYR A 50 -21.006 1.733 1.759 1.00 0.00 C ATOM 798 OH TYR A 50 -21.745 1.217 0.718 1.00 0.00 O ATOM 0 H TYR A 50 -18.574 5.625 3.939 1.00 0.00 H new ATOM 0 HA TYR A 50 -20.372 4.412 5.868 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -17.705 3.581 4.655 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -18.609 2.594 5.786 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -19.371 4.531 2.648 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -19.854 0.887 4.804 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -20.689 3.614 0.794 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -21.166 -0.038 2.944 1.00 0.00 H new ATOM 0 HH TYR A 50 -22.023 0.303 0.936 1.00 0.00 H new ATOM 808 N ASN A 51 -17.794 6.046 6.832 1.00 0.00 N ATOM 809 CA ASN A 51 -17.023 6.525 7.983 1.00 0.00 C ATOM 810 C ASN A 51 -15.639 5.898 7.973 1.00 0.00 C ATOM 811 O ASN A 51 -15.463 4.772 7.506 1.00 0.00 O ATOM 812 CB ASN A 51 -17.724 6.228 9.317 1.00 0.00 C ATOM 813 CG ASN A 51 -19.147 6.749 9.350 1.00 0.00 C ATOM 814 OD1 ASN A 51 -19.386 7.947 9.196 1.00 0.00 O ATOM 815 ND2 ASN A 51 -20.102 5.850 9.555 1.00 0.00 N ATOM 0 H ASN A 51 -17.646 6.589 5.981 1.00 0.00 H new ATOM 0 HA ASN A 51 -16.940 7.608 7.894 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -17.730 5.152 9.490 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -17.156 6.678 10.131 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -21.079 6.142 9.590 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -19.859 4.867 9.678 1.00 0.00 H new ATOM 822 N PRO A 52 -14.626 6.620 8.471 1.00 0.00 N ATOM 823 CA PRO A 52 -13.255 6.116 8.491 1.00 0.00 C ATOM 824 C PRO A 52 -13.130 4.816 9.289 1.00 0.00 C ATOM 825 O PRO A 52 -14.061 4.434 10.000 1.00 0.00 O ATOM 826 CB PRO A 52 -12.454 7.234 9.170 1.00 0.00 C ATOM 827 CG PRO A 52 -13.308 8.452 9.076 1.00 0.00 C ATOM 828 CD PRO A 52 -14.731 7.973 9.042 1.00 0.00 C ATOM 0 HA PRO A 52 -12.902 5.879 7.487 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -12.238 6.986 10.209 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -11.496 7.387 8.673 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -13.140 9.110 9.929 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -13.070 9.025 8.180 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -15.172 7.955 10.039 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -15.358 8.620 8.428 1.00 0.00 H new ATOM 836 N THR A 53 -11.986 4.128 9.175 1.00 0.00 N ATOM 837 CA THR A 53 -10.876 4.568 8.335 1.00 0.00 C ATOM 838 C THR A 53 -10.626 3.571 7.212 1.00 0.00 C ATOM 839 O THR A 53 -10.470 2.378 7.463 1.00 0.00 O ATOM 840 CB THR A 53 -9.616 4.721 9.184 1.00 0.00 C ATOM 841 OG1 THR A 53 -8.555 5.269 8.422 1.00 0.00 O ATOM 842 CG2 THR A 53 -9.129 3.412 9.773 1.00 0.00 C ATOM 0 H THR A 53 -11.809 3.251 9.665 1.00 0.00 H new ATOM 0 HA THR A 53 -11.133 5.530 7.892 1.00 0.00 H new ATOM 0 HB THR A 53 -9.899 5.387 9.999 1.00 0.00 H new ATOM 0 HG1 THR A 53 -7.701 5.070 8.860 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.231 3.591 10.365 1.00 0.00 H new ATOM 0 HG22 THR A 53 -9.905 2.989 10.410 1.00 0.00 H new ATOM 0 HG23 THR A 53 -8.900 2.714 8.968 1.00 0.00 H new ATOM 850 N TRP A 54 -10.599 4.060 5.976 1.00 0.00 N ATOM 851 CA TRP A 54 -10.380 3.193 4.825 1.00 0.00 C ATOM 852 C TRP A 54 -8.980 3.341 4.248 1.00 0.00 C ATOM 853 O TRP A 54 -8.489 4.452 4.047 1.00 0.00 O ATOM 854 CB TRP A 54 -11.409 3.485 3.742 1.00 0.00 C ATOM 855 CG TRP A 54 -12.810 3.237 4.188 1.00 0.00 C ATOM 856 CD1 TRP A 54 -13.463 3.854 5.212 1.00 0.00 C ATOM 857 CD2 TRP A 54 -13.728 2.292 3.631 1.00 0.00 C ATOM 858 NE1 TRP A 54 -14.739 3.365 5.320 1.00 0.00 N ATOM 859 CE2 TRP A 54 -14.926 2.400 4.361 1.00 0.00 C ATOM 860 CE3 TRP A 54 -13.653 1.368 2.584 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -16.043 1.622 4.074 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -14.764 0.593 2.303 1.00 0.00 C ATOM 863 CH2 TRP A 54 -15.945 0.726 3.045 1.00 0.00 C ATOM 0 H TRP A 54 -10.725 5.046 5.747 1.00 0.00 H new ATOM 0 HA TRP A 54 -10.489 2.166 5.175 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -11.312 4.524 3.427 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -11.196 2.867 2.870 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -13.037 4.617 5.846 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -15.435 3.668 6.001 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -12.746 1.262 2.007 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -16.955 1.722 4.643 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -14.720 -0.126 1.499 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -16.796 0.108 2.799 1.00 0.00 H new ATOM 874 N HIS A 55 -8.357 2.206 3.966 1.00 0.00 N ATOM 875 CA HIS A 55 -7.025 2.182 3.386 1.00 0.00 C ATOM 876 C HIS A 55 -7.114 1.687 1.947 1.00 0.00 C ATOM 877 O HIS A 55 -7.887 0.771 1.653 1.00 0.00 O ATOM 878 CB HIS A 55 -6.115 1.274 4.209 1.00 0.00 C ATOM 879 CG HIS A 55 -6.305 1.433 5.686 1.00 0.00 C ATOM 880 ND1 HIS A 55 -6.144 2.634 6.345 1.00 0.00 N ATOM 881 CD2 HIS A 55 -6.653 0.532 6.630 1.00 0.00 C ATOM 882 CE1 HIS A 55 -6.382 2.461 7.633 1.00 0.00 C ATOM 883 NE2 HIS A 55 -6.693 1.193 7.834 1.00 0.00 N ATOM 0 H HIS A 55 -8.758 1.283 4.132 1.00 0.00 H new ATOM 0 HA HIS A 55 -6.603 3.187 3.392 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -6.303 0.236 3.934 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.076 1.487 3.958 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -5.882 3.517 5.907 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.861 -0.515 6.468 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -6.331 3.227 8.393 1.00 0.00 H new ATOM 892 N CYS A 56 -6.350 2.296 1.046 1.00 0.00 N ATOM 893 CA CYS A 56 -6.395 1.899 -0.358 1.00 0.00 C ATOM 894 C CYS A 56 -5.006 1.834 -0.983 1.00 0.00 C ATOM 895 O CYS A 56 -4.087 2.543 -0.574 1.00 0.00 O ATOM 896 CB CYS A 56 -7.276 2.865 -1.151 1.00 0.00 C ATOM 897 SG CYS A 56 -7.458 2.432 -2.897 1.00 0.00 S ATOM 0 H CYS A 56 -5.702 3.055 1.257 1.00 0.00 H new ATOM 0 HA CYS A 56 -6.821 0.896 -0.397 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -8.264 2.900 -0.691 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -6.855 3.868 -1.078 1.00 0.00 H new ATOM 0 HG CYS A 56 -7.584 1.143 -3.014 1.00 0.00 H new ATOM 903 N ILE A 57 -4.876 0.973 -1.988 1.00 0.00 N ATOM 904 CA ILE A 57 -3.619 0.788 -2.700 1.00 0.00 C ATOM 905 C ILE A 57 -3.892 0.394 -4.149 1.00 0.00 C ATOM 906 O ILE A 57 -4.866 -0.302 -4.437 1.00 0.00 O ATOM 907 CB ILE A 57 -2.746 -0.293 -2.031 1.00 0.00 C ATOM 908 CG1 ILE A 57 -2.471 0.074 -0.571 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.438 -0.470 -2.791 1.00 0.00 C ATOM 910 CD1 ILE A 57 -1.619 -0.942 0.158 1.00 0.00 C ATOM 0 H ILE A 57 -5.637 0.386 -2.330 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.078 1.734 -2.670 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.288 -1.239 -2.055 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.975 1.044 -0.536 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -3.421 0.182 -0.047 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.835 -1.237 -2.304 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -1.651 -0.773 -3.816 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -0.890 0.472 -2.797 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -1.465 -0.617 1.187 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -2.123 -1.909 0.155 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -0.655 -1.034 -0.342 1.00 0.00 H new ATOM 922 N VAL A 58 -3.039 0.850 -5.060 1.00 0.00 N ATOM 923 CA VAL A 58 -3.204 0.552 -6.477 1.00 0.00 C ATOM 924 C VAL A 58 -1.875 0.655 -7.213 1.00 0.00 C ATOM 925 O VAL A 58 -1.086 1.563 -6.962 1.00 0.00 O ATOM 926 CB VAL A 58 -4.219 1.509 -7.135 1.00 0.00 C ATOM 927 CG1 VAL A 58 -4.429 1.155 -8.602 1.00 0.00 C ATOM 928 CG2 VAL A 58 -5.542 1.492 -6.384 1.00 0.00 C ATOM 0 H VAL A 58 -2.227 1.427 -4.842 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.579 -0.469 -6.548 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.811 2.518 -7.085 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -5.149 1.844 -9.043 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.481 1.231 -9.134 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -4.808 0.136 -8.680 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -6.243 2.174 -6.866 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -5.953 0.483 -6.394 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -5.379 1.807 -5.353 1.00 0.00 H new ATOM 938 N GLY A 59 -1.635 -0.283 -8.123 1.00 0.00 N ATOM 939 CA GLY A 59 -0.400 -0.275 -8.882 1.00 0.00 C ATOM 940 C GLY A 59 -0.310 -1.436 -9.855 1.00 0.00 C ATOM 941 O GLY A 59 -1.287 -1.766 -10.528 1.00 0.00 O ATOM 0 H GLY A 59 -2.273 -1.047 -8.348 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -0.321 0.663 -9.432 1.00 0.00 H new ATOM 0 HA3 GLY A 59 0.445 -0.314 -8.195 1.00 0.00 H new ATOM 945 N ARG A 60 0.863 -2.052 -9.927 1.00 0.00 N ATOM 946 CA ARG A 60 1.073 -3.182 -10.830 1.00 0.00 C ATOM 947 C ARG A 60 2.458 -3.793 -10.621 1.00 0.00 C ATOM 948 O ARG A 60 3.123 -4.186 -11.577 1.00 0.00 O ATOM 949 CB ARG A 60 0.910 -2.724 -12.280 1.00 0.00 C ATOM 950 CG ARG A 60 0.927 -3.858 -13.294 1.00 0.00 C ATOM 951 CD ARG A 60 0.699 -3.338 -14.701 1.00 0.00 C ATOM 952 NE ARG A 60 1.717 -2.370 -15.100 1.00 0.00 N ATOM 953 CZ ARG A 60 1.740 -1.761 -16.284 1.00 0.00 C ATOM 954 NH1 ARG A 60 0.800 -2.015 -17.186 1.00 0.00 N ATOM 955 NH2 ARG A 60 2.704 -0.894 -16.564 1.00 0.00 N ATOM 0 H ARG A 60 1.681 -1.792 -9.375 1.00 0.00 H new ATOM 0 HA ARG A 60 0.328 -3.946 -10.610 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -0.030 -2.180 -12.375 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.710 -2.023 -12.521 1.00 0.00 H new ATOM 0 HG2 ARG A 60 1.884 -4.378 -13.246 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.156 -4.586 -13.043 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.700 -4.174 -15.401 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -0.285 -2.874 -14.760 1.00 0.00 H new ATOM 0 HE ARG A 60 2.455 -2.147 -14.432 1.00 0.00 H new ATOM 0 HH11 ARG A 60 0.056 -2.679 -16.974 1.00 0.00 H new ATOM 0 HH12 ARG A 60 0.822 -1.546 -18.091 1.00 0.00 H new ATOM 0 HH21 ARG A 60 3.427 -0.694 -15.873 1.00 0.00 H new ATOM 0 HH22 ARG A 60 2.722 -0.427 -17.471 1.00 0.00 H new ATOM 969 N ASN A 61 2.870 -3.868 -9.355 1.00 0.00 N ATOM 970 CA ASN A 61 4.163 -4.423 -8.959 1.00 0.00 C ATOM 971 C ASN A 61 4.561 -3.888 -7.588 1.00 0.00 C ATOM 972 O ASN A 61 5.305 -2.912 -7.494 1.00 0.00 O ATOM 973 CB ASN A 61 5.255 -4.078 -9.972 1.00 0.00 C ATOM 974 CG ASN A 61 6.561 -4.758 -9.641 1.00 0.00 C ATOM 975 OD1 ASN A 61 7.357 -4.263 -8.843 1.00 0.00 O ATOM 976 ND2 ASN A 61 6.757 -5.924 -10.228 1.00 0.00 N ATOM 0 H ASN A 61 2.309 -3.542 -8.568 1.00 0.00 H new ATOM 0 HA ASN A 61 4.060 -5.507 -8.920 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.933 -4.376 -10.970 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.403 -2.998 -9.994 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.601 -6.460 -10.027 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.064 -6.289 -10.882 1.00 0.00 H new ATOM 983 N PHE A 62 4.057 -4.509 -6.523 1.00 0.00 N ATOM 984 CA PHE A 62 4.373 -4.046 -5.178 1.00 0.00 C ATOM 985 C PHE A 62 3.838 -4.984 -4.101 1.00 0.00 C ATOM 986 O PHE A 62 2.694 -5.435 -4.159 1.00 0.00 O ATOM 987 CB PHE A 62 3.793 -2.646 -4.975 1.00 0.00 C ATOM 988 CG PHE A 62 2.287 -2.614 -4.973 1.00 0.00 C ATOM 989 CD1 PHE A 62 1.575 -3.017 -3.855 1.00 0.00 C ATOM 990 CD2 PHE A 62 1.586 -2.193 -6.092 1.00 0.00 C ATOM 991 CE1 PHE A 62 0.192 -2.999 -3.853 1.00 0.00 C ATOM 992 CE2 PHE A 62 0.204 -2.171 -6.094 1.00 0.00 C ATOM 993 CZ PHE A 62 -0.493 -2.575 -4.972 1.00 0.00 C ATOM 0 H PHE A 62 3.439 -5.320 -6.565 1.00 0.00 H new ATOM 0 HA PHE A 62 5.459 -4.026 -5.082 1.00 0.00 H new ATOM 0 HB2 PHE A 62 4.158 -2.244 -4.030 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.161 -1.991 -5.764 1.00 0.00 H new ATOM 0 HD1 PHE A 62 2.106 -3.349 -2.975 1.00 0.00 H new ATOM 0 HD2 PHE A 62 2.126 -1.878 -6.973 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.351 -3.317 -2.975 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -0.330 -1.838 -6.972 1.00 0.00 H new ATOM 0 HZ PHE A 62 -1.573 -2.559 -4.971 1.00 0.00 H new ATOM 1003 N GLY A 63 4.676 -5.249 -3.107 1.00 0.00 N ATOM 1004 CA GLY A 63 4.284 -6.105 -2.001 1.00 0.00 C ATOM 1005 C GLY A 63 3.588 -5.313 -0.909 1.00 0.00 C ATOM 1006 O GLY A 63 4.043 -4.226 -0.549 1.00 0.00 O ATOM 0 H GLY A 63 5.627 -4.884 -3.046 1.00 0.00 H new ATOM 0 HA2 GLY A 63 3.620 -6.890 -2.364 1.00 0.00 H new ATOM 0 HA3 GLY A 63 5.165 -6.598 -1.590 1.00 0.00 H new ATOM 1010 N SER A 64 2.482 -5.835 -0.386 1.00 0.00 N ATOM 1011 CA SER A 64 1.738 -5.131 0.656 1.00 0.00 C ATOM 1012 C SER A 64 1.448 -6.022 1.861 1.00 0.00 C ATOM 1013 O SER A 64 1.186 -7.220 1.722 1.00 0.00 O ATOM 1014 CB SER A 64 0.426 -4.583 0.094 1.00 0.00 C ATOM 1015 OG SER A 64 0.660 -3.753 -1.028 1.00 0.00 O ATOM 0 H SER A 64 2.084 -6.733 -0.662 1.00 0.00 H new ATOM 0 HA SER A 64 2.366 -4.307 0.995 1.00 0.00 H new ATOM 0 HB2 SER A 64 -0.225 -5.410 -0.191 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.096 -4.018 0.866 1.00 0.00 H new ATOM 0 HG SER A 64 0.915 -4.306 -1.796 1.00 0.00 H new ATOM 1021 N TYR A 65 1.486 -5.408 3.042 1.00 0.00 N ATOM 1022 CA TYR A 65 1.221 -6.101 4.297 1.00 0.00 C ATOM 1023 C TYR A 65 0.507 -5.145 5.253 1.00 0.00 C ATOM 1024 O TYR A 65 0.968 -4.027 5.479 1.00 0.00 O ATOM 1025 CB TYR A 65 2.535 -6.592 4.910 1.00 0.00 C ATOM 1026 CG TYR A 65 2.365 -7.681 5.946 1.00 0.00 C ATOM 1027 CD1 TYR A 65 1.727 -8.873 5.627 1.00 0.00 C ATOM 1028 CD2 TYR A 65 2.857 -7.525 7.235 1.00 0.00 C ATOM 1029 CE1 TYR A 65 1.583 -9.878 6.564 1.00 0.00 C ATOM 1030 CE2 TYR A 65 2.715 -8.525 8.178 1.00 0.00 C ATOM 1031 CZ TYR A 65 2.079 -9.698 7.837 1.00 0.00 C ATOM 1032 OH TYR A 65 1.942 -10.697 8.774 1.00 0.00 O ATOM 0 H TYR A 65 1.701 -4.417 3.154 1.00 0.00 H new ATOM 0 HA TYR A 65 0.585 -6.967 4.114 1.00 0.00 H new ATOM 0 HB2 TYR A 65 3.180 -6.962 4.113 1.00 0.00 H new ATOM 0 HB3 TYR A 65 3.048 -5.746 5.368 1.00 0.00 H new ATOM 0 HD1 TYR A 65 1.337 -9.016 4.630 1.00 0.00 H new ATOM 0 HD2 TYR A 65 3.359 -6.607 7.505 1.00 0.00 H new ATOM 0 HE1 TYR A 65 1.085 -10.799 6.300 1.00 0.00 H new ATOM 0 HE2 TYR A 65 3.101 -8.387 9.177 1.00 0.00 H new ATOM 0 HH TYR A 65 1.146 -10.526 9.320 1.00 0.00 H new ATOM 1042 N VAL A 66 -0.638 -5.572 5.779 1.00 0.00 N ATOM 1043 CA VAL A 66 -1.438 -4.732 6.672 1.00 0.00 C ATOM 1044 C VAL A 66 -2.368 -5.573 7.550 1.00 0.00 C ATOM 1045 O VAL A 66 -2.549 -6.760 7.305 1.00 0.00 O ATOM 1046 CB VAL A 66 -2.311 -3.756 5.847 1.00 0.00 C ATOM 1047 CG1 VAL A 66 -3.062 -2.788 6.746 1.00 0.00 C ATOM 1048 CG2 VAL A 66 -1.472 -3.000 4.830 1.00 0.00 C ATOM 0 H VAL A 66 -1.035 -6.495 5.603 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.742 -4.183 7.306 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.047 -4.352 5.308 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.665 -2.117 6.135 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.711 -3.347 7.420 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.349 -2.205 7.329 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.110 -2.321 4.264 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.702 -2.427 5.347 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.001 -3.708 4.148 1.00 0.00 H new ATOM 1058 N THR A 67 -2.967 -4.941 8.559 1.00 0.00 N ATOM 1059 CA THR A 67 -3.901 -5.618 9.459 1.00 0.00 C ATOM 1060 C THR A 67 -5.273 -4.958 9.371 1.00 0.00 C ATOM 1061 O THR A 67 -5.377 -3.775 9.049 1.00 0.00 O ATOM 1062 CB THR A 67 -3.385 -5.583 10.900 1.00 0.00 C ATOM 1063 OG1 THR A 67 -2.152 -6.271 11.006 1.00 0.00 O ATOM 1064 CG2 THR A 67 -4.342 -6.202 11.897 1.00 0.00 C ATOM 0 H THR A 67 -2.821 -3.955 8.775 1.00 0.00 H new ATOM 0 HA THR A 67 -3.987 -6.661 9.154 1.00 0.00 H new ATOM 0 HB THR A 67 -3.272 -4.526 11.140 1.00 0.00 H new ATOM 0 HG1 THR A 67 -2.269 -7.067 11.565 1.00 0.00 H new ATOM 0 HG21 THR A 67 -3.913 -6.143 12.897 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.289 -5.663 11.876 1.00 0.00 H new ATOM 0 HG23 THR A 67 -4.514 -7.246 11.637 1.00 0.00 H new ATOM 1072 N HIS A 68 -6.326 -5.730 9.623 1.00 0.00 N ATOM 1073 CA HIS A 68 -7.686 -5.205 9.534 1.00 0.00 C ATOM 1074 C HIS A 68 -8.693 -6.163 10.163 1.00 0.00 C ATOM 1075 O HIS A 68 -8.552 -7.382 10.054 1.00 0.00 O ATOM 1076 CB HIS A 68 -8.028 -4.989 8.065 1.00 0.00 C ATOM 1077 CG HIS A 68 -7.847 -6.232 7.258 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -8.748 -7.274 7.276 1.00 0.00 N ATOM 1079 CD2 HIS A 68 -6.836 -6.624 6.448 1.00 0.00 C ATOM 1080 CE1 HIS A 68 -8.299 -8.253 6.513 1.00 0.00 C ATOM 1081 NE2 HIS A 68 -7.141 -7.885 5.996 1.00 0.00 N ATOM 0 H HIS A 68 -6.266 -6.713 9.888 1.00 0.00 H new ATOM 0 HA HIS A 68 -7.738 -4.263 10.081 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -9.060 -4.649 7.980 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -7.397 -4.198 7.659 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -9.625 -7.287 7.797 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -5.954 -6.052 6.203 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -8.795 -9.197 6.341 1.00 0.00 H new ATOM 1090 N GLU A 69 -9.712 -5.611 10.817 1.00 0.00 N ATOM 1091 CA GLU A 69 -10.737 -6.436 11.454 1.00 0.00 C ATOM 1092 C GLU A 69 -11.526 -7.222 10.410 1.00 0.00 C ATOM 1093 O GLU A 69 -11.672 -6.784 9.269 1.00 0.00 O ATOM 1094 CB GLU A 69 -11.689 -5.578 12.288 1.00 0.00 C ATOM 1095 CG GLU A 69 -12.561 -4.651 11.461 1.00 0.00 C ATOM 1096 CD GLU A 69 -13.545 -3.870 12.312 1.00 0.00 C ATOM 1097 OE1 GLU A 69 -13.095 -3.128 13.210 1.00 0.00 O ATOM 1098 OE2 GLU A 69 -14.765 -4.001 12.082 1.00 0.00 O ATOM 0 H GLU A 69 -9.850 -4.606 10.920 1.00 0.00 H new ATOM 0 HA GLU A 69 -10.232 -7.140 12.116 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -12.329 -6.232 12.880 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.106 -4.983 12.990 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -11.927 -3.955 10.912 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.108 -5.235 10.721 1.00 0.00 H new ATOM 1105 N THR A 70 -12.027 -8.389 10.806 1.00 0.00 N ATOM 1106 CA THR A 70 -12.797 -9.244 9.905 1.00 0.00 C ATOM 1107 C THR A 70 -13.961 -8.488 9.272 1.00 0.00 C ATOM 1108 O THR A 70 -14.509 -7.560 9.866 1.00 0.00 O ATOM 1109 CB THR A 70 -13.319 -10.472 10.647 1.00 0.00 C ATOM 1110 OG1 THR A 70 -14.120 -10.090 11.751 1.00 0.00 O ATOM 1111 CG2 THR A 70 -12.220 -11.373 11.166 1.00 0.00 C ATOM 0 H THR A 70 -11.914 -8.766 11.747 1.00 0.00 H new ATOM 0 HA THR A 70 -12.127 -9.564 9.108 1.00 0.00 H new ATOM 0 HB THR A 70 -13.901 -11.026 9.910 1.00 0.00 H new ATOM 0 HG1 THR A 70 -14.446 -10.891 12.212 1.00 0.00 H new ATOM 0 HG21 THR A 70 -12.662 -12.225 11.682 1.00 0.00 H new ATOM 0 HG22 THR A 70 -11.616 -11.728 10.331 1.00 0.00 H new ATOM 0 HG23 THR A 70 -11.590 -10.816 11.859 1.00 0.00 H new ATOM 1119 N LYS A 71 -14.328 -8.892 8.055 1.00 0.00 N ATOM 1120 CA LYS A 71 -15.420 -8.257 7.320 1.00 0.00 C ATOM 1121 C LYS A 71 -15.029 -6.846 6.902 1.00 0.00 C ATOM 1122 O LYS A 71 -15.857 -5.935 6.898 1.00 0.00 O ATOM 1123 CB LYS A 71 -16.696 -8.216 8.164 1.00 0.00 C ATOM 1124 CG LYS A 71 -17.165 -9.577 8.664 1.00 0.00 C ATOM 1125 CD LYS A 71 -17.625 -10.488 7.532 1.00 0.00 C ATOM 1126 CE LYS A 71 -16.460 -11.180 6.840 1.00 0.00 C ATOM 1127 NZ LYS A 71 -15.604 -11.925 7.803 1.00 0.00 N ATOM 0 H LYS A 71 -13.881 -9.661 7.556 1.00 0.00 H new ATOM 0 HA LYS A 71 -15.615 -8.851 6.427 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -16.528 -7.565 9.022 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.493 -7.765 7.573 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -16.353 -10.060 9.208 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.984 -9.439 9.370 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -18.308 -11.239 7.928 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -18.183 -9.903 6.801 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -16.843 -11.869 6.087 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -15.857 -10.438 6.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -15.369 -12.858 7.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -14.728 -11.391 7.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -16.116 -12.047 8.700 1.00 0.00 H new ATOM 1141 N HIS A 72 -13.760 -6.676 6.549 1.00 0.00 N ATOM 1142 CA HIS A 72 -13.247 -5.378 6.127 1.00 0.00 C ATOM 1143 C HIS A 72 -11.978 -5.542 5.295 1.00 0.00 C ATOM 1144 O HIS A 72 -10.895 -5.121 5.703 1.00 0.00 O ATOM 1145 CB HIS A 72 -12.962 -4.486 7.341 1.00 0.00 C ATOM 1146 CG HIS A 72 -14.165 -4.217 8.191 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -14.711 -5.150 9.046 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -14.940 -3.114 8.301 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -15.768 -4.633 9.645 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -15.928 -3.397 9.209 1.00 0.00 N ATOM 0 H HIS A 72 -13.066 -7.423 6.547 1.00 0.00 H new ATOM 0 HA HIS A 72 -14.010 -4.901 5.512 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -12.194 -4.958 7.954 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -12.554 -3.536 6.994 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -14.354 -6.094 9.193 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -14.806 -2.182 7.772 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -16.394 -5.135 10.368 1.00 0.00 H new ATOM 1159 N PHE A 73 -12.120 -6.159 4.127 1.00 0.00 N ATOM 1160 CA PHE A 73 -10.988 -6.383 3.234 1.00 0.00 C ATOM 1161 C PHE A 73 -11.461 -6.744 1.828 1.00 0.00 C ATOM 1162 O PHE A 73 -12.430 -7.485 1.661 1.00 0.00 O ATOM 1163 CB PHE A 73 -10.085 -7.492 3.781 1.00 0.00 C ATOM 1164 CG PHE A 73 -8.976 -7.881 2.845 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -8.054 -6.943 2.414 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -8.865 -9.186 2.389 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -7.039 -7.298 1.546 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -7.850 -9.546 1.521 1.00 0.00 C ATOM 1169 CZ PHE A 73 -6.937 -8.601 1.099 1.00 0.00 C ATOM 0 H PHE A 73 -13.009 -6.514 3.776 1.00 0.00 H new ATOM 0 HA PHE A 73 -10.418 -5.455 3.178 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -9.653 -7.164 4.726 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -10.693 -8.371 3.996 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -8.129 -5.923 2.760 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -9.578 -9.929 2.715 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -6.326 -6.557 1.217 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.772 -10.566 1.174 1.00 0.00 H new ATOM 0 HZ PHE A 73 -6.144 -8.880 0.421 1.00 0.00 H new ATOM 1179 N ILE A 74 -10.772 -6.213 0.821 1.00 0.00 N ATOM 1180 CA ILE A 74 -11.129 -6.481 -0.568 1.00 0.00 C ATOM 1181 C ILE A 74 -9.976 -6.164 -1.516 1.00 0.00 C ATOM 1182 O ILE A 74 -9.283 -5.158 -1.362 1.00 0.00 O ATOM 1183 CB ILE A 74 -12.371 -5.672 -0.992 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -12.741 -5.975 -2.446 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -12.124 -4.183 -0.801 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -13.953 -5.213 -2.930 1.00 0.00 C ATOM 0 H ILE A 74 -9.967 -5.598 0.940 1.00 0.00 H new ATOM 0 HA ILE A 74 -11.355 -7.545 -0.633 1.00 0.00 H new ATOM 0 HB ILE A 74 -13.208 -5.967 -0.359 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -11.892 -5.736 -3.086 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -12.928 -7.044 -2.550 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -13.010 -3.625 -1.105 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -11.910 -3.981 0.249 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -11.274 -3.874 -1.410 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -14.158 -5.476 -3.968 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -14.814 -5.470 -2.314 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -13.762 -4.142 -2.858 1.00 0.00 H new ATOM 1198 N TYR A 75 -9.788 -7.038 -2.497 1.00 0.00 N ATOM 1199 CA TYR A 75 -8.732 -6.882 -3.490 1.00 0.00 C ATOM 1200 C TYR A 75 -9.237 -7.326 -4.861 1.00 0.00 C ATOM 1201 O TYR A 75 -9.937 -8.333 -4.972 1.00 0.00 O ATOM 1202 CB TYR A 75 -7.505 -7.703 -3.087 1.00 0.00 C ATOM 1203 CG TYR A 75 -6.381 -7.673 -4.100 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -5.777 -6.475 -4.463 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -5.925 -8.843 -4.691 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -4.750 -6.447 -5.386 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -4.898 -8.822 -5.614 1.00 0.00 C ATOM 1208 CZ TYR A 75 -4.314 -7.623 -5.960 1.00 0.00 C ATOM 1209 OH TYR A 75 -3.290 -7.600 -6.877 1.00 0.00 O ATOM 0 H TYR A 75 -10.361 -7.872 -2.627 1.00 0.00 H new ATOM 0 HA TYR A 75 -8.447 -5.831 -3.542 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -7.130 -7.332 -2.133 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.809 -8.738 -2.929 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -6.116 -5.552 -4.016 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -6.381 -9.785 -4.425 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -4.290 -5.508 -5.657 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -4.554 -9.742 -6.063 1.00 0.00 H new ATOM 0 HH TYR A 75 -3.653 -7.739 -7.777 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.900 -6.568 -5.901 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.351 -6.899 -7.248 1.00 0.00 C ATOM 1221 C PHE A 76 -8.589 -6.116 -8.316 1.00 0.00 C ATOM 1222 O PHE A 76 -8.311 -4.926 -8.155 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.856 -6.632 -7.369 1.00 0.00 C ATOM 1224 CG PHE A 76 -11.244 -5.208 -7.088 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -10.899 -4.192 -7.964 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -11.955 -4.884 -5.942 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -11.255 -2.881 -7.705 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -12.313 -3.576 -5.679 1.00 0.00 C ATOM 1229 CZ PHE A 76 -11.963 -2.574 -6.560 1.00 0.00 C ATOM 0 H PHE A 76 -8.323 -5.730 -5.838 1.00 0.00 H new ATOM 0 HA PHE A 76 -9.150 -7.957 -7.417 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -11.183 -6.896 -8.375 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -11.388 -7.287 -6.679 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.345 -4.427 -8.861 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -12.232 -5.663 -5.247 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -10.980 -2.099 -8.397 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.867 -3.338 -4.783 1.00 0.00 H new ATOM 0 HZ PHE A 76 -12.242 -1.551 -6.355 1.00 0.00 H new ATOM 1239 N TYR A 77 -8.263 -6.799 -9.411 1.00 0.00 N ATOM 1240 CA TYR A 77 -7.545 -6.185 -10.525 1.00 0.00 C ATOM 1241 C TYR A 77 -8.504 -5.388 -11.407 1.00 0.00 C ATOM 1242 O TYR A 77 -9.664 -5.763 -11.570 1.00 0.00 O ATOM 1243 CB TYR A 77 -6.835 -7.252 -11.359 1.00 0.00 C ATOM 1244 CG TYR A 77 -5.694 -7.934 -10.636 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -4.561 -7.222 -10.264 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -5.750 -9.286 -10.324 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -3.515 -7.839 -9.604 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -4.708 -9.910 -9.663 1.00 0.00 C ATOM 1249 CZ TYR A 77 -3.594 -9.182 -9.305 1.00 0.00 C ATOM 1250 OH TYR A 77 -2.555 -9.799 -8.648 1.00 0.00 O ATOM 0 H TYR A 77 -8.487 -7.784 -9.551 1.00 0.00 H new ATOM 0 HA TYR A 77 -6.798 -5.505 -10.114 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.562 -8.005 -11.663 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -6.452 -6.792 -12.270 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.496 -6.169 -10.494 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.622 -9.860 -10.602 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -2.640 -7.271 -9.324 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -4.767 -10.963 -9.428 1.00 0.00 H new ATOM 0 HH TYR A 77 -2.386 -9.340 -7.799 1.00 0.00 H new ATOM 1260 N LEU A 78 -8.015 -4.289 -11.971 1.00 0.00 N ATOM 1261 CA LEU A 78 -8.835 -3.445 -12.836 1.00 0.00 C ATOM 1262 C LEU A 78 -7.990 -2.391 -13.547 1.00 0.00 C ATOM 1263 O LEU A 78 -7.032 -1.862 -12.982 1.00 0.00 O ATOM 1264 CB LEU A 78 -9.935 -2.762 -12.022 1.00 0.00 C ATOM 1265 CG LEU A 78 -10.864 -1.850 -12.829 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -11.512 -2.620 -13.972 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -11.925 -1.238 -11.924 1.00 0.00 C ATOM 0 H LEU A 78 -7.057 -3.961 -11.846 1.00 0.00 H new ATOM 0 HA LEU A 78 -9.289 -4.086 -13.592 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -10.537 -3.530 -11.536 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -9.469 -2.174 -11.231 1.00 0.00 H new ATOM 0 HG LEU A 78 -10.269 -1.043 -13.257 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -12.168 -1.955 -14.533 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -10.738 -3.009 -14.634 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -12.094 -3.448 -13.569 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.577 -0.593 -12.513 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.516 -2.032 -11.468 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -11.442 -0.651 -11.143 1.00 0.00 H new ATOM 1279 N GLY A 79 -8.353 -2.096 -14.792 1.00 0.00 N ATOM 1280 CA GLY A 79 -7.626 -1.107 -15.567 1.00 0.00 C ATOM 1281 C GLY A 79 -6.154 -1.442 -15.692 1.00 0.00 C ATOM 1282 O GLY A 79 -5.298 -0.563 -15.585 1.00 0.00 O ATOM 0 H GLY A 79 -9.140 -2.526 -15.279 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.065 -1.034 -16.562 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -7.735 -0.129 -15.098 1.00 0.00 H new ATOM 1286 N GLN A 80 -5.861 -2.717 -15.914 1.00 0.00 N ATOM 1287 CA GLN A 80 -4.484 -3.172 -16.049 1.00 0.00 C ATOM 1288 C GLN A 80 -3.660 -2.769 -14.829 1.00 0.00 C ATOM 1289 O GLN A 80 -2.474 -2.464 -14.944 1.00 0.00 O ATOM 1290 CB GLN A 80 -3.856 -2.594 -17.319 1.00 0.00 C ATOM 1291 CG GLN A 80 -4.599 -2.970 -18.591 1.00 0.00 C ATOM 1292 CD GLN A 80 -3.970 -2.368 -19.832 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -2.810 -2.633 -20.146 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -4.736 -1.549 -20.544 1.00 0.00 N ATOM 0 H GLN A 80 -6.560 -3.455 -16.004 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.490 -4.260 -16.120 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -3.822 -1.508 -17.236 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -2.825 -2.940 -17.395 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -4.619 -4.055 -18.688 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -5.634 -2.637 -18.515 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -5.693 -1.358 -20.246 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -4.368 -1.111 -21.389 1.00 0.00 H new ATOM 1303 N VAL A 81 -4.303 -2.768 -13.664 1.00 0.00 N ATOM 1304 CA VAL A 81 -3.637 -2.400 -12.419 1.00 0.00 C ATOM 1305 C VAL A 81 -4.391 -2.950 -11.212 1.00 0.00 C ATOM 1306 O VAL A 81 -5.619 -2.903 -11.160 1.00 0.00 O ATOM 1307 CB VAL A 81 -3.512 -0.870 -12.276 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -2.642 -0.292 -13.381 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -4.889 -0.220 -12.284 1.00 0.00 C ATOM 0 H VAL A 81 -5.286 -3.018 -13.557 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.639 -2.836 -12.454 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.033 -0.655 -11.321 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.569 0.789 -13.259 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.646 -0.732 -13.327 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -3.087 -0.518 -14.350 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -4.782 0.860 -12.182 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.393 -0.448 -13.223 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.479 -0.606 -11.453 1.00 0.00 H new ATOM 1319 N ALA A 82 -3.643 -3.471 -10.246 1.00 0.00 N ATOM 1320 CA ALA A 82 -4.233 -4.035 -9.038 1.00 0.00 C ATOM 1321 C ALA A 82 -4.835 -2.946 -8.155 1.00 0.00 C ATOM 1322 O ALA A 82 -4.309 -1.838 -8.075 1.00 0.00 O ATOM 1323 CB ALA A 82 -3.191 -4.824 -8.262 1.00 0.00 C ATOM 0 H ALA A 82 -2.624 -3.514 -10.276 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.037 -4.707 -9.339 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -3.645 -5.240 -7.362 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -2.811 -5.634 -8.884 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -2.369 -4.165 -7.982 1.00 0.00 H new ATOM 1329 N ILE A 83 -5.939 -3.275 -7.493 1.00 0.00 N ATOM 1330 CA ILE A 83 -6.613 -2.331 -6.611 1.00 0.00 C ATOM 1331 C ILE A 83 -6.948 -2.987 -5.274 1.00 0.00 C ATOM 1332 O ILE A 83 -7.378 -4.138 -5.228 1.00 0.00 O ATOM 1333 CB ILE A 83 -7.908 -1.785 -7.251 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -7.592 -1.112 -8.587 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.601 -0.809 -6.310 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -8.810 -0.546 -9.283 1.00 0.00 C ATOM 0 H ILE A 83 -6.386 -4.190 -7.551 1.00 0.00 H new ATOM 0 HA ILE A 83 -5.929 -1.499 -6.446 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.585 -2.620 -7.433 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -6.874 -0.309 -8.419 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.112 -1.837 -9.245 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.511 -0.435 -6.779 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.855 -1.318 -5.380 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.934 0.026 -6.096 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -8.510 -0.084 -10.224 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.520 -1.348 -9.483 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -9.279 0.203 -8.645 1.00 0.00 H new ATOM 1348 N LEU A 84 -6.736 -2.251 -4.189 1.00 0.00 N ATOM 1349 CA LEU A 84 -7.004 -2.767 -2.852 1.00 0.00 C ATOM 1350 C LEU A 84 -7.794 -1.763 -2.017 1.00 0.00 C ATOM 1351 O LEU A 84 -7.618 -0.552 -2.149 1.00 0.00 O ATOM 1352 CB LEU A 84 -5.693 -3.113 -2.144 1.00 0.00 C ATOM 1353 CG LEU A 84 -5.848 -3.681 -0.733 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -6.614 -4.996 -0.766 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -4.485 -3.872 -0.083 1.00 0.00 C ATOM 0 H LEU A 84 -6.379 -1.296 -4.209 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.605 -3.670 -2.959 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.150 -3.836 -2.752 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -5.078 -2.214 -2.092 1.00 0.00 H new ATOM 0 HG LEU A 84 -6.417 -2.968 -0.136 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.714 -5.384 0.248 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -7.604 -4.830 -1.190 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.073 -5.717 -1.379 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -4.614 -4.277 0.921 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.891 -4.564 -0.680 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.972 -2.912 -0.024 1.00 0.00 H new ATOM 1367 N LEU A 85 -8.666 -2.280 -1.157 1.00 0.00 N ATOM 1368 CA LEU A 85 -9.488 -1.441 -0.293 1.00 0.00 C ATOM 1369 C LEU A 85 -9.874 -2.192 0.976 1.00 0.00 C ATOM 1370 O LEU A 85 -10.146 -3.394 0.940 1.00 0.00 O ATOM 1371 CB LEU A 85 -10.749 -0.984 -1.026 1.00 0.00 C ATOM 1372 CG LEU A 85 -11.676 -0.085 -0.206 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -10.981 1.223 0.140 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -12.970 0.177 -0.962 1.00 0.00 C ATOM 0 H LEU A 85 -8.822 -3.281 -1.040 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.901 -0.564 -0.020 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -10.454 -0.450 -1.930 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.307 -1.865 -1.344 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.921 -0.598 0.724 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -11.655 1.850 0.723 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -10.084 1.015 0.723 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -10.705 1.742 -0.778 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.617 0.818 -0.364 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -12.745 0.670 -1.908 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -13.476 -0.769 -1.157 1.00 0.00 H new ATOM 1386 N PHE A 86 -9.893 -1.477 2.099 1.00 0.00 N ATOM 1387 CA PHE A 86 -10.240 -2.079 3.382 1.00 0.00 C ATOM 1388 C PHE A 86 -10.172 -1.047 4.502 1.00 0.00 C ATOM 1389 O PHE A 86 -9.183 -0.327 4.630 1.00 0.00 O ATOM 1390 CB PHE A 86 -9.296 -3.240 3.700 1.00 0.00 C ATOM 1391 CG PHE A 86 -7.863 -2.826 3.875 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -7.128 -2.343 2.803 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -7.252 -2.914 5.115 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -5.811 -1.958 2.966 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -5.936 -2.532 5.283 1.00 0.00 C ATOM 1396 CZ PHE A 86 -5.213 -2.053 4.208 1.00 0.00 C ATOM 0 H PHE A 86 -9.672 -0.482 2.145 1.00 0.00 H new ATOM 0 HA PHE A 86 -11.261 -2.454 3.310 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -9.636 -3.733 4.611 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -9.357 -3.975 2.898 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -7.590 -2.267 1.830 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -7.812 -3.286 5.960 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -5.249 -1.583 2.123 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -5.472 -2.608 6.255 1.00 0.00 H new ATOM 0 HZ PHE A 86 -4.183 -1.754 4.338 1.00 0.00 H new ATOM 1406 N LYS A 87 -11.222 -0.979 5.317 1.00 0.00 N ATOM 1407 CA LYS A 87 -11.255 -0.029 6.423 1.00 0.00 C ATOM 1408 C LYS A 87 -11.000 -0.720 7.755 1.00 0.00 C ATOM 1409 O LYS A 87 -10.978 -1.948 7.839 1.00 0.00 O ATOM 1410 CB LYS A 87 -12.591 0.712 6.483 1.00 0.00 C ATOM 1411 CG LYS A 87 -13.768 -0.166 6.874 1.00 0.00 C ATOM 1412 CD LYS A 87 -14.976 0.675 7.253 1.00 0.00 C ATOM 1413 CE LYS A 87 -16.186 -0.186 7.577 1.00 0.00 C ATOM 1414 NZ LYS A 87 -17.396 0.638 7.847 1.00 0.00 N ATOM 0 H LYS A 87 -12.053 -1.565 5.233 1.00 0.00 H new ATOM 0 HA LYS A 87 -10.459 0.693 6.241 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.509 1.531 7.198 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -12.791 1.158 5.509 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -14.025 -0.825 6.045 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.487 -0.804 7.712 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.731 1.296 8.115 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.220 1.350 6.433 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.385 -0.861 6.745 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -15.968 -0.807 8.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -18.095 0.069 8.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -17.132 1.466 8.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -17.808 0.956 6.946 1.00 0.00 H new ATOM 1428 N SER A 88 -10.810 0.084 8.794 1.00 0.00 N ATOM 1429 CA SER A 88 -10.557 -0.441 10.130 1.00 0.00 C ATOM 1430 C SER A 88 -9.318 -1.323 10.133 1.00 0.00 C ATOM 1431 O SER A 88 -9.251 -2.324 10.846 1.00 0.00 O ATOM 1432 CB SER A 88 -11.770 -1.225 10.626 1.00 0.00 C ATOM 1433 OG SER A 88 -11.539 -1.750 11.922 1.00 0.00 O ATOM 0 H SER A 88 -10.826 1.102 8.737 1.00 0.00 H new ATOM 0 HA SER A 88 -10.382 0.397 10.804 1.00 0.00 H new ATOM 0 HB2 SER A 88 -12.645 -0.576 10.643 1.00 0.00 H new ATOM 0 HB3 SER A 88 -11.990 -2.038 9.934 1.00 0.00 H new ATOM 0 HG SER A 88 -12.376 -1.742 12.432 1.00 0.00 H new ATOM 1439 N GLY A 89 -8.339 -0.934 9.327 1.00 0.00 N ATOM 1440 CA GLY A 89 -7.104 -1.687 9.241 1.00 0.00 C ATOM 1441 C GLY A 89 -6.381 -1.763 10.573 1.00 0.00 C ATOM 1442 O GLY A 89 -6.333 -2.866 11.160 1.00 0.00 O ATOM 1443 OXT GLY A 89 -5.863 -0.722 11.027 1.00 0.00 O ATOM 0 H GLY A 89 -8.379 -0.108 8.730 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -7.320 -2.696 8.890 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.450 -1.225 8.501 1.00 0.00 H new TER 1447 GLY A 89 ATOM 1448 N MET B 1 28.436 -4.162 3.614 1.00 0.00 N ATOM 1449 CA MET B 1 27.922 -4.175 5.008 1.00 0.00 C ATOM 1450 C MET B 1 26.823 -3.135 5.200 1.00 0.00 C ATOM 1451 O MET B 1 26.949 -1.995 4.754 1.00 0.00 O ATOM 1452 CB MET B 1 29.086 -3.897 5.961 1.00 0.00 C ATOM 1453 CG MET B 1 30.205 -4.921 5.871 1.00 0.00 C ATOM 1454 SD MET B 1 31.561 -4.569 7.006 1.00 0.00 S ATOM 1455 CE MET B 1 32.666 -5.932 6.646 1.00 0.00 C ATOM 0 H1 MET B 1 28.958 -5.042 3.428 1.00 0.00 H new ATOM 0 H2 MET B 1 27.639 -4.086 2.951 1.00 0.00 H new ATOM 0 H3 MET B 1 29.072 -3.349 3.486 1.00 0.00 H new ATOM 0 HA MET B 1 27.489 -5.153 5.220 1.00 0.00 H new ATOM 0 HB2 MET B 1 29.492 -2.908 5.747 1.00 0.00 H new ATOM 0 HB3 MET B 1 28.709 -3.872 6.984 1.00 0.00 H new ATOM 0 HG2 MET B 1 29.804 -5.911 6.086 1.00 0.00 H new ATOM 0 HG3 MET B 1 30.588 -4.947 4.851 1.00 0.00 H new ATOM 0 HE1 MET B 1 33.555 -5.854 7.271 1.00 0.00 H new ATOM 0 HE2 MET B 1 32.159 -6.875 6.851 1.00 0.00 H new ATOM 0 HE3 MET B 1 32.956 -5.897 5.596 1.00 0.00 H new ATOM 1467 N CYS B 2 25.748 -3.535 5.870 1.00 0.00 N ATOM 1468 CA CYS B 2 24.626 -2.637 6.124 1.00 0.00 C ATOM 1469 C CYS B 2 25.077 -1.416 6.919 1.00 0.00 C ATOM 1470 O CYS B 2 25.844 -1.534 7.873 1.00 0.00 O ATOM 1471 CB CYS B 2 23.517 -3.372 6.880 1.00 0.00 C ATOM 1472 SG CYS B 2 24.030 -4.031 8.483 1.00 0.00 S ATOM 0 H CYS B 2 25.629 -4.475 6.247 1.00 0.00 H new ATOM 0 HA CYS B 2 24.238 -2.300 5.163 1.00 0.00 H new ATOM 0 HB2 CYS B 2 22.680 -2.690 7.030 1.00 0.00 H new ATOM 0 HB3 CYS B 2 23.152 -4.192 6.262 1.00 0.00 H new ATOM 0 HG CYS B 2 24.974 -3.286 8.976 1.00 0.00 H new ATOM 1478 N ASP B 3 24.592 -0.243 6.518 1.00 0.00 N ATOM 1479 CA ASP B 3 24.946 1.002 7.192 1.00 0.00 C ATOM 1480 C ASP B 3 23.898 2.080 6.927 1.00 0.00 C ATOM 1481 O ASP B 3 24.233 3.228 6.633 1.00 0.00 O ATOM 1482 CB ASP B 3 26.321 1.488 6.726 1.00 0.00 C ATOM 1483 CG ASP B 3 27.424 0.495 7.032 1.00 0.00 C ATOM 1484 OD1 ASP B 3 27.627 0.180 8.224 1.00 0.00 O ATOM 1485 OD2 ASP B 3 28.086 0.030 6.080 1.00 0.00 O ATOM 0 H ASP B 3 23.954 -0.130 5.731 1.00 0.00 H new ATOM 0 HA ASP B 3 24.981 0.808 8.264 1.00 0.00 H new ATOM 0 HB2 ASP B 3 26.292 1.674 5.652 1.00 0.00 H new ATOM 0 HB3 ASP B 3 26.549 2.439 7.208 1.00 0.00 H new ATOM 1490 N ARG B 4 22.629 1.701 7.032 1.00 0.00 N ATOM 1491 CA ARG B 4 21.529 2.633 6.803 1.00 0.00 C ATOM 1492 C ARG B 4 21.599 3.232 5.402 1.00 0.00 C ATOM 1493 O ARG B 4 21.424 4.436 5.219 1.00 0.00 O ATOM 1494 CB ARG B 4 21.543 3.751 7.850 1.00 0.00 C ATOM 1495 CG ARG B 4 21.118 3.299 9.240 1.00 0.00 C ATOM 1496 CD ARG B 4 22.045 2.232 9.800 1.00 0.00 C ATOM 1497 NE ARG B 4 23.429 2.692 9.872 1.00 0.00 N ATOM 1498 CZ ARG B 4 24.428 1.962 10.363 1.00 0.00 C ATOM 1499 NH1 ARG B 4 24.201 0.738 10.826 1.00 0.00 N ATOM 1500 NH2 ARG B 4 25.658 2.455 10.391 1.00 0.00 N ATOM 0 H ARG B 4 22.336 0.755 7.274 1.00 0.00 H new ATOM 0 HA ARG B 4 20.597 2.075 6.893 1.00 0.00 H new ATOM 0 HB2 ARG B 4 22.548 4.170 7.906 1.00 0.00 H new ATOM 0 HB3 ARG B 4 20.881 4.552 7.521 1.00 0.00 H new ATOM 0 HG2 ARG B 4 21.105 4.157 9.912 1.00 0.00 H new ATOM 0 HG3 ARG B 4 20.100 2.910 9.200 1.00 0.00 H new ATOM 0 HD2 ARG B 4 21.707 1.944 10.795 1.00 0.00 H new ATOM 0 HD3 ARG B 4 21.991 1.341 9.175 1.00 0.00 H new ATOM 0 HE ARG B 4 23.643 3.627 9.526 1.00 0.00 H new ATOM 0 HH11 ARG B 4 23.257 0.352 10.807 1.00 0.00 H new ATOM 0 HH12 ARG B 4 24.971 0.184 11.201 1.00 0.00 H new ATOM 0 HH21 ARG B 4 25.839 3.394 10.036 1.00 0.00 H new ATOM 0 HH22 ARG B 4 26.423 1.895 10.767 1.00 0.00 H new ATOM 1514 N LYS B 5 21.850 2.380 4.413 1.00 0.00 N ATOM 1515 CA LYS B 5 21.937 2.822 3.026 1.00 0.00 C ATOM 1516 C LYS B 5 20.628 3.466 2.584 1.00 0.00 C ATOM 1517 O LYS B 5 20.624 4.450 1.843 1.00 0.00 O ATOM 1518 CB LYS B 5 22.274 1.640 2.113 1.00 0.00 C ATOM 1519 CG LYS B 5 22.358 2.014 0.643 1.00 0.00 C ATOM 1520 CD LYS B 5 23.379 3.113 0.407 1.00 0.00 C ATOM 1521 CE LYS B 5 23.472 3.483 -1.065 1.00 0.00 C ATOM 1522 NZ LYS B 5 24.474 4.558 -1.304 1.00 0.00 N ATOM 0 H LYS B 5 21.997 1.379 4.547 1.00 0.00 H new ATOM 0 HA LYS B 5 22.732 3.565 2.952 1.00 0.00 H new ATOM 0 HB2 LYS B 5 23.226 1.210 2.425 1.00 0.00 H new ATOM 0 HB3 LYS B 5 21.517 0.866 2.240 1.00 0.00 H new ATOM 0 HG2 LYS B 5 22.626 1.135 0.057 1.00 0.00 H new ATOM 0 HG3 LYS B 5 21.380 2.344 0.294 1.00 0.00 H new ATOM 0 HD2 LYS B 5 23.107 3.994 0.988 1.00 0.00 H new ATOM 0 HD3 LYS B 5 24.356 2.786 0.763 1.00 0.00 H new ATOM 0 HE2 LYS B 5 23.741 2.600 -1.645 1.00 0.00 H new ATOM 0 HE3 LYS B 5 22.495 3.812 -1.419 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 24.508 4.782 -2.319 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 24.204 5.409 -0.771 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 25.411 4.235 -0.989 1.00 0.00 H new ATOM 1536 N ALA B 6 19.519 2.895 3.040 1.00 0.00 N ATOM 1537 CA ALA B 6 18.192 3.395 2.698 1.00 0.00 C ATOM 1538 C ALA B 6 18.091 4.908 2.871 1.00 0.00 C ATOM 1539 O ALA B 6 18.456 5.448 3.914 1.00 0.00 O ATOM 1540 CB ALA B 6 17.142 2.712 3.559 1.00 0.00 C ATOM 0 H ALA B 6 19.513 2.079 3.652 1.00 0.00 H new ATOM 0 HA ALA B 6 18.016 3.166 1.647 1.00 0.00 H new ATOM 0 HB1 ALA B 6 16.154 3.091 3.297 1.00 0.00 H new ATOM 0 HB2 ALA B 6 17.175 1.636 3.388 1.00 0.00 H new ATOM 0 HB3 ALA B 6 17.343 2.918 4.610 1.00 0.00 H new ATOM 1546 N VAL B 7 17.585 5.587 1.844 1.00 0.00 N ATOM 1547 CA VAL B 7 17.427 7.026 1.893 1.00 0.00 C ATOM 1548 C VAL B 7 16.025 7.416 2.335 1.00 0.00 C ATOM 1549 O VAL B 7 15.036 6.842 1.884 1.00 0.00 O ATOM 1550 CB VAL B 7 17.714 7.668 0.534 1.00 0.00 C ATOM 1551 CG1 VAL B 7 19.180 7.510 0.161 1.00 0.00 C ATOM 1552 CG2 VAL B 7 16.814 7.080 -0.541 1.00 0.00 C ATOM 0 H VAL B 7 17.279 5.158 0.971 1.00 0.00 H new ATOM 0 HA VAL B 7 18.149 7.393 2.622 1.00 0.00 H new ATOM 0 HB VAL B 7 17.498 8.734 0.609 1.00 0.00 H new ATOM 0 HG11 VAL B 7 19.361 7.974 -0.809 1.00 0.00 H new ATOM 0 HG12 VAL B 7 19.801 7.992 0.915 1.00 0.00 H new ATOM 0 HG13 VAL B 7 19.430 6.450 0.109 1.00 0.00 H new ATOM 0 HG21 VAL B 7 17.035 7.551 -1.499 1.00 0.00 H new ATOM 0 HG22 VAL B 7 16.989 6.007 -0.615 1.00 0.00 H new ATOM 0 HG23 VAL B 7 15.771 7.260 -0.281 1.00 0.00 H new ATOM 1562 N ILE B 8 15.952 8.404 3.216 1.00 0.00 N ATOM 1563 CA ILE B 8 14.673 8.884 3.726 1.00 0.00 C ATOM 1564 C ILE B 8 14.073 9.946 2.806 1.00 0.00 C ATOM 1565 O ILE B 8 14.774 10.842 2.337 1.00 0.00 O ATOM 1566 CB ILE B 8 14.809 9.459 5.157 1.00 0.00 C ATOM 1567 CG1 ILE B 8 15.193 8.355 6.147 1.00 0.00 C ATOM 1568 CG2 ILE B 8 13.513 10.130 5.596 1.00 0.00 C ATOM 1569 CD1 ILE B 8 16.536 7.718 5.864 1.00 0.00 C ATOM 0 H ILE B 8 16.765 8.891 3.594 1.00 0.00 H new ATOM 0 HA ILE B 8 14.005 8.023 3.758 1.00 0.00 H new ATOM 0 HB ILE B 8 15.600 10.209 5.145 1.00 0.00 H new ATOM 0 HG12 ILE B 8 15.204 8.772 7.154 1.00 0.00 H new ATOM 0 HG13 ILE B 8 14.425 7.582 6.130 1.00 0.00 H new ATOM 0 HG21 ILE B 8 13.632 10.527 6.604 1.00 0.00 H new ATOM 0 HG22 ILE B 8 13.275 10.944 4.912 1.00 0.00 H new ATOM 0 HG23 ILE B 8 12.704 9.400 5.587 1.00 0.00 H new ATOM 0 HD11 ILE B 8 16.737 6.947 6.607 1.00 0.00 H new ATOM 0 HD12 ILE B 8 16.524 7.270 4.870 1.00 0.00 H new ATOM 0 HD13 ILE B 8 17.316 8.478 5.910 1.00 0.00 H new ATOM 1581 N LYS B 9 12.772 9.838 2.562 1.00 0.00 N ATOM 1582 CA LYS B 9 12.074 10.792 1.708 1.00 0.00 C ATOM 1583 C LYS B 9 11.010 11.546 2.498 1.00 0.00 C ATOM 1584 O LYS B 9 10.967 12.776 2.483 1.00 0.00 O ATOM 1585 CB LYS B 9 11.437 10.072 0.519 1.00 0.00 C ATOM 1586 CG LYS B 9 12.442 9.343 -0.358 1.00 0.00 C ATOM 1587 CD LYS B 9 13.490 10.296 -0.911 1.00 0.00 C ATOM 1588 CE LYS B 9 14.518 9.566 -1.759 1.00 0.00 C ATOM 1589 NZ LYS B 9 15.550 10.492 -2.303 1.00 0.00 N ATOM 0 H LYS B 9 12.180 9.100 2.943 1.00 0.00 H new ATOM 0 HA LYS B 9 12.801 11.513 1.335 1.00 0.00 H new ATOM 0 HB2 LYS B 9 10.703 9.356 0.889 1.00 0.00 H new ATOM 0 HB3 LYS B 9 10.896 10.798 -0.088 1.00 0.00 H new ATOM 0 HG2 LYS B 9 12.930 8.559 0.220 1.00 0.00 H new ATOM 0 HG3 LYS B 9 11.921 8.855 -1.182 1.00 0.00 H new ATOM 0 HD2 LYS B 9 13.003 11.065 -1.511 1.00 0.00 H new ATOM 0 HD3 LYS B 9 13.992 10.804 -0.087 1.00 0.00 H new ATOM 0 HE2 LYS B 9 15.002 8.796 -1.159 1.00 0.00 H new ATOM 0 HE3 LYS B 9 14.015 9.059 -2.583 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 16.232 9.954 -2.875 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 15.092 11.212 -2.897 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 16.048 10.957 -1.517 1.00 0.00 H new ATOM 1603 N ASN B 10 10.158 10.801 3.198 1.00 0.00 N ATOM 1604 CA ASN B 10 9.102 11.406 4.005 1.00 0.00 C ATOM 1605 C ASN B 10 9.547 11.532 5.460 1.00 0.00 C ATOM 1606 O ASN B 10 9.969 12.602 5.898 1.00 0.00 O ATOM 1607 CB ASN B 10 7.816 10.582 3.910 1.00 0.00 C ATOM 1608 CG ASN B 10 7.257 10.547 2.501 1.00 0.00 C ATOM 1609 OD1 ASN B 10 7.912 10.077 1.572 1.00 0.00 O ATOM 1610 ND2 ASN B 10 6.039 11.051 2.336 1.00 0.00 N ATOM 0 H ASN B 10 10.178 9.781 3.223 1.00 0.00 H new ATOM 0 HA ASN B 10 8.902 12.405 3.617 1.00 0.00 H new ATOM 0 HB2 ASN B 10 8.014 9.564 4.245 1.00 0.00 H new ATOM 0 HB3 ASN B 10 7.069 11.000 4.585 1.00 0.00 H new ATOM 0 HD21 ASN B 10 5.611 11.058 1.410 1.00 0.00 H new ATOM 0 HD22 ASN B 10 5.532 11.431 3.135 1.00 0.00 H new ATOM 1617 N ALA B 11 9.465 10.427 6.197 1.00 0.00 N ATOM 1618 CA ALA B 11 9.871 10.398 7.598 1.00 0.00 C ATOM 1619 C ALA B 11 9.100 11.410 8.442 1.00 0.00 C ATOM 1620 O ALA B 11 8.998 12.585 8.091 1.00 0.00 O ATOM 1621 CB ALA B 11 11.367 10.649 7.712 1.00 0.00 C ATOM 0 H ALA B 11 9.119 9.535 5.844 1.00 0.00 H new ATOM 0 HA ALA B 11 9.637 9.407 7.987 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.661 10.626 8.761 1.00 0.00 H new ATOM 0 HB2 ALA B 11 11.908 9.876 7.166 1.00 0.00 H new ATOM 0 HB3 ALA B 11 11.605 11.625 7.290 1.00 0.00 H new ATOM 1627 N ASP B 12 8.575 10.944 9.570 1.00 0.00 N ATOM 1628 CA ASP B 12 7.828 11.802 10.486 1.00 0.00 C ATOM 1629 C ASP B 12 7.374 11.024 11.715 1.00 0.00 C ATOM 1630 O ASP B 12 6.183 10.783 11.913 1.00 0.00 O ATOM 1631 CB ASP B 12 6.633 12.453 9.787 1.00 0.00 C ATOM 1632 CG ASP B 12 5.644 11.440 9.257 1.00 0.00 C ATOM 1633 OD1 ASP B 12 6.044 10.609 8.418 1.00 0.00 O ATOM 1634 OD2 ASP B 12 4.471 11.481 9.681 1.00 0.00 O ATOM 0 H ASP B 12 8.653 9.973 9.874 1.00 0.00 H new ATOM 0 HA ASP B 12 8.499 12.596 10.814 1.00 0.00 H new ATOM 0 HB2 ASP B 12 6.126 13.118 10.486 1.00 0.00 H new ATOM 0 HB3 ASP B 12 6.991 13.070 8.963 1.00 0.00 H new ATOM 1639 N MET B 13 8.344 10.635 12.534 1.00 0.00 N ATOM 1640 CA MET B 13 8.075 9.880 13.751 1.00 0.00 C ATOM 1641 C MET B 13 9.331 9.794 14.611 1.00 0.00 C ATOM 1642 O MET B 13 10.385 10.306 14.236 1.00 0.00 O ATOM 1643 CB MET B 13 7.579 8.476 13.398 1.00 0.00 C ATOM 1644 CG MET B 13 8.529 7.708 12.491 1.00 0.00 C ATOM 1645 SD MET B 13 7.810 6.178 11.863 1.00 0.00 S ATOM 1646 CE MET B 13 7.460 5.312 13.391 1.00 0.00 C ATOM 0 H MET B 13 9.332 10.832 12.375 1.00 0.00 H new ATOM 0 HA MET B 13 7.301 10.396 14.319 1.00 0.00 H new ATOM 0 HB2 MET B 13 7.430 7.910 14.317 1.00 0.00 H new ATOM 0 HB3 MET B 13 6.607 8.554 12.911 1.00 0.00 H new ATOM 0 HG2 MET B 13 8.814 8.342 11.651 1.00 0.00 H new ATOM 0 HG3 MET B 13 9.442 7.477 13.040 1.00 0.00 H new ATOM 0 HE1 MET B 13 7.830 4.289 13.322 1.00 0.00 H new ATOM 0 HE2 MET B 13 7.953 5.821 14.219 1.00 0.00 H new ATOM 0 HE3 MET B 13 6.384 5.298 13.563 1.00 0.00 H new ATOM 1656 N SER B 14 9.215 9.152 15.768 1.00 0.00 N ATOM 1657 CA SER B 14 10.348 9.011 16.681 1.00 0.00 C ATOM 1658 C SER B 14 11.577 8.461 15.955 1.00 0.00 C ATOM 1659 O SER B 14 11.474 7.535 15.151 1.00 0.00 O ATOM 1660 CB SER B 14 9.979 8.100 17.851 1.00 0.00 C ATOM 1661 OG SER B 14 9.565 6.825 17.396 1.00 0.00 O ATOM 0 H SER B 14 8.351 8.721 16.097 1.00 0.00 H new ATOM 0 HA SER B 14 10.594 10.001 17.065 1.00 0.00 H new ATOM 0 HB2 SER B 14 10.836 7.991 18.515 1.00 0.00 H new ATOM 0 HB3 SER B 14 9.180 8.558 18.434 1.00 0.00 H new ATOM 0 HG SER B 14 8.586 6.776 17.405 1.00 0.00 H new ATOM 1667 N GLU B 15 12.734 9.053 16.239 1.00 0.00 N ATOM 1668 CA GLU B 15 13.992 8.647 15.615 1.00 0.00 C ATOM 1669 C GLU B 15 14.250 7.155 15.774 1.00 0.00 C ATOM 1670 O GLU B 15 14.723 6.498 14.849 1.00 0.00 O ATOM 1671 CB GLU B 15 15.157 9.441 16.210 1.00 0.00 C ATOM 1672 CG GLU B 15 15.031 10.942 16.015 1.00 0.00 C ATOM 1673 CD GLU B 15 16.198 11.707 16.607 1.00 0.00 C ATOM 1674 OE1 GLU B 15 17.346 11.464 16.179 1.00 0.00 O ATOM 1675 OE2 GLU B 15 15.963 12.550 17.497 1.00 0.00 O ATOM 0 H GLU B 15 12.827 9.822 16.903 1.00 0.00 H new ATOM 0 HA GLU B 15 13.911 8.859 14.549 1.00 0.00 H new ATOM 0 HB2 GLU B 15 15.226 9.226 17.276 1.00 0.00 H new ATOM 0 HB3 GLU B 15 16.088 9.101 15.756 1.00 0.00 H new ATOM 0 HG2 GLU B 15 14.960 11.162 14.950 1.00 0.00 H new ATOM 0 HG3 GLU B 15 14.105 11.288 16.474 1.00 0.00 H new ATOM 1682 N GLU B 16 13.955 6.627 16.951 1.00 0.00 N ATOM 1683 CA GLU B 16 14.175 5.212 17.216 1.00 0.00 C ATOM 1684 C GLU B 16 13.366 4.334 16.270 1.00 0.00 C ATOM 1685 O GLU B 16 13.890 3.374 15.710 1.00 0.00 O ATOM 1686 CB GLU B 16 13.829 4.881 18.669 1.00 0.00 C ATOM 1687 CG GLU B 16 12.387 5.185 19.037 1.00 0.00 C ATOM 1688 CD GLU B 16 12.074 4.861 20.485 1.00 0.00 C ATOM 1689 OE1 GLU B 16 12.218 3.683 20.873 1.00 0.00 O ATOM 1690 OE2 GLU B 16 11.686 5.784 21.230 1.00 0.00 O ATOM 0 H GLU B 16 13.565 7.152 17.734 1.00 0.00 H new ATOM 0 HA GLU B 16 15.231 5.004 17.045 1.00 0.00 H new ATOM 0 HB2 GLU B 16 14.026 3.824 18.848 1.00 0.00 H new ATOM 0 HB3 GLU B 16 14.490 5.444 19.328 1.00 0.00 H new ATOM 0 HG2 GLU B 16 12.183 6.240 18.852 1.00 0.00 H new ATOM 0 HG3 GLU B 16 11.722 4.614 18.389 1.00 0.00 H new ATOM 1697 N MET B 17 12.092 4.658 16.094 1.00 0.00 N ATOM 1698 CA MET B 17 11.235 3.877 15.211 1.00 0.00 C ATOM 1699 C MET B 17 11.732 3.928 13.774 1.00 0.00 C ATOM 1700 O MET B 17 11.883 2.894 13.123 1.00 0.00 O ATOM 1701 CB MET B 17 9.790 4.369 15.290 1.00 0.00 C ATOM 1702 CG MET B 17 9.146 4.148 16.649 1.00 0.00 C ATOM 1703 SD MET B 17 7.462 4.786 16.732 1.00 0.00 S ATOM 1704 CE MET B 17 7.024 4.364 18.418 1.00 0.00 C ATOM 0 H MET B 17 11.632 5.448 16.546 1.00 0.00 H new ATOM 0 HA MET B 17 11.271 2.840 15.545 1.00 0.00 H new ATOM 0 HB2 MET B 17 9.764 5.433 15.053 1.00 0.00 H new ATOM 0 HB3 MET B 17 9.199 3.858 14.530 1.00 0.00 H new ATOM 0 HG2 MET B 17 9.138 3.081 16.874 1.00 0.00 H new ATOM 0 HG3 MET B 17 9.751 4.631 17.416 1.00 0.00 H new ATOM 0 HE1 MET B 17 6.409 5.157 18.844 1.00 0.00 H new ATOM 0 HE2 MET B 17 6.465 3.428 18.425 1.00 0.00 H new ATOM 0 HE3 MET B 17 7.931 4.249 19.012 1.00 0.00 H new ATOM 1714 N GLN B 18 11.990 5.130 13.282 1.00 0.00 N ATOM 1715 CA GLN B 18 12.476 5.299 11.920 1.00 0.00 C ATOM 1716 C GLN B 18 13.858 4.684 11.757 1.00 0.00 C ATOM 1717 O GLN B 18 14.169 4.101 10.719 1.00 0.00 O ATOM 1718 CB GLN B 18 12.507 6.780 11.542 1.00 0.00 C ATOM 1719 CG GLN B 18 13.327 7.634 12.488 1.00 0.00 C ATOM 1720 CD GLN B 18 13.250 9.106 12.142 1.00 0.00 C ATOM 1721 OE1 GLN B 18 12.600 9.876 13.004 1.00 0.00 O flip ATOM 1722 NE2 GLN B 18 13.753 9.542 11.107 1.00 0.00 N flip ATOM 0 H GLN B 18 11.872 5.999 13.802 1.00 0.00 H new ATOM 0 HA GLN B 18 11.790 4.782 11.250 1.00 0.00 H new ATOM 0 HB2 GLN B 18 12.910 6.880 10.534 1.00 0.00 H new ATOM 0 HB3 GLN B 18 11.486 7.161 11.516 1.00 0.00 H new ATOM 0 HG2 GLN B 18 12.975 7.483 13.508 1.00 0.00 H new ATOM 0 HG3 GLN B 18 14.367 7.310 12.459 1.00 0.00 H new ATOM 0 HE21 GLN B 18 14.244 8.911 10.473 1.00 0.00 H new ATOM 0 HE22 GLN B 18 13.679 10.534 10.883 1.00 0.00 H new ATOM 1731 N GLN B 19 14.687 4.814 12.786 1.00 0.00 N ATOM 1732 CA GLN B 19 16.035 4.264 12.748 1.00 0.00 C ATOM 1733 C GLN B 19 16.011 2.741 12.817 1.00 0.00 C ATOM 1734 O GLN B 19 16.771 2.069 12.119 1.00 0.00 O ATOM 1735 CB GLN B 19 16.875 4.844 13.887 1.00 0.00 C ATOM 1736 CG GLN B 19 17.301 6.286 13.654 1.00 0.00 C ATOM 1737 CD GLN B 19 18.104 6.849 14.809 1.00 0.00 C ATOM 1738 OE1 GLN B 19 17.626 6.910 15.941 1.00 0.00 O ATOM 1739 NE2 GLN B 19 19.334 7.266 14.528 1.00 0.00 N ATOM 0 H GLN B 19 14.450 5.294 13.654 1.00 0.00 H new ATOM 0 HA GLN B 19 16.491 4.545 11.799 1.00 0.00 H new ATOM 0 HB2 GLN B 19 16.304 4.787 14.814 1.00 0.00 H new ATOM 0 HB3 GLN B 19 17.764 4.228 14.022 1.00 0.00 H new ATOM 0 HG2 GLN B 19 17.895 6.343 12.742 1.00 0.00 H new ATOM 0 HG3 GLN B 19 16.416 6.902 13.497 1.00 0.00 H new ATOM 0 HE21 GLN B 19 19.691 7.197 13.575 1.00 0.00 H new ATOM 0 HE22 GLN B 19 19.921 7.655 15.265 1.00 0.00 H new ATOM 1748 N ASP B 20 15.127 2.198 13.647 1.00 0.00 N ATOM 1749 CA ASP B 20 15.009 0.751 13.782 1.00 0.00 C ATOM 1750 C ASP B 20 14.376 0.149 12.538 1.00 0.00 C ATOM 1751 O ASP B 20 14.735 -0.948 12.122 1.00 0.00 O ATOM 1752 CB ASP B 20 14.195 0.379 15.023 1.00 0.00 C ATOM 1753 CG ASP B 20 14.904 0.743 16.314 1.00 0.00 C ATOM 1754 OD1 ASP B 20 16.054 0.295 16.506 1.00 0.00 O ATOM 1755 OD2 ASP B 20 14.305 1.466 17.138 1.00 0.00 O ATOM 0 H ASP B 20 14.486 2.733 14.232 1.00 0.00 H new ATOM 0 HA ASP B 20 16.013 0.342 13.898 1.00 0.00 H new ATOM 0 HB2 ASP B 20 13.231 0.886 14.986 1.00 0.00 H new ATOM 0 HB3 ASP B 20 13.992 -0.692 15.013 1.00 0.00 H new ATOM 1760 N SER B 21 13.440 0.875 11.944 1.00 0.00 N ATOM 1761 CA SER B 21 12.774 0.405 10.738 1.00 0.00 C ATOM 1762 C SER B 21 13.754 0.370 9.573 1.00 0.00 C ATOM 1763 O SER B 21 13.760 -0.575 8.783 1.00 0.00 O ATOM 1764 CB SER B 21 11.582 1.301 10.399 1.00 0.00 C ATOM 1765 OG SER B 21 11.996 2.637 10.168 1.00 0.00 O ATOM 0 H SER B 21 13.126 1.787 12.275 1.00 0.00 H new ATOM 0 HA SER B 21 12.407 -0.605 10.918 1.00 0.00 H new ATOM 0 HB2 SER B 21 11.074 0.916 9.514 1.00 0.00 H new ATOM 0 HB3 SER B 21 10.861 1.277 11.216 1.00 0.00 H new ATOM 0 HG SER B 21 12.891 2.772 10.545 1.00 0.00 H new ATOM 1771 N VAL B 22 14.586 1.402 9.476 1.00 0.00 N ATOM 1772 CA VAL B 22 15.576 1.483 8.410 1.00 0.00 C ATOM 1773 C VAL B 22 16.594 0.359 8.537 1.00 0.00 C ATOM 1774 O VAL B 22 16.894 -0.334 7.565 1.00 0.00 O ATOM 1775 CB VAL B 22 16.302 2.845 8.423 1.00 0.00 C ATOM 1776 CG1 VAL B 22 17.368 2.909 7.338 1.00 0.00 C ATOM 1777 CG2 VAL B 22 15.301 3.981 8.261 1.00 0.00 C ATOM 0 H VAL B 22 14.594 2.192 10.121 1.00 0.00 H new ATOM 0 HA VAL B 22 15.047 1.381 7.462 1.00 0.00 H new ATOM 0 HB VAL B 22 16.800 2.955 9.386 1.00 0.00 H new ATOM 0 HG11 VAL B 22 17.863 3.880 7.371 1.00 0.00 H new ATOM 0 HG12 VAL B 22 18.103 2.121 7.503 1.00 0.00 H new ATOM 0 HG13 VAL B 22 16.902 2.772 6.362 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.828 4.935 8.272 1.00 0.00 H new ATOM 0 HG22 VAL B 22 14.774 3.869 7.314 1.00 0.00 H new ATOM 0 HG23 VAL B 22 14.584 3.953 9.081 1.00 0.00 H new ATOM 1787 N GLU B 23 17.110 0.174 9.744 1.00 0.00 N ATOM 1788 CA GLU B 23 18.084 -0.879 9.999 1.00 0.00 C ATOM 1789 C GLU B 23 17.419 -2.244 9.886 1.00 0.00 C ATOM 1790 O GLU B 23 17.974 -3.178 9.306 1.00 0.00 O ATOM 1791 CB GLU B 23 18.704 -0.709 11.386 1.00 0.00 C ATOM 1792 CG GLU B 23 19.460 0.598 11.560 1.00 0.00 C ATOM 1793 CD GLU B 23 20.064 0.743 12.943 1.00 0.00 C ATOM 1794 OE1 GLU B 23 20.891 -0.112 13.322 1.00 0.00 O ATOM 1795 OE2 GLU B 23 19.711 1.713 13.646 1.00 0.00 O ATOM 0 H GLU B 23 16.872 0.737 10.560 1.00 0.00 H new ATOM 0 HA GLU B 23 18.876 -0.808 9.254 1.00 0.00 H new ATOM 0 HB2 GLU B 23 17.915 -0.765 12.136 1.00 0.00 H new ATOM 0 HB3 GLU B 23 19.384 -1.540 11.575 1.00 0.00 H new ATOM 0 HG2 GLU B 23 20.252 0.657 10.814 1.00 0.00 H new ATOM 0 HG3 GLU B 23 18.784 1.432 11.374 1.00 0.00 H new ATOM 1802 N CYS B 24 16.219 -2.345 10.445 1.00 0.00 N ATOM 1803 CA CYS B 24 15.458 -3.588 10.413 1.00 0.00 C ATOM 1804 C CYS B 24 15.047 -3.939 8.987 1.00 0.00 C ATOM 1805 O CYS B 24 14.972 -5.114 8.623 1.00 0.00 O ATOM 1806 CB CYS B 24 14.220 -3.474 11.306 1.00 0.00 C ATOM 1807 SG CYS B 24 13.259 -4.998 11.436 1.00 0.00 S ATOM 0 H CYS B 24 15.751 -1.578 10.928 1.00 0.00 H new ATOM 0 HA CYS B 24 16.096 -4.387 10.791 1.00 0.00 H new ATOM 0 HB2 CYS B 24 14.533 -3.168 12.304 1.00 0.00 H new ATOM 0 HB3 CYS B 24 13.577 -2.684 10.918 1.00 0.00 H new ATOM 0 HG CYS B 24 12.851 -5.151 12.661 1.00 0.00 H new ATOM 1813 N ALA B 25 14.789 -2.915 8.177 1.00 0.00 N ATOM 1814 CA ALA B 25 14.395 -3.125 6.794 1.00 0.00 C ATOM 1815 C ALA B 25 15.572 -3.652 5.995 1.00 0.00 C ATOM 1816 O ALA B 25 15.421 -4.524 5.136 1.00 0.00 O ATOM 1817 CB ALA B 25 13.873 -1.830 6.189 1.00 0.00 C ATOM 0 H ALA B 25 14.847 -1.936 8.457 1.00 0.00 H new ATOM 0 HA ALA B 25 13.593 -3.863 6.763 1.00 0.00 H new ATOM 0 HB1 ALA B 25 13.582 -2.004 5.153 1.00 0.00 H new ATOM 0 HB2 ALA B 25 13.008 -1.486 6.756 1.00 0.00 H new ATOM 0 HB3 ALA B 25 14.655 -1.071 6.224 1.00 0.00 H new ATOM 1823 N THR B 26 16.752 -3.118 6.291 1.00 0.00 N ATOM 1824 CA THR B 26 17.961 -3.534 5.607 1.00 0.00 C ATOM 1825 C THR B 26 18.222 -5.015 5.839 1.00 0.00 C ATOM 1826 O THR B 26 18.509 -5.763 4.905 1.00 0.00 O ATOM 1827 CB THR B 26 19.159 -2.705 6.077 1.00 0.00 C ATOM 1828 OG1 THR B 26 18.941 -1.327 5.836 1.00 0.00 O ATOM 1829 CG2 THR B 26 20.457 -3.089 5.398 1.00 0.00 C ATOM 0 H THR B 26 16.892 -2.398 6.999 1.00 0.00 H new ATOM 0 HA THR B 26 17.823 -3.368 4.539 1.00 0.00 H new ATOM 0 HB THR B 26 19.251 -2.910 7.144 1.00 0.00 H new ATOM 0 HG1 THR B 26 18.237 -0.998 6.433 1.00 0.00 H new ATOM 0 HG21 THR B 26 21.265 -2.463 5.777 1.00 0.00 H new ATOM 0 HG22 THR B 26 20.681 -4.135 5.606 1.00 0.00 H new ATOM 0 HG23 THR B 26 20.361 -2.945 4.322 1.00 0.00 H new ATOM 1837 N GLN B 27 18.104 -5.433 7.093 1.00 0.00 N ATOM 1838 CA GLN B 27 18.312 -6.828 7.451 1.00 0.00 C ATOM 1839 C GLN B 27 17.308 -7.709 6.719 1.00 0.00 C ATOM 1840 O GLN B 27 17.641 -8.796 6.250 1.00 0.00 O ATOM 1841 CB GLN B 27 18.172 -7.019 8.962 1.00 0.00 C ATOM 1842 CG GLN B 27 19.166 -6.201 9.773 1.00 0.00 C ATOM 1843 CD GLN B 27 19.011 -6.411 11.266 1.00 0.00 C ATOM 1844 OE1 GLN B 27 19.148 -7.528 11.765 1.00 0.00 O ATOM 1845 NE2 GLN B 27 18.721 -5.334 11.987 1.00 0.00 N ATOM 0 H GLN B 27 17.866 -4.826 7.877 1.00 0.00 H new ATOM 0 HA GLN B 27 19.321 -7.116 7.156 1.00 0.00 H new ATOM 0 HB2 GLN B 27 17.160 -6.747 9.262 1.00 0.00 H new ATOM 0 HB3 GLN B 27 18.303 -8.075 9.200 1.00 0.00 H new ATOM 0 HG2 GLN B 27 20.180 -6.469 9.475 1.00 0.00 H new ATOM 0 HG3 GLN B 27 19.035 -5.144 9.543 1.00 0.00 H new ATOM 0 HE21 GLN B 27 18.617 -4.428 11.531 1.00 0.00 H new ATOM 0 HE22 GLN B 27 18.603 -5.413 12.997 1.00 0.00 H new ATOM 1854 N ALA B 28 16.075 -7.223 6.619 1.00 0.00 N ATOM 1855 CA ALA B 28 15.014 -7.956 5.942 1.00 0.00 C ATOM 1856 C ALA B 28 15.406 -8.296 4.509 1.00 0.00 C ATOM 1857 O ALA B 28 15.210 -9.422 4.056 1.00 0.00 O ATOM 1858 CB ALA B 28 13.726 -7.147 5.955 1.00 0.00 C ATOM 0 H ALA B 28 15.787 -6.322 7.000 1.00 0.00 H new ATOM 0 HA ALA B 28 14.854 -8.891 6.479 1.00 0.00 H new ATOM 0 HB1 ALA B 28 12.940 -7.705 5.446 1.00 0.00 H new ATOM 0 HB2 ALA B 28 13.426 -6.957 6.986 1.00 0.00 H new ATOM 0 HB3 ALA B 28 13.887 -6.198 5.443 1.00 0.00 H new ATOM 1864 N LEU B 29 15.954 -7.316 3.798 1.00 0.00 N ATOM 1865 CA LEU B 29 16.364 -7.529 2.415 1.00 0.00 C ATOM 1866 C LEU B 29 17.470 -8.566 2.317 1.00 0.00 C ATOM 1867 O LEU B 29 17.413 -9.474 1.491 1.00 0.00 O ATOM 1868 CB LEU B 29 16.824 -6.213 1.788 1.00 0.00 C ATOM 1869 CG LEU B 29 15.695 -5.251 1.435 1.00 0.00 C ATOM 1870 CD1 LEU B 29 16.242 -3.859 1.155 1.00 0.00 C ATOM 1871 CD2 LEU B 29 14.919 -5.768 0.231 1.00 0.00 C ATOM 0 H LEU B 29 16.123 -6.375 4.153 1.00 0.00 H new ATOM 0 HA LEU B 29 15.500 -7.904 1.867 1.00 0.00 H new ATOM 0 HB2 LEU B 29 17.506 -5.715 2.478 1.00 0.00 H new ATOM 0 HB3 LEU B 29 17.391 -6.435 0.884 1.00 0.00 H new ATOM 0 HG LEU B 29 15.018 -5.187 2.287 1.00 0.00 H new ATOM 0 HD11 LEU B 29 15.420 -3.188 0.905 1.00 0.00 H new ATOM 0 HD12 LEU B 29 16.758 -3.486 2.040 1.00 0.00 H new ATOM 0 HD13 LEU B 29 16.940 -3.904 0.319 1.00 0.00 H new ATOM 0 HD21 LEU B 29 14.116 -5.072 -0.010 1.00 0.00 H new ATOM 0 HD22 LEU B 29 15.590 -5.858 -0.623 1.00 0.00 H new ATOM 0 HD23 LEU B 29 14.495 -6.745 0.464 1.00 0.00 H new ATOM 1883 N GLU B 30 18.477 -8.423 3.164 1.00 0.00 N ATOM 1884 CA GLU B 30 19.605 -9.346 3.173 1.00 0.00 C ATOM 1885 C GLU B 30 19.187 -10.735 3.646 1.00 0.00 C ATOM 1886 O GLU B 30 19.773 -11.739 3.242 1.00 0.00 O ATOM 1887 CB GLU B 30 20.722 -8.806 4.068 1.00 0.00 C ATOM 1888 CG GLU B 30 21.258 -7.455 3.625 1.00 0.00 C ATOM 1889 CD GLU B 30 22.360 -6.940 4.530 1.00 0.00 C ATOM 1890 OE1 GLU B 30 23.396 -7.626 4.653 1.00 0.00 O ATOM 1891 OE2 GLU B 30 22.188 -5.849 5.112 1.00 0.00 O ATOM 0 H GLU B 30 18.538 -7.676 3.856 1.00 0.00 H new ATOM 0 HA GLU B 30 19.971 -9.433 2.150 1.00 0.00 H new ATOM 0 HB2 GLU B 30 20.350 -8.723 5.089 1.00 0.00 H new ATOM 0 HB3 GLU B 30 21.541 -9.525 4.085 1.00 0.00 H new ATOM 0 HG2 GLU B 30 21.637 -7.535 2.606 1.00 0.00 H new ATOM 0 HG3 GLU B 30 20.442 -6.733 3.606 1.00 0.00 H new ATOM 1898 N LYS B 31 18.185 -10.788 4.520 1.00 0.00 N ATOM 1899 CA LYS B 31 17.712 -12.055 5.060 1.00 0.00 C ATOM 1900 C LYS B 31 16.644 -12.697 4.181 1.00 0.00 C ATOM 1901 O LYS B 31 16.582 -13.922 4.069 1.00 0.00 O ATOM 1902 CB LYS B 31 17.168 -11.856 6.476 1.00 0.00 C ATOM 1903 CG LYS B 31 18.227 -11.428 7.480 1.00 0.00 C ATOM 1904 CD LYS B 31 17.628 -11.199 8.860 1.00 0.00 C ATOM 1905 CE LYS B 31 16.986 -12.465 9.406 1.00 0.00 C ATOM 1906 NZ LYS B 31 16.399 -12.252 10.758 1.00 0.00 N ATOM 0 H LYS B 31 17.687 -9.968 4.868 1.00 0.00 H new ATOM 0 HA LYS B 31 18.566 -12.732 5.085 1.00 0.00 H new ATOM 0 HB2 LYS B 31 16.378 -11.105 6.451 1.00 0.00 H new ATOM 0 HB3 LYS B 31 16.712 -12.786 6.815 1.00 0.00 H new ATOM 0 HG2 LYS B 31 19.002 -12.192 7.541 1.00 0.00 H new ATOM 0 HG3 LYS B 31 18.708 -10.513 7.135 1.00 0.00 H new ATOM 0 HD2 LYS B 31 18.406 -10.860 9.544 1.00 0.00 H new ATOM 0 HD3 LYS B 31 16.883 -10.405 8.807 1.00 0.00 H new ATOM 0 HE2 LYS B 31 16.208 -12.802 8.721 1.00 0.00 H new ATOM 0 HE3 LYS B 31 17.732 -13.258 9.455 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 15.972 -13.138 11.094 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 17.146 -11.955 11.418 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 15.669 -11.513 10.707 1.00 0.00 H new ATOM 1920 N TYR B 32 15.785 -11.880 3.578 1.00 0.00 N ATOM 1921 CA TYR B 32 14.713 -12.409 2.744 1.00 0.00 C ATOM 1922 C TYR B 32 14.894 -12.065 1.267 1.00 0.00 C ATOM 1923 O TYR B 32 14.686 -12.912 0.399 1.00 0.00 O ATOM 1924 CB TYR B 32 13.359 -11.896 3.235 1.00 0.00 C ATOM 1925 CG TYR B 32 12.995 -12.392 4.617 1.00 0.00 C ATOM 1926 CD1 TYR B 32 12.870 -13.752 4.874 1.00 0.00 C ATOM 1927 CD2 TYR B 32 12.780 -11.504 5.663 1.00 0.00 C ATOM 1928 CE1 TYR B 32 12.538 -14.211 6.134 1.00 0.00 C ATOM 1929 CE2 TYR B 32 12.447 -11.956 6.926 1.00 0.00 C ATOM 1930 CZ TYR B 32 12.329 -13.310 7.156 1.00 0.00 C ATOM 1931 OH TYR B 32 11.998 -13.765 8.413 1.00 0.00 O ATOM 0 H TYR B 32 15.810 -10.863 3.650 1.00 0.00 H new ATOM 0 HA TYR B 32 14.750 -13.495 2.831 1.00 0.00 H new ATOM 0 HB2 TYR B 32 13.371 -10.806 3.240 1.00 0.00 H new ATOM 0 HB3 TYR B 32 12.585 -12.203 2.531 1.00 0.00 H new ATOM 0 HD1 TYR B 32 13.035 -14.461 4.076 1.00 0.00 H new ATOM 0 HD2 TYR B 32 12.875 -10.443 5.487 1.00 0.00 H new ATOM 0 HE1 TYR B 32 12.443 -15.271 6.317 1.00 0.00 H new ATOM 0 HE2 TYR B 32 12.280 -11.252 7.728 1.00 0.00 H new ATOM 0 HH TYR B 32 11.886 -13.002 9.018 1.00 0.00 H new ATOM 1941 N ASN B 33 15.264 -10.823 0.984 1.00 0.00 N ATOM 1942 CA ASN B 33 15.448 -10.379 -0.394 1.00 0.00 C ATOM 1943 C ASN B 33 14.118 -10.405 -1.144 1.00 0.00 C ATOM 1944 O ASN B 33 14.059 -10.778 -2.314 1.00 0.00 O ATOM 1945 CB ASN B 33 16.465 -11.268 -1.120 1.00 0.00 C ATOM 1946 CG ASN B 33 17.806 -11.323 -0.415 1.00 0.00 C ATOM 1947 OD1 ASN B 33 17.901 -11.771 0.728 1.00 0.00 O ATOM 1948 ND2 ASN B 33 18.850 -10.866 -1.094 1.00 0.00 N ATOM 0 H ASN B 33 15.443 -10.106 1.687 1.00 0.00 H new ATOM 0 HA ASN B 33 15.827 -9.357 -0.371 1.00 0.00 H new ATOM 0 HB2 ASN B 33 16.063 -12.277 -1.205 1.00 0.00 H new ATOM 0 HB3 ASN B 33 16.608 -10.895 -2.134 1.00 0.00 H new ATOM 0 HD21 ASN B 33 19.778 -10.877 -0.671 1.00 0.00 H new ATOM 0 HD22 ASN B 33 18.725 -10.504 -2.039 1.00 0.00 H new ATOM 1955 N ILE B 34 13.050 -10.004 -0.456 1.00 0.00 N ATOM 1956 CA ILE B 34 11.718 -9.980 -1.049 1.00 0.00 C ATOM 1957 C ILE B 34 10.852 -8.914 -0.382 1.00 0.00 C ATOM 1958 O ILE B 34 10.750 -8.863 0.841 1.00 0.00 O ATOM 1959 CB ILE B 34 11.023 -11.350 -0.918 1.00 0.00 C ATOM 1960 CG1 ILE B 34 11.867 -12.443 -1.580 1.00 0.00 C ATOM 1961 CG2 ILE B 34 9.627 -11.308 -1.529 1.00 0.00 C ATOM 1962 CD1 ILE B 34 11.236 -13.817 -1.517 1.00 0.00 C ATOM 0 H ILE B 34 13.084 -9.691 0.514 1.00 0.00 H new ATOM 0 HA ILE B 34 11.837 -9.744 -2.107 1.00 0.00 H new ATOM 0 HB ILE B 34 10.924 -11.584 0.142 1.00 0.00 H new ATOM 0 HG12 ILE B 34 12.036 -12.178 -2.624 1.00 0.00 H new ATOM 0 HG13 ILE B 34 12.844 -12.478 -1.098 1.00 0.00 H new ATOM 0 HG21 ILE B 34 9.155 -12.285 -1.425 1.00 0.00 H new ATOM 0 HG22 ILE B 34 9.027 -10.558 -1.013 1.00 0.00 H new ATOM 0 HG23 ILE B 34 9.700 -11.050 -2.586 1.00 0.00 H new ATOM 0 HD11 ILE B 34 11.889 -14.540 -2.005 1.00 0.00 H new ATOM 0 HD12 ILE B 34 11.092 -14.104 -0.475 1.00 0.00 H new ATOM 0 HD13 ILE B 34 10.272 -13.798 -2.025 1.00 0.00 H new ATOM 1974 N GLU B 35 10.239 -8.065 -1.197 1.00 0.00 N ATOM 1975 CA GLU B 35 9.392 -6.984 -0.698 1.00 0.00 C ATOM 1976 C GLU B 35 8.368 -7.475 0.327 1.00 0.00 C ATOM 1977 O GLU B 35 8.200 -6.872 1.387 1.00 0.00 O ATOM 1978 CB GLU B 35 8.668 -6.311 -1.866 1.00 0.00 C ATOM 1979 CG GLU B 35 7.786 -7.261 -2.662 1.00 0.00 C ATOM 1980 CD GLU B 35 7.152 -6.603 -3.872 1.00 0.00 C ATOM 1981 OE1 GLU B 35 7.403 -5.401 -4.097 1.00 0.00 O ATOM 1982 OE2 GLU B 35 6.404 -7.293 -4.598 1.00 0.00 O ATOM 0 H GLU B 35 10.312 -8.103 -2.214 1.00 0.00 H new ATOM 0 HA GLU B 35 10.042 -6.267 -0.196 1.00 0.00 H new ATOM 0 HB2 GLU B 35 8.056 -5.495 -1.482 1.00 0.00 H new ATOM 0 HB3 GLU B 35 9.407 -5.868 -2.534 1.00 0.00 H new ATOM 0 HG2 GLU B 35 8.381 -8.114 -2.989 1.00 0.00 H new ATOM 0 HG3 GLU B 35 7.001 -7.650 -2.013 1.00 0.00 H new ATOM 1989 N LYS B 36 7.672 -8.556 -0.003 1.00 0.00 N ATOM 1990 CA LYS B 36 6.647 -9.107 0.883 1.00 0.00 C ATOM 1991 C LYS B 36 7.216 -9.504 2.247 1.00 0.00 C ATOM 1992 O LYS B 36 6.732 -9.052 3.285 1.00 0.00 O ATOM 1993 CB LYS B 36 5.993 -10.328 0.241 1.00 0.00 C ATOM 1994 CG LYS B 36 4.785 -10.842 1.008 1.00 0.00 C ATOM 1995 CD LYS B 36 4.447 -12.272 0.625 1.00 0.00 C ATOM 1996 CE LYS B 36 5.495 -13.245 1.141 1.00 0.00 C ATOM 1997 NZ LYS B 36 5.560 -13.249 2.630 1.00 0.00 N ATOM 0 H LYS B 36 7.796 -9.070 -0.875 1.00 0.00 H new ATOM 0 HA LYS B 36 5.906 -8.322 1.038 1.00 0.00 H new ATOM 0 HB2 LYS B 36 5.688 -10.075 -0.775 1.00 0.00 H new ATOM 0 HB3 LYS B 36 6.731 -11.127 0.163 1.00 0.00 H new ATOM 0 HG2 LYS B 36 4.983 -10.789 2.078 1.00 0.00 H new ATOM 0 HG3 LYS B 36 3.927 -10.199 0.810 1.00 0.00 H new ATOM 0 HD2 LYS B 36 3.470 -12.538 1.030 1.00 0.00 H new ATOM 0 HD3 LYS B 36 4.375 -12.353 -0.460 1.00 0.00 H new ATOM 0 HE2 LYS B 36 5.266 -14.249 0.784 1.00 0.00 H new ATOM 0 HE3 LYS B 36 6.471 -12.978 0.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 6.028 -14.119 2.955 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 6.101 -12.423 2.956 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 4.597 -13.208 3.020 1.00 0.00 H new ATOM 2011 N ASP B 37 8.228 -10.366 2.238 1.00 0.00 N ATOM 2012 CA ASP B 37 8.847 -10.842 3.475 1.00 0.00 C ATOM 2013 C ASP B 37 9.279 -9.690 4.379 1.00 0.00 C ATOM 2014 O ASP B 37 9.093 -9.742 5.595 1.00 0.00 O ATOM 2015 CB ASP B 37 10.048 -11.736 3.158 1.00 0.00 C ATOM 2016 CG ASP B 37 9.644 -13.013 2.447 1.00 0.00 C ATOM 2017 OD1 ASP B 37 8.844 -13.783 3.019 1.00 0.00 O ATOM 2018 OD2 ASP B 37 10.129 -13.245 1.322 1.00 0.00 O ATOM 0 H ASP B 37 8.639 -10.751 1.387 1.00 0.00 H new ATOM 0 HA ASP B 37 8.095 -11.420 4.012 1.00 0.00 H new ATOM 0 HB2 ASP B 37 10.754 -11.185 2.537 1.00 0.00 H new ATOM 0 HB3 ASP B 37 10.566 -11.987 4.084 1.00 0.00 H new ATOM 2023 N ILE B 38 9.857 -8.654 3.782 1.00 0.00 N ATOM 2024 CA ILE B 38 10.318 -7.491 4.538 1.00 0.00 C ATOM 2025 C ILE B 38 9.212 -6.950 5.446 1.00 0.00 C ATOM 2026 O ILE B 38 9.415 -6.751 6.645 1.00 0.00 O ATOM 2027 CB ILE B 38 10.782 -6.367 3.584 1.00 0.00 C ATOM 2028 CG1 ILE B 38 11.934 -6.857 2.706 1.00 0.00 C ATOM 2029 CG2 ILE B 38 11.205 -5.128 4.359 1.00 0.00 C ATOM 2030 CD1 ILE B 38 12.279 -5.905 1.584 1.00 0.00 C ATOM 0 H ILE B 38 10.018 -8.594 2.777 1.00 0.00 H new ATOM 0 HA ILE B 38 11.157 -7.815 5.153 1.00 0.00 H new ATOM 0 HB ILE B 38 9.939 -6.098 2.947 1.00 0.00 H new ATOM 0 HG12 ILE B 38 12.816 -7.009 3.328 1.00 0.00 H new ATOM 0 HG13 ILE B 38 11.672 -7.826 2.283 1.00 0.00 H new ATOM 0 HG21 ILE B 38 11.526 -4.355 3.661 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.363 -4.761 4.945 1.00 0.00 H new ATOM 0 HG23 ILE B 38 12.029 -5.380 5.026 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.104 -6.314 1.001 1.00 0.00 H new ATOM 0 HD12 ILE B 38 11.410 -5.772 0.940 1.00 0.00 H new ATOM 0 HD13 ILE B 38 12.572 -4.942 2.001 1.00 0.00 H new ATOM 2042 N ALA B 39 8.050 -6.706 4.857 1.00 0.00 N ATOM 2043 CA ALA B 39 6.906 -6.173 5.588 1.00 0.00 C ATOM 2044 C ALA B 39 6.356 -7.159 6.617 1.00 0.00 C ATOM 2045 O ALA B 39 5.799 -6.752 7.637 1.00 0.00 O ATOM 2046 CB ALA B 39 5.812 -5.774 4.611 1.00 0.00 C ATOM 0 H ALA B 39 7.873 -6.870 3.866 1.00 0.00 H new ATOM 0 HA ALA B 39 7.251 -5.298 6.138 1.00 0.00 H new ATOM 0 HB1 ALA B 39 4.960 -5.376 5.162 1.00 0.00 H new ATOM 0 HB2 ALA B 39 6.192 -5.012 3.931 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.499 -6.647 4.039 1.00 0.00 H new ATOM 2052 N ALA B 40 6.487 -8.451 6.338 1.00 0.00 N ATOM 2053 CA ALA B 40 5.966 -9.477 7.237 1.00 0.00 C ATOM 2054 C ALA B 40 6.698 -9.507 8.577 1.00 0.00 C ATOM 2055 O ALA B 40 6.097 -9.287 9.632 1.00 0.00 O ATOM 2056 CB ALA B 40 6.043 -10.841 6.569 1.00 0.00 C ATOM 0 H ALA B 40 6.946 -8.813 5.502 1.00 0.00 H new ATOM 0 HA ALA B 40 4.926 -9.226 7.445 1.00 0.00 H new ATOM 0 HB1 ALA B 40 5.652 -11.600 7.246 1.00 0.00 H new ATOM 0 HB2 ALA B 40 5.451 -10.832 5.654 1.00 0.00 H new ATOM 0 HB3 ALA B 40 7.081 -11.070 6.327 1.00 0.00 H new ATOM 2062 N HIS B 41 7.989 -9.805 8.532 1.00 0.00 N ATOM 2063 CA HIS B 41 8.798 -9.900 9.742 1.00 0.00 C ATOM 2064 C HIS B 41 8.941 -8.546 10.440 1.00 0.00 C ATOM 2065 O HIS B 41 8.853 -8.460 11.664 1.00 0.00 O ATOM 2066 CB HIS B 41 10.175 -10.485 9.400 1.00 0.00 C ATOM 2067 CG HIS B 41 11.280 -9.477 9.348 1.00 0.00 C ATOM 2068 ND1 HIS B 41 11.880 -8.967 10.481 1.00 0.00 N ATOM 2069 CD2 HIS B 41 11.889 -8.878 8.299 1.00 0.00 C ATOM 2070 CE1 HIS B 41 12.811 -8.101 10.131 1.00 0.00 C ATOM 2071 NE2 HIS B 41 12.840 -8.028 8.812 1.00 0.00 N ATOM 0 H HIS B 41 8.501 -9.986 7.669 1.00 0.00 H new ATOM 0 HA HIS B 41 8.288 -10.565 10.439 1.00 0.00 H new ATOM 0 HB2 HIS B 41 10.427 -11.245 10.140 1.00 0.00 H new ATOM 0 HB3 HIS B 41 10.113 -10.988 8.435 1.00 0.00 H new ATOM 0 HD1 HIS B 41 11.641 -9.220 11.440 1.00 0.00 H new ATOM 0 HD2 HIS B 41 11.669 -9.038 7.254 1.00 0.00 H new ATOM 0 HE1 HIS B 41 13.443 -7.545 10.808 1.00 0.00 H new ATOM 2080 N ILE B 42 9.179 -7.493 9.664 1.00 0.00 N ATOM 2081 CA ILE B 42 9.348 -6.161 10.233 1.00 0.00 C ATOM 2082 C ILE B 42 8.096 -5.703 10.981 1.00 0.00 C ATOM 2083 O ILE B 42 8.191 -5.157 12.079 1.00 0.00 O ATOM 2084 CB ILE B 42 9.714 -5.119 9.154 1.00 0.00 C ATOM 2085 CG1 ILE B 42 11.053 -5.467 8.516 1.00 0.00 C ATOM 2086 CG2 ILE B 42 9.762 -3.717 9.747 1.00 0.00 C ATOM 2087 CD1 ILE B 42 11.438 -4.527 7.400 1.00 0.00 C ATOM 0 H ILE B 42 9.259 -7.535 8.648 1.00 0.00 H new ATOM 0 HA ILE B 42 10.173 -6.233 10.942 1.00 0.00 H new ATOM 0 HB ILE B 42 8.941 -5.139 8.386 1.00 0.00 H new ATOM 0 HG12 ILE B 42 11.829 -5.450 9.281 1.00 0.00 H new ATOM 0 HG13 ILE B 42 11.010 -6.485 8.128 1.00 0.00 H new ATOM 0 HG21 ILE B 42 10.022 -3.001 8.967 1.00 0.00 H new ATOM 0 HG22 ILE B 42 8.786 -3.464 10.162 1.00 0.00 H new ATOM 0 HG23 ILE B 42 10.512 -3.682 10.537 1.00 0.00 H new ATOM 0 HD11 ILE B 42 12.401 -4.828 6.987 1.00 0.00 H new ATOM 0 HD12 ILE B 42 10.680 -4.562 6.617 1.00 0.00 H new ATOM 0 HD13 ILE B 42 11.512 -3.511 7.789 1.00 0.00 H new ATOM 2099 N LYS B 43 6.926 -5.915 10.387 1.00 0.00 N ATOM 2100 CA LYS B 43 5.680 -5.501 11.022 1.00 0.00 C ATOM 2101 C LYS B 43 5.441 -6.244 12.334 1.00 0.00 C ATOM 2102 O LYS B 43 5.213 -5.623 13.371 1.00 0.00 O ATOM 2103 CB LYS B 43 4.488 -5.714 10.083 1.00 0.00 C ATOM 2104 CG LYS B 43 3.150 -5.383 10.728 1.00 0.00 C ATOM 2105 CD LYS B 43 1.997 -5.531 9.749 1.00 0.00 C ATOM 2106 CE LYS B 43 0.656 -5.301 10.430 1.00 0.00 C ATOM 2107 NZ LYS B 43 0.411 -6.285 11.522 1.00 0.00 N ATOM 0 H LYS B 43 6.814 -6.365 9.479 1.00 0.00 H new ATOM 0 HA LYS B 43 5.774 -4.438 11.243 1.00 0.00 H new ATOM 0 HB2 LYS B 43 4.619 -5.096 9.195 1.00 0.00 H new ATOM 0 HB3 LYS B 43 4.477 -6.752 9.750 1.00 0.00 H new ATOM 0 HG2 LYS B 43 2.987 -6.039 11.583 1.00 0.00 H new ATOM 0 HG3 LYS B 43 3.174 -4.362 11.110 1.00 0.00 H new ATOM 0 HD2 LYS B 43 2.118 -4.820 8.932 1.00 0.00 H new ATOM 0 HD3 LYS B 43 2.017 -6.528 9.309 1.00 0.00 H new ATOM 0 HE2 LYS B 43 0.625 -4.291 10.838 1.00 0.00 H new ATOM 0 HE3 LYS B 43 -0.143 -5.372 9.692 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 -0.605 -6.314 11.742 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 0.726 -7.228 11.217 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 0.941 -6.001 12.371 1.00 0.00 H new ATOM 2121 N LYS B 44 5.483 -7.573 12.288 1.00 0.00 N ATOM 2122 CA LYS B 44 5.251 -8.377 13.485 1.00 0.00 C ATOM 2123 C LYS B 44 6.251 -8.039 14.587 1.00 0.00 C ATOM 2124 O LYS B 44 5.924 -8.101 15.772 1.00 0.00 O ATOM 2125 CB LYS B 44 5.286 -9.875 13.149 1.00 0.00 C ATOM 2126 CG LYS B 44 6.605 -10.362 12.562 1.00 0.00 C ATOM 2127 CD LYS B 44 7.614 -10.719 13.643 1.00 0.00 C ATOM 2128 CE LYS B 44 8.903 -11.260 13.045 1.00 0.00 C ATOM 2129 NZ LYS B 44 9.897 -11.613 14.096 1.00 0.00 N ATOM 0 H LYS B 44 5.674 -8.112 11.443 1.00 0.00 H new ATOM 0 HA LYS B 44 4.257 -8.135 13.861 1.00 0.00 H new ATOM 0 HB2 LYS B 44 5.075 -10.442 14.055 1.00 0.00 H new ATOM 0 HB3 LYS B 44 4.486 -10.094 12.442 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.422 -11.234 11.935 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.023 -9.588 11.918 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.833 -9.836 14.244 1.00 0.00 H new ATOM 0 HD3 LYS B 44 7.183 -11.462 14.314 1.00 0.00 H new ATOM 0 HE2 LYS B 44 8.682 -12.142 12.443 1.00 0.00 H new ATOM 0 HE3 LYS B 44 9.332 -10.516 12.374 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 10.762 -11.978 13.648 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 10.127 -10.766 14.654 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 9.497 -12.342 14.721 1.00 0.00 H new ATOM 2143 N GLU B 45 7.470 -7.680 14.195 1.00 0.00 N ATOM 2144 CA GLU B 45 8.507 -7.334 15.160 1.00 0.00 C ATOM 2145 C GLU B 45 8.157 -6.045 15.900 1.00 0.00 C ATOM 2146 O GLU B 45 8.221 -5.985 17.128 1.00 0.00 O ATOM 2147 CB GLU B 45 9.857 -7.185 14.457 1.00 0.00 C ATOM 2148 CG GLU B 45 10.997 -6.819 15.393 1.00 0.00 C ATOM 2149 CD GLU B 45 11.226 -7.860 16.472 1.00 0.00 C ATOM 2150 OE1 GLU B 45 10.296 -8.102 17.270 1.00 0.00 O ATOM 2151 OE2 GLU B 45 12.335 -8.433 16.520 1.00 0.00 O ATOM 0 H GLU B 45 7.763 -7.621 13.220 1.00 0.00 H new ATOM 0 HA GLU B 45 8.573 -8.141 15.890 1.00 0.00 H new ATOM 0 HB2 GLU B 45 10.099 -8.121 13.953 1.00 0.00 H new ATOM 0 HB3 GLU B 45 9.772 -6.420 13.686 1.00 0.00 H new ATOM 0 HG2 GLU B 45 11.912 -6.695 14.814 1.00 0.00 H new ATOM 0 HG3 GLU B 45 10.783 -5.858 15.861 1.00 0.00 H new ATOM 2158 N PHE B 46 7.787 -5.016 15.143 1.00 0.00 N ATOM 2159 CA PHE B 46 7.426 -3.729 15.726 1.00 0.00 C ATOM 2160 C PHE B 46 6.096 -3.806 16.464 1.00 0.00 C ATOM 2161 O PHE B 46 5.932 -3.210 17.529 1.00 0.00 O ATOM 2162 CB PHE B 46 7.370 -2.649 14.643 1.00 0.00 C ATOM 2163 CG PHE B 46 8.725 -2.215 14.157 1.00 0.00 C ATOM 2164 CD1 PHE B 46 9.631 -3.138 13.662 1.00 0.00 C ATOM 2165 CD2 PHE B 46 9.092 -0.879 14.195 1.00 0.00 C ATOM 2166 CE1 PHE B 46 10.876 -2.738 13.215 1.00 0.00 C ATOM 2167 CE2 PHE B 46 10.335 -0.473 13.750 1.00 0.00 C ATOM 2168 CZ PHE B 46 11.228 -1.404 13.259 1.00 0.00 C ATOM 0 H PHE B 46 7.730 -5.049 14.125 1.00 0.00 H new ATOM 0 HA PHE B 46 8.196 -3.464 16.450 1.00 0.00 H new ATOM 0 HB2 PHE B 46 6.792 -3.023 13.798 1.00 0.00 H new ATOM 0 HB3 PHE B 46 6.838 -1.781 15.034 1.00 0.00 H new ATOM 0 HD1 PHE B 46 9.361 -4.183 13.625 1.00 0.00 H new ATOM 0 HD2 PHE B 46 8.397 -0.146 14.577 1.00 0.00 H new ATOM 0 HE1 PHE B 46 11.573 -3.469 12.832 1.00 0.00 H new ATOM 0 HE2 PHE B 46 10.608 0.571 13.786 1.00 0.00 H new ATOM 0 HZ PHE B 46 12.200 -1.089 12.910 1.00 0.00 H new ATOM 2178 N ASP B 47 5.147 -4.544 15.900 1.00 0.00 N ATOM 2179 CA ASP B 47 3.833 -4.693 16.516 1.00 0.00 C ATOM 2180 C ASP B 47 3.958 -5.294 17.909 1.00 0.00 C ATOM 2181 O ASP B 47 3.276 -4.877 18.843 1.00 0.00 O ATOM 2182 CB ASP B 47 2.931 -5.576 15.651 1.00 0.00 C ATOM 2183 CG ASP B 47 2.727 -5.016 14.257 1.00 0.00 C ATOM 2184 OD1 ASP B 47 3.342 -3.977 13.937 1.00 0.00 O ATOM 2185 OD2 ASP B 47 1.956 -5.619 13.483 1.00 0.00 O ATOM 0 H ASP B 47 5.262 -5.047 15.020 1.00 0.00 H new ATOM 0 HA ASP B 47 3.385 -3.703 16.598 1.00 0.00 H new ATOM 0 HB2 ASP B 47 3.367 -6.572 15.578 1.00 0.00 H new ATOM 0 HB3 ASP B 47 1.963 -5.687 16.139 1.00 0.00 H new ATOM 2190 N LYS B 48 4.831 -6.282 18.038 1.00 0.00 N ATOM 2191 CA LYS B 48 5.051 -6.955 19.308 1.00 0.00 C ATOM 2192 C LYS B 48 5.810 -6.066 20.294 1.00 0.00 C ATOM 2193 O LYS B 48 5.495 -6.034 21.484 1.00 0.00 O ATOM 2194 CB LYS B 48 5.824 -8.253 19.066 1.00 0.00 C ATOM 2195 CG LYS B 48 6.227 -8.973 20.339 1.00 0.00 C ATOM 2196 CD LYS B 48 5.016 -9.361 21.171 1.00 0.00 C ATOM 2197 CE LYS B 48 4.093 -10.296 20.408 1.00 0.00 C ATOM 2198 NZ LYS B 48 4.782 -11.556 20.013 1.00 0.00 N ATOM 0 H LYS B 48 5.402 -6.637 17.271 1.00 0.00 H new ATOM 0 HA LYS B 48 4.080 -7.179 19.750 1.00 0.00 H new ATOM 0 HB2 LYS B 48 5.212 -8.921 18.460 1.00 0.00 H new ATOM 0 HB3 LYS B 48 6.720 -8.029 18.487 1.00 0.00 H new ATOM 0 HG2 LYS B 48 6.797 -9.867 20.087 1.00 0.00 H new ATOM 0 HG3 LYS B 48 6.883 -8.332 20.928 1.00 0.00 H new ATOM 0 HD2 LYS B 48 5.345 -9.844 22.091 1.00 0.00 H new ATOM 0 HD3 LYS B 48 4.469 -8.464 21.460 1.00 0.00 H new ATOM 0 HE2 LYS B 48 3.227 -10.534 21.025 1.00 0.00 H new ATOM 0 HE3 LYS B 48 3.721 -9.791 19.517 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 4.079 -12.246 19.680 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 5.460 -11.356 19.250 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 5.289 -11.946 20.833 1.00 0.00 H new ATOM 2212 N LYS B 49 6.825 -5.372 19.795 1.00 0.00 N ATOM 2213 CA LYS B 49 7.651 -4.508 20.634 1.00 0.00 C ATOM 2214 C LYS B 49 7.019 -3.142 20.887 1.00 0.00 C ATOM 2215 O LYS B 49 6.735 -2.776 22.027 1.00 0.00 O ATOM 2216 CB LYS B 49 9.022 -4.320 19.985 1.00 0.00 C ATOM 2217 CG LYS B 49 9.807 -5.612 19.843 1.00 0.00 C ATOM 2218 CD LYS B 49 9.981 -6.291 21.188 1.00 0.00 C ATOM 2219 CE LYS B 49 10.795 -7.568 21.068 1.00 0.00 C ATOM 2220 NZ LYS B 49 10.147 -8.559 20.165 1.00 0.00 N ATOM 0 H LYS B 49 7.098 -5.390 18.812 1.00 0.00 H new ATOM 0 HA LYS B 49 7.747 -5.003 21.601 1.00 0.00 H new ATOM 0 HB2 LYS B 49 8.890 -3.874 18.999 1.00 0.00 H new ATOM 0 HB3 LYS B 49 9.603 -3.615 20.579 1.00 0.00 H new ATOM 0 HG2 LYS B 49 9.290 -6.283 19.157 1.00 0.00 H new ATOM 0 HG3 LYS B 49 10.784 -5.402 19.408 1.00 0.00 H new ATOM 0 HD2 LYS B 49 10.474 -5.608 21.880 1.00 0.00 H new ATOM 0 HD3 LYS B 49 9.002 -6.521 21.610 1.00 0.00 H new ATOM 0 HE2 LYS B 49 11.790 -7.330 20.691 1.00 0.00 H new ATOM 0 HE3 LYS B 49 10.926 -8.009 22.056 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 10.549 -9.502 20.339 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 9.124 -8.579 20.349 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 10.315 -8.289 19.175 1.00 0.00 H new ATOM 2234 N TYR B 50 6.839 -2.385 19.819 1.00 0.00 N ATOM 2235 CA TYR B 50 6.282 -1.036 19.911 1.00 0.00 C ATOM 2236 C TYR B 50 4.756 -1.025 19.990 1.00 0.00 C ATOM 2237 O TYR B 50 4.164 0.009 20.293 1.00 0.00 O ATOM 2238 CB TYR B 50 6.755 -0.193 18.728 1.00 0.00 C ATOM 2239 CG TYR B 50 8.253 0.024 18.703 1.00 0.00 C ATOM 2240 CD1 TYR B 50 9.127 -1.051 18.602 1.00 0.00 C ATOM 2241 CD2 TYR B 50 8.792 1.301 18.790 1.00 0.00 C ATOM 2242 CE1 TYR B 50 10.494 -0.861 18.587 1.00 0.00 C ATOM 2243 CE2 TYR B 50 10.160 1.499 18.774 1.00 0.00 C ATOM 2244 CZ TYR B 50 11.005 0.415 18.672 1.00 0.00 C ATOM 2245 OH TYR B 50 12.369 0.608 18.658 1.00 0.00 O ATOM 0 H TYR B 50 7.070 -2.679 18.870 1.00 0.00 H new ATOM 0 HA TYR B 50 6.648 -0.605 20.843 1.00 0.00 H new ATOM 0 HB2 TYR B 50 6.451 -0.679 17.801 1.00 0.00 H new ATOM 0 HB3 TYR B 50 6.256 0.775 18.759 1.00 0.00 H new ATOM 0 HD1 TYR B 50 8.730 -2.053 18.534 1.00 0.00 H new ATOM 0 HD2 TYR B 50 8.132 2.152 18.871 1.00 0.00 H new ATOM 0 HE1 TYR B 50 11.159 -1.708 18.509 1.00 0.00 H new ATOM 0 HE2 TYR B 50 10.565 2.498 18.841 1.00 0.00 H new ATOM 0 HH TYR B 50 12.638 0.981 17.792 1.00 0.00 H new ATOM 2255 N ASN B 51 4.127 -2.168 19.706 1.00 0.00 N ATOM 2256 CA ASN B 51 2.664 -2.298 19.733 1.00 0.00 C ATOM 2257 C ASN B 51 2.076 -1.995 18.359 1.00 0.00 C ATOM 2258 O ASN B 51 2.540 -1.095 17.662 1.00 0.00 O ATOM 2259 CB ASN B 51 2.020 -1.388 20.789 1.00 0.00 C ATOM 2260 CG ASN B 51 2.553 -1.645 22.186 1.00 0.00 C ATOM 2261 OD1 ASN B 51 3.745 -1.492 22.448 1.00 0.00 O ATOM 2262 ND2 ASN B 51 1.666 -2.041 23.091 1.00 0.00 N ATOM 0 H ASN B 51 4.613 -3.028 19.451 1.00 0.00 H new ATOM 0 HA ASN B 51 2.440 -3.330 20.005 1.00 0.00 H new ATOM 0 HB2 ASN B 51 2.198 -0.346 20.522 1.00 0.00 H new ATOM 0 HB3 ASN B 51 0.940 -1.538 20.783 1.00 0.00 H new ATOM 0 HD21 ASN B 51 1.964 -2.231 24.048 1.00 0.00 H new ATOM 0 HD22 ASN B 51 0.687 -2.155 22.830 1.00 0.00 H new ATOM 2269 N PRO B 52 1.052 -2.759 17.944 1.00 0.00 N ATOM 2270 CA PRO B 52 0.412 -2.578 16.638 1.00 0.00 C ATOM 2271 C PRO B 52 -0.342 -1.250 16.521 1.00 0.00 C ATOM 2272 O PRO B 52 -0.494 -0.534 17.509 1.00 0.00 O ATOM 2273 CB PRO B 52 -0.562 -3.758 16.548 1.00 0.00 C ATOM 2274 CG PRO B 52 -0.833 -4.135 17.963 1.00 0.00 C ATOM 2275 CD PRO B 52 0.442 -3.865 18.708 1.00 0.00 C ATOM 0 HA PRO B 52 1.147 -2.550 15.834 1.00 0.00 H new ATOM 0 HB2 PRO B 52 -1.479 -3.476 16.031 1.00 0.00 H new ATOM 0 HB3 PRO B 52 -0.127 -4.589 15.993 1.00 0.00 H new ATOM 0 HG2 PRO B 52 -1.657 -3.551 18.373 1.00 0.00 H new ATOM 0 HG3 PRO B 52 -1.117 -5.184 18.041 1.00 0.00 H new ATOM 0 HD2 PRO B 52 0.251 -3.582 19.743 1.00 0.00 H new ATOM 0 HD3 PRO B 52 1.088 -4.743 18.731 1.00 0.00 H new ATOM 2283 N THR B 53 -0.815 -0.918 15.307 1.00 0.00 N ATOM 2284 CA THR B 53 -0.638 -1.765 14.131 1.00 0.00 C ATOM 2285 C THR B 53 0.204 -1.065 13.068 1.00 0.00 C ATOM 2286 O THR B 53 -0.182 -0.022 12.540 1.00 0.00 O ATOM 2287 CB THR B 53 -2.003 -2.141 13.559 1.00 0.00 C ATOM 2288 OG1 THR B 53 -1.865 -3.048 12.481 1.00 0.00 O ATOM 2289 CG2 THR B 53 -2.795 -0.951 13.060 1.00 0.00 C ATOM 0 H THR B 53 -1.328 -0.056 15.121 1.00 0.00 H new ATOM 0 HA THR B 53 -0.110 -2.669 14.434 1.00 0.00 H new ATOM 0 HB THR B 53 -2.545 -2.594 14.389 1.00 0.00 H new ATOM 0 HG1 THR B 53 -2.249 -2.653 11.670 1.00 0.00 H new ATOM 0 HG21 THR B 53 -3.753 -1.291 12.667 1.00 0.00 H new ATOM 0 HG22 THR B 53 -2.965 -0.257 13.883 1.00 0.00 H new ATOM 0 HG23 THR B 53 -2.237 -0.448 12.270 1.00 0.00 H new ATOM 2297 N TRP B 54 1.357 -1.648 12.769 1.00 0.00 N ATOM 2298 CA TRP B 54 2.270 -1.091 11.777 1.00 0.00 C ATOM 2299 C TRP B 54 1.954 -1.586 10.373 1.00 0.00 C ATOM 2300 O TRP B 54 2.017 -2.782 10.092 1.00 0.00 O ATOM 2301 CB TRP B 54 3.710 -1.446 12.132 1.00 0.00 C ATOM 2302 CG TRP B 54 4.109 -0.958 13.485 1.00 0.00 C ATOM 2303 CD1 TRP B 54 3.566 -1.327 14.679 1.00 0.00 C ATOM 2304 CD2 TRP B 54 5.124 0.004 13.782 1.00 0.00 C ATOM 2305 NE1 TRP B 54 4.187 -0.663 15.705 1.00 0.00 N ATOM 2306 CE2 TRP B 54 5.147 0.163 15.180 1.00 0.00 C ATOM 2307 CE3 TRP B 54 6.018 0.745 13.003 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 6.028 1.032 15.815 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 6.892 1.609 13.634 1.00 0.00 C ATOM 2310 CH2 TRP B 54 6.890 1.746 15.029 1.00 0.00 C ATOM 0 H TRP B 54 1.685 -2.512 13.202 1.00 0.00 H new ATOM 0 HA TRP B 54 2.142 -0.009 11.788 1.00 0.00 H new ATOM 0 HB2 TRP B 54 3.834 -2.528 12.090 1.00 0.00 H new ATOM 0 HB3 TRP B 54 4.379 -1.020 11.385 1.00 0.00 H new ATOM 0 HD1 TRP B 54 2.763 -2.039 14.800 1.00 0.00 H new ATOM 0 HE1 TRP B 54 3.970 -0.767 16.696 1.00 0.00 H new ATOM 0 HE3 TRP B 54 6.025 0.644 11.928 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 6.031 1.139 16.890 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 7.587 2.188 13.044 1.00 0.00 H new ATOM 0 HH2 TRP B 54 7.584 2.430 15.493 1.00 0.00 H new ATOM 2321 N HIS B 55 1.645 -0.650 9.488 1.00 0.00 N ATOM 2322 CA HIS B 55 1.351 -0.975 8.102 1.00 0.00 C ATOM 2323 C HIS B 55 2.636 -0.893 7.291 1.00 0.00 C ATOM 2324 O HIS B 55 3.451 0.004 7.515 1.00 0.00 O ATOM 2325 CB HIS B 55 0.303 -0.013 7.549 1.00 0.00 C ATOM 2326 CG HIS B 55 -0.848 0.199 8.482 1.00 0.00 C ATOM 2327 ND1 HIS B 55 -1.582 -0.838 9.017 1.00 0.00 N ATOM 2328 CD2 HIS B 55 -1.388 1.335 8.978 1.00 0.00 C ATOM 2329 CE1 HIS B 55 -2.525 -0.348 9.799 1.00 0.00 C ATOM 2330 NE2 HIS B 55 -2.431 0.968 9.794 1.00 0.00 N ATOM 0 H HIS B 55 1.591 0.345 9.707 1.00 0.00 H new ATOM 0 HA HIS B 55 0.950 -1.986 8.037 1.00 0.00 H new ATOM 0 HB2 HIS B 55 0.774 0.947 7.339 1.00 0.00 H new ATOM 0 HB3 HIS B 55 -0.072 -0.399 6.601 1.00 0.00 H new ATOM 0 HD2 HIS B 55 -1.061 2.343 8.771 1.00 0.00 H new ATOM 0 HE1 HIS B 55 -3.251 -0.927 10.350 1.00 0.00 H new ATOM 0 HE2 HIS B 55 -3.034 1.608 10.311 1.00 0.00 H new ATOM 2339 N CYS B 56 2.843 -1.830 6.372 1.00 0.00 N ATOM 2340 CA CYS B 56 4.070 -1.824 5.581 1.00 0.00 C ATOM 2341 C CYS B 56 3.827 -2.193 4.122 1.00 0.00 C ATOM 2342 O CYS B 56 2.929 -2.972 3.798 1.00 0.00 O ATOM 2343 CB CYS B 56 5.097 -2.776 6.195 1.00 0.00 C ATOM 2344 SG CYS B 56 6.689 -2.795 5.339 1.00 0.00 S ATOM 0 H CYS B 56 2.194 -2.588 6.159 1.00 0.00 H new ATOM 0 HA CYS B 56 4.455 -0.804 5.597 1.00 0.00 H new ATOM 0 HB2 CYS B 56 5.259 -2.496 7.236 1.00 0.00 H new ATOM 0 HB3 CYS B 56 4.685 -3.785 6.197 1.00 0.00 H new ATOM 0 HG CYS B 56 7.013 -1.583 4.998 1.00 0.00 H new ATOM 2350 N ILE B 57 4.649 -1.617 3.253 1.00 0.00 N ATOM 2351 CA ILE B 57 4.570 -1.853 1.819 1.00 0.00 C ATOM 2352 C ILE B 57 5.960 -1.724 1.199 1.00 0.00 C ATOM 2353 O ILE B 57 6.765 -0.903 1.640 1.00 0.00 O ATOM 2354 CB ILE B 57 3.611 -0.856 1.140 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.232 -0.914 1.798 1.00 0.00 C ATOM 2356 CG2 ILE B 57 3.503 -1.148 -0.350 1.00 0.00 C ATOM 2357 CD1 ILE B 57 1.231 0.045 1.189 1.00 0.00 C ATOM 0 H ILE B 57 5.391 -0.972 3.525 1.00 0.00 H new ATOM 0 HA ILE B 57 4.184 -2.860 1.663 1.00 0.00 H new ATOM 0 HB ILE B 57 4.013 0.150 1.264 1.00 0.00 H new ATOM 0 HG12 ILE B 57 1.844 -1.930 1.720 1.00 0.00 H new ATOM 0 HG13 ILE B 57 2.335 -0.693 2.860 1.00 0.00 H new ATOM 0 HG21 ILE B 57 2.822 -0.434 -0.812 1.00 0.00 H new ATOM 0 HG22 ILE B 57 4.487 -1.061 -0.810 1.00 0.00 H new ATOM 0 HG23 ILE B 57 3.123 -2.159 -0.496 1.00 0.00 H new ATOM 0 HD11 ILE B 57 0.275 -0.050 1.705 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.598 1.066 1.290 1.00 0.00 H new ATOM 0 HD13 ILE B 57 1.098 -0.190 0.133 1.00 0.00 H new ATOM 2369 N VAL B 58 6.248 -2.538 0.190 1.00 0.00 N ATOM 2370 CA VAL B 58 7.556 -2.501 -0.455 1.00 0.00 C ATOM 2371 C VAL B 58 7.473 -2.959 -1.904 1.00 0.00 C ATOM 2372 O VAL B 58 6.764 -3.908 -2.227 1.00 0.00 O ATOM 2373 CB VAL B 58 8.571 -3.390 0.293 1.00 0.00 C ATOM 2374 CG1 VAL B 58 9.945 -3.316 -0.362 1.00 0.00 C ATOM 2375 CG2 VAL B 58 8.648 -2.991 1.760 1.00 0.00 C ATOM 0 H VAL B 58 5.601 -3.225 -0.196 1.00 0.00 H new ATOM 0 HA VAL B 58 7.893 -1.465 -0.426 1.00 0.00 H new ATOM 0 HB VAL B 58 8.228 -4.423 0.236 1.00 0.00 H new ATOM 0 HG11 VAL B 58 10.643 -3.951 0.184 1.00 0.00 H new ATOM 0 HG12 VAL B 58 9.875 -3.658 -1.395 1.00 0.00 H new ATOM 0 HG13 VAL B 58 10.302 -2.286 -0.344 1.00 0.00 H new ATOM 0 HG21 VAL B 58 9.368 -3.628 2.273 1.00 0.00 H new ATOM 0 HG22 VAL B 58 8.963 -1.951 1.838 1.00 0.00 H new ATOM 0 HG23 VAL B 58 7.667 -3.108 2.221 1.00 0.00 H new ATOM 2385 N GLY B 59 8.207 -2.274 -2.771 1.00 0.00 N ATOM 2386 CA GLY B 59 8.211 -2.615 -4.179 1.00 0.00 C ATOM 2387 C GLY B 59 9.017 -1.630 -5.002 1.00 0.00 C ATOM 2388 O GLY B 59 10.167 -1.335 -4.675 1.00 0.00 O ATOM 0 H GLY B 59 8.802 -1.484 -2.522 1.00 0.00 H new ATOM 0 HA2 GLY B 59 8.622 -3.616 -4.308 1.00 0.00 H new ATOM 0 HA3 GLY B 59 7.186 -2.642 -4.548 1.00 0.00 H new ATOM 2392 N ARG B 60 8.414 -1.114 -6.067 1.00 0.00 N ATOM 2393 CA ARG B 60 9.092 -0.150 -6.932 1.00 0.00 C ATOM 2394 C ARG B 60 8.169 0.350 -8.041 1.00 0.00 C ATOM 2395 O ARG B 60 8.600 0.541 -9.178 1.00 0.00 O ATOM 2396 CB ARG B 60 10.347 -0.776 -7.544 1.00 0.00 C ATOM 2397 CG ARG B 60 10.060 -2.007 -8.391 1.00 0.00 C ATOM 2398 CD ARG B 60 11.334 -2.578 -8.989 1.00 0.00 C ATOM 2399 NE ARG B 60 11.072 -3.760 -9.807 1.00 0.00 N ATOM 2400 CZ ARG B 60 12.018 -4.443 -10.450 1.00 0.00 C ATOM 2401 NH1 ARG B 60 13.288 -4.064 -10.370 1.00 0.00 N ATOM 2402 NH2 ARG B 60 11.694 -5.506 -11.172 1.00 0.00 N ATOM 0 H ARG B 60 7.462 -1.344 -6.353 1.00 0.00 H new ATOM 0 HA ARG B 60 9.378 0.703 -6.317 1.00 0.00 H new ATOM 0 HB2 ARG B 60 10.852 -0.031 -8.159 1.00 0.00 H new ATOM 0 HB3 ARG B 60 11.035 -1.048 -6.744 1.00 0.00 H new ATOM 0 HG2 ARG B 60 9.572 -2.766 -7.779 1.00 0.00 H new ATOM 0 HG3 ARG B 60 9.366 -1.747 -9.190 1.00 0.00 H new ATOM 0 HD2 ARG B 60 11.822 -1.817 -9.598 1.00 0.00 H new ATOM 0 HD3 ARG B 60 12.026 -2.837 -8.188 1.00 0.00 H new ATOM 0 HE ARG B 60 10.108 -4.081 -9.891 1.00 0.00 H new ATOM 0 HH11 ARG B 60 13.542 -3.247 -9.815 1.00 0.00 H new ATOM 0 HH12 ARG B 60 14.009 -4.590 -10.864 1.00 0.00 H new ATOM 0 HH21 ARG B 60 10.720 -5.802 -11.236 1.00 0.00 H new ATOM 0 HH22 ARG B 60 12.419 -6.028 -11.664 1.00 0.00 H new ATOM 2416 N ASN B 61 6.901 0.564 -7.694 1.00 0.00 N ATOM 2417 CA ASN B 61 5.890 1.045 -8.637 1.00 0.00 C ATOM 2418 C ASN B 61 4.498 0.801 -8.067 1.00 0.00 C ATOM 2419 O ASN B 61 3.860 -0.201 -8.390 1.00 0.00 O ATOM 2420 CB ASN B 61 6.016 0.341 -9.997 1.00 0.00 C ATOM 2421 CG ASN B 61 4.983 0.800 -11.020 1.00 0.00 C ATOM 2422 OD1 ASN B 61 4.277 1.893 -10.736 1.00 0.00 O flip ATOM 2423 ND2 ASN B 61 4.838 0.184 -12.077 1.00 0.00 N flip ATOM 0 H ASN B 61 6.544 0.409 -6.751 1.00 0.00 H new ATOM 0 HA ASN B 61 6.049 2.113 -8.787 1.00 0.00 H new ATOM 0 HB2 ASN B 61 7.014 0.518 -10.397 1.00 0.00 H new ATOM 0 HB3 ASN B 61 5.917 -0.735 -9.851 1.00 0.00 H new ATOM 0 HD21 ASN B 61 5.396 -0.650 -12.262 1.00 0.00 H new ATOM 0 HD22 ASN B 61 4.160 0.508 -12.767 1.00 0.00 H new ATOM 2430 N PHE B 62 4.033 1.701 -7.206 1.00 0.00 N ATOM 2431 CA PHE B 62 2.719 1.532 -6.596 1.00 0.00 C ATOM 2432 C PHE B 62 2.180 2.818 -5.983 1.00 0.00 C ATOM 2433 O PHE B 62 2.864 3.497 -5.217 1.00 0.00 O ATOM 2434 CB PHE B 62 2.794 0.460 -5.510 1.00 0.00 C ATOM 2435 CG PHE B 62 3.629 0.862 -4.327 1.00 0.00 C ATOM 2436 CD1 PHE B 62 4.978 1.142 -4.476 1.00 0.00 C ATOM 2437 CD2 PHE B 62 3.064 0.966 -3.065 1.00 0.00 C ATOM 2438 CE1 PHE B 62 5.748 1.517 -3.390 1.00 0.00 C ATOM 2439 CE2 PHE B 62 3.828 1.340 -1.976 1.00 0.00 C ATOM 2440 CZ PHE B 62 5.171 1.616 -2.140 1.00 0.00 C ATOM 0 H PHE B 62 4.536 2.541 -6.919 1.00 0.00 H new ATOM 0 HA PHE B 62 2.036 1.236 -7.392 1.00 0.00 H new ATOM 0 HB2 PHE B 62 1.785 0.227 -5.170 1.00 0.00 H new ATOM 0 HB3 PHE B 62 3.204 -0.454 -5.940 1.00 0.00 H new ATOM 0 HD1 PHE B 62 5.434 1.066 -5.452 1.00 0.00 H new ATOM 0 HD2 PHE B 62 2.014 0.752 -2.932 1.00 0.00 H new ATOM 0 HE1 PHE B 62 6.798 1.732 -3.520 1.00 0.00 H new ATOM 0 HE2 PHE B 62 3.376 1.416 -0.998 1.00 0.00 H new ATOM 0 HZ PHE B 62 5.770 1.909 -1.290 1.00 0.00 H new ATOM 2450 N GLY B 63 0.925 3.109 -6.297 1.00 0.00 N ATOM 2451 CA GLY B 63 0.260 4.273 -5.742 1.00 0.00 C ATOM 2452 C GLY B 63 -0.608 3.868 -4.570 1.00 0.00 C ATOM 2453 O GLY B 63 -1.200 2.790 -4.596 1.00 0.00 O ATOM 0 H GLY B 63 0.351 2.555 -6.932 1.00 0.00 H new ATOM 0 HA2 GLY B 63 1.000 5.005 -5.420 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -0.350 4.752 -6.508 1.00 0.00 H new ATOM 2457 N SER B 64 -0.675 4.688 -3.528 1.00 0.00 N ATOM 2458 CA SER B 64 -1.475 4.319 -2.364 1.00 0.00 C ATOM 2459 C SER B 64 -1.856 5.511 -1.492 1.00 0.00 C ATOM 2460 O SER B 64 -1.150 6.521 -1.432 1.00 0.00 O ATOM 2461 CB SER B 64 -0.721 3.291 -1.520 1.00 0.00 C ATOM 2462 OG SER B 64 0.520 3.809 -1.072 1.00 0.00 O ATOM 0 H SER B 64 -0.200 5.588 -3.463 1.00 0.00 H new ATOM 0 HA SER B 64 -2.403 3.895 -2.747 1.00 0.00 H new ATOM 0 HB2 SER B 64 -1.329 3.004 -0.662 1.00 0.00 H new ATOM 0 HB3 SER B 64 -0.551 2.388 -2.107 1.00 0.00 H new ATOM 0 HG SER B 64 0.981 3.133 -0.533 1.00 0.00 H new ATOM 2468 N TYR B 65 -2.984 5.351 -0.802 1.00 0.00 N ATOM 2469 CA TYR B 65 -3.511 6.362 0.107 1.00 0.00 C ATOM 2470 C TYR B 65 -3.926 5.682 1.411 1.00 0.00 C ATOM 2471 O TYR B 65 -4.535 4.613 1.390 1.00 0.00 O ATOM 2472 CB TYR B 65 -4.705 7.078 -0.533 1.00 0.00 C ATOM 2473 CG TYR B 65 -5.244 8.233 0.283 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -5.809 8.026 1.536 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -5.187 9.532 -0.206 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -6.303 9.082 2.276 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -5.680 10.593 0.531 1.00 0.00 C ATOM 2478 CZ TYR B 65 -6.235 10.363 1.770 1.00 0.00 C ATOM 2479 OH TYR B 65 -6.726 11.417 2.506 1.00 0.00 O ATOM 0 H TYR B 65 -3.560 4.511 -0.860 1.00 0.00 H new ATOM 0 HA TYR B 65 -2.744 7.108 0.316 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -4.409 7.448 -1.515 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -5.505 6.355 -0.692 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -5.862 7.025 1.937 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -4.751 9.716 -1.177 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -6.741 8.905 3.247 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -5.630 11.597 0.137 1.00 0.00 H new ATOM 0 HH TYR B 65 -6.600 12.251 2.007 1.00 0.00 H new ATOM 2489 N VAL B 66 -3.562 6.279 2.541 1.00 0.00 N ATOM 2490 CA VAL B 66 -3.868 5.693 3.845 1.00 0.00 C ATOM 2491 C VAL B 66 -3.888 6.753 4.943 1.00 0.00 C ATOM 2492 O VAL B 66 -3.395 7.855 4.753 1.00 0.00 O ATOM 2493 CB VAL B 66 -2.802 4.640 4.219 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -3.169 3.909 5.500 1.00 0.00 C ATOM 2495 CG2 VAL B 66 -2.590 3.653 3.081 1.00 0.00 C ATOM 0 H VAL B 66 -3.057 7.164 2.583 1.00 0.00 H new ATOM 0 HA VAL B 66 -4.853 5.233 3.768 1.00 0.00 H new ATOM 0 HB VAL B 66 -1.865 5.170 4.393 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -2.398 3.175 5.734 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -3.249 4.625 6.318 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -4.124 3.401 5.368 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -1.835 2.922 3.369 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -3.527 3.140 2.865 1.00 0.00 H new ATOM 0 HG23 VAL B 66 -2.256 4.189 2.192 1.00 0.00 H new ATOM 2505 N THR B 67 -4.441 6.397 6.100 1.00 0.00 N ATOM 2506 CA THR B 67 -4.495 7.302 7.247 1.00 0.00 C ATOM 2507 C THR B 67 -3.589 6.763 8.347 1.00 0.00 C ATOM 2508 O THR B 67 -3.298 5.567 8.380 1.00 0.00 O ATOM 2509 CB THR B 67 -5.929 7.440 7.760 1.00 0.00 C ATOM 2510 OG1 THR B 67 -6.797 7.868 6.726 1.00 0.00 O ATOM 2511 CG2 THR B 67 -6.063 8.422 8.905 1.00 0.00 C ATOM 0 H THR B 67 -4.861 5.483 6.269 1.00 0.00 H new ATOM 0 HA THR B 67 -4.152 8.290 6.941 1.00 0.00 H new ATOM 0 HB THR B 67 -6.202 6.447 8.117 1.00 0.00 H new ATOM 0 HG1 THR B 67 -6.779 8.846 6.668 1.00 0.00 H new ATOM 0 HG21 THR B 67 -7.105 8.472 9.221 1.00 0.00 H new ATOM 0 HG22 THR B 67 -5.446 8.093 9.741 1.00 0.00 H new ATOM 0 HG23 THR B 67 -5.735 9.409 8.578 1.00 0.00 H new ATOM 2519 N HIS B 68 -3.111 7.636 9.228 1.00 0.00 N ATOM 2520 CA HIS B 68 -2.207 7.197 10.283 1.00 0.00 C ATOM 2521 C HIS B 68 -2.047 8.238 11.384 1.00 0.00 C ATOM 2522 O HIS B 68 -2.096 9.443 11.136 1.00 0.00 O ATOM 2523 CB HIS B 68 -0.852 6.890 9.662 1.00 0.00 C ATOM 2524 CG HIS B 68 -0.308 8.042 8.878 1.00 0.00 C ATOM 2525 ND1 HIS B 68 0.242 9.160 9.468 1.00 0.00 N ATOM 2526 CD2 HIS B 68 -0.269 8.263 7.545 1.00 0.00 C ATOM 2527 CE1 HIS B 68 0.596 10.018 8.529 1.00 0.00 C ATOM 2528 NE2 HIS B 68 0.297 9.498 7.353 1.00 0.00 N ATOM 0 H HIS B 68 -3.329 8.632 9.234 1.00 0.00 H new ATOM 0 HA HIS B 68 -2.633 6.308 10.748 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -0.147 6.625 10.449 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -0.943 6.021 9.010 1.00 0.00 H new ATOM 0 HD1 HIS B 68 0.357 9.302 10.471 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -0.618 7.592 6.774 1.00 0.00 H new ATOM 0 HE1 HIS B 68 1.053 10.982 8.695 1.00 0.00 H new ATOM 2537 N GLU B 69 -1.844 7.751 12.604 1.00 0.00 N ATOM 2538 CA GLU B 69 -1.661 8.615 13.764 1.00 0.00 C ATOM 2539 C GLU B 69 -0.455 9.533 13.571 1.00 0.00 C ATOM 2540 O GLU B 69 0.576 9.114 13.046 1.00 0.00 O ATOM 2541 CB GLU B 69 -1.476 7.762 15.021 1.00 0.00 C ATOM 2542 CG GLU B 69 -1.286 8.574 16.291 1.00 0.00 C ATOM 2543 CD GLU B 69 -2.474 9.463 16.602 1.00 0.00 C ATOM 2544 OE1 GLU B 69 -2.794 10.341 15.773 1.00 0.00 O ATOM 2545 OE2 GLU B 69 -3.087 9.278 17.676 1.00 0.00 O ATOM 0 H GLU B 69 -1.802 6.754 12.815 1.00 0.00 H new ATOM 0 HA GLU B 69 -2.549 9.237 13.878 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -2.345 7.115 15.141 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -0.612 7.112 14.884 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -1.116 7.897 17.128 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -0.392 9.190 16.193 1.00 0.00 H new ATOM 2552 N THR B 70 -0.596 10.785 13.994 1.00 0.00 N ATOM 2553 CA THR B 70 0.479 11.765 13.861 1.00 0.00 C ATOM 2554 C THR B 70 1.761 11.281 14.530 1.00 0.00 C ATOM 2555 O THR B 70 1.722 10.523 15.501 1.00 0.00 O ATOM 2556 CB THR B 70 0.061 13.103 14.463 1.00 0.00 C ATOM 2557 OG1 THR B 70 -0.264 12.959 15.834 1.00 0.00 O ATOM 2558 CG2 THR B 70 -1.129 13.731 13.771 1.00 0.00 C ATOM 0 H THR B 70 -1.444 11.146 14.432 1.00 0.00 H new ATOM 0 HA THR B 70 0.674 11.893 12.796 1.00 0.00 H new ATOM 0 HB THR B 70 0.922 13.757 14.328 1.00 0.00 H new ATOM 0 HG1 THR B 70 -0.528 13.829 16.201 1.00 0.00 H new ATOM 0 HG21 THR B 70 -1.371 14.679 14.251 1.00 0.00 H new ATOM 0 HG22 THR B 70 -0.889 13.906 12.722 1.00 0.00 H new ATOM 0 HG23 THR B 70 -1.986 13.061 13.840 1.00 0.00 H new ATOM 2566 N LYS B 71 2.897 11.725 14.001 1.00 0.00 N ATOM 2567 CA LYS B 71 4.198 11.340 14.537 1.00 0.00 C ATOM 2568 C LYS B 71 4.391 9.836 14.437 1.00 0.00 C ATOM 2569 O LYS B 71 4.964 9.211 15.331 1.00 0.00 O ATOM 2570 CB LYS B 71 4.330 11.784 15.998 1.00 0.00 C ATOM 2571 CG LYS B 71 4.168 13.283 16.214 1.00 0.00 C ATOM 2572 CD LYS B 71 5.464 14.050 15.981 1.00 0.00 C ATOM 2573 CE LYS B 71 5.969 13.909 14.554 1.00 0.00 C ATOM 2574 NZ LYS B 71 7.117 14.816 14.281 1.00 0.00 N ATOM 0 H LYS B 71 2.943 12.354 13.199 1.00 0.00 H new ATOM 0 HA LYS B 71 4.969 11.835 13.946 1.00 0.00 H new ATOM 0 HB2 LYS B 71 3.583 11.260 16.594 1.00 0.00 H new ATOM 0 HB3 LYS B 71 5.307 11.478 16.372 1.00 0.00 H new ATOM 0 HG2 LYS B 71 3.399 13.663 15.541 1.00 0.00 H new ATOM 0 HG3 LYS B 71 3.820 13.465 17.231 1.00 0.00 H new ATOM 0 HD2 LYS B 71 5.305 15.105 16.205 1.00 0.00 H new ATOM 0 HD3 LYS B 71 6.226 13.689 16.671 1.00 0.00 H new ATOM 0 HE2 LYS B 71 6.271 12.877 14.376 1.00 0.00 H new ATOM 0 HE3 LYS B 71 5.159 14.129 13.859 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 7.433 14.690 13.298 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 6.822 15.803 14.426 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 7.900 14.590 14.928 1.00 0.00 H new ATOM 2588 N HIS B 72 3.916 9.259 13.341 1.00 0.00 N ATOM 2589 CA HIS B 72 4.040 7.823 13.125 1.00 0.00 C ATOM 2590 C HIS B 72 3.926 7.467 11.647 1.00 0.00 C ATOM 2591 O HIS B 72 2.954 6.842 11.220 1.00 0.00 O ATOM 2592 CB HIS B 72 2.973 7.070 13.924 1.00 0.00 C ATOM 2593 CG HIS B 72 3.100 7.238 15.406 1.00 0.00 C ATOM 2594 ND1 HIS B 72 4.220 6.856 16.115 1.00 0.00 N ATOM 2595 CD2 HIS B 72 2.241 7.755 16.317 1.00 0.00 C ATOM 2596 CE1 HIS B 72 4.043 7.129 17.395 1.00 0.00 C ATOM 2597 NE2 HIS B 72 2.850 7.673 17.542 1.00 0.00 N ATOM 0 H HIS B 72 3.443 9.761 12.590 1.00 0.00 H new ATOM 0 HA HIS B 72 5.029 7.523 13.471 1.00 0.00 H new ATOM 0 HB2 HIS B 72 1.987 7.415 13.611 1.00 0.00 H new ATOM 0 HB3 HIS B 72 3.032 6.009 13.681 1.00 0.00 H new ATOM 0 HD2 HIS B 72 1.259 8.157 16.115 1.00 0.00 H new ATOM 0 HE1 HIS B 72 4.753 6.939 18.186 1.00 0.00 H new ATOM 0 HE2 HIS B 72 2.446 7.983 18.426 1.00 0.00 H new ATOM 2606 N PHE B 73 4.932 7.855 10.871 1.00 0.00 N ATOM 2607 CA PHE B 73 4.955 7.562 9.443 1.00 0.00 C ATOM 2608 C PHE B 73 6.367 7.724 8.898 1.00 0.00 C ATOM 2609 O PHE B 73 7.089 8.640 9.288 1.00 0.00 O ATOM 2610 CB PHE B 73 3.983 8.468 8.679 1.00 0.00 C ATOM 2611 CG PHE B 73 4.066 8.312 7.185 1.00 0.00 C ATOM 2612 CD1 PHE B 73 3.764 7.102 6.582 1.00 0.00 C ATOM 2613 CD2 PHE B 73 4.460 9.374 6.384 1.00 0.00 C ATOM 2614 CE1 PHE B 73 3.854 6.953 5.212 1.00 0.00 C ATOM 2615 CE2 PHE B 73 4.549 9.232 5.013 1.00 0.00 C ATOM 2616 CZ PHE B 73 4.247 8.019 4.426 1.00 0.00 C ATOM 0 H PHE B 73 5.743 8.374 11.208 1.00 0.00 H new ATOM 0 HA PHE B 73 4.636 6.529 9.302 1.00 0.00 H new ATOM 0 HB2 PHE B 73 2.965 8.251 9.003 1.00 0.00 H new ATOM 0 HB3 PHE B 73 4.186 9.507 8.940 1.00 0.00 H new ATOM 0 HD1 PHE B 73 3.454 6.265 7.191 1.00 0.00 H new ATOM 0 HD2 PHE B 73 4.700 10.324 6.838 1.00 0.00 H new ATOM 0 HE1 PHE B 73 3.617 6.003 4.755 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.854 10.068 4.401 1.00 0.00 H new ATOM 0 HZ PHE B 73 4.318 7.904 3.354 1.00 0.00 H new ATOM 2626 N ILE B 74 6.765 6.826 8.005 1.00 0.00 N ATOM 2627 CA ILE B 74 8.100 6.889 7.434 1.00 0.00 C ATOM 2628 C ILE B 74 8.180 6.174 6.091 1.00 0.00 C ATOM 2629 O ILE B 74 7.646 5.079 5.916 1.00 0.00 O ATOM 2630 CB ILE B 74 9.150 6.284 8.386 1.00 0.00 C ATOM 2631 CG1 ILE B 74 10.553 6.441 7.796 1.00 0.00 C ATOM 2632 CG2 ILE B 74 8.840 4.818 8.654 1.00 0.00 C ATOM 2633 CD1 ILE B 74 11.644 5.867 8.669 1.00 0.00 C ATOM 0 H ILE B 74 6.189 6.056 7.665 1.00 0.00 H new ATOM 0 HA ILE B 74 8.316 7.947 7.283 1.00 0.00 H new ATOM 0 HB ILE B 74 9.113 6.820 9.334 1.00 0.00 H new ATOM 0 HG12 ILE B 74 10.585 5.954 6.822 1.00 0.00 H new ATOM 0 HG13 ILE B 74 10.752 7.500 7.630 1.00 0.00 H new ATOM 0 HG21 ILE B 74 9.590 4.405 9.328 1.00 0.00 H new ATOM 0 HG22 ILE B 74 7.855 4.732 9.112 1.00 0.00 H new ATOM 0 HG23 ILE B 74 8.853 4.266 7.714 1.00 0.00 H new ATOM 0 HD11 ILE B 74 12.611 6.014 8.187 1.00 0.00 H new ATOM 0 HD12 ILE B 74 11.640 6.371 9.636 1.00 0.00 H new ATOM 0 HD13 ILE B 74 11.470 4.801 8.815 1.00 0.00 H new ATOM 2645 N TYR B 75 8.872 6.807 5.153 1.00 0.00 N ATOM 2646 CA TYR B 75 9.064 6.256 3.819 1.00 0.00 C ATOM 2647 C TYR B 75 10.520 6.432 3.404 1.00 0.00 C ATOM 2648 O TYR B 75 11.118 7.477 3.660 1.00 0.00 O ATOM 2649 CB TYR B 75 8.141 6.947 2.813 1.00 0.00 C ATOM 2650 CG TYR B 75 8.305 6.440 1.398 1.00 0.00 C ATOM 2651 CD1 TYR B 75 8.060 5.110 1.083 1.00 0.00 C ATOM 2652 CD2 TYR B 75 8.708 7.293 0.379 1.00 0.00 C ATOM 2653 CE1 TYR B 75 8.214 4.644 -0.209 1.00 0.00 C ATOM 2654 CE2 TYR B 75 8.862 6.835 -0.915 1.00 0.00 C ATOM 2655 CZ TYR B 75 8.615 5.511 -1.205 1.00 0.00 C ATOM 2656 OH TYR B 75 8.770 5.052 -2.494 1.00 0.00 O ATOM 0 H TYR B 75 9.315 7.715 5.295 1.00 0.00 H new ATOM 0 HA TYR B 75 8.817 5.195 3.834 1.00 0.00 H new ATOM 0 HB2 TYR B 75 7.106 6.805 3.124 1.00 0.00 H new ATOM 0 HB3 TYR B 75 8.335 8.020 2.831 1.00 0.00 H new ATOM 0 HD1 TYR B 75 7.744 4.429 1.860 1.00 0.00 H new ATOM 0 HD2 TYR B 75 8.904 8.331 0.602 1.00 0.00 H new ATOM 0 HE1 TYR B 75 8.021 3.606 -0.438 1.00 0.00 H new ATOM 0 HE2 TYR B 75 9.175 7.512 -1.696 1.00 0.00 H new ATOM 0 HH TYR B 75 9.714 5.113 -2.752 1.00 0.00 H new ATOM 2666 N PHE B 76 11.101 5.406 2.789 1.00 0.00 N ATOM 2667 CA PHE B 76 12.499 5.483 2.385 1.00 0.00 C ATOM 2668 C PHE B 76 12.888 4.350 1.438 1.00 0.00 C ATOM 2669 O PHE B 76 12.461 3.207 1.605 1.00 0.00 O ATOM 2670 CB PHE B 76 13.389 5.455 3.632 1.00 0.00 C ATOM 2671 CG PHE B 76 13.238 4.207 4.457 1.00 0.00 C ATOM 2672 CD1 PHE B 76 13.696 2.987 3.985 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.632 4.254 5.704 1.00 0.00 C ATOM 2674 CE1 PHE B 76 13.554 1.838 4.739 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.489 3.106 6.462 1.00 0.00 C ATOM 2676 CZ PHE B 76 12.950 1.898 5.979 1.00 0.00 C ATOM 0 H PHE B 76 10.635 4.527 2.563 1.00 0.00 H new ATOM 0 HA PHE B 76 12.641 6.418 1.843 1.00 0.00 H new ATOM 0 HB2 PHE B 76 14.431 5.553 3.326 1.00 0.00 H new ATOM 0 HB3 PHE B 76 13.156 6.320 4.253 1.00 0.00 H new ATOM 0 HD1 PHE B 76 14.170 2.934 3.016 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.268 5.196 6.087 1.00 0.00 H new ATOM 0 HE1 PHE B 76 13.915 0.894 4.359 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.017 3.155 7.432 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.838 1.001 6.570 1.00 0.00 H new ATOM 2686 N TYR B 77 13.715 4.683 0.451 1.00 0.00 N ATOM 2687 CA TYR B 77 14.192 3.705 -0.519 1.00 0.00 C ATOM 2688 C TYR B 77 15.291 2.846 0.095 1.00 0.00 C ATOM 2689 O TYR B 77 16.026 3.306 0.968 1.00 0.00 O ATOM 2690 CB TYR B 77 14.717 4.407 -1.774 1.00 0.00 C ATOM 2691 CG TYR B 77 13.639 5.076 -2.595 1.00 0.00 C ATOM 2692 CD1 TYR B 77 12.629 4.329 -3.190 1.00 0.00 C ATOM 2693 CD2 TYR B 77 13.631 6.453 -2.781 1.00 0.00 C ATOM 2694 CE1 TYR B 77 11.645 4.933 -3.947 1.00 0.00 C ATOM 2695 CE2 TYR B 77 12.647 7.066 -3.535 1.00 0.00 C ATOM 2696 CZ TYR B 77 11.657 6.301 -4.115 1.00 0.00 C ATOM 2697 OH TYR B 77 10.677 6.907 -4.868 1.00 0.00 O ATOM 0 H TYR B 77 14.070 5.628 0.303 1.00 0.00 H new ATOM 0 HA TYR B 77 13.357 3.064 -0.801 1.00 0.00 H new ATOM 0 HB2 TYR B 77 15.453 5.155 -1.479 1.00 0.00 H new ATOM 0 HB3 TYR B 77 15.235 3.678 -2.397 1.00 0.00 H new ATOM 0 HD1 TYR B 77 12.614 3.257 -3.058 1.00 0.00 H new ATOM 0 HD2 TYR B 77 14.406 7.054 -2.329 1.00 0.00 H new ATOM 0 HE1 TYR B 77 10.870 4.337 -4.405 1.00 0.00 H new ATOM 0 HE2 TYR B 77 12.654 8.138 -3.669 1.00 0.00 H new ATOM 0 HH TYR B 77 10.830 7.875 -4.886 1.00 0.00 H new ATOM 2707 N LEU B 78 15.397 1.602 -0.355 1.00 0.00 N ATOM 2708 CA LEU B 78 16.411 0.688 0.167 1.00 0.00 C ATOM 2709 C LEU B 78 16.538 -0.554 -0.704 1.00 0.00 C ATOM 2710 O LEU B 78 15.540 -1.111 -1.160 1.00 0.00 O ATOM 2711 CB LEU B 78 16.066 0.277 1.597 1.00 0.00 C ATOM 2712 CG LEU B 78 17.077 -0.658 2.265 1.00 0.00 C ATOM 2713 CD1 LEU B 78 18.472 -0.050 2.235 1.00 0.00 C ATOM 2714 CD2 LEU B 78 16.655 -0.964 3.697 1.00 0.00 C ATOM 0 H LEU B 78 14.797 1.202 -1.077 1.00 0.00 H new ATOM 0 HA LEU B 78 17.366 1.213 0.159 1.00 0.00 H new ATOM 0 HB2 LEU B 78 15.970 1.177 2.204 1.00 0.00 H new ATOM 0 HB3 LEU B 78 15.091 -0.210 1.593 1.00 0.00 H new ATOM 0 HG LEU B 78 17.101 -1.594 1.706 1.00 0.00 H new ATOM 0 HD11 LEU B 78 19.176 -0.730 2.715 1.00 0.00 H new ATOM 0 HD12 LEU B 78 18.775 0.115 1.201 1.00 0.00 H new ATOM 0 HD13 LEU B 78 18.466 0.901 2.768 1.00 0.00 H new ATOM 0 HD21 LEU B 78 17.385 -1.630 4.157 1.00 0.00 H new ATOM 0 HD22 LEU B 78 16.601 -0.036 4.267 1.00 0.00 H new ATOM 0 HD23 LEU B 78 15.677 -1.445 3.693 1.00 0.00 H new ATOM 2726 N GLY B 79 17.775 -0.986 -0.929 1.00 0.00 N ATOM 2727 CA GLY B 79 18.017 -2.166 -1.742 1.00 0.00 C ATOM 2728 C GLY B 79 17.360 -2.073 -3.102 1.00 0.00 C ATOM 2729 O GLY B 79 16.812 -3.054 -3.607 1.00 0.00 O ATOM 0 H GLY B 79 18.616 -0.540 -0.563 1.00 0.00 H new ATOM 0 HA2 GLY B 79 19.091 -2.303 -1.869 1.00 0.00 H new ATOM 0 HA3 GLY B 79 17.643 -3.047 -1.220 1.00 0.00 H new ATOM 2733 N GLN B 80 17.413 -0.886 -3.692 1.00 0.00 N ATOM 2734 CA GLN B 80 16.818 -0.653 -5.001 1.00 0.00 C ATOM 2735 C GLN B 80 15.325 -0.966 -4.988 1.00 0.00 C ATOM 2736 O GLN B 80 14.782 -1.492 -5.959 1.00 0.00 O ATOM 2737 CB GLN B 80 17.521 -1.502 -6.062 1.00 0.00 C ATOM 2738 CG GLN B 80 19.007 -1.212 -6.187 1.00 0.00 C ATOM 2739 CD GLN B 80 19.290 0.227 -6.567 1.00 0.00 C ATOM 2740 OE1 GLN B 80 18.859 0.702 -7.618 1.00 0.00 O ATOM 2741 NE2 GLN B 80 20.021 0.933 -5.710 1.00 0.00 N ATOM 0 H GLN B 80 17.864 -0.067 -3.283 1.00 0.00 H new ATOM 0 HA GLN B 80 16.945 0.402 -5.246 1.00 0.00 H new ATOM 0 HB2 GLN B 80 17.384 -2.556 -5.821 1.00 0.00 H new ATOM 0 HB3 GLN B 80 17.044 -1.331 -7.027 1.00 0.00 H new ATOM 0 HG2 GLN B 80 19.498 -1.437 -5.240 1.00 0.00 H new ATOM 0 HG3 GLN B 80 19.441 -1.874 -6.937 1.00 0.00 H new ATOM 0 HE21 GLN B 80 20.358 0.500 -4.850 1.00 0.00 H new ATOM 0 HE22 GLN B 80 20.245 1.907 -5.912 1.00 0.00 H new ATOM 2750 N VAL B 81 14.665 -0.628 -3.883 1.00 0.00 N ATOM 2751 CA VAL B 81 13.231 -0.863 -3.741 1.00 0.00 C ATOM 2752 C VAL B 81 12.638 0.048 -2.670 1.00 0.00 C ATOM 2753 O VAL B 81 13.223 0.238 -1.605 1.00 0.00 O ATOM 2754 CB VAL B 81 12.920 -2.332 -3.386 1.00 0.00 C ATOM 2755 CG1 VAL B 81 13.367 -3.261 -4.504 1.00 0.00 C ATOM 2756 CG2 VAL B 81 13.576 -2.723 -2.070 1.00 0.00 C ATOM 0 H VAL B 81 15.101 -0.190 -3.072 1.00 0.00 H new ATOM 0 HA VAL B 81 12.778 -0.638 -4.706 1.00 0.00 H new ATOM 0 HB VAL B 81 11.841 -2.430 -3.269 1.00 0.00 H new ATOM 0 HG11 VAL B 81 13.139 -4.292 -4.234 1.00 0.00 H new ATOM 0 HG12 VAL B 81 12.842 -3.002 -5.424 1.00 0.00 H new ATOM 0 HG13 VAL B 81 14.441 -3.156 -4.657 1.00 0.00 H new ATOM 0 HG21 VAL B 81 13.342 -3.763 -1.842 1.00 0.00 H new ATOM 0 HG22 VAL B 81 14.656 -2.604 -2.152 1.00 0.00 H new ATOM 0 HG23 VAL B 81 13.200 -2.083 -1.272 1.00 0.00 H new ATOM 2766 N ALA B 82 11.476 0.619 -2.969 1.00 0.00 N ATOM 2767 CA ALA B 82 10.804 1.519 -2.042 1.00 0.00 C ATOM 2768 C ALA B 82 10.264 0.771 -0.830 1.00 0.00 C ATOM 2769 O ALA B 82 9.693 -0.312 -0.959 1.00 0.00 O ATOM 2770 CB ALA B 82 9.677 2.257 -2.752 1.00 0.00 C ATOM 0 H ALA B 82 10.980 0.473 -3.848 1.00 0.00 H new ATOM 0 HA ALA B 82 11.538 2.242 -1.686 1.00 0.00 H new ATOM 0 HB1 ALA B 82 9.182 2.927 -2.049 1.00 0.00 H new ATOM 0 HB2 ALA B 82 10.086 2.837 -3.579 1.00 0.00 H new ATOM 0 HB3 ALA B 82 8.955 1.536 -3.136 1.00 0.00 H new ATOM 2776 N ILE B 83 10.441 1.360 0.347 1.00 0.00 N ATOM 2777 CA ILE B 83 9.965 0.757 1.585 1.00 0.00 C ATOM 2778 C ILE B 83 9.104 1.745 2.364 1.00 0.00 C ATOM 2779 O ILE B 83 9.406 2.937 2.419 1.00 0.00 O ATOM 2780 CB ILE B 83 11.134 0.283 2.475 1.00 0.00 C ATOM 2781 CG1 ILE B 83 11.988 -0.742 1.723 1.00 0.00 C ATOM 2782 CG2 ILE B 83 10.611 -0.312 3.776 1.00 0.00 C ATOM 2783 CD1 ILE B 83 13.123 -1.309 2.547 1.00 0.00 C ATOM 0 H ILE B 83 10.912 2.257 0.469 1.00 0.00 H new ATOM 0 HA ILE B 83 9.367 -0.112 1.311 1.00 0.00 H new ATOM 0 HB ILE B 83 11.755 1.145 2.719 1.00 0.00 H new ATOM 0 HG12 ILE B 83 11.349 -1.560 1.390 1.00 0.00 H new ATOM 0 HG13 ILE B 83 12.399 -0.273 0.829 1.00 0.00 H new ATOM 0 HG21 ILE B 83 11.450 -0.640 4.389 1.00 0.00 H new ATOM 0 HG22 ILE B 83 10.039 0.442 4.317 1.00 0.00 H new ATOM 0 HG23 ILE B 83 9.969 -1.164 3.554 1.00 0.00 H new ATOM 0 HD11 ILE B 83 13.683 -2.027 1.949 1.00 0.00 H new ATOM 0 HD12 ILE B 83 13.785 -0.501 2.859 1.00 0.00 H new ATOM 0 HD13 ILE B 83 12.719 -1.807 3.428 1.00 0.00 H new ATOM 2795 N LEU B 84 8.027 1.244 2.957 1.00 0.00 N ATOM 2796 CA LEU B 84 7.118 2.089 3.722 1.00 0.00 C ATOM 2797 C LEU B 84 6.695 1.404 5.017 1.00 0.00 C ATOM 2798 O LEU B 84 6.476 0.192 5.049 1.00 0.00 O ATOM 2799 CB LEU B 84 5.883 2.427 2.885 1.00 0.00 C ATOM 2800 CG LEU B 84 4.872 3.351 3.567 1.00 0.00 C ATOM 2801 CD1 LEU B 84 5.509 4.694 3.893 1.00 0.00 C ATOM 2802 CD2 LEU B 84 3.645 3.537 2.687 1.00 0.00 C ATOM 0 H LEU B 84 7.762 0.260 2.923 1.00 0.00 H new ATOM 0 HA LEU B 84 7.644 3.010 3.976 1.00 0.00 H new ATOM 0 HB2 LEU B 84 6.209 2.894 1.955 1.00 0.00 H new ATOM 0 HB3 LEU B 84 5.380 1.498 2.616 1.00 0.00 H new ATOM 0 HG LEU B 84 4.557 2.888 4.502 1.00 0.00 H new ATOM 0 HD11 LEU B 84 4.774 5.337 4.377 1.00 0.00 H new ATOM 0 HD12 LEU B 84 6.356 4.542 4.562 1.00 0.00 H new ATOM 0 HD13 LEU B 84 5.854 5.166 2.973 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.936 4.197 3.187 1.00 0.00 H new ATOM 0 HD22 LEU B 84 3.943 3.978 1.736 1.00 0.00 H new ATOM 0 HD23 LEU B 84 3.176 2.570 2.507 1.00 0.00 H new ATOM 2814 N LEU B 85 6.582 2.190 6.082 1.00 0.00 N ATOM 2815 CA LEU B 85 6.187 1.667 7.383 1.00 0.00 C ATOM 2816 C LEU B 85 5.575 2.767 8.243 1.00 0.00 C ATOM 2817 O LEU B 85 6.018 3.918 8.210 1.00 0.00 O ATOM 2818 CB LEU B 85 7.391 1.055 8.102 1.00 0.00 C ATOM 2819 CG LEU B 85 7.072 0.395 9.445 1.00 0.00 C ATOM 2820 CD1 LEU B 85 6.136 -0.788 9.248 1.00 0.00 C ATOM 2821 CD2 LEU B 85 8.350 -0.042 10.142 1.00 0.00 C ATOM 0 H LEU B 85 6.759 3.194 6.069 1.00 0.00 H new ATOM 0 HA LEU B 85 5.438 0.891 7.222 1.00 0.00 H new ATOM 0 HB2 LEU B 85 7.847 0.312 7.448 1.00 0.00 H new ATOM 0 HB3 LEU B 85 8.134 1.836 8.265 1.00 0.00 H new ATOM 0 HG LEU B 85 6.571 1.127 10.079 1.00 0.00 H new ATOM 0 HD11 LEU B 85 5.920 -1.246 10.213 1.00 0.00 H new ATOM 0 HD12 LEU B 85 5.207 -0.445 8.793 1.00 0.00 H new ATOM 0 HD13 LEU B 85 6.610 -1.522 8.597 1.00 0.00 H new ATOM 0 HD21 LEU B 85 8.103 -0.509 11.095 1.00 0.00 H new ATOM 0 HD22 LEU B 85 8.881 -0.758 9.514 1.00 0.00 H new ATOM 0 HD23 LEU B 85 8.984 0.827 10.317 1.00 0.00 H new ATOM 2833 N PHE B 86 4.546 2.408 9.008 1.00 0.00 N ATOM 2834 CA PHE B 86 3.868 3.368 9.872 1.00 0.00 C ATOM 2835 C PHE B 86 2.772 2.691 10.689 1.00 0.00 C ATOM 2836 O PHE B 86 1.907 2.009 10.141 1.00 0.00 O ATOM 2837 CB PHE B 86 3.274 4.501 9.036 1.00 0.00 C ATOM 2838 CG PHE B 86 2.239 4.050 8.044 1.00 0.00 C ATOM 2839 CD1 PHE B 86 2.589 3.261 6.960 1.00 0.00 C ATOM 2840 CD2 PHE B 86 0.915 4.422 8.195 1.00 0.00 C ATOM 2841 CE1 PHE B 86 1.637 2.851 6.047 1.00 0.00 C ATOM 2842 CE2 PHE B 86 -0.043 4.015 7.287 1.00 0.00 C ATOM 2843 CZ PHE B 86 0.317 3.229 6.209 1.00 0.00 C ATOM 0 H PHE B 86 4.166 1.462 9.046 1.00 0.00 H new ATOM 0 HA PHE B 86 4.603 3.781 10.563 1.00 0.00 H new ATOM 0 HB2 PHE B 86 2.826 5.236 9.705 1.00 0.00 H new ATOM 0 HB3 PHE B 86 4.079 5.005 8.502 1.00 0.00 H new ATOM 0 HD1 PHE B 86 3.619 2.963 6.827 1.00 0.00 H new ATOM 0 HD2 PHE B 86 0.627 5.039 9.034 1.00 0.00 H new ATOM 0 HE1 PHE B 86 1.924 2.236 5.207 1.00 0.00 H new ATOM 0 HE2 PHE B 86 -1.073 4.311 7.420 1.00 0.00 H new ATOM 0 HZ PHE B 86 -0.430 2.911 5.496 1.00 0.00 H new ATOM 2853 N LYS B 87 2.819 2.883 12.004 1.00 0.00 N ATOM 2854 CA LYS B 87 1.835 2.287 12.900 1.00 0.00 C ATOM 2855 C LYS B 87 0.609 3.181 13.051 1.00 0.00 C ATOM 2856 O LYS B 87 0.665 4.381 12.784 1.00 0.00 O ATOM 2857 CB LYS B 87 2.467 2.001 14.267 1.00 0.00 C ATOM 2858 CG LYS B 87 2.639 3.228 15.147 1.00 0.00 C ATOM 2859 CD LYS B 87 1.415 3.460 16.016 1.00 0.00 C ATOM 2860 CE LYS B 87 1.282 2.391 17.089 1.00 0.00 C ATOM 2861 NZ LYS B 87 2.473 2.344 17.979 1.00 0.00 N ATOM 0 H LYS B 87 3.528 3.447 12.472 1.00 0.00 H new ATOM 0 HA LYS B 87 1.505 1.345 12.462 1.00 0.00 H new ATOM 0 HB2 LYS B 87 1.849 1.274 14.794 1.00 0.00 H new ATOM 0 HB3 LYS B 87 3.442 1.539 14.114 1.00 0.00 H new ATOM 0 HG2 LYS B 87 3.518 3.104 15.779 1.00 0.00 H new ATOM 0 HG3 LYS B 87 2.816 4.104 14.523 1.00 0.00 H new ATOM 0 HD2 LYS B 87 1.482 4.442 16.485 1.00 0.00 H new ATOM 0 HD3 LYS B 87 0.521 3.465 15.393 1.00 0.00 H new ATOM 0 HE2 LYS B 87 0.391 2.585 17.686 1.00 0.00 H new ATOM 0 HE3 LYS B 87 1.144 1.418 16.617 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 2.231 1.840 18.856 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 3.248 1.847 17.496 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 2.773 3.313 18.208 1.00 0.00 H new ATOM 2875 N SER B 88 -0.499 2.584 13.479 1.00 0.00 N ATOM 2876 CA SER B 88 -1.741 3.320 13.667 1.00 0.00 C ATOM 2877 C SER B 88 -2.516 2.783 14.865 1.00 0.00 C ATOM 2878 O SER B 88 -2.602 1.574 15.070 1.00 0.00 O ATOM 2879 CB SER B 88 -2.603 3.230 12.408 1.00 0.00 C ATOM 2880 OG SER B 88 -1.932 3.779 11.288 1.00 0.00 O ATOM 0 H SER B 88 -0.560 1.591 13.702 1.00 0.00 H new ATOM 0 HA SER B 88 -1.491 4.364 13.857 1.00 0.00 H new ATOM 0 HB2 SER B 88 -2.854 2.188 12.210 1.00 0.00 H new ATOM 0 HB3 SER B 88 -3.542 3.760 12.568 1.00 0.00 H new ATOM 0 HG SER B 88 -2.505 3.707 10.496 1.00 0.00 H new ATOM 2886 N GLY B 89 -3.079 3.693 15.651 1.00 0.00 N ATOM 2887 CA GLY B 89 -3.841 3.295 16.820 1.00 0.00 C ATOM 2888 C GLY B 89 -5.048 2.448 16.466 1.00 0.00 C ATOM 2889 O GLY B 89 -4.996 1.220 16.683 1.00 0.00 O ATOM 2890 OXT GLY B 89 -6.045 3.015 15.972 1.00 0.00 O ATOM 0 H GLY B 89 -3.021 4.700 15.500 1.00 0.00 H new ATOM 0 HA2 GLY B 89 -3.195 2.736 17.498 1.00 0.00 H new ATOM 0 HA3 GLY B 89 -4.170 4.185 17.355 1.00 0.00 H new TER 2894 GLY B 89 ATOM 2895 N MET C 1 -10.127 -10.332 13.130 1.00 0.00 N ATOM 2896 CA MET C 1 -9.104 -9.488 12.457 1.00 0.00 C ATOM 2897 C MET C 1 -7.973 -10.343 11.897 1.00 0.00 C ATOM 2898 O MET C 1 -7.549 -11.314 12.525 1.00 0.00 O ATOM 2899 CB MET C 1 -8.552 -8.475 13.465 1.00 0.00 C ATOM 2900 CG MET C 1 -7.803 -9.109 14.628 1.00 0.00 C ATOM 2901 SD MET C 1 -7.124 -7.884 15.763 1.00 0.00 S ATOM 2902 CE MET C 1 -8.616 -7.044 16.288 1.00 0.00 C ATOM 0 H1 MET C 1 -11.064 -9.895 13.021 1.00 0.00 H new ATOM 0 H2 MET C 1 -10.134 -11.279 12.699 1.00 0.00 H new ATOM 0 H3 MET C 1 -9.899 -10.414 14.141 1.00 0.00 H new ATOM 0 HA MET C 1 -9.569 -8.963 11.622 1.00 0.00 H new ATOM 0 HB2 MET C 1 -7.883 -7.788 12.946 1.00 0.00 H new ATOM 0 HB3 MET C 1 -9.377 -7.881 13.858 1.00 0.00 H new ATOM 0 HG2 MET C 1 -8.477 -9.770 15.173 1.00 0.00 H new ATOM 0 HG3 MET C 1 -6.994 -9.728 14.240 1.00 0.00 H new ATOM 0 HE1 MET C 1 -8.428 -6.520 17.225 1.00 0.00 H new ATOM 0 HE2 MET C 1 -8.917 -6.326 15.525 1.00 0.00 H new ATOM 0 HE3 MET C 1 -9.412 -7.774 16.434 1.00 0.00 H new ATOM 2914 N LYS C 2 -7.490 -9.979 10.714 1.00 0.00 N ATOM 2915 CA LYS C 2 -6.407 -10.718 10.071 1.00 0.00 C ATOM 2916 C LYS C 2 -5.605 -9.822 9.139 1.00 0.00 C ATOM 2917 O LYS C 2 -6.164 -9.028 8.382 1.00 0.00 O ATOM 2918 CB LYS C 2 -6.961 -11.916 9.298 1.00 0.00 C ATOM 2919 CG LYS C 2 -7.601 -12.972 10.185 1.00 0.00 C ATOM 2920 CD LYS C 2 -6.587 -13.600 11.127 1.00 0.00 C ATOM 2921 CE LYS C 2 -7.236 -14.631 12.036 1.00 0.00 C ATOM 2922 NZ LYS C 2 -8.308 -14.033 12.879 1.00 0.00 N ATOM 0 H LYS C 2 -7.830 -9.179 10.181 1.00 0.00 H new ATOM 0 HA LYS C 2 -5.740 -11.078 10.854 1.00 0.00 H new ATOM 0 HB2 LYS C 2 -7.699 -11.563 8.578 1.00 0.00 H new ATOM 0 HB3 LYS C 2 -6.153 -12.374 8.727 1.00 0.00 H new ATOM 0 HG2 LYS C 2 -8.407 -12.522 10.765 1.00 0.00 H new ATOM 0 HG3 LYS C 2 -8.050 -13.747 9.564 1.00 0.00 H new ATOM 0 HD2 LYS C 2 -5.794 -14.072 10.547 1.00 0.00 H new ATOM 0 HD3 LYS C 2 -6.120 -12.823 11.732 1.00 0.00 H new ATOM 0 HE2 LYS C 2 -7.656 -15.435 11.431 1.00 0.00 H new ATOM 0 HE3 LYS C 2 -6.477 -15.078 12.678 1.00 0.00 H new ATOM 0 HZ1 LYS C 2 -8.220 -14.385 13.854 1.00 0.00 H new ATOM 0 HZ2 LYS C 2 -8.216 -12.997 12.875 1.00 0.00 H new ATOM 0 HZ3 LYS C 2 -9.238 -14.299 12.498 1.00 0.00 H new ATOM 2936 N ASP C 3 -4.288 -9.954 9.216 1.00 0.00 N ATOM 2937 CA ASP C 3 -3.384 -9.160 8.397 1.00 0.00 C ATOM 2938 C ASP C 3 -3.443 -9.566 6.929 1.00 0.00 C ATOM 2939 O ASP C 3 -3.285 -10.739 6.591 1.00 0.00 O ATOM 2940 CB ASP C 3 -1.954 -9.296 8.921 1.00 0.00 C ATOM 2941 CG ASP C 3 -1.512 -10.744 9.024 1.00 0.00 C ATOM 2942 OD1 ASP C 3 -2.308 -11.638 8.669 1.00 0.00 O ATOM 2943 OD2 ASP C 3 -0.369 -10.984 9.466 1.00 0.00 O ATOM 0 H ASP C 3 -3.820 -10.609 9.842 1.00 0.00 H new ATOM 0 HA ASP C 3 -3.702 -8.120 8.464 1.00 0.00 H new ATOM 0 HB2 ASP C 3 -1.275 -8.758 8.260 1.00 0.00 H new ATOM 0 HB3 ASP C 3 -1.883 -8.826 9.902 1.00 0.00 H new ATOM 2948 N THR C 4 -3.651 -8.583 6.059 1.00 0.00 N ATOM 2949 CA THR C 4 -3.708 -8.828 4.629 1.00 0.00 C ATOM 2950 C THR C 4 -2.303 -9.055 4.080 1.00 0.00 C ATOM 2951 O THR C 4 -1.371 -8.328 4.424 1.00 0.00 O ATOM 2952 CB THR C 4 -4.359 -7.643 3.916 1.00 0.00 C ATOM 2953 OG1 THR C 4 -4.524 -7.919 2.534 1.00 0.00 O ATOM 2954 CG2 THR C 4 -3.562 -6.363 4.041 1.00 0.00 C ATOM 0 H THR C 4 -3.783 -7.607 6.324 1.00 0.00 H new ATOM 0 HA THR C 4 -4.308 -9.721 4.451 1.00 0.00 H new ATOM 0 HB THR C 4 -5.322 -7.500 4.405 1.00 0.00 H new ATOM 0 HG1 THR C 4 -5.459 -8.151 2.356 1.00 0.00 H new ATOM 0 HG21 THR C 4 -4.078 -5.560 3.514 1.00 0.00 H new ATOM 0 HG22 THR C 4 -3.461 -6.099 5.094 1.00 0.00 H new ATOM 0 HG23 THR C 4 -2.573 -6.506 3.606 1.00 0.00 H new ATOM 2962 N GLY C 5 -2.157 -10.059 3.227 1.00 0.00 N ATOM 2963 CA GLY C 5 -0.858 -10.348 2.650 1.00 0.00 C ATOM 2964 C GLY C 5 -0.938 -10.615 1.163 1.00 0.00 C ATOM 2965 O GLY C 5 -1.585 -11.568 0.731 1.00 0.00 O ATOM 0 H GLY C 5 -2.910 -10.677 2.925 1.00 0.00 H new ATOM 0 HA2 GLY C 5 -0.187 -9.508 2.831 1.00 0.00 H new ATOM 0 HA3 GLY C 5 -0.425 -11.215 3.150 1.00 0.00 H new ATOM 2969 N ILE C 6 -0.275 -9.768 0.382 1.00 0.00 N ATOM 2970 CA ILE C 6 -0.268 -9.906 -1.070 1.00 0.00 C ATOM 2971 C ILE C 6 0.881 -9.122 -1.682 1.00 0.00 C ATOM 2972 O ILE C 6 1.544 -8.342 -1.001 1.00 0.00 O ATOM 2973 CB ILE C 6 -1.598 -9.426 -1.699 1.00 0.00 C ATOM 2974 CG1 ILE C 6 -1.911 -7.984 -1.285 1.00 0.00 C ATOM 2975 CG2 ILE C 6 -2.744 -10.348 -1.315 1.00 0.00 C ATOM 2976 CD1 ILE C 6 -1.029 -6.950 -1.952 1.00 0.00 C ATOM 0 H ILE C 6 0.266 -8.977 0.732 1.00 0.00 H new ATOM 0 HA ILE C 6 -0.143 -10.967 -1.285 1.00 0.00 H new ATOM 0 HB ILE C 6 -1.483 -9.454 -2.783 1.00 0.00 H new ATOM 0 HG12 ILE C 6 -2.952 -7.766 -1.522 1.00 0.00 H new ATOM 0 HG13 ILE C 6 -1.805 -7.895 -0.204 1.00 0.00 H new ATOM 0 HG21 ILE C 6 -3.668 -9.989 -1.769 1.00 0.00 H new ATOM 0 HG22 ILE C 6 -2.533 -11.357 -1.669 1.00 0.00 H new ATOM 0 HG23 ILE C 6 -2.854 -10.360 -0.231 1.00 0.00 H new ATOM 0 HD11 ILE C 6 -1.311 -5.955 -1.609 1.00 0.00 H new ATOM 0 HD12 ILE C 6 0.013 -7.140 -1.695 1.00 0.00 H new ATOM 0 HD13 ILE C 6 -1.153 -7.009 -3.033 1.00 0.00 H new ATOM 2988 N GLN C 7 1.113 -9.327 -2.972 1.00 0.00 N ATOM 2989 CA GLN C 7 2.182 -8.626 -3.669 1.00 0.00 C ATOM 2990 C GLN C 7 1.991 -8.705 -5.177 1.00 0.00 C ATOM 2991 O GLN C 7 1.942 -9.791 -5.755 1.00 0.00 O ATOM 2992 CB GLN C 7 3.548 -9.200 -3.280 1.00 0.00 C ATOM 2993 CG GLN C 7 3.735 -10.664 -3.656 1.00 0.00 C ATOM 2994 CD GLN C 7 2.744 -11.582 -2.965 1.00 0.00 C ATOM 2995 OE1 GLN C 7 2.695 -11.648 -1.737 1.00 0.00 O ATOM 2996 NE2 GLN C 7 1.948 -12.294 -3.754 1.00 0.00 N ATOM 0 H GLN C 7 0.577 -9.970 -3.555 1.00 0.00 H new ATOM 0 HA GLN C 7 2.145 -7.578 -3.371 1.00 0.00 H new ATOM 0 HB2 GLN C 7 4.329 -8.610 -3.760 1.00 0.00 H new ATOM 0 HB3 GLN C 7 3.683 -9.092 -2.204 1.00 0.00 H new ATOM 0 HG2 GLN C 7 3.632 -10.773 -4.736 1.00 0.00 H new ATOM 0 HG3 GLN C 7 4.748 -10.973 -3.400 1.00 0.00 H new ATOM 0 HE21 GLN C 7 2.024 -12.207 -4.767 1.00 0.00 H new ATOM 0 HE22 GLN C 7 1.260 -12.928 -3.347 1.00 0.00 H new ATOM 3005 N VAL C 8 1.880 -7.543 -5.809 1.00 0.00 N ATOM 3006 CA VAL C 8 1.692 -7.470 -7.248 1.00 0.00 C ATOM 3007 C VAL C 8 3.024 -7.612 -7.977 1.00 0.00 C ATOM 3008 O VAL C 8 4.064 -7.176 -7.484 1.00 0.00 O ATOM 3009 CB VAL C 8 1.019 -6.150 -7.666 1.00 0.00 C ATOM 3010 CG1 VAL C 8 0.727 -6.147 -9.159 1.00 0.00 C ATOM 3011 CG2 VAL C 8 -0.256 -5.926 -6.867 1.00 0.00 C ATOM 0 H VAL C 8 1.917 -6.636 -5.343 1.00 0.00 H new ATOM 0 HA VAL C 8 1.038 -8.296 -7.527 1.00 0.00 H new ATOM 0 HB VAL C 8 1.705 -5.330 -7.452 1.00 0.00 H new ATOM 0 HG11 VAL C 8 0.251 -5.206 -9.435 1.00 0.00 H new ATOM 0 HG12 VAL C 8 1.659 -6.258 -9.712 1.00 0.00 H new ATOM 0 HG13 VAL C 8 0.061 -6.975 -9.401 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -0.719 -4.988 -7.175 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -0.948 -6.749 -7.048 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -0.016 -5.880 -5.805 1.00 0.00 H new ATOM 3021 N ASP C 9 2.982 -8.228 -9.152 1.00 0.00 N ATOM 3022 C ASP C 9 3.819 -9.041 -11.303 1.00 0.00 C ATOM 3023 O ASP C 9 4.387 -10.052 -11.715 1.00 0.00 O ATOM 3024 CB ASP C 9 5.165 -9.341 -9.215 1.00 0.00 C ATOM 3025 CG ASP C 9 4.581 -10.708 -8.910 1.00 0.00 C ATOM 3026 OD1 ASP C 9 5.294 -11.537 -8.308 1.00 0.00 O ATOM 3027 OD2 ASP C 9 3.410 -10.947 -9.276 1.00 0.00 O ATOM 3032 N ARG C 10 2.860 -8.421 -11.983 1.00 0.00 N ATOM 3033 CA ARG C 10 2.413 -8.909 -13.283 1.00 0.00 C ATOM 3034 C ARG C 10 1.454 -7.926 -13.951 1.00 0.00 C ATOM 3035 O ARG C 10 0.601 -7.327 -13.298 1.00 0.00 O ATOM 3036 CB ARG C 10 1.764 -10.293 -13.133 1.00 0.00 C ATOM 3037 CG ARG C 10 0.949 -10.469 -11.856 1.00 0.00 C ATOM 3038 CD ARG C 10 -0.395 -9.760 -11.923 1.00 0.00 C ATOM 3039 NE ARG C 10 -1.290 -10.372 -12.902 1.00 0.00 N ATOM 3040 CZ ARG C 10 -1.793 -11.599 -12.782 1.00 0.00 C ATOM 3041 NH1 ARG C 10 -1.525 -12.332 -11.706 1.00 0.00 N ATOM 3042 NH2 ARG C 10 -2.578 -12.091 -13.730 1.00 0.00 N ATOM 0 H ARG C 10 2.379 -7.583 -11.657 1.00 0.00 H new ATOM 0 HA ARG C 10 3.286 -8.999 -13.930 1.00 0.00 H new ATOM 0 HB2 ARG C 10 1.116 -10.473 -13.991 1.00 0.00 H new ATOM 0 HB3 ARG C 10 2.545 -11.053 -13.159 1.00 0.00 H new ATOM 0 HG2 ARG C 10 0.787 -11.532 -11.675 1.00 0.00 H new ATOM 0 HG3 ARG C 10 1.518 -10.084 -11.009 1.00 0.00 H new ATOM 0 HD2 ARG C 10 -0.865 -9.781 -10.940 1.00 0.00 H new ATOM 0 HD3 ARG C 10 -0.239 -8.712 -12.180 1.00 0.00 H new ATOM 0 HE ARG C 10 -1.545 -9.827 -13.726 1.00 0.00 H new ATOM 0 HH11 ARG C 10 -0.931 -11.955 -10.967 1.00 0.00 H new ATOM 0 HH12 ARG C 10 -1.913 -13.271 -11.619 1.00 0.00 H new ATOM 0 HH21 ARG C 10 -2.797 -11.530 -14.553 1.00 0.00 H new ATOM 0 HH22 ARG C 10 -2.963 -13.031 -13.637 1.00 0.00 H new ATOM 3056 N ASP C 11 1.612 -7.756 -15.261 1.00 0.00 N ATOM 3057 CA ASP C 11 0.768 -6.842 -16.022 1.00 0.00 C ATOM 3058 C ASP C 11 -0.448 -7.559 -16.587 1.00 0.00 C ATOM 3059 O ASP C 11 -0.797 -7.387 -17.755 1.00 0.00 O ATOM 3060 CB ASP C 11 1.569 -6.192 -17.154 1.00 0.00 C ATOM 3061 CG ASP C 11 2.768 -5.418 -16.643 1.00 0.00 C ATOM 3062 OD1 ASP C 11 3.642 -6.034 -15.996 1.00 0.00 O ATOM 3063 OD2 ASP C 11 2.836 -4.196 -16.892 1.00 0.00 O ATOM 0 H ASP C 11 2.317 -8.240 -15.817 1.00 0.00 H new ATOM 0 HA ASP C 11 0.419 -6.064 -15.342 1.00 0.00 H new ATOM 0 HB2 ASP C 11 1.906 -6.963 -17.846 1.00 0.00 H new ATOM 0 HB3 ASP C 11 0.920 -5.521 -17.716 1.00 0.00 H new ATOM 3068 N LEU C 12 -1.082 -8.377 -15.755 1.00 0.00 N ATOM 3069 CA LEU C 12 -2.252 -9.136 -16.177 1.00 0.00 C ATOM 3070 C LEU C 12 -1.926 -9.989 -17.401 1.00 0.00 C ATOM 3071 O LEU C 12 -2.825 -10.514 -18.060 1.00 0.00 O ATOM 3072 CB LEU C 12 -3.419 -8.196 -16.490 1.00 0.00 C ATOM 3073 CG LEU C 12 -3.931 -7.373 -15.305 1.00 0.00 C ATOM 3074 CD1 LEU C 12 -2.850 -6.433 -14.795 1.00 0.00 C ATOM 3075 CD2 LEU C 12 -5.175 -6.593 -15.701 1.00 0.00 C ATOM 0 H LEU C 12 -0.806 -8.531 -14.785 1.00 0.00 H new ATOM 0 HA LEU C 12 -2.542 -9.795 -15.358 1.00 0.00 H new ATOM 0 HB2 LEU C 12 -3.111 -7.512 -17.281 1.00 0.00 H new ATOM 0 HB3 LEU C 12 -4.245 -8.788 -16.884 1.00 0.00 H new ATOM 0 HG LEU C 12 -4.193 -8.058 -14.498 1.00 0.00 H new ATOM 0 HD11 LEU C 12 -3.235 -5.858 -13.953 1.00 0.00 H new ATOM 0 HD12 LEU C 12 -1.986 -7.013 -14.473 1.00 0.00 H new ATOM 0 HD13 LEU C 12 -2.553 -5.753 -15.593 1.00 0.00 H new ATOM 0 HD21 LEU C 12 -5.527 -6.013 -14.848 1.00 0.00 H new ATOM 0 HD22 LEU C 12 -4.936 -5.920 -16.524 1.00 0.00 H new ATOM 0 HD23 LEU C 12 -5.955 -7.287 -16.015 1.00 0.00 H new ATOM 3087 N ASP C 13 -0.633 -10.122 -17.701 1.00 0.00 N ATOM 3088 CA ASP C 13 -0.190 -10.912 -18.848 1.00 0.00 C ATOM 3089 C ASP C 13 -0.959 -10.521 -20.108 1.00 0.00 C ATOM 3090 O ASP C 13 -1.336 -11.378 -20.908 1.00 0.00 O ATOM 3091 CB ASP C 13 -0.371 -12.405 -18.565 1.00 0.00 C ATOM 3092 CG ASP C 13 0.430 -12.867 -17.364 1.00 0.00 C ATOM 3093 OD1 ASP C 13 0.195 -12.339 -16.256 1.00 0.00 O ATOM 3094 OD2 ASP C 13 1.291 -13.755 -17.530 1.00 0.00 O ATOM 0 H ASP C 13 0.123 -9.694 -17.167 1.00 0.00 H new ATOM 0 HA ASP C 13 0.868 -10.707 -19.013 1.00 0.00 H new ATOM 0 HB2 ASP C 13 -1.427 -12.615 -18.396 1.00 0.00 H new ATOM 0 HB3 ASP C 13 -0.069 -12.977 -19.442 1.00 0.00 H new ATOM 3099 N GLY C 14 -1.188 -9.222 -20.274 1.00 0.00 N ATOM 3100 CA GLY C 14 -1.913 -8.732 -21.434 1.00 0.00 C ATOM 3101 C GLY C 14 -3.385 -9.109 -21.408 1.00 0.00 C ATOM 3102 O GLY C 14 -4.252 -8.235 -21.398 1.00 0.00 O ATOM 0 H GLY C 14 -0.884 -8.497 -19.624 1.00 0.00 H new ATOM 0 HA2 GLY C 14 -1.821 -7.647 -21.483 1.00 0.00 H new ATOM 0 HA3 GLY C 14 -1.456 -9.132 -22.339 1.00 0.00 H new ATOM 3106 N LYS C 15 -3.665 -10.409 -21.391 1.00 0.00 N ATOM 3107 CA LYS C 15 -5.039 -10.900 -21.360 1.00 0.00 C ATOM 3108 C LYS C 15 -5.067 -12.425 -21.377 1.00 0.00 C ATOM 3109 O LYS C 15 -5.801 -13.052 -20.615 1.00 0.00 O ATOM 3110 CB LYS C 15 -5.834 -10.351 -22.548 1.00 0.00 C ATOM 3111 CG LYS C 15 -5.250 -10.727 -23.900 1.00 0.00 C ATOM 3112 CD LYS C 15 -6.073 -10.153 -25.040 1.00 0.00 C ATOM 3113 CE LYS C 15 -5.492 -10.531 -26.393 1.00 0.00 C ATOM 3114 NZ LYS C 15 -4.101 -10.029 -26.560 1.00 0.00 N ATOM 0 H LYS C 15 -2.957 -11.143 -21.398 1.00 0.00 H new ATOM 0 HA LYS C 15 -5.501 -10.552 -20.436 1.00 0.00 H new ATOM 0 HB2 LYS C 15 -6.858 -10.719 -22.490 1.00 0.00 H new ATOM 0 HB3 LYS C 15 -5.881 -9.265 -22.472 1.00 0.00 H new ATOM 0 HG2 LYS C 15 -4.225 -10.362 -23.969 1.00 0.00 H new ATOM 0 HG3 LYS C 15 -5.208 -11.812 -23.990 1.00 0.00 H new ATOM 0 HD2 LYS C 15 -7.098 -10.517 -24.969 1.00 0.00 H new ATOM 0 HD3 LYS C 15 -6.113 -9.067 -24.951 1.00 0.00 H new ATOM 0 HE2 LYS C 15 -5.502 -11.615 -26.502 1.00 0.00 H new ATOM 0 HE3 LYS C 15 -6.122 -10.125 -27.185 1.00 0.00 H new ATOM 0 HZ1 LYS C 15 -3.814 -10.126 -27.555 1.00 0.00 H new ATOM 0 HZ2 LYS C 15 -4.058 -9.028 -26.283 1.00 0.00 H new ATOM 0 HZ3 LYS C 15 -3.458 -10.583 -25.959 1.00 0.00 H new ATOM 3128 N SER C 16 -4.259 -13.014 -22.253 1.00 0.00 N ATOM 3129 CA SER C 16 -4.183 -14.464 -22.375 1.00 0.00 C ATOM 3130 C SER C 16 -3.666 -15.094 -21.086 1.00 0.00 C ATOM 3131 O SER C 16 -2.753 -14.568 -20.449 1.00 0.00 O ATOM 3132 CB SER C 16 -3.277 -14.853 -23.544 1.00 0.00 C ATOM 3133 OG SER C 16 -3.771 -14.332 -24.766 1.00 0.00 O ATOM 0 H SER C 16 -3.646 -12.506 -22.891 1.00 0.00 H new ATOM 0 HA SER C 16 -5.189 -14.839 -22.563 1.00 0.00 H new ATOM 0 HB2 SER C 16 -2.268 -14.479 -23.367 1.00 0.00 H new ATOM 0 HB3 SER C 16 -3.208 -15.939 -23.609 1.00 0.00 H new ATOM 0 HG SER C 16 -3.174 -14.593 -25.498 1.00 0.00 H new ATOM 3139 N HIS C 17 -4.255 -16.225 -20.706 1.00 0.00 N ATOM 3140 CA HIS C 17 -3.853 -16.928 -19.493 1.00 0.00 C ATOM 3141 C HIS C 17 -4.143 -16.071 -18.254 1.00 0.00 C ATOM 3142 O HIS C 17 -5.203 -15.454 -18.162 1.00 0.00 O ATOM 3143 CB HIS C 17 -2.369 -17.300 -19.574 1.00 0.00 C ATOM 3144 CG HIS C 17 -2.020 -18.105 -20.789 1.00 0.00 C ATOM 3145 ND1 HIS C 17 -0.742 -18.546 -21.059 1.00 0.00 N ATOM 3146 CD2 HIS C 17 -2.792 -18.548 -21.809 1.00 0.00 C ATOM 3147 CE1 HIS C 17 -0.742 -19.223 -22.193 1.00 0.00 C ATOM 3148 NE2 HIS C 17 -1.973 -19.240 -22.668 1.00 0.00 N ATOM 0 H HIS C 17 -5.012 -16.674 -21.221 1.00 0.00 H new ATOM 0 HA HIS C 17 -4.433 -17.846 -19.404 1.00 0.00 H new ATOM 0 HB2 HIS C 17 -1.773 -16.387 -19.569 1.00 0.00 H new ATOM 0 HB3 HIS C 17 -2.095 -17.865 -18.683 1.00 0.00 H new ATOM 0 HD2 HIS C 17 -3.854 -18.387 -21.926 1.00 0.00 H new ATOM 0 HE1 HIS C 17 0.119 -19.684 -22.653 1.00 0.00 H new ATOM 0 HE2 HIS C 17 -2.269 -19.693 -23.533 1.00 0.00 H new ATOM 3157 N LYS C 18 -3.209 -16.031 -17.302 1.00 0.00 N ATOM 3158 CA LYS C 18 -3.392 -15.247 -16.086 1.00 0.00 C ATOM 3159 C LYS C 18 -3.654 -13.782 -16.415 1.00 0.00 C ATOM 3160 O LYS C 18 -4.164 -13.060 -15.532 1.00 0.00 O ATOM 3161 CB LYS C 18 -2.161 -15.368 -15.185 1.00 0.00 C ATOM 3162 CG LYS C 18 -1.858 -16.794 -14.756 1.00 0.00 C ATOM 3163 CD LYS C 18 -3.012 -17.398 -13.973 1.00 0.00 C ATOM 3164 CE LYS C 18 -2.710 -18.825 -13.546 1.00 0.00 C ATOM 3165 NZ LYS C 18 -3.836 -19.425 -12.780 1.00 0.00 N ATOM 3166 OXT LYS C 18 -3.346 -13.367 -17.553 1.00 0.00 O ATOM 0 H LYS C 18 -2.322 -16.532 -17.352 1.00 0.00 H new ATOM 0 HA LYS C 18 -4.260 -15.642 -15.558 1.00 0.00 H new ATOM 0 HB2 LYS C 18 -1.296 -14.964 -15.710 1.00 0.00 H new ATOM 0 HB3 LYS C 18 -2.310 -14.754 -14.297 1.00 0.00 H new ATOM 0 HG2 LYS C 18 -1.655 -17.404 -15.636 1.00 0.00 H new ATOM 0 HG3 LYS C 18 -0.956 -16.807 -14.144 1.00 0.00 H new ATOM 0 HD2 LYS C 18 -3.214 -16.789 -13.092 1.00 0.00 H new ATOM 0 HD3 LYS C 18 -3.915 -17.383 -14.584 1.00 0.00 H new ATOM 0 HE2 LYS C 18 -2.506 -19.432 -14.428 1.00 0.00 H new ATOM 0 HE3 LYS C 18 -1.808 -18.838 -12.935 1.00 0.00 H new ATOM 0 HZ1 LYS C 18 -3.591 -20.398 -12.507 1.00 0.00 H new ATOM 0 HZ2 LYS C 18 -4.014 -18.860 -11.925 1.00 0.00 H new ATOM 0 HZ3 LYS C 18 -4.691 -19.436 -13.372 1.00 0.00 H new TER 3180 LYS C 18 ATOM 3181 N MET D 1 -3.587 10.905 12.737 1.00 0.00 N ATOM 3182 CA MET D 1 -4.538 11.903 12.184 1.00 0.00 C ATOM 3183 C MET D 1 -3.967 12.558 10.931 1.00 0.00 C ATOM 3184 O MET D 1 -3.988 13.782 10.792 1.00 0.00 O ATOM 3185 CB MET D 1 -4.821 12.954 13.261 1.00 0.00 C ATOM 3186 CG MET D 1 -5.917 13.940 12.883 1.00 0.00 C ATOM 3187 SD MET D 1 -6.248 15.141 14.186 1.00 0.00 S ATOM 3188 CE MET D 1 -6.741 14.061 15.527 1.00 0.00 C ATOM 0 H1 MET D 1 -4.107 10.049 13.018 1.00 0.00 H new ATOM 0 H2 MET D 1 -2.882 10.660 12.013 1.00 0.00 H new ATOM 0 H3 MET D 1 -3.106 11.307 13.567 1.00 0.00 H new ATOM 0 HA MET D 1 -5.466 11.407 11.900 1.00 0.00 H new ATOM 0 HB2 MET D 1 -5.103 12.448 14.184 1.00 0.00 H new ATOM 0 HB3 MET D 1 -3.904 13.506 13.467 1.00 0.00 H new ATOM 0 HG2 MET D 1 -5.629 14.467 11.973 1.00 0.00 H new ATOM 0 HG3 MET D 1 -6.832 13.392 12.658 1.00 0.00 H new ATOM 0 HE1 MET D 1 -7.305 14.631 16.265 1.00 0.00 H new ATOM 0 HE2 MET D 1 -7.364 13.257 15.136 1.00 0.00 H new ATOM 0 HE3 MET D 1 -5.854 13.636 15.997 1.00 0.00 H new ATOM 3200 N LYS D 2 -3.455 11.737 10.020 1.00 0.00 N ATOM 3201 CA LYS D 2 -2.876 12.235 8.776 1.00 0.00 C ATOM 3202 C LYS D 2 -2.913 11.172 7.692 1.00 0.00 C ATOM 3203 O LYS D 2 -2.563 10.014 7.923 1.00 0.00 O ATOM 3204 CB LYS D 2 -1.437 12.706 8.997 1.00 0.00 C ATOM 3205 CG LYS D 2 -1.324 13.927 9.894 1.00 0.00 C ATOM 3206 CD LYS D 2 -2.022 15.134 9.286 1.00 0.00 C ATOM 3207 CE LYS D 2 -1.930 16.348 10.197 1.00 0.00 C ATOM 3208 NZ LYS D 2 -2.563 16.098 11.521 1.00 0.00 N ATOM 0 H LYS D 2 -3.429 10.722 10.119 1.00 0.00 H new ATOM 0 HA LYS D 2 -3.477 13.083 8.449 1.00 0.00 H new ATOM 0 HB2 LYS D 2 -0.860 11.891 9.434 1.00 0.00 H new ATOM 0 HB3 LYS D 2 -0.986 12.933 8.031 1.00 0.00 H new ATOM 0 HG2 LYS D 2 -1.761 13.706 10.868 1.00 0.00 H new ATOM 0 HG3 LYS D 2 -0.273 14.160 10.062 1.00 0.00 H new ATOM 0 HD2 LYS D 2 -1.573 15.367 8.321 1.00 0.00 H new ATOM 0 HD3 LYS D 2 -3.069 14.895 9.101 1.00 0.00 H new ATOM 0 HE2 LYS D 2 -0.883 16.616 10.340 1.00 0.00 H new ATOM 0 HE3 LYS D 2 -2.414 17.199 9.718 1.00 0.00 H new ATOM 0 HZ1 LYS D 2 -3.153 16.914 11.783 1.00 0.00 H new ATOM 0 HZ2 LYS D 2 -3.156 15.245 11.467 1.00 0.00 H new ATOM 0 HZ3 LYS D 2 -1.823 15.960 12.239 1.00 0.00 H new ATOM 3222 N ASP D 3 -3.351 11.577 6.508 1.00 0.00 N ATOM 3223 CA ASP D 3 -3.452 10.665 5.380 1.00 0.00 C ATOM 3224 C ASP D 3 -2.171 10.652 4.553 1.00 0.00 C ATOM 3225 O ASP D 3 -1.778 11.674 3.987 1.00 0.00 O ATOM 3226 CB ASP D 3 -4.629 11.059 4.490 1.00 0.00 C ATOM 3227 CG ASP D 3 -5.934 11.145 5.258 1.00 0.00 C ATOM 3228 OD1 ASP D 3 -6.349 10.122 5.840 1.00 0.00 O ATOM 3229 OD2 ASP D 3 -6.540 12.237 5.277 1.00 0.00 O ATOM 0 H ASP D 3 -3.642 12.533 6.305 1.00 0.00 H new ATOM 0 HA ASP D 3 -3.611 9.663 5.779 1.00 0.00 H new ATOM 0 HB2 ASP D 3 -4.421 12.022 4.024 1.00 0.00 H new ATOM 0 HB3 ASP D 3 -4.732 10.331 3.685 1.00 0.00 H new ATOM 3234 N THR D 4 -1.535 9.489 4.467 1.00 0.00 N ATOM 3235 CA THR D 4 -0.318 9.343 3.688 1.00 0.00 C ATOM 3236 C THR D 4 -0.659 9.183 2.211 1.00 0.00 C ATOM 3237 O THR D 4 -1.632 8.512 1.861 1.00 0.00 O ATOM 3238 CB THR D 4 0.479 8.136 4.179 1.00 0.00 C ATOM 3239 OG1 THR D 4 1.733 8.070 3.531 1.00 0.00 O ATOM 3240 CG2 THR D 4 -0.224 6.819 3.944 1.00 0.00 C ATOM 0 H THR D 4 -1.845 8.634 4.929 1.00 0.00 H new ATOM 0 HA THR D 4 0.291 10.239 3.813 1.00 0.00 H new ATOM 0 HB THR D 4 0.593 8.283 5.253 1.00 0.00 H new ATOM 0 HG1 THR D 4 2.448 8.201 4.188 1.00 0.00 H new ATOM 0 HG21 THR D 4 0.397 6.004 4.316 1.00 0.00 H new ATOM 0 HG22 THR D 4 -1.179 6.817 4.470 1.00 0.00 H new ATOM 0 HG23 THR D 4 -0.398 6.685 2.876 1.00 0.00 H new ATOM 3248 N GLY D 5 0.137 9.797 1.347 1.00 0.00 N ATOM 3249 CA GLY D 5 -0.113 9.702 -0.078 1.00 0.00 C ATOM 3250 C GLY D 5 1.161 9.546 -0.878 1.00 0.00 C ATOM 3251 O GLY D 5 2.147 10.240 -0.630 1.00 0.00 O ATOM 0 H GLY D 5 0.949 10.358 1.606 1.00 0.00 H new ATOM 0 HA2 GLY D 5 -0.768 8.853 -0.273 1.00 0.00 H new ATOM 0 HA3 GLY D 5 -0.641 10.595 -0.412 1.00 0.00 H new ATOM 3255 N ILE D 6 1.145 8.630 -1.840 1.00 0.00 N ATOM 3256 CA ILE D 6 2.314 8.388 -2.672 1.00 0.00 C ATOM 3257 C ILE D 6 1.929 7.778 -4.014 1.00 0.00 C ATOM 3258 O ILE D 6 0.782 7.387 -4.229 1.00 0.00 O ATOM 3259 CB ILE D 6 3.328 7.458 -1.977 1.00 0.00 C ATOM 3260 CG1 ILE D 6 2.698 6.092 -1.702 1.00 0.00 C ATOM 3261 CG2 ILE D 6 3.829 8.087 -0.685 1.00 0.00 C ATOM 3262 CD1 ILE D 6 3.680 5.079 -1.159 1.00 0.00 C ATOM 0 H ILE D 6 0.338 8.046 -2.061 1.00 0.00 H new ATOM 0 HA ILE D 6 2.777 9.361 -2.837 1.00 0.00 H new ATOM 0 HB ILE D 6 4.180 7.316 -2.642 1.00 0.00 H new ATOM 0 HG12 ILE D 6 1.881 6.213 -0.991 1.00 0.00 H new ATOM 0 HG13 ILE D 6 2.263 5.708 -2.625 1.00 0.00 H new ATOM 0 HG21 ILE D 6 4.544 7.417 -0.207 1.00 0.00 H new ATOM 0 HG22 ILE D 6 4.315 9.037 -0.907 1.00 0.00 H new ATOM 0 HG23 ILE D 6 2.988 8.258 -0.013 1.00 0.00 H new ATOM 0 HD11 ILE D 6 3.168 4.132 -0.986 1.00 0.00 H new ATOM 0 HD12 ILE D 6 4.485 4.930 -1.879 1.00 0.00 H new ATOM 0 HD13 ILE D 6 4.096 5.443 -0.220 1.00 0.00 H new ATOM 3274 N GLN D 7 2.902 7.707 -4.914 1.00 0.00 N ATOM 3275 CA GLN D 7 2.688 7.152 -6.243 1.00 0.00 C ATOM 3276 C GLN D 7 4.016 6.741 -6.868 1.00 0.00 C ATOM 3277 O GLN D 7 4.490 7.362 -7.819 1.00 0.00 O ATOM 3278 CB GLN D 7 1.973 8.171 -7.136 1.00 0.00 C ATOM 3279 CG GLN D 7 2.681 9.514 -7.222 1.00 0.00 C ATOM 3280 CD GLN D 7 1.939 10.509 -8.091 1.00 0.00 C ATOM 3281 OE1 GLN D 7 0.790 10.855 -7.816 1.00 0.00 O ATOM 3282 NE2 GLN D 7 2.593 10.974 -9.149 1.00 0.00 N ATOM 0 H GLN D 7 3.855 8.030 -4.744 1.00 0.00 H new ATOM 0 HA GLN D 7 2.059 6.266 -6.152 1.00 0.00 H new ATOM 0 HB2 GLN D 7 1.877 7.756 -8.139 1.00 0.00 H new ATOM 0 HB3 GLN D 7 0.963 8.327 -6.757 1.00 0.00 H new ATOM 0 HG2 GLN D 7 2.794 9.926 -6.219 1.00 0.00 H new ATOM 0 HG3 GLN D 7 3.685 9.367 -7.621 1.00 0.00 H new ATOM 0 HE21 GLN D 7 3.545 10.660 -9.339 1.00 0.00 H new ATOM 0 HE22 GLN D 7 2.144 11.645 -9.772 1.00 0.00 H new ATOM 3291 N VAL D 8 4.615 5.691 -6.317 1.00 0.00 N ATOM 3292 CA VAL D 8 5.894 5.193 -6.805 1.00 0.00 C ATOM 3293 C VAL D 8 5.750 4.550 -8.181 1.00 0.00 C ATOM 3294 O VAL D 8 4.759 3.877 -8.465 1.00 0.00 O ATOM 3295 CB VAL D 8 6.509 4.174 -5.826 1.00 0.00 C ATOM 3296 CG1 VAL D 8 7.876 3.715 -6.313 1.00 0.00 C ATOM 3297 CG2 VAL D 8 6.605 4.773 -4.431 1.00 0.00 C ATOM 0 H VAL D 8 4.233 5.167 -5.529 1.00 0.00 H new ATOM 0 HA VAL D 8 6.559 6.053 -6.884 1.00 0.00 H new ATOM 0 HB VAL D 8 5.858 3.301 -5.782 1.00 0.00 H new ATOM 0 HG11 VAL D 8 8.291 2.996 -5.607 1.00 0.00 H new ATOM 0 HG12 VAL D 8 7.775 3.245 -7.291 1.00 0.00 H new ATOM 0 HG13 VAL D 8 8.542 4.574 -6.390 1.00 0.00 H new ATOM 0 HG21 VAL D 8 7.041 4.042 -3.750 1.00 0.00 H new ATOM 0 HG22 VAL D 8 7.234 5.663 -4.460 1.00 0.00 H new ATOM 0 HG23 VAL D 8 5.609 5.044 -4.082 1.00 0.00 H new ATOM 3307 N ASP D 9 6.752 4.766 -9.026 1.00 0.00 N ATOM 3308 CA ASP D 9 6.756 4.215 -10.377 1.00 0.00 C ATOM 3309 C ASP D 9 8.104 4.486 -11.039 1.00 0.00 C ATOM 3310 O ASP D 9 8.173 4.883 -12.202 1.00 0.00 O ATOM 3311 CB ASP D 9 5.621 4.829 -11.202 1.00 0.00 C ATOM 3312 CG ASP D 9 5.372 4.086 -12.503 1.00 0.00 C ATOM 3313 OD1 ASP D 9 6.301 4.009 -13.336 1.00 0.00 O ATOM 3314 OD2 ASP D 9 4.246 3.582 -12.691 1.00 0.00 O ATOM 0 H ASP D 9 7.576 5.322 -8.798 1.00 0.00 H new ATOM 0 HA ASP D 9 6.599 3.138 -10.325 1.00 0.00 H new ATOM 0 HB2 ASP D 9 4.706 4.831 -10.609 1.00 0.00 H new ATOM 0 HB3 ASP D 9 5.860 5.869 -11.423 1.00 0.00 H new ATOM 3319 N ARG D 10 9.173 4.277 -10.279 1.00 0.00 N ATOM 3320 CA ARG D 10 10.526 4.502 -10.779 1.00 0.00 C ATOM 3321 C ARG D 10 11.116 3.227 -11.369 1.00 0.00 C ATOM 3322 O ARG D 10 11.707 3.242 -12.449 1.00 0.00 O ATOM 3323 CB ARG D 10 11.426 5.031 -9.659 1.00 0.00 C ATOM 3324 CG ARG D 10 11.489 4.120 -8.443 1.00 0.00 C ATOM 3325 CD ARG D 10 12.410 4.684 -7.374 1.00 0.00 C ATOM 3326 NE ARG D 10 13.784 4.821 -7.850 1.00 0.00 N ATOM 3327 CZ ARG D 10 14.783 5.290 -7.108 1.00 0.00 C ATOM 3328 NH1 ARG D 10 14.565 5.676 -5.856 1.00 0.00 N ATOM 3329 NH2 ARG D 10 16.004 5.379 -7.618 1.00 0.00 N ATOM 0 H ARG D 10 9.130 3.952 -9.313 1.00 0.00 H new ATOM 0 HA ARG D 10 10.470 5.247 -11.572 1.00 0.00 H new ATOM 0 HB2 ARG D 10 12.434 5.170 -10.050 1.00 0.00 H new ATOM 0 HB3 ARG D 10 11.066 6.012 -9.349 1.00 0.00 H new ATOM 0 HG2 ARG D 10 10.488 3.990 -8.031 1.00 0.00 H new ATOM 0 HG3 ARG D 10 11.840 3.133 -8.744 1.00 0.00 H new ATOM 0 HD2 ARG D 10 12.039 5.657 -7.053 1.00 0.00 H new ATOM 0 HD3 ARG D 10 12.393 4.032 -6.500 1.00 0.00 H new ATOM 0 HE ARG D 10 13.990 4.540 -8.809 1.00 0.00 H new ATOM 0 HH11 ARG D 10 13.628 5.613 -5.459 1.00 0.00 H new ATOM 0 HH12 ARG D 10 15.335 6.035 -5.292 1.00 0.00 H new ATOM 0 HH21 ARG D 10 16.177 5.088 -8.580 1.00 0.00 H new ATOM 0 HH22 ARG D 10 16.770 5.739 -7.048 1.00 0.00 H new ATOM 3343 N ASP D 11 10.955 2.124 -10.649 1.00 0.00 N ATOM 3344 CA ASP D 11 11.473 0.836 -11.092 1.00 0.00 C ATOM 3345 C ASP D 11 12.986 0.885 -11.259 1.00 0.00 C ATOM 3346 O ASP D 11 13.531 0.354 -12.225 1.00 0.00 O ATOM 3347 CB ASP D 11 10.812 0.422 -12.409 1.00 0.00 C ATOM 3348 CG ASP D 11 9.308 0.287 -12.284 1.00 0.00 C ATOM 3349 OD1 ASP D 11 8.851 -0.539 -11.467 1.00 0.00 O ATOM 3350 OD2 ASP D 11 8.586 1.011 -13.003 1.00 0.00 O ATOM 0 H ASP D 11 10.468 2.096 -9.753 1.00 0.00 H new ATOM 0 HA ASP D 11 11.237 0.095 -10.328 1.00 0.00 H new ATOM 0 HB2 ASP D 11 11.045 1.160 -13.177 1.00 0.00 H new ATOM 0 HB3 ASP D 11 11.233 -0.527 -12.741 1.00 0.00 H new ATOM 3355 N LEU D 12 13.658 1.534 -10.310 1.00 0.00 N ATOM 3356 CA LEU D 12 15.112 1.663 -10.347 1.00 0.00 C ATOM 3357 C LEU D 12 15.570 2.526 -11.523 1.00 0.00 C ATOM 3358 O LEU D 12 16.734 2.923 -11.591 1.00 0.00 O ATOM 3359 CB LEU D 12 15.778 0.285 -10.421 1.00 0.00 C ATOM 3360 CG LEU D 12 15.544 -0.622 -9.210 1.00 0.00 C ATOM 3361 CD1 LEU D 12 14.066 -0.943 -9.054 1.00 0.00 C ATOM 3362 CD2 LEU D 12 16.357 -1.901 -9.340 1.00 0.00 C ATOM 0 H LEU D 12 13.217 1.979 -9.505 1.00 0.00 H new ATOM 0 HA LEU D 12 15.417 2.156 -9.424 1.00 0.00 H new ATOM 0 HB2 LEU D 12 15.417 -0.227 -11.313 1.00 0.00 H new ATOM 0 HB3 LEU D 12 16.852 0.425 -10.547 1.00 0.00 H new ATOM 0 HG LEU D 12 15.873 -0.091 -8.316 1.00 0.00 H new ATOM 0 HD11 LEU D 12 13.923 -1.589 -8.187 1.00 0.00 H new ATOM 0 HD12 LEU D 12 13.506 -0.019 -8.914 1.00 0.00 H new ATOM 0 HD13 LEU D 12 13.708 -1.452 -9.949 1.00 0.00 H new ATOM 0 HD21 LEU D 12 16.180 -2.535 -8.471 1.00 0.00 H new ATOM 0 HD22 LEU D 12 16.058 -2.432 -10.244 1.00 0.00 H new ATOM 0 HD23 LEU D 12 17.417 -1.654 -9.398 1.00 0.00 H new ATOM 3374 N ASP D 13 14.660 2.813 -12.453 1.00 0.00 N ATOM 3375 CA ASP D 13 14.991 3.625 -13.618 1.00 0.00 C ATOM 3376 C ASP D 13 16.096 2.952 -14.440 1.00 0.00 C ATOM 3377 O ASP D 13 16.255 1.733 -14.386 1.00 0.00 O ATOM 3378 CB ASP D 13 15.426 5.025 -13.173 1.00 0.00 C ATOM 3379 CG ASP D 13 14.374 5.718 -12.327 1.00 0.00 C ATOM 3380 OD1 ASP D 13 13.305 5.116 -12.096 1.00 0.00 O ATOM 3381 OD2 ASP D 13 14.619 6.864 -11.896 1.00 0.00 O ATOM 0 H ASP D 13 13.691 2.495 -12.421 1.00 0.00 H new ATOM 0 HA ASP D 13 14.106 3.718 -14.247 1.00 0.00 H new ATOM 0 HB2 ASP D 13 16.353 4.951 -12.605 1.00 0.00 H new ATOM 0 HB3 ASP D 13 15.639 5.633 -14.052 1.00 0.00 H new ATOM 3386 N GLY D 14 16.853 3.742 -15.199 1.00 0.00 N ATOM 3387 CA GLY D 14 17.923 3.183 -16.007 1.00 0.00 C ATOM 3388 C GLY D 14 19.098 2.715 -15.171 1.00 0.00 C ATOM 3389 O GLY D 14 18.925 2.271 -14.036 1.00 0.00 O ATOM 0 H GLY D 14 16.745 4.754 -15.268 1.00 0.00 H new ATOM 0 HA2 GLY D 14 17.536 2.344 -16.586 1.00 0.00 H new ATOM 0 HA3 GLY D 14 18.265 3.933 -16.721 1.00 0.00 H new ATOM 3393 N LYS D 15 20.298 2.814 -15.734 1.00 0.00 N ATOM 3394 CA LYS D 15 21.507 2.395 -15.030 1.00 0.00 C ATOM 3395 C LYS D 15 21.735 3.238 -13.778 1.00 0.00 C ATOM 3396 O LYS D 15 22.078 2.714 -12.720 1.00 0.00 O ATOM 3397 CB LYS D 15 22.733 2.472 -15.950 1.00 0.00 C ATOM 3398 CG LYS D 15 23.192 3.887 -16.288 1.00 0.00 C ATOM 3399 CD LYS D 15 22.200 4.619 -17.177 1.00 0.00 C ATOM 3400 CE LYS D 15 22.724 5.986 -17.584 1.00 0.00 C ATOM 3401 NZ LYS D 15 21.760 6.715 -18.454 1.00 0.00 N ATOM 0 H LYS D 15 20.460 3.179 -16.672 1.00 0.00 H new ATOM 0 HA LYS D 15 21.367 1.358 -14.725 1.00 0.00 H new ATOM 0 HB2 LYS D 15 23.559 1.941 -15.477 1.00 0.00 H new ATOM 0 HB3 LYS D 15 22.507 1.947 -16.878 1.00 0.00 H new ATOM 0 HG2 LYS D 15 23.334 4.450 -15.366 1.00 0.00 H new ATOM 0 HG3 LYS D 15 24.160 3.843 -16.787 1.00 0.00 H new ATOM 0 HD2 LYS D 15 22.000 4.024 -18.068 1.00 0.00 H new ATOM 0 HD3 LYS D 15 21.252 4.733 -16.651 1.00 0.00 H new ATOM 0 HE2 LYS D 15 22.926 6.578 -16.691 1.00 0.00 H new ATOM 0 HE3 LYS D 15 23.671 5.869 -18.110 1.00 0.00 H new ATOM 0 HZ1 LYS D 15 22.155 7.642 -18.709 1.00 0.00 H new ATOM 0 HZ2 LYS D 15 21.586 6.163 -19.318 1.00 0.00 H new ATOM 0 HZ3 LYS D 15 20.864 6.849 -17.943 1.00 0.00 H new ATOM 3415 N SER D 16 21.546 4.548 -13.906 1.00 0.00 N ATOM 3416 CA SER D 16 21.734 5.463 -12.785 1.00 0.00 C ATOM 3417 C SER D 16 20.690 5.222 -11.701 1.00 0.00 C ATOM 3418 O SER D 16 19.506 5.054 -11.992 1.00 0.00 O ATOM 3419 CB SER D 16 21.662 6.913 -13.267 1.00 0.00 C ATOM 3420 OG SER D 16 22.665 7.181 -14.231 1.00 0.00 O ATOM 0 H SER D 16 21.263 5.000 -14.775 1.00 0.00 H new ATOM 0 HA SER D 16 22.720 5.277 -12.359 1.00 0.00 H new ATOM 0 HB2 SER D 16 20.679 7.108 -13.696 1.00 0.00 H new ATOM 0 HB3 SER D 16 21.779 7.588 -12.419 1.00 0.00 H new ATOM 0 HG SER D 16 22.596 8.114 -14.524 1.00 0.00 H new ATOM 3426 N HIS D 17 21.135 5.214 -10.448 1.00 0.00 N ATOM 3427 CA HIS D 17 20.241 4.999 -9.316 1.00 0.00 C ATOM 3428 C HIS D 17 19.462 6.270 -8.975 1.00 0.00 C ATOM 3429 O HIS D 17 19.438 6.703 -7.822 1.00 0.00 O ATOM 3430 CB HIS D 17 21.038 4.532 -8.095 1.00 0.00 C ATOM 3431 CG HIS D 17 21.789 3.258 -8.323 1.00 0.00 C ATOM 3432 ND1 HIS D 17 21.174 2.071 -8.660 1.00 0.00 N ATOM 3433 CD2 HIS D 17 23.115 2.988 -8.260 1.00 0.00 C ATOM 3434 CE1 HIS D 17 22.089 1.126 -8.794 1.00 0.00 C ATOM 3435 NE2 HIS D 17 23.274 1.658 -8.558 1.00 0.00 N ATOM 0 H HIS D 17 22.112 5.354 -10.191 1.00 0.00 H new ATOM 0 HA HIS D 17 19.525 4.226 -9.596 1.00 0.00 H new ATOM 0 HB2 HIS D 17 21.742 5.314 -7.810 1.00 0.00 H new ATOM 0 HB3 HIS D 17 20.356 4.397 -7.256 1.00 0.00 H new ATOM 0 HD1 HIS D 17 20.170 1.942 -8.786 1.00 0.00 H new ATOM 0 HD2 HIS D 17 23.901 3.689 -8.020 1.00 0.00 H new ATOM 0 HE1 HIS D 17 21.899 0.095 -9.052 1.00 0.00 H new ATOM 3444 N LYS D 18 18.823 6.864 -9.980 1.00 0.00 N ATOM 3445 CA LYS D 18 18.044 8.076 -9.788 1.00 0.00 C ATOM 3446 C LYS D 18 18.854 9.143 -9.054 1.00 0.00 C ATOM 3447 O LYS D 18 19.514 9.955 -9.736 1.00 0.00 O ATOM 3448 CB LYS D 18 16.767 7.762 -9.014 1.00 0.00 C ATOM 3449 CG LYS D 18 15.758 8.887 -9.067 1.00 0.00 C ATOM 3450 CD LYS D 18 14.496 8.547 -8.292 1.00 0.00 C ATOM 3451 CE LYS D 18 13.484 9.680 -8.349 1.00 0.00 C ATOM 3452 NZ LYS D 18 13.073 9.987 -9.747 1.00 0.00 N ATOM 3453 OXT LYS D 18 18.819 9.156 -7.806 1.00 0.00 O ATOM 0 H LYS D 18 18.832 6.520 -10.940 1.00 0.00 H new ATOM 0 HA LYS D 18 17.781 8.468 -10.771 1.00 0.00 H new ATOM 0 HB2 LYS D 18 16.316 6.856 -9.419 1.00 0.00 H new ATOM 0 HB3 LYS D 18 17.019 7.555 -7.974 1.00 0.00 H new ATOM 0 HG2 LYS D 18 16.203 9.794 -8.658 1.00 0.00 H new ATOM 0 HG3 LYS D 18 15.502 9.097 -10.105 1.00 0.00 H new ATOM 0 HD2 LYS D 18 14.051 7.639 -8.700 1.00 0.00 H new ATOM 0 HD3 LYS D 18 14.751 8.338 -7.253 1.00 0.00 H new ATOM 0 HE2 LYS D 18 12.605 9.412 -7.763 1.00 0.00 H new ATOM 0 HE3 LYS D 18 13.912 10.572 -7.892 1.00 0.00 H new ATOM 0 HZ1 LYS D 18 12.223 10.587 -9.735 1.00 0.00 H new ATOM 0 HZ2 LYS D 18 13.844 10.488 -10.233 1.00 0.00 H new ATOM 0 HZ3 LYS D 18 12.864 9.101 -10.250 1.00 0.00 H new TER 3467 LYS D 18